A0A096MP64_PAPAN Loading...

Galactosylgalactosylxylosylprotein 3-beta-glucuronosyltransferase

AlphaFold DB , UniProt , Accession A0A096MP64, Species PAPAN (Papio anubis, Olive baboon), Gene B3GAT2, Length 323 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	51.7	Low	57.3	Low	232 Å²	232	141.5 Å²	141.5	100%	1.143	69%	0.69	S	S	*	*				0	32.6	0	-67.4	166.3	69.4	0	0	114.1
2	K	53.4	Low	58.2	Low	189 Å²	189	138.2 Å²	138.2	82%	0.822	68%	0.677	S	S	*	*			trans	-113.2	-5.6	177	-71.2	-175.6	178.1	179.8	0	114.7
3	S	58.5	Low	59.5	Low	93 Å²	93	134 Å²	134	65%	0.65	66%	0.659	S	S	*	*	H	α-helix	trans	-91.3	-18.8	-172.6	-168.9	0	0	0	0	115.2	T7	S3-T7 PolarHBondContact O-OG1 2.97Å
4	V	55.5	Low	60.6	Low	103 Å²	103	129.6 Å²	129.6	62%	0.624	65%	0.645	S	S	*	*	H	α-helix	trans	-88.9	-24.4	-173	-176.6	0	0	0	0	112.6
5	L	55.4	Low	61.5	Low	138 Å²	138	132.5 Å²	132.5	72%	0.723	65%	0.646	S	S	*	*	H	α-helix	trans	-74.5	-36.2	178.3	-83.4	155.7	0	0	0	112.3	F9	L5-F9 PolarHBondContact O-N 3.08Å
6	F	53.2	Low	62.5	Low	147 Å²	147	130.6 Å²	130.6	65%	0.645	64%	0.638	S	S	*	*	H	α-helix	trans	-68.7	-38.3	179.2	-92.5	-83.9	0	0	0	112.4	R8 F9 F10	F6-R8 VanDerWaalsContact C-N 3.35Å; F6-R8 PolarHBondContact O-N 2.88Å; F6-F9 PolarHBondContact O-N 2.82Å; F6-F10 HydrophobicContact CD1-CE2 4.18Å; F6-F10 WeakPolarHBondContact O-CD2 3.32Å; F6-F10 PolarHBondContact O-N 2.81Å
7	T	56.7	Low	63	Low	84 Å²	84	128.8 Å²	128.8	52%	0.515	63%	0.631	S	S	.	*	H	α-helix	trans	-66.9	-35.3	-178.8	-25	0	0	0	0	112.4	S3 I11	S3-T7 PolarHBondContact O-OG1 2.97Å; T7-I11 VanDerWaalsContact O-CD1 3.31Å; T7-I11 WeakPolarHBondContact O-CD1 3.45Å; T7-I11 VanDerWaalsContact O-CG1 3.26Å; T7-I11 WeakPolarHBondContact O-CG1 3.49Å; T7-I11 PolarHBondContact O-N 3.1Å
8	R	57	Low	63.7	Low	179 Å²	179	126.6 Å²	126.6	68%	0.675	62%	0.622	S	S	*	*	H	α-helix	trans	-73.1	-28	177.2	-69.9	-173.8	175.4	-171.1	-1.1	113	F6 L12	F6-R8 VanDerWaalsContact C-N 3.35Å; F6-R8 PolarHBondContact O-N 2.88Å; R8-L12 WeakPolarHBondContact O-CG 3.35Å
9	F	58.6	Low	64.1	Low	142 Å²	142	124.5 Å²	124.5	62%	0.623	62%	0.617	S	S	*	*	H	α-helix	trans	-72.1	-39.5	179.1	-153.4	-95.2	0	0	0	111.9	L5 F6 L12 L13	L5-F9 PolarHBondContact O-N 3.08Å; F6-F9 PolarHBondContact O-N 2.82Å; F9-L12 PolarHBondContact O-N 3.08Å; F9-L13 HydrophobicContact CD1-CD1 4.32Å; F9-L13 HydrophobicContact CE1-CD1 4.25Å; F9-L13 PolarHBondContact O-N 3.04Å
10	F	60	Low	64.5	Low	142 Å²	142	123.4 Å²	123.4	62%	0.623	61%	0.612	S	S	*	*	H	α-helix	trans	-74.1	-23.3	178.2	-81.7	-76.7	0	0	0	114.2	F6 P14	F6-F10 HydrophobicContact CD1-CE2 4.18Å; F6-F10 WeakPolarHBondContact O-CD2 3.32Å; F6-F10 PolarHBondContact O-N 2.81Å; F10-P14 WeakPolarHBondContact O-CD 3.36Å
11	I	70.4	Confident	64.8	Low	107 Å²	107	122 Å²	122	55%	0.549	61%	0.606	S	S	.	*	H	α-helix	trans	-75.4	-29.6	176.6	-66.7	166	0	0	0	111.8	T7 W15	T7-I11 VanDerWaalsContact O-CD1 3.31Å; T7-I11 WeakPolarHBondContact O-CD1 3.45Å; T7-I11 VanDerWaalsContact O-CG1 3.26Å; T7-I11 WeakPolarHBondContact O-CG1 3.49Å; T7-I11 PolarHBondContact O-N 3.1Å; I11-W15 VanDerWaalsContact O-CD1 3.31Å
12	L	68.1	Low	65.3	Low	102 Å²	102	117.5 Å²	117.5	53%	0.534	58%	0.584	S	S	.	*	H	α-helix	trans	-89.6	-21.5	-175.6	-68.4	171.1	0	0	0	113.8	R8 F9 P14 W15 I16	R8-L12 WeakPolarHBondContact O-CG 3.35Å; F9-L12 PolarHBondContact O-N 3.08Å; L12-P14 VanDerWaalsContact C-CD 3.48Å; L12-W15 PolarHBondContact O-N 3.43Å; L12-I16 HydrophobicContact CB-CD1 4.5Å; L12-I16 WeakPolarHBondContact O-CG1 3.4Å; L12-I16 PolarHBondContact O-N 2.96Å; L12-I16 VanDerWaalsContact O-N 3.1Å
13	L	74.9	Confident	65.7	Low	84 Å²	84	114.1 Å²	114.1	44%	0.44	57%	0.574	S	S	.	*	H	α-helix	trans	-59.9	-40.7	-176.4	-141.6	143.9	0	0	0	114.2	F9 W15 I16 L17	F9-L13 HydrophobicContact CD1-CD1 4.32Å; F9-L13 HydrophobicContact CE1-CD1 4.25Å; F9-L13 PolarHBondContact O-N 3.04Å; L13-W15 VanDerWaalsContact C-N 3.33Å; L13-W15 PolarHBondContact O-N 3.03Å; L13-I16 PolarHBondContact O-N 3.35Å; L13-L17 PolarHBondContact O-N 3.28Å; L13-L17 VanDerWaalsContact O-N 3.15Å
14	P	75.6	Confident	65.3	Low	72 Å²	72	113.3 Å²	113.3	47%	0.468	56%	0.563	S	S	.	*	H	α-helix	trans	-63.5	-38.2	176	-19.2	31.1	0	0	0	112.6	F10 L12 L17 I18	F10-P14 WeakPolarHBondContact O-CD 3.36Å; L12-P14 VanDerWaalsContact C-CD 3.48Å; P14-L17 PolarHBondContact O-N 3.29Å; P14-I18 WeakPolarHBondContact O-CG1 3.44Å; P14-I18 PolarHBondContact O-N 3.27Å; P14-I18 VanDerWaalsContact O-N 3.13Å
15	W	74.1	Confident	65.2	Low	173 Å²	173	113.1 Å²	113.1	66%	0.655	56%	0.562	S	S	*	*	H	α-helix	trans	-71.4	-37.7	-178.9	-63.7	101.5	0	0	0	112.3	I11 L12 L13 L17 I18 V19	I11-W15 VanDerWaalsContact O-CD1 3.31Å; L12-W15 PolarHBondContact O-N 3.43Å; L13-W15 VanDerWaalsContact C-N 3.33Å; L13-W15 PolarHBondContact O-N 3.03Å; W15-L17 VanDerWaalsContact C-N 3.34Å; W15-I18 HydrophobicContact CE3-CD1 4.47Å; W15-I18 PolarHBondContact O-N 3.42Å; W15-V19 WeakPolarHBondContact O-CG2 3.34Å; W15-V19 PolarHBondContact O-N 2.75Å; W15-V19 VanDerWaalsContact O-N 3.15Å
16	I	76.3	Confident	64.8	Low	102 Å²	102	112.5 Å²	112.5	52%	0.523	56%	0.559	S	S	.	*	H	α-helix	trans	-64.9	-40.5	174.8	-66.6	169.1	0	0	0	110.5	L12 L13 I18 V19 I20	L12-I16 HydrophobicContact CB-CD1 4.5Å; L12-I16 WeakPolarHBondContact O-CG1 3.4Å; L12-I16 PolarHBondContact O-N 2.96Å; L12-I16 VanDerWaalsContact O-N 3.1Å; L13-I16 PolarHBondContact O-N 3.35Å; I16-I18 PolarHBondContact O-N 3.05Å; I16-V19 PolarHBondContact O-N 3.08Å; I16-I20 HydrophobicContact CG2-CD1 3.93Å; I16-I20 WeakPolarHBondContact O-CG1 3.05Å; I16-I20 PolarHBondContact O-N 3.39Å
17	L	72.4	Confident	64.6	Low	100 Å²	100	110.4 Å²	110.4	52%	0.524	56%	0.558	S	S	.	*	H	α-helix	trans	-63.8	-40.6	177.6	-153.9	89.6	0	0	0	111.9	L13 P14 W15 V19 I20 I21	L13-L17 PolarHBondContact O-N 3.28Å; L13-L17 VanDerWaalsContact O-N 3.15Å; P14-L17 PolarHBondContact O-N 3.29Å; W15-L17 VanDerWaalsContact C-N 3.34Å; L17-V19 PolarHBondContact O-N 3.09Å; L17-I20 PolarHBondContact O-N 3.47Å; L17-I21 HydrophobicContact CD2-CD1 4.08Å; L17-I21 HydrophobicContact CG-CD1 4.19Å; L17-I21 VanDerWaalsContact O-CG1 3.28Å; L17-I21 WeakPolarHBondContact O-CG1 3.41Å; L17-I21 PolarHBondContact O-N 3.28Å
18	I	74.9	Confident	64	Low	89 Å²	89	115.1 Å²	115.1	46%	0.456	57%	0.567	S	S	.	*	H	α-helix	trans	-62.2	-42.6	176.1	-69.2	166	0	0	0	111.2	P14 W15 I16 I20 I21 M22	P14-I18 WeakPolarHBondContact O-CG1 3.44Å; P14-I18 PolarHBondContact O-N 3.27Å; P14-I18 VanDerWaalsContact O-N 3.13Å; W15-I18 HydrophobicContact CE3-CD1 4.47Å; W15-I18 PolarHBondContact O-N 3.42Å; I16-I18 PolarHBondContact O-N 3.05Å; I18-I20 VanDerWaalsContact C-N 3.35Å; I18-I20 PolarHBondContact O-N 3.41Å; I18-I21 PolarHBondContact O-N 2.87Å; I18-M22 PolarHBondContact O-N 2.88Å
19	V	71.1	Confident	63.3	Low	88 Å²	88	114.7 Å²	114.7	53%	0.533	57%	0.57	S	S	.	*	H	α-helix	trans	-63.9	-40.9	177.4	172.3	0	0	0	0	111.3	W15 I16 L17 M22 L23	W15-V19 WeakPolarHBondContact O-CG2 3.34Å; W15-V19 PolarHBondContact O-N 2.75Å; W15-V19 VanDerWaalsContact O-N 3.15Å; I16-V19 PolarHBondContact O-N 3.08Å; L17-V19 PolarHBondContact O-N 3.09Å; V19-M22 PolarHBondContact O-N 2.88Å; V19-L23 HydrophobicContact CG1-CD1 3.96Å; V19-L23 WeakPolarHBondContact O-CB 3.27Å; V19-L23 WeakPolarHBondContact O-CG 3.16Å; V19-L23 PolarHBondContact O-N 3.11Å
20	I	72.9	Confident	62.5	Low	101 Å²	101	113.9 Å²	113.9	52%	0.518	58%	0.579	S	S	.	*	H	α-helix	trans	-65.5	-42.2	176.7	-67.1	168.8	0	0	0	111	I16 L17 I18 L23 D24	I16-I20 HydrophobicContact CG2-CD1 3.93Å; I16-I20 WeakPolarHBondContact O-CG1 3.05Å; I16-I20 PolarHBondContact O-N 3.39Å; L17-I20 PolarHBondContact O-N 3.47Å; I18-I20 VanDerWaalsContact C-N 3.35Å; I18-I20 PolarHBondContact O-N 3.41Å; I20-L23 PolarHBondContact O-N 3.45Å; I20-D24 PolarHBondContact O-N 2.88Å
21	I	69.9	Low	61.9	Low	94 Å²	94	111.4 Å²	111.4	48%	0.482	58%	0.584	S	S	.	*	H	α-helix	trans	-66.8	-41.2	177.9	-67.5	166.7	0	0	0	111	L17 I18 L23 D24 V25	L17-I21 HydrophobicContact CD2-CD1 4.08Å; L17-I21 HydrophobicContact CG-CD1 4.19Å; L17-I21 VanDerWaalsContact O-CG1 3.28Å; L17-I21 WeakPolarHBondContact O-CG1 3.41Å; L17-I21 PolarHBondContact O-N 3.28Å; I18-I21 PolarHBondContact O-N 2.87Å; I21-L23 VanDerWaalsContact C-N 3.31Å; I21-L23 PolarHBondContact O-N 3Å; I21-D24 PolarHBondContact O-N 2.83Å; I21-V25 HydrophobicContact CG2-CG2 4.28Å; I21-V25 VanDerWaalsContact O-CG2 3.27Å; I21-V25 WeakPolarHBondContact O-CG2 3.43Å; I21-V25 PolarHBondContact O-N 2.94Å
22	M	63.3	Low	60.8	Low	139 Å²	139	111.7 Å²	111.7	69%	0.685	59%	0.593	S	S	*	*	H	α-helix	trans	-64.1	-36.6	175.5	-75.2	-151.5	93.2	0	0	112.4	I18 V19 D26	I18-M22 PolarHBondContact O-N 2.88Å; V19-M22 PolarHBondContact O-N 2.88Å; M22-D26 PolarHBondContact O-N 3.35Å
23	L	60	Low	59.4	Low	117 Å²	117	112.6 Å²	112.6	61%	0.613	61%	0.605	S	S	*	*	H	α-helix	trans	-68.2	-34.1	175.3	-76.3	163.8	0	0	0	112.6	V19 I20 I21 T27	V19-L23 HydrophobicContact CG1-CD1 3.96Å; V19-L23 WeakPolarHBondContact O-CB 3.27Å; V19-L23 WeakPolarHBondContact O-CG 3.16Å; V19-L23 PolarHBondContact O-N 3.11Å; I20-L23 PolarHBondContact O-N 3.45Å; I21-L23 VanDerWaalsContact C-N 3.31Å; I21-L23 PolarHBondContact O-N 3Å; L23-T27 WeakPolarHBondContact O-CG2 3.34Å
24	D	51.6	Low	57.6	Low	76 Å²	76	117.1 Å²	117.1	41%	0.406	63%	0.629	S	S	.	*	H	α-helix	trans	-81	-22.9	178	-161.4	51	0	0	0	113.5	I20 I21 T27 R28	I20-D24 PolarHBondContact O-N 2.88Å; I21-D24 PolarHBondContact O-N 2.83Å; D24-T27 PolarHBondContact O-OG1 3.21Å; D24-R28 IonicContact OD1-NH2 3.75Å; D24-R28 IonicContact OD2-CZ 3.7Å; D24-R28 IonicContact OD2-NE 3.51Å; D24-R28 PolarHBondContact OD2-NE 3.26Å; D24-R28 IonicContact OD2-NH2 2.79Å; D24-R28 PolarHBondContact OD2-NH2 3.26Å
25	V	52.4	Low	55.8	Low	100 Å²	100	119.7 Å²	119.7	61%	0.606	64%	0.644	S	S	*	*	H	α-helix	trans	-75.5	-34.1	175	170	0	0	0	0	111.5	I21 T27 R28	I21-V25 HydrophobicContact CG2-CG2 4.28Å; I21-V25 VanDerWaalsContact O-CG2 3.27Å; I21-V25 WeakPolarHBondContact O-CG2 3.43Å; I21-V25 PolarHBondContact O-N 2.94Å; V25-T27 VanDerWaalsContact C-N 3.3Å; V25-T27 PolarHBondContact O-N 3.36Å; V25-R28 PolarHBondContact O-N 3.35Å
26	D	48.3	Very low	54	Low	125 Å²	125	117.4 Å²	117.4	67%	0.668	65%	0.651	S	S	*	*	H	α-helix	trans	-74.9	-17.7	179	-108.4	-20.2	0	0	0	113.6	M22	M22-D26 PolarHBondContact O-N 3.35Å
27	T	48.1	Very low	51.9	Low	103 Å²	103	124 Å²	124	63%	0.632	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-9.4	176.9	56.7	0	0	0	0	113.7	L23 D24 V25	L23-T27 WeakPolarHBondContact O-CG2 3.34Å; D24-T27 PolarHBondContact O-OG1 3.21Å; V25-T27 VanDerWaalsContact C-N 3.3Å; V25-T27 PolarHBondContact O-N 3.36Å
28	R	43.6	Very low	50.9	Low	182 Å²	182	124.3 Å²	124.3	69%	0.687	68%	0.677	S	S	*	*			trans	-111.3	47.3	-175.3	-60.9	-169.5	-162.6	-169.9	8.1	114.3	D24 V25	D24-R28 IonicContact OD1-NH2 3.75Å; D24-R28 IonicContact OD2-CZ 3.7Å; D24-R28 IonicContact OD2-NE 3.51Å; D24-R28 PolarHBondContact OD2-NE 3.26Å; D24-R28 IonicContact OD2-NH2 2.79Å; D24-R28 PolarHBondContact OD2-NH2 3.26Å; V25-R28 PolarHBondContact O-N 3.35Å
29	K	42.2	Very low	48.9	Very low	171 Å²	171	129.6 Å²	129.6	74%	0.743	69%	0.693	S	S	*	*			trans	-95	113.7	162.4	-73.6	-175.4	-176.9	169.1	0	110
30	P	43	Very low	47.1	Very low	125 Å²	125	133.1 Å²	133.1	81%	0.812	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-67.1	134	173.7	-0.4	10.7	0	0	0	110.4
31	A	48	Very low	45.6	Very low	89 Å²	89	133.2 Å²	133.2	74%	0.736	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-69	140.6	172	0	0	0	0	0	110.7
32	P	46.9	Very low	44.2	Very low	113 Å²	113	134 Å²	134	73%	0.734	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-70.2	146.1	176.5	27.1	-31.8	0	0	0	111.5
33	P	37.5	Very low	42.7	Very low	121 Å²	121	138.2 Å²	138.2	79%	0.786	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-70.5	131.9	-175.2	26.5	-32.5	0	0	0	112.2	T35	P33-T35 PolarHBondContact O-N 2.9Å
34	L	37.4	Very low	41.4	Very low	179 Å²	179	137.4 Å²	137.4	94%	0.937	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-77.2	116.3	172.7	-71.3	164.8	0	0	0	109.6
35	T	38.3	Very low	40.8	Very low	127 Å²	127	140.6 Å²	140.6	78%	0.779	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-94	134.4	168.1	47	0	0	0	0	109.7	P33	P33-T35 PolarHBondContact O-N 2.9Å
36	P	35.8	Very low	39.8	Very low	125 Å²	125	139 Å²	139	81%	0.812	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-88.1	123.4	176.6	31.7	-28	0	0	0	109.7
37	R	32.2	Very low	39.2	Very low	241 Å²	241	145 Å²	145	91%	0.909	78%	0.781	S	S	*	*			trans	-114.6	132.6	156.8	-86.2	-169.8	173.2	-174.5	-0.8	109.9
38	P	51.3	Low	38.3	Very low	106 Å²	106	143.7 Å²	143.7	69%	0.688	79%	0.788	S	S	*	*			trans	-79.9	171.1	173.7	35.5	-32.3	0	0	0	109.5
39	Y	33.3	Very low	37.7	Very low	200 Å²	200	138.9 Å²	138.9	78%	0.784	80%	0.795	S	S	*	*			trans	149.8	141	148	-96.1	-108.7	0	0	0	107.9
40	F	33.3	Very low	37.2	Very low	162 Å²	162	135.4 Å²	135.4	71%	0.711	80%	0.797	S	S	*	*			cis	-169	148.7	-13.6	-132.8	-109.7	0	0	0	103.9
41	S	40.8	Very low	36.7	Very low	103 Å²	103	141.2 Å²	141.2	72%	0.72	80%	0.803	S	S	*	*			trans	-103.7	139.7	169.5	174.8	0	0	0	0	109.4
42	P	41.5	Very low	36.3	Very low	110 Å²	110	144 Å²	144	71%	0.714	81%	0.805	S	S	*	*			trans	-136	112.5	156	32.6	-14.8	0	0	0	112.8
43	Y	31.5	Very low	36.1	Very low	227 Å²	227	144.6 Å²	144.6	89%	0.89	81%	0.809	S	S	*	*			trans	-119	97.7	144.4	-79.5	-78.6	0	0	0	107.8
44	A	33.5	Very low	36	Very low	100 Å²	100	146.2 Å²	146.2	83%	0.826	81%	0.81	S	S	*	*			trans	-119.6	105.2	163.7	0	0	0	0	0	106.8
45	V	37.2	Very low	35.9	Very low	144 Å²	144	149.8 Å²	149.8	87%	0.873	81%	0.811	S	S	*	*			trans	-93.1	116	172.6	176.6	0	0	0	0	107.4
46	G	31.7	Very low	35.8	Very low	65 Å²	65	155.5 Å²	155.5	67%	0.67	82%	0.818	S	S	*	*			trans	-124.9	132.7	166.9	0	0	0	0	0	110.4
47	R	35.3	Very low	35.7	Very low	253 Å²	253	153.6 Å²	153.6	96%	0.955	82%	0.822	S	S	*	*			trans	160.7	126	153.5	-93	173.4	-174.6	-157.4	2.2	106.6
48	G	30.8	Very low	35.6	Very low	75 Å²	75	145.7 Å²	145.7	77%	0.773	82%	0.815	S	S	*	*			cis	105.9	93.8	19.6	0	0	0	0	0	110.9
49	G	31.1	Very low	35.6	Very low	81 Å²	81	146.9 Å²	146.9	84%	0.835	82%	0.823	S	S	*	*			trans	71.1	148.1	160.5	0	0	0	0	0	117.6
50	A	31.7	Very low	35.8	Very low	97 Å²	97	141.5 Å²	141.5	80%	0.802	82%	0.82	S	S	*	*			cis	-166.1	149.3	9.6	0	0	0	0	0	111.3
51	R	32.7	Very low	36	Very low	247 Å²	247	143.5 Å²	143.5	93%	0.932	83%	0.831	S	S	*	*			trans	37.8	126.7	144.2	-65.8	-178	179.6	-174.5	-0.3	122.7
52	L	37.9	Very low	35.7	Very low	148 Å²	148	141.9 Å²	141.9	78%	0.775	83%	0.83	S	S	*	*			trans	-52.7	164.2	156.6	-75.5	145.6	0	0	0	114.1
53	P	43.1	Very low	35.9	Very low	125 Å²	125	143.7 Å²	143.7	81%	0.812	84%	0.839	S	S	*	*				-133.5	144.2	109.9	32.4	-19.3	0	0	0	114.7
54	L	35.4	Very low	36.3	Very low	156 Å²	156	141.5 Å²	141.5	82%	0.817	84%	0.838	S	S	*	*			trans	-65.9	141.5	162.5	-96.9	86.3	0	0	0	110.8
55	R	34.8	Very low	36.8	Very low	253 Å²	253	146.2 Å²	146.2	96%	0.955	84%	0.839	S	S	*	*			trans	-144.2	135.1	150.4	-141.9	176.3	179.3	-164.8	-1.2	112
56	R	36.1	Very low	37	Very low	247 Å²	247	149 Å²	149	93%	0.932	83%	0.834	S	S	*	*			trans	-68.2	139.1	-175.7	-89.2	168.6	159.1	170.1	-6.8	114.1
57	G	33.9	Very low	37.8	Very low	86 Å²	86	153.3 Å²	153.3	89%	0.887	84%	0.842	S	S	*	*				48.8	125.4	125.1	0	0	0	0	0	123
58	G	31.8	Very low	38.6	Very low	74 Å²	74	147.3 Å²	147.3	76%	0.763	83%	0.825	S	S	*	*			trans	163.7	145.6	155.5	0	0	0	0	0	113.5
59	P	49.4	Very low	39.6	Very low	131 Å²	131	149.1 Å²	149.1	85%	0.851	83%	0.826	S	S	*	*			trans	-110.8	168.2	-142	39.9	-31.8	0	0	0	117.6
60	A	37.8	Very low	40.7	Very low	87 Å²	87	156 Å²	156	72%	0.719	83%	0.826	S	S	*	*			trans	77.3	140.4	148.9	0	0	0	0	0	122.1
61	H	37.3	Very low	41.7	Very low	204 Å²	204	156.9 Å²	156.9	94%	0.944	82%	0.824	S	S	*	*			trans	87.6	123.6	160.7	-73.8	-20	0	0	0	120.5
62	G	35.9	Very low	42.7	Very low	69 Å²	69	153.4 Å²	153.4	71%	0.711	82%	0.818	S	S	*	*			trans	139.8	65.1	165.5	0	0	0	0	0	113.7	Q64	G62-Q64 PolarHBondContact O-N 3.19Å
63	T	44.1	Very low	43.4	Very low	148 Å²	148	152.2 Å²	152.2	91%	0.908	82%	0.819	S	S	*	*			trans	-60.3	98.3	164	-2.1	0	0	0	0	109.1
64	Q	40.8	Very low	43.9	Very low	182 Å²	182	154.7 Å²	154.7	85%	0.85	82%	0.82	S	S	*	*			trans	-114.4	100.3	160.2	-81.3	-172.9	-7.4	0	0	108.6	G62 R66	G62-Q64 PolarHBondContact O-N 3.19Å; Q64-R66 VanDerWaalsContact C-N 3.27Å; Q64-R66 PolarHBondContact O-N 2.81Å
65	K	44.2	Very low	45.1	Very low	199 Å²	199	153 Å²	153	87%	0.865	82%	0.819	S	S	*	*			trans	-61.5	90.4	164	-79.6	-179.1	174.7	178.1	0	108.3	N67	K65-N67 VanDerWaalsContact C-N 3.31Å; K65-N67 PolarHBondContact O-N 2.76Å; K65-N67 VanDerWaalsContact O-N 3.08Å
66	R	41.8	Very low	46.5	Very low	201 Å²	201	149.4 Å²	149.4	76%	0.758	81%	0.812	S	S	*	*			trans	-78.8	87.5	166.3	-150.2	-178.5	-172.6	-170.5	-0.2	107.3	Q64 Q68	Q64-R66 VanDerWaalsContact C-N 3.27Å; Q64-R66 PolarHBondContact O-N 2.81Å; R66-Q68 HydrophobicContact CG-CG 4.17Å; R66-Q68 VanDerWaalsContact NE-NE2 3.16Å; R66-Q68 PolarHBondContact O-N 2.93Å
67	N	48.9	Very low	48	Very low	156 Å²	156	143.6 Å²	143.6	83%	0.834	81%	0.807	S	S	*	*			trans	-64.5	80.8	163.3	-92	-3	0	0	0	108.3	K65	K65-N67 VanDerWaalsContact C-N 3.31Å; K65-N67 PolarHBondContact O-N 2.76Å; K65-N67 VanDerWaalsContact O-N 3.08Å
68	Q	50.4	Low	50.4	Low	128 Å²	128	145.7 Å²	145.7	60%	0.598	79%	0.794	S	S	*	*			trans	-89.4	95.5	158.4	-78.7	-177.3	-3.4	0	0	106.7	R66 R70	R66-Q68 HydrophobicContact CG-CG 4.17Å; R66-Q68 VanDerWaalsContact NE-NE2 3.16Å; R66-Q68 PolarHBondContact O-N 2.93Å; Q68-R70 PolarHBondContact O-N 2.85Å
69	S	52.8	Low	53.4	Low	113 Å²	113	146.2 Å²	146.2	79%	0.79	78%	0.778	S	S	*	*			trans	-58.9	88.6	156.5	50	0	0	0	0	107.4	P71	S69-P71 WeakPolarHBondContact O-CD 3.35Å
70	R	54.2	Low	55.6	Low	226 Å²	226	141.4 Å²	141.4	85%	0.853	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-57.4	121.9	170.7	-158.4	174.1	-171.9	-177.8	1.3	105.8	Q68 Q72	Q68-R70 PolarHBondContact O-N 2.85Å; R70-Q72 PolarHBondContact O-N 3.22Å; R70-Q72 VanDerWaalsContact O-N 3.1Å
71	P	53.3	Low	58.5	Low	114 Å²	114	138.4 Å²	138.4	74%	0.74	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-52.9	125.2	174	-20.5	30.3	0	0	0	107.2	S69	S69-P71 WeakPolarHBondContact O-CD 3.35Å
72	Q	52.8	Low	61.4	Low	175 Å²	175	128.7 Å²	128.7	82%	0.818	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-54.4	132	170.8	-73.6	-173.3	-15.1	0	0	107	R70 Q74	R70-Q72 PolarHBondContact O-N 3.22Å; R70-Q72 VanDerWaalsContact O-N 3.1Å; Q72-Q74 PolarHBondContact O-N 3.34Å
73	P	52.6	Low	64.4	Low	123 Å²	123	126.4 Å²	126.4	80%	0.799	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-52.3	121.6	174.7	-19.3	29	0	0	0	107.3
74	Q	54.1	Low	67	Low	176 Å²	176	119.4 Å²	119.4	82%	0.822	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-56.3	134.1	171.3	-69.1	-163.9	-7.5	0	0	107	Q72 E76	Q72-Q74 PolarHBondContact O-N 3.34Å; Q74-E76 PolarHBondContact O-N 3.24Å; Q74-E76 VanDerWaalsContact O-N 3.08Å
75	P	60.2	Low	69.8	Low	122 Å²	122	110.7 Å²	110.7	79%	0.792	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-53.5	124.1	177.7	20.3	-30.3	0	0	0	107.9
76	E	63.4	Low	72.4	Confident	176 Å²	176	101.2 Å²	101.2	82%	0.822	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-52.7	136.9	179.7	-73.4	-167.6	168.6	0	0	109.2	Q74 Q78	Q74-E76 PolarHBondContact O-N 3.24Å; Q74-E76 VanDerWaalsContact O-N 3.08Å; E76-Q78 PolarHBondContact O-N 2.72Å
77	P	69.1	Low	75.1	Confident	126 Å²	126	92.2 Å²	92.2	82%	0.818	49%	0.487	S	S	*	.	P	Polyproline II helix	trans	-56.9	118.8	-179.1	17.5	-26.1	0	0	0	109.3	L79	P77-L79 PolarHBondContact O-N 3.31Å
78	Q	84.2	Confident	77.5	Confident	130 Å²	130	85 Å²	85	61%	0.607	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-60.6	127.8	-178.3	-69	-177.7	2.8	0	0	109.8	E76 P80 P178	E76-Q78 PolarHBondContact O-N 2.72Å; Q78-P80 WeakPolarHBondContact O-CD 3.29Å; Q78-P178 HydrophobicContact CB-CG 4.34Å
79	L	94.1	Very high	79.8	Confident	85 Å²	85	83 Å²	83	45%	0.445	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-59.6	120.4	177.8	-176.8	66.4	0	0	0	109.5	P77 T81 A109 Q110 R199	P77-L79 PolarHBondContact O-N 3.31Å; L79-T81 PolarHBondContact O-N 2.6Å; L79-A109 HydrophobicContact CD2-CB 3.92Å; L79-Q110 HydrophobicContact CB-CG 4.26Å; L79-Q110 HydrophobicContact CD2-CB 4.01Å; L79-Q110 HydrophobicContact CD2-CG 3.92Å; L79-Q110 HydrophobicContact CG-CB 4.3Å; L79-Q110 HydrophobicContact CG-CG 4.28Å; L79-R199 HydrophobicContact CD1-CG 4.19Å
80	P	96.7	Very high	81.9	Confident	30 Å²	30	81.4 Å²	81.4	20%	0.195	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-59	135.2	-176.6	-24.4	32.2	0	0	0	112.7	Q78 P178 R199	Q78-P80 WeakPolarHBondContact O-CD 3.29Å; P80-P178 WeakPolarHBondContact CA-O 3.14Å; P80-P178 HydrophobicContact CB-CB 4.1Å; P80-P178 HydrophobicContact CG-CB 4.08Å; P80-R199 HydrophobicContact CB-CG 4.37Å; P80-R199 HydrophobicContact CG-CG 4.27Å; P80-R199 WeakPolarHBondContact O-CD 3.37Å; P80-R199 PolarHBondContact O-NH1 3.48Å
81	T	97.7	Very high	84	Confident	24 Å²	24	72.7 Å²	72.7	15%	0.147	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	129.4	175.5	-52.2	0	0	0	0	110.6	L79 Y83 Q110 H112 P178 G179 V180	L79-T81 PolarHBondContact O-N 2.6Å; T81-Y83 HydrophobicContact CG2-CD2 4.32Å; T81-Y83 HydrophobicContact CG2-CE1 4.11Å; T81-Y83 HydrophobicContact CG2-CE2 3.86Å; T81-Q110 CarbonylContact C-O 3.56Å; T81-Q110 WeakPolarHBondContact CA-O 3.5Å; T81-Q110 PolarHBondContact OG1-OE1 3.43Å; T81-H112 HydrophobicContact CG2-CB 3.99Å; T81-P178 PolarHBondContact N-O 3.18Å; T81-G179 CarbonylContact O-C 3.53Å; T81-G179 WeakPolarHBondContact O-CA 3.46Å; T81-V180 PolarHBondContact O-N 3.1Å
82	I	98.8	Very high	86.2	Confident	0 Å²	0	71 Å²	71	0%	0	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	119	167	-69.1	172	0	0	0	108.4	V108 Q110 L111 H112 V180 F195 M198 R199	I82-V108 HydrophobicContact CD1-CG1 4.23Å; I82-Q110 PolarHBondContact N-O 2.84Å; I82-L111 HydrophobicContact CB-CG 4.49Å; I82-L111 HydrophobicContact CG2-CD1 4.29Å; I82-L111 HydrophobicContact CG2-CG 4.4Å; I82-L111 CarbonylContact O-C 3.53Å; I82-L111 WeakPolarHBondContact O-CA 3.49Å; I82-H112 PolarHBondContact O-N 3.24Å; I82-V180 CarbonylContact C-O 3.58Å; I82-V180 WeakPolarHBondContact CA-O 3.22Å; I82-V180 HydrophobicContact CB-CG1 4.19Å; I82-V180 HydrophobicContact CG1-CG1 3.45Å; I82-V180 VanDerWaalsContact CG1-CG1 3.45Å; I82-F195 HydrophobicContact CD1-CB 3.78Å; I82-F195 HydrophobicContact CD1-CD1 3.92Å; I82-F195 HydrophobicContact CD1-CG 4.34Å; I82-F195 WeakPolarHBondContact CD1-O 3.38Å; I82-M198 HydrophobicContact CD1-CG 3.85Å; I82-M198 HydrophobicContact CD1-SD 3.9Å; I82-M198 HydrophobicContact CG1-CG 4.33Å; I82-M198 HydrophobicContact CG1-SD 4.3Å; I82-M198 HydrophobicContact CG2-SD 4.06Å; I82-R199 VanDerWaalsContact CG1-CZ 3.45Å
83	Y	98.8	Very high	88.3	Confident	21 Å²	21	63.8 Å²	63.8	8%	0.082	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	104.2	169.1	-63.5	-84.5	0	0	0	108.7	T81 H112 I114 W166 L167 H171 V180 L181 F182 L251	T81-Y83 HydrophobicContact CG2-CD2 4.32Å; T81-Y83 HydrophobicContact CG2-CE1 4.11Å; T81-Y83 HydrophobicContact CG2-CE2 3.86Å; Y83-H112 WeakPolarHBondContact CA-O 3.34Å; Y83-H112 HydrophobicContact CD1-CB 3.82Å; Y83-H112 HydrophobicContact CE1-CB 3.96Å; Y83-I114 HydrophobicContact CD1-CD1 4.15Å; Y83-W166 HydrophobicContact CD1-CZ3 4.4Å; Y83-W166 HydrophobicContact CE1-CZ3 4.49Å; Y83-L167 HydrophobicContact CD1-CD1 3.54Å; Y83-L167 HydrophobicContact CD2-CD1 3.99Å; Y83-L167 HydrophobicContact CE1-CD1 3.83Å; Y83-L167 HydrophobicContact CE2-CD1 4.26Å; Y83-L167 HydrophobicContact CG-CD1 3.63Å; Y83-H171 AromaticContact CZ-NE2 3.56Å; Y83-H171 PolarHBondContact OH-CE1 2.7Å; Y83-H171 PolarHBondContact OH-NE2 2.63Å; Y83-V180 PolarHBondContact N-O 2.89Å; Y83-L181 WeakPolarHBondContact O-CA 3.42Å; Y83-L181 WeakPolarHBondContact O-CD1 3.41Å; Y83-F182 PolarHBondContact O-N 2.65Å; Y83-L251 HydrophobicContact CE2-CD2 4.04Å
84	A	98.8	Very high	90.5	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	108.9	176.3	0	0	0	0	0	109.2	F105 H112 I114 F182	A84-F105 HydrophobicContact CB-CD2 4.5Å; A84-F105 HydrophobicContact CB-CE2 3.69Å; A84-F105 HydrophobicContact CB-CZ 3.96Å; A84-H112 PolarHBondContact N-O 3.38Å; A84-I114 PolarHBondContact O-N 3.16Å; A84-F182 CarbonylContact C-O 3.59Å; A84-F182 WeakPolarHBondContact CA-O 3.13Å
85	I	98.9	Very high	92.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	115	172	-69.2	174	0	0	0	108.4	I114 R160 G163 L181 F182 F183 A184	I85-I114 WeakPolarHBondContact CA-O 3.44Å; I85-I114 HydrophobicContact CG1-CB 4.11Å; I85-I114 HydrophobicContact CG1-CD1 3.88Å; I85-I114 HydrophobicContact CG1-CG2 4.38Å; I85-R160 HydrophobicContact CG2-CG 4.49Å; I85-G163 VanDerWaalsContact CD1-C 3.48Å; I85-L181 HydrophobicContact CB-CD1 4.4Å; I85-L181 HydrophobicContact CD1-CD1 3.28Å; I85-L181 HydrophobicContact CD1-CD2 4.19Å; I85-L181 HydrophobicContact CD1-CG 4.29Å; I85-L181 HydrophobicContact CG1-CD1 3.56Å; I85-F182 PolarHBondContact N-O 2.94Å; I85-F183 HydrophobicContact CB-CD1 3.89Å; I85-F183 HydrophobicContact CB-CE1 4.19Å; I85-F183 HydrophobicContact CD1-CD1 4.3Å; I85-F183 HydrophobicContact CD1-CE1 3.71Å; I85-F183 HydrophobicContact CG2-CD1 4Å; I85-F183 HydrophobicContact CG2-CE1 4.27Å; I85-A184 PolarHBondContact O-N 3Å
86	T	98.9	Very high	94.5	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	107.4	178.5	-62.8	0	0	0	0	110	L101 W113 I114 L115 V116 A184 D186	T86-L101 HydrophobicContact CG2-CD2 4Å; T86-W113 HydrophobicContact CG2-CZ2 4.39Å; T86-W113 PolarHBondContact OG1-NE1 3.24Å; T86-I114 PolarHBondContact N-O 3.17Å; T86-L115 HydrophobicContact CG2-CD1 3.58Å; T86-L115 WeakPolarHBondContact O-CD1 3.31Å; T86-V116 PolarHBondContact O-N 3.1Å; T86-A184 WeakPolarHBondContact CA-O 3.29Å; T86-A184 VanDerWaalsContact CB-O 3.24Å; T86-A184 WeakPolarHBondContact CB-O 3.45Å; T86-A184 VanDerWaalsContact CG2-O 3.27Å; T86-A184 WeakPolarHBondContact CG2-O 3.41Å; T86-A184 PolarHBondContact OG1-O 2.84Å; T86-D186 HydrophobicContact CG2-CB 3.81Å
87	P	98.8	Very high	96.2	Very high	11 Å²	11	40.7 Å²	40.7	7%	0.071	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	139	166.1	32.2	-34.1	0	0	0	109.6	V116 A156 Q159 R160 D185	P87-V116 WeakPolarHBondContact CA-O 3.34Å; P87-A156 HydrophobicContact CB-CB 3.44Å; P87-A156 VanDerWaalsContact CB-CB 3.44Å; P87-A156 HydrophobicContact CG-CB 3.47Å; P87-A156 VanDerWaalsContact CG-CB 3.47Å; P87-Q159 HydrophobicContact CB-CB 3.74Å; P87-Q159 HydrophobicContact CB-CG 4.45Å; P87-R160 HydrophobicContact CG-CG 4.48Å; P87-D185 WeakPolarHBondContact CG-OD1 3.27Å
88	T	98.7	Very high	97.6	Very high	4 Å²	4	34.7 Å²	34.7	3%	0.025	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	162.5	173.9	-169.8	0	0	0	0	111	Q94 L115 V116 E117 D118 D186	T88-Q94 PolarHBondContact OG1-NE2 3.38Å; T88-Q94 VanDerWaalsContact OG1-NE2 3.16Å; T88-L115 HydrophobicContact CG2-CD1 3.76Å; T88-L115 HydrophobicContact CG2-CG 4.05Å; T88-V116 PolarHBondContact N-O 2.86Å; T88-E117 HydrophobicContact CG2-CG 3.89Å; T88-E117 CarbonylContact O-C 3.59Å; T88-E117 WeakPolarHBondContact O-CA 3.33Å; T88-D118 PolarHBondContact O-N 3.46Å; T88-D186 WeakPolarHBondContact CB-OD2 3.42Å; T88-D186 PolarHBondContact OG1-OD2 2.85Å
89	Y	98.4	Very high	98.3	Very high	88 Å²	88	31.1 Å²	31.1	35%	0.345	18%	0.178	S	C	.	.			trans	-149.6	152	174.8	73.2	-79.7	0	0	0	110.9	R91 Q94 R155	Y89-R91 HydrophobicContact CD2-CB 4.34Å; Y89-R91 HydrophobicContact CE2-CB 3.88Å; Y89-R91 HydrophobicContact CE2-CG 4.31Å; Y89-R91 PolarHBondContact O-N 3.22Å; Y89-R91 PolarHBondContact O-NH1 3.29Å; Y89-R91 WeakPolarHBondContact OH-CD 3.24Å; Y89-Q94 PolarHBondContact O-NE2 3.32Å; Y89-R155 PolarHBondContact OH-NH1 3.32Å; Y89-R155 VanDerWaalsContact OH-NH1 3.09Å
90	S	98.3	Very high	98.5	Very high	79 Å²	79	31.9 Å²	31.9	55%	0.552	18%	0.175	S	C	*	.			trans	-64.5	120.6	-179.3	-55.1	0	0	0	0	111.9
91	R	97.9	Very high	98.6	Very high	42 Å²	42	30.7 Å²	30.7	16%	0.158	17%	0.167	C	C	.	.			trans	-159.3	162	176.6	69.2	-168	-175	-88.7	11.8	109.1	Y89 V93 Q94 D186	Y89-R91 HydrophobicContact CD2-CB 4.34Å; Y89-R91 HydrophobicContact CE2-CB 3.88Å; Y89-R91 HydrophobicContact CE2-CG 4.31Å; Y89-R91 PolarHBondContact O-N 3.22Å; Y89-R91 PolarHBondContact O-NH1 3.29Å; Y89-R91 WeakPolarHBondContact OH-CD 3.24Å; R91-V93 HydrophobicContact CG-CG2 3.92Å; R91-V93 PolarHBondContact O-N 3.24Å; R91-Q94 HydrophobicContact CG-CB 4.12Å; R91-Q94 VanDerWaalsContact O-CB 3.23Å; R91-Q94 WeakPolarHBondContact O-CB 3.35Å; R91-Q94 PolarHBondContact O-N 3.06Å; R91-D186 IonicContact CZ-OD1 2.69Å; R91-D186 IonicContact CZ-OD2 3.39Å; R91-D186 IonicContact NH1-OD1 2.88Å; R91-D186 IonicContact NH1-OD2 3.19Å; R91-D186 PolarHBondContact NH1-OD2 3.5Å; R91-D186 IonicContact NH2-OD1 3.86Å; R91-D186 PolarHBondContact NH2-OD1 3.32Å; R91-D186 IonicContact NH2-OD2 2.65Å; R91-D186 PolarHBondContact NH2-OD2 3.17Å
92	P	98.5	Very high	98.7	Very high	78 Å²	78	29.5 Å²	29.5	51%	0.506	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-35	-175.3	-30.8	37.1	0	0	0	115.2	V306 L308	P92-V306 HydrophobicContact CB-CB 4.18Å; P92-V306 HydrophobicContact CB-CG2 3.75Å; P92-L308 HydrophobicContact CG-CD1 4.46Å
93	V	98.6	Very high	98.7	Very high	24 Å²	24	33.2 Å²	33.2	15%	0.145	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-2.8	-179	-58.3	0	0	0	0	113.9	R91 K95 A96 E97 T303 V306	R91-V93 HydrophobicContact CG-CG2 3.92Å; R91-V93 PolarHBondContact O-N 3.24Å; V93-K95 PolarHBondContact O-N 3.36Å; V93-A96 PolarHBondContact O-N 3.11Å; V93-A96 VanDerWaalsContact O-N 3.11Å; V93-E97 HydrophobicContact CB-CG 4.11Å; V93-E97 HydrophobicContact CG2-CG 3.84Å; V93-E97 WeakPolarHBondContact O-CG 3.42Å; V93-E97 PolarHBondContact O-N 3.09Å; V93-T303 HydrophobicContact CB-CG2 4.35Å; V93-T303 HydrophobicContact CG1-CG2 3.86Å; V93-T303 HydrophobicContact CG2-CG2 4.46Å; V93-V306 HydrophobicContact CG1-CG2 3.38Å
94	Q	98.8	Very high	98.7	Very high	5 Å²	5	33.9 Å²	33.9	2%	0.023	19%	0.186	C	C	.	.	H	α-helix	trans	-53.2	-50.1	-169.3	-173.4	-172.6	24.8	0	0	112.4	T88 Y89 R91 A96 E97 L98	T88-Q94 PolarHBondContact OG1-NE2 3.38Å; T88-Q94 VanDerWaalsContact OG1-NE2 3.16Å; Y89-Q94 PolarHBondContact O-NE2 3.32Å; R91-Q94 HydrophobicContact CG-CB 4.12Å; R91-Q94 VanDerWaalsContact O-CB 3.23Å; R91-Q94 WeakPolarHBondContact O-CB 3.35Å; R91-Q94 PolarHBondContact O-N 3.06Å; Q94-A96 PolarHBondContact O-N 2.89Å; Q94-E97 WeakPolarHBondContact O-CB 3.38Å; Q94-E97 PolarHBondContact O-N 2.95Å; Q94-L98 HydrophobicContact CG-CD1 4.01Å; Q94-L98 HydrophobicContact CG-CG 4.44Å; Q94-L98 VanDerWaalsContact O-CG 3.3Å; Q94-L98 WeakPolarHBondContact O-CG 3.38Å; Q94-L98 PolarHBondContact O-N 2.99Å
95	K	98.8	Very high	98.7	Very high	44 Å²	44	34 Å²	34	19%	0.191	19%	0.186	C	C	.	.	H	α-helix	trans	-65.8	-39.2	-177.7	-173.5	172.7	164.2	-171	0	111.9	V93 T99 L125 E322 V323	V93-K95 PolarHBondContact O-N 3.36Å; K95-T99 VanDerWaalsContact O-CB 3.25Å; K95-T99 WeakPolarHBondContact O-CB 3.24Å; K95-T99 PolarHBondContact O-N 3.03Å; K95-T99 PolarHBondContact O-OG1 2.92Å; K95-L125 HydrophobicContact CB-CD1 4.39Å; K95-L125 HydrophobicContact CB-CD2 4.22Å; K95-L125 HydrophobicContact CD-CD1 4.47Å; K95-L125 HydrophobicContact CD-CG 4.48Å; K95-L125 HydrophobicContact CG-CD2 4.45Å; K95-E322 HydrophobicContact CD-CG 4.19Å; K95-E322 WeakPolarHBondContact CE-OE1 3.47Å; K95-E322 PolarHBondContact NZ-O 2.8Å; K95-E322 IonicContact NZ-OE1 2.75Å; K95-E322 PolarHBondContact NZ-OE1 3.47Å; K95-V323 WeakPolarHBondContact CB-OXT 3.3Å; K95-V323 WeakPolarHBondContact CD-OXT 3.44Å
96	A	98.7	Very high	98.6	Very high	59 Å²	59	39.4 Å²	39.4	49%	0.488	21%	0.207	S	C	.	.	H	α-helix	trans	-63.3	-43.5	175.1	0	0	0	0	0	112	V93 Q94 T99 R100	V93-A96 PolarHBondContact O-N 3.11Å; V93-A96 VanDerWaalsContact O-N 3.11Å; Q94-A96 PolarHBondContact O-N 2.89Å; A96-T99 WeakPolarHBondContact O-CB 3.37Å; A96-T99 PolarHBondContact O-N 3.14Å; A96-R100 PolarHBondContact O-N 3.48Å
97	E	98.8	Very high	98.6	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.019	24%	0.236	C	C	.	.	H	α-helix	trans	-60.3	-52.4	177.1	-66.5	-73.1	-166.5	0	0	111.9	V93 Q94 T99 R100 L101 D187 T303	V93-E97 HydrophobicContact CB-CG 4.11Å; V93-E97 HydrophobicContact CG2-CG 3.84Å; V93-E97 WeakPolarHBondContact O-CG 3.42Å; V93-E97 PolarHBondContact O-N 3.09Å; Q94-E97 WeakPolarHBondContact O-CB 3.38Å; Q94-E97 PolarHBondContact O-N 2.95Å; E97-T99 VanDerWaalsContact C-N 3.26Å; E97-T99 PolarHBondContact O-N 2.9Å; E97-R100 VanDerWaalsContact CD-NH2 3.29Å; E97-R100 WeakPolarHBondContact O-CG 3.12Å; E97-R100 PolarHBondContact O-N 2.9Å; E97-R100 IonicContact OE1-NH2 2.6Å; E97-R100 PolarHBondContact OE1-NH2 2.98Å; E97-R100 IonicContact OE2-CZ 2.7Å; E97-R100 IonicContact OE2-NE 3.27Å; E97-R100 PolarHBondContact OE2-NE 3.42Å; E97-R100 IonicContact OE2-NH2 2.99Å; E97-R100 PolarHBondContact OE2-NH2 2.83Å; E97-L101 WeakPolarHBondContact O-CB 3.24Å; E97-L101 PolarHBondContact O-N 3.26Å; E97-D187 WeakPolarHBondContact OE2-CA 3.31Å; E97-T303 WeakPolarHBondContact OE1-CB 3.43Å; E97-T303 PolarHBondContact OE1-OG1 3.15Å
98	L	98.8	Very high	98.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.9	-36.6	176.3	-64.5	177.4	0	0	0	111.6	Q94 L101 A102 W113 L115 V126 F129 D186	Q94-L98 HydrophobicContact CG-CD1 4.01Å; Q94-L98 HydrophobicContact CG-CG 4.44Å; Q94-L98 VanDerWaalsContact O-CG 3.3Å; Q94-L98 WeakPolarHBondContact O-CG 3.38Å; Q94-L98 PolarHBondContact O-N 2.99Å; L98-L101 PolarHBondContact O-N 3.25Å; L98-A102 WeakPolarHBondContact O-CB 3.24Å; L98-A102 PolarHBondContact O-N 3.03Å; L98-W113 HydrophobicContact CB-CH2 4.4Å; L98-W113 HydrophobicContact CD2-CH2 4.07Å; L98-W113 HydrophobicContact CD2-CZ2 3.95Å; L98-L115 HydrophobicContact CD1-CD2 4.15Å; L98-L115 HydrophobicContact CD2-CD1 3.74Å; L98-L115 HydrophobicContact CD2-CD2 4.09Å; L98-V126 HydrophobicContact CD1-CG2 4.07Å; L98-F129 HydrophobicContact CB-CD1 4.21Å; L98-F129 HydrophobicContact CB-CE1 3.68Å; L98-F129 HydrophobicContact CB-CE2 4.32Å; L98-F129 HydrophobicContact CB-CZ 3.76Å; L98-F129 HydrophobicContact CD1-CD1 4.45Å; L98-F129 VanDerWaalsContact O-CZ 3.27Å; L98-F129 WeakPolarHBondContact O-CZ 3.44Å; L98-D186 HydrophobicContact CD2-CB 4.05Å
99	T	98.8	Very high	98.6	Very high	56 Å²	56	48.3 Å²	48.3	34%	0.344	26%	0.257	S	S	.	.	H	α-helix	trans	-61.2	-54.2	177.9	-62.7	0	0	0	0	111	K95 A96 E97 L101 A102 N103 F129	K95-T99 VanDerWaalsContact O-CB 3.25Å; K95-T99 WeakPolarHBondContact O-CB 3.24Å; K95-T99 PolarHBondContact O-N 3.03Å; K95-T99 PolarHBondContact O-OG1 2.92Å; A96-T99 WeakPolarHBondContact O-CB 3.37Å; A96-T99 PolarHBondContact O-N 3.14Å; E97-T99 VanDerWaalsContact C-N 3.26Å; E97-T99 PolarHBondContact O-N 2.9Å; T99-L101 VanDerWaalsContact C-N 3.31Å; T99-L101 PolarHBondContact O-N 3.4Å; T99-A102 PolarHBondContact O-N 2.8Å; T99-N103 PolarHBondContact O-N 2.75Å; T99-N103 PolarHBondContact O-ND2 2.94Å; T99-F129 WeakPolarHBondContact OG1-CE2 3.3Å
100	R	98.6	Very high	98.5	Very high	100 Å²	100	49.2 Å²	49.2	38%	0.377	27%	0.265	S	S	.	.	H	α-helix	trans	-63.7	-38.7	-179.7	66.4	177.3	-178.4	176	-1.1	112	A96 E97 N103 T104 D187 T303	A96-R100 PolarHBondContact O-N 3.48Å; E97-R100 VanDerWaalsContact CD-NH2 3.29Å; E97-R100 WeakPolarHBondContact O-CG 3.12Å; E97-R100 PolarHBondContact O-N 2.9Å; E97-R100 IonicContact OE1-NH2 2.6Å; E97-R100 PolarHBondContact OE1-NH2 2.98Å; E97-R100 IonicContact OE2-CZ 2.7Å; E97-R100 IonicContact OE2-NE 3.27Å; E97-R100 PolarHBondContact OE2-NE 3.42Å; E97-R100 IonicContact OE2-NH2 2.99Å; E97-R100 PolarHBondContact OE2-NH2 2.83Å; R100-N103 WeakPolarHBondContact O-CB 3.33Å; R100-N103 PolarHBondContact O-N 2.69Å; R100-T104 PolarHBondContact O-N 2.92Å; R100-D187 PolarHBondContact NH2-O 3.24Å; R100-D187 VanDerWaalsContact NH2-O 3.12Å; R100-T303 PolarHBondContact NH2-OG1 2.9Å
101	L	98.8	Very high	98.5	Very high	5 Å²	5	45.9 Å²	45.9	3%	0.026	24%	0.241	C	C	.	.	H	α-helix	trans	-64.8	-45.1	177.3	-174.6	58.8	0	0	0	111.7	T86 E97 L98 T99 N103 T104 F105 W113 Y190	T86-L101 HydrophobicContact CG2-CD2 4Å; E97-L101 WeakPolarHBondContact O-CB 3.24Å; E97-L101 PolarHBondContact O-N 3.26Å; L98-L101 PolarHBondContact O-N 3.25Å; T99-L101 VanDerWaalsContact C-N 3.31Å; T99-L101 PolarHBondContact O-N 3.4Å; L101-N103 VanDerWaalsContact C-N 3.27Å; L101-N103 PolarHBondContact O-N 2.87Å; L101-T104 WeakPolarHBondContact O-CB 3.35Å; L101-T104 PolarHBondContact O-N 3.23Å; L101-T104 VanDerWaalsContact O-N 3.15Å; L101-F105 HydrophobicContact CD1-CD1 3.96Å; L101-F105 HydrophobicContact CD1-CE1 3.4Å; L101-F105 VanDerWaalsContact CD1-CE1 3.4Å; L101-F105 HydrophobicContact CD1-CE2 4.16Å; L101-F105 HydrophobicContact CD1-CZ 3.54Å; L101-F105 HydrophobicContact CD2-CE2 4.17Å; L101-F105 HydrophobicContact CD2-CZ 4.14Å; L101-F105 HydrophobicContact CG-CD1 4.43Å; L101-F105 HydrophobicContact CG-CD2 4.3Å; L101-F105 HydrophobicContact CG-CE1 4.1Å; L101-F105 HydrophobicContact CG-CE2 3.99Å; L101-F105 HydrophobicContact CG-CZ 3.89Å; L101-F105 PolarHBondContact O-N 3.31Å; L101-W113 HydrophobicContact CD2-CZ2 3.95Å; L101-W113 HydrophobicContact CG-CZ2 4.34Å; L101-Y190 HydrophobicContact CD1-CD2 3.61Å; L101-Y190 HydrophobicContact CD1-CE2 3.76Å
102	A	98.8	Very high	98.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.7	-34.1	175.9	0	0	0	0	0	112.3	L98 T99 T104 F105 R106 W113 F129 A133 L135	L98-A102 WeakPolarHBondContact O-CB 3.24Å; L98-A102 PolarHBondContact O-N 3.03Å; T99-A102 PolarHBondContact O-N 2.8Å; A102-T104 VanDerWaalsContact C-N 3.31Å; A102-T104 PolarHBondContact O-N 3.35Å; A102-F105 PolarHBondContact O-N 2.78Å; A102-R106 VanDerWaalsContact O-CB 3.3Å; A102-R106 WeakPolarHBondContact O-CB 3.44Å; A102-R106 PolarHBondContact O-N 3.37Å; A102-W113 HydrophobicContact CB-CH2 4.14Å; A102-W113 HydrophobicContact CB-CZ3 3.92Å; A102-F129 HydrophobicContact CB-CE1 4.23Å; A102-F129 HydrophobicContact CB-CZ 3.77Å; A102-A133 HydrophobicContact CB-CB 4.49Å; A102-L135 HydrophobicContact CB-CD2 4.37Å
103	N	98.7	Very high	98.6	Very high	78 Å²	78	42 Å²	42	42%	0.417	22%	0.218	S	C	.	.	H	α-helix	trans	-62.8	-38.7	175.6	-82.3	-123.7	0	0	0	111.3	T99 R100 L101 Q107	T99-N103 PolarHBondContact O-N 2.75Å; T99-N103 PolarHBondContact O-ND2 2.94Å; R100-N103 WeakPolarHBondContact O-CB 3.33Å; R100-N103 PolarHBondContact O-N 2.69Å; L101-N103 VanDerWaalsContact C-N 3.27Å; L101-N103 PolarHBondContact O-N 2.87Å; N103-Q107 PolarHBondContact O-NE2 3.41Å
104	T	98.8	Very high	98.6	Very high	34 Å²	34	40.9 Å²	40.9	21%	0.209	21%	0.211	C	C	.	.	H	α-helix	trans	-69.2	-51.9	171.4	-59.3	0	0	0	0	111.6	R100 L101 A102 R106 Q107 L192 F195	R100-T104 PolarHBondContact O-N 2.92Å; L101-T104 WeakPolarHBondContact O-CB 3.35Å; L101-T104 PolarHBondContact O-N 3.23Å; L101-T104 VanDerWaalsContact O-N 3.15Å; A102-T104 VanDerWaalsContact C-N 3.31Å; A102-T104 PolarHBondContact O-N 3.35Å; T104-R106 VanDerWaalsContact C-N 3.29Å; T104-R106 PolarHBondContact O-N 3.46Å; T104-Q107 WeakPolarHBondContact O-CB 3.44Å; T104-Q107 PolarHBondContact O-N 3.32Å; T104-Q107 VanDerWaalsContact O-N 3.09Å; T104-L192 HydrophobicContact CG2-CD2 3.94Å; T104-F195 HydrophobicContact CG2-CE2 4.14Å
105	F	98.8	Very high	98.6	Very high	2 Å²	2	40.7 Å²	40.7	1%	0.009	21%	0.21	C	C	.	.	H	α-helix	trans	-63.1	-31.6	-174.1	-77.2	7.8	0	0	0	113.6	A84 L101 A102 Q107 V108 L111 W113 L135 A184 Y190 F195	A84-F105 HydrophobicContact CB-CD2 4.5Å; A84-F105 HydrophobicContact CB-CE2 3.69Å; A84-F105 HydrophobicContact CB-CZ 3.96Å; L101-F105 HydrophobicContact CD1-CD1 3.96Å; L101-F105 HydrophobicContact CD1-CE1 3.4Å; L101-F105 VanDerWaalsContact CD1-CE1 3.4Å; L101-F105 HydrophobicContact CD1-CE2 4.16Å; L101-F105 HydrophobicContact CD1-CZ 3.54Å; L101-F105 HydrophobicContact CD2-CE2 4.17Å; L101-F105 HydrophobicContact CD2-CZ 4.14Å; L101-F105 HydrophobicContact CG-CD1 4.43Å; L101-F105 HydrophobicContact CG-CD2 4.3Å; L101-F105 HydrophobicContact CG-CE1 4.1Å; L101-F105 HydrophobicContact CG-CE2 3.99Å; L101-F105 HydrophobicContact CG-CZ 3.89Å; L101-F105 PolarHBondContact O-N 3.31Å; A102-F105 PolarHBondContact O-N 2.78Å; F105-Q107 PolarHBondContact O-N 3.09Å; F105-Q107 VanDerWaalsContact O-N 3.14Å; F105-V108 WeakPolarHBondContact O-CB 3.47Å; F105-V108 PolarHBondContact O-N 3.21Å; F105-L111 HydrophobicContact CB-CD1 4.23Å; F105-L111 HydrophobicContact CB-CD2 4.08Å; F105-L111 HydrophobicContact CD1-CD1 4.12Å; F105-L111 HydrophobicContact CD2-CD1 4.29Å; F105-L111 HydrophobicContact CD2-CD2 3.9Å; F105-L111 HydrophobicContact CG-CD1 3.95Å; F105-L111 HydrophobicContact CG-CD2 4.12Å; F105-W113 AromaticContact CD2-CD1 3.93Å; F105-W113 HydrophobicContact CD2-CD2 4.07Å; F105-W113 AromaticContact CD2-CG 3.97Å; F105-W113 HydrophobicContact CD2-CG 3.97Å; F105-W113 AromaticContact CD2-NE1 3.98Å; F105-W113 AromaticContact CE2-CD1 3.63Å; F105-W113 HydrophobicContact CE2-CD2 4.38Å; F105-W113 AromaticContact CE2-CE2 3.99Å; F105-W113 HydrophobicContact CE2-CG 4.14Å; F105-W113 AromaticContact CE2-NE1 3.53Å; F105-L135 HydrophobicContact CB-CD1 3.79Å; F105-L135 HydrophobicContact CD2-CD1 4.36Å; F105-A184 HydrophobicContact CZ-CB 3.94Å; F105-Y190 HydrophobicContact CE1-CD2 4.39Å; F105-F195 HydrophobicContact CD1-CE1 4.2Å; F105-F195 AromaticContact CD1-CZ 3.86Å; F105-F195 HydrophobicContact CD1-CZ 3.86Å; F105-F195 AromaticContact CE1-CE1 3.85Å; F105-F195 HydrophobicContact CE1-CE1 3.85Å; F105-F195 AromaticContact CE1-CZ 3.55Å; F105-F195 HydrophobicContact CE1-CZ 3.55Å
106	R	98.4	Very high	98.6	Very high	115 Å²	115	38.6 Å²	38.6	43%	0.434	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-22.3	177.1	-166.2	179.4	-55.8	110.6	5.1	113.4	A102 T104 V108 A133	A102-R106 VanDerWaalsContact O-CB 3.3Å; A102-R106 WeakPolarHBondContact O-CB 3.44Å; A102-R106 PolarHBondContact O-N 3.37Å; T104-R106 VanDerWaalsContact C-N 3.29Å; T104-R106 PolarHBondContact O-N 3.46Å; R106-V108 VanDerWaalsContact C-N 3.32Å; R106-A133 VanDerWaalsContact CZ-O 3.27Å; R106-A133 PolarHBondContact NE-O 2.83Å; R106-A133 PolarHBondContact NH2-O 2.81Å
107	Q	98.5	Very high	98.6	Very high	131 Å²	131	35.8 Å²	35.8	61%	0.612	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-5	178.8	-59.9	171	63.3	0	0	112.4	N103 T104 F105 L192	N103-Q107 PolarHBondContact O-NE2 3.41Å; T104-Q107 WeakPolarHBondContact O-CB 3.44Å; T104-Q107 PolarHBondContact O-N 3.32Å; T104-Q107 VanDerWaalsContact O-N 3.09Å; F105-Q107 PolarHBondContact O-N 3.09Å; F105-Q107 VanDerWaalsContact O-N 3.14Å; Q107-L192 HydrophobicContact CB-CD1 4.18Å; Q107-L192 HydrophobicContact CB-CD2 3.86Å
108	V	98.5	Very high	98.6	Very high	15 Å²	15	37.1 Å²	37.1	9%	0.091	19%	0.185	C	C	.	.	S	Bend	trans	-97.5	113.2	-176.8	-175.3	0	0	0	0	109.7	I82 F105 R106 L111 L192 F195	I82-V108 HydrophobicContact CD1-CG1 4.23Å; F105-V108 WeakPolarHBondContact O-CB 3.47Å; F105-V108 PolarHBondContact O-N 3.21Å; R106-V108 VanDerWaalsContact C-N 3.32Å; V108-L111 HydrophobicContact CB-CB 4.08Å; V108-L111 HydrophobicContact CB-CD1 3.83Å; V108-L111 HydrophobicContact CG1-CB 3.98Å; V108-L111 HydrophobicContact CG1-CD1 3.84Å; V108-L111 HydrophobicContact CG2-CD1 4.25Å; V108-L192 HydrophobicContact CG2-CD2 4.11Å; V108-F195 HydrophobicContact CB-CG 4.45Å; V108-F195 HydrophobicContact CG1-CB 3.67Å; V108-F195 HydrophobicContact CG1-CD1 4.05Å; V108-F195 HydrophobicContact CG1-CG 3.86Å; V108-F195 HydrophobicContact CG2-CB 4.15Å; V108-F195 HydrophobicContact CG2-CD1 4.11Å; V108-F195 HydrophobicContact CG2-CD2 3.63Å; V108-F195 HydrophobicContact CG2-CE1 4.47Å; V108-F195 HydrophobicContact CG2-CE2 4.03Å; V108-F195 HydrophobicContact CG2-CG 3.68Å; V108-F195 HydrophobicContact CG2-CZ 4.45Å
109	A	97.6	Very high	98.6	Very high	55 Å²	55	38.2 Å²	38.2	46%	0.455	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	144.3	175.3	0	0	0	0	0	111.5	L79 L111 R199	L79-A109 HydrophobicContact CD2-CB 3.92Å; A109-L111 VanDerWaalsContact C-N 3.3Å; A109-L111 PolarHBondContact O-N 3.23Å; A109-R199 VanDerWaalsContact O-CZ 3.22Å; A109-R199 PolarHBondContact O-NH1 2.83Å; A109-R199 PolarHBondContact O-NH2 3.11Å
110	Q	97.3	Very high	98.5	Very high	108 Å²	108	39.4 Å²	39.4	51%	0.505	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	49.5	179.1	-75.4	-67.2	-42.8	0	0	112.9	L79 T81 I82 R199	L79-Q110 HydrophobicContact CB-CG 4.26Å; L79-Q110 HydrophobicContact CD2-CB 4.01Å; L79-Q110 HydrophobicContact CD2-CG 3.92Å; L79-Q110 HydrophobicContact CG-CB 4.3Å; L79-Q110 HydrophobicContact CG-CG 4.28Å; T81-Q110 CarbonylContact C-O 3.56Å; T81-Q110 WeakPolarHBondContact CA-O 3.5Å; T81-Q110 PolarHBondContact OG1-OE1 3.43Å; I82-Q110 PolarHBondContact N-O 2.84Å; Q110-R199 PolarHBondContact O-NH1 3.49Å
111	L	98.5	Very high	98.5	Very high	9 Å²	9	37.6 Å²	37.6	5%	0.047	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.5	171	-174.6	150.1	0	0	0	109.6	I82 F105 V108 A109 W113 L135 F195	I82-L111 HydrophobicContact CB-CG 4.49Å; I82-L111 HydrophobicContact CG2-CD1 4.29Å; I82-L111 HydrophobicContact CG2-CG 4.4Å; I82-L111 CarbonylContact O-C 3.53Å; I82-L111 WeakPolarHBondContact O-CA 3.49Å; F105-L111 HydrophobicContact CB-CD1 4.23Å; F105-L111 HydrophobicContact CB-CD2 4.08Å; F105-L111 HydrophobicContact CD1-CD1 4.12Å; F105-L111 HydrophobicContact CD2-CD1 4.29Å; F105-L111 HydrophobicContact CD2-CD2 3.9Å; F105-L111 HydrophobicContact CG-CD1 3.95Å; F105-L111 HydrophobicContact CG-CD2 4.12Å; V108-L111 HydrophobicContact CB-CB 4.08Å; V108-L111 HydrophobicContact CB-CD1 3.83Å; V108-L111 HydrophobicContact CG1-CB 3.98Å; V108-L111 HydrophobicContact CG1-CD1 3.84Å; V108-L111 HydrophobicContact CG2-CD1 4.25Å; A109-L111 VanDerWaalsContact C-N 3.3Å; A109-L111 PolarHBondContact O-N 3.23Å; L111-W113 HydrophobicContact CD2-CB 4.05Å; L111-L135 HydrophobicContact CD2-CD1 4.28Å; L111-F195 HydrophobicContact CD1-CD1 4.16Å; L111-F195 HydrophobicContact CD1-CE1 4.06Å
112	H	98.6	Very high	98.5	Very high	39 Å²	39	44.5 Å²	44.5	18%	0.181	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	117.5	171	-172.2	113.4	0	0	0	109	T81 I82 Y83 A84 T138 W166	T81-H112 HydrophobicContact CG2-CB 3.99Å; I82-H112 PolarHBondContact O-N 3.24Å; Y83-H112 WeakPolarHBondContact CA-O 3.34Å; Y83-H112 HydrophobicContact CD1-CB 3.82Å; Y83-H112 HydrophobicContact CE1-CB 3.96Å; A84-H112 PolarHBondContact N-O 3.38Å; H112-T138 PolarHBondContact CE1-OG1 3.24Å; H112-T138 PolarHBondContact NE2-OG1 2.97Å; H112-W166 AromaticContact CE1-CH2 3.92Å; H112-W166 AromaticContact NE2-CH2 3.55Å
113	W	98.8	Very high	98.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	114.6	-175.9	-169.2	23	0	0	0	112.1	T86 L98 L101 A102 F105 L111 L115 F129 L130 L135 P136 S137 T138	T86-W113 HydrophobicContact CG2-CZ2 4.39Å; T86-W113 PolarHBondContact OG1-NE1 3.24Å; L98-W113 HydrophobicContact CB-CH2 4.4Å; L98-W113 HydrophobicContact CD2-CH2 4.07Å; L98-W113 HydrophobicContact CD2-CZ2 3.95Å; L101-W113 HydrophobicContact CD2-CZ2 3.95Å; L101-W113 HydrophobicContact CG-CZ2 4.34Å; A102-W113 HydrophobicContact CB-CH2 4.14Å; A102-W113 HydrophobicContact CB-CZ3 3.92Å; F105-W113 AromaticContact CD2-CD1 3.93Å; F105-W113 HydrophobicContact CD2-CD2 4.07Å; F105-W113 AromaticContact CD2-CG 3.97Å; F105-W113 HydrophobicContact CD2-CG 3.97Å; F105-W113 AromaticContact CD2-NE1 3.98Å; F105-W113 AromaticContact CE2-CD1 3.63Å; F105-W113 HydrophobicContact CE2-CD2 4.38Å; F105-W113 AromaticContact CE2-CE2 3.99Å; F105-W113 HydrophobicContact CE2-CG 4.14Å; F105-W113 AromaticContact CE2-NE1 3.53Å; L111-W113 HydrophobicContact CD2-CB 4.05Å; W113-L115 HydrophobicContact CH2-CD2 4.38Å; W113-L115 HydrophobicContact CZ2-CD1 3.93Å; W113-L115 HydrophobicContact CZ2-CD2 4.34Å; W113-F129 AromaticContact CH2-CE1 3.84Å; W113-F129 HydrophobicContact CH2-CE1 3.84Å; W113-F129 AromaticContact CZ3-CE1 3.78Å; W113-F129 HydrophobicContact CZ3-CE1 3.78Å; W113-L130 HydrophobicContact CD2-CD2 4.42Å; W113-L130 HydrophobicContact CE3-CD2 3.52Å; W113-L130 HydrophobicContact CZ3-CD2 3.61Å; W113-L135 HydrophobicContact CB-CD1 3.79Å; W113-L135 HydrophobicContact CB-CG 4.45Å; W113-L135 HydrophobicContact CD2-CD1 4Å; W113-L135 HydrophobicContact CE3-CD1 3.49Å; W113-L135 VanDerWaalsContact CE3-CD1 3.49Å; W113-L135 HydrophobicContact CE3-CD2 3.9Å; W113-L135 HydrophobicContact CE3-CG 3.93Å; W113-L135 HydrophobicContact CG-CD1 4.19Å; W113-L135 HydrophobicContact CZ3-CD1 4.23Å; W113-L135 HydrophobicContact CZ3-CD2 4.11Å; W113-P136 PolarHBondContact N-O 2.92Å; W113-S137 CarbonylContact O-C 3.42Å; W113-S137 WeakPolarHBondContact O-CA 3.31Å; W113-S137 VanDerWaalsContact O-CB 3.28Å; W113-S137 WeakPolarHBondContact O-CB 3.34Å; W113-T138 PolarHBondContact O-N 3.47Å
114	I	98.9	Very high	98.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	95.1	176.9	-53	168.9	0	0	0	107.7	Y83 A84 I85 T86 V116 L140 W166 L167	Y83-I114 HydrophobicContact CD1-CD1 4.15Å; A84-I114 PolarHBondContact O-N 3.16Å; I85-I114 WeakPolarHBondContact CA-O 3.44Å; I85-I114 HydrophobicContact CG1-CB 4.11Å; I85-I114 HydrophobicContact CG1-CD1 3.88Å; I85-I114 HydrophobicContact CG1-CG2 4.38Å; T86-I114 PolarHBondContact N-O 3.17Å; I114-V116 HydrophobicContact CG2-CG2 3.99Å; I114-L140 HydrophobicContact CG2-CD1 3.89Å; I114-W166 HydrophobicContact CD1-CE3 3.62Å; I114-W166 HydrophobicContact CD1-CZ3 3.55Å; I114-W166 HydrophobicContact CG1-CE3 4.14Å; I114-W166 HydrophobicContact CG1-CZ3 3.93Å; I114-L167 HydrophobicContact CD1-CD1 4.36Å
115	L	98.9	Very high	98.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	121.3	-179.3	-170.2	62.2	0	0	0	109.8	T86 T88 L98 W113 V126 L130 T138 L140	T86-L115 HydrophobicContact CG2-CD1 3.58Å; T86-L115 WeakPolarHBondContact O-CD1 3.31Å; T88-L115 HydrophobicContact CG2-CD1 3.76Å; T88-L115 HydrophobicContact CG2-CG 4.05Å; L98-L115 HydrophobicContact CD1-CD2 4.15Å; L98-L115 HydrophobicContact CD2-CD1 3.74Å; L98-L115 HydrophobicContact CD2-CD2 4.09Å; W113-L115 HydrophobicContact CH2-CD2 4.38Å; W113-L115 HydrophobicContact CZ2-CD1 3.93Å; W113-L115 HydrophobicContact CZ2-CD2 4.34Å; L115-V126 HydrophobicContact CD2-CG1 3.43Å; L115-V126 VanDerWaalsContact CD2-CG1 3.43Å; L115-V126 HydrophobicContact CG-CG1 4.28Å; L115-L130 HydrophobicContact CB-CD1 4.19Å; L115-L130 HydrophobicContact CB-CD2 4.49Å; L115-L130 HydrophobicContact CD2-CD1 3.98Å; L115-L130 HydrophobicContact CD2-CD2 3.86Å; L115-L130 HydrophobicContact CD2-CG 4Å; L115-T138 PolarHBondContact N-O 3.33Å; L115-L140 PolarHBondContact O-N 3.46Å
116	V	98.9	Very high	98.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	110.4	-172.6	-167.4	0	0	0	0	110.6	T86 P87 T88 I114 L140 V142 Q159 A162	T86-V116 PolarHBondContact O-N 3.1Å; P87-V116 WeakPolarHBondContact CA-O 3.34Å; T88-V116 PolarHBondContact N-O 2.86Å; I114-V116 HydrophobicContact CG2-CG2 3.99Å; V116-L140 WeakPolarHBondContact CA-O 3.11Å; V116-L140 HydrophobicContact CB-CB 4.39Å; V116-L140 HydrophobicContact CG1-CB 4.01Å; V116-L140 HydrophobicContact CG2-CB 4.1Å; V116-L140 HydrophobicContact CG2-CD1 4.19Å; V116-V142 HydrophobicContact CG1-CG1 4.08Å; V116-Q159 HydrophobicContact CB-CB 3.95Å; V116-Q159 HydrophobicContact CB-CG 4.46Å; V116-Q159 HydrophobicContact CG1-CB 3.7Å; V116-Q159 HydrophobicContact CG1-CG 3.95Å; V116-A162 HydrophobicContact CG1-CB 4.17Å
117	E	98.9	Very high	98.5	Very high	1 Å²	1	45 Å²	45	1%	0.005	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	134.5	179.9	-63.1	-170.3	-90.6	0	0	112.3	T88 A119 R122 S123 V126 H139 L140 H141 V142	T88-E117 HydrophobicContact CG2-CG 3.89Å; T88-E117 CarbonylContact O-C 3.59Å; T88-E117 WeakPolarHBondContact O-CA 3.33Å; E117-A119 HydrophobicContact CB-CB 4.13Å; E117-A119 PolarHBondContact O-N 3.4Å; E117-R122 VanDerWaalsContact OE1-CA 3.3Å; E117-R122 WeakPolarHBondContact OE1-CA 3.49Å; E117-S123 PolarHBondContact OE1-N 2.82Å; E117-S123 PolarHBondContact OE1-OG 2.79Å; E117-S123 VanDerWaalsContact OE2-CB 3.29Å; E117-S123 WeakPolarHBondContact OE2-CB 3.21Å; E117-S123 PolarHBondContact OE2-OG 3.45Å; E117-V126 HydrophobicContact CG-CB 4.41Å; E117-V126 HydrophobicContact CG-CG1 4.3Å; E117-V126 HydrophobicContact CG-CG2 4.23Å; E117-V126 WeakPolarHBondContact OE2-CG2 3.4Å; E117-H139 IonicContact OE1-CD2 3.4Å; E117-H139 IonicContact OE1-CE1 3.43Å; E117-H139 PolarHBondContact OE1-CE1 3.38Å; E117-H139 IonicContact OE1-NE2 3.5Å; E117-H139 PolarHBondContact OE1-NE2 3.06Å; E117-L140 PolarHBondContact N-O 3.04Å; E117-H141 HydrophobicContact CB-CB 4.19Å; E117-H141 CarbonylContact O-C 3.42Å; E117-H141 WeakPolarHBondContact O-CA 3.34Å; E117-V142 PolarHBondContact O-N 3.3Å
118	D	98.6	Very high	98.5	Very high	32 Å²	32	43.9 Å²	43.9	17%	0.171	24%	0.243	C	C	.	.	S	Bend	trans	-74.6	70.7	161.7	179.1	6.9	0	0	0	110.1	T88 V142 T144 K149 Q159	T88-D118 PolarHBondContact O-N 3.46Å; D118-V142 WeakPolarHBondContact CA-O 3.43Å; D118-T144 PolarHBondContact OD1-N 3.44Å; D118-K149 WeakPolarHBondContact OD1-CE 3.3Å; D118-K149 IonicContact OD1-NZ 3.47Å; D118-K149 PolarHBondContact OD1-NZ 2.74Å; D118-K149 WeakPolarHBondContact OD2-CE 3.38Å; D118-K149 IonicContact OD2-NZ 2.64Å; D118-K149 PolarHBondContact OD2-NZ 3.21Å; D118-Q159 HydrophobicContact CB-CG 4.29Å
119	A	98.3	Very high	98.5	Very high	23 Å²	23	44.1 Å²	44.1	19%	0.19	24%	0.243	C	C	.	.	S	Bend	trans	-149.4	154.8	-178.5	0	0	0	0	0	111.4	E117 A121 H141 V142 P143	E117-A119 HydrophobicContact CB-CB 4.13Å; E117-A119 PolarHBondContact O-N 3.4Å; A119-A121 WeakPolarHBondContact CB-O 3.26Å; A119-A121 PolarHBondContact O-N 3.15Å; A119-H141 PolarHBondContact O-ND1 3.47Å; A119-V142 CarbonylContact O-C 3.56Å; A119-P143 WeakPolarHBondContact O-CD 3.46Å
120	A	98.1	Very high	98.5	Very high	81 Å²	81	42 Å²	42	67%	0.669	22%	0.224	S	C	*	.	S	Bend	trans	-71.4	-21.3	176.8	0	0	0	0	0	112.9	H141 P143	A120-H141 VanDerWaalsContact C-ND1 3.35Å; A120-H141 PolarHBondContact O-CE1 3.07Å; A120-H141 PolarHBondContact O-ND1 3Å; A120-H141 VanDerWaalsContact O-ND1 3.12Å; A120-P143 HydrophobicContact CB-CG 4.48Å
121	A	98.5	Very high	98.6	Very high	62 Å²	62	41 Å²	41	51%	0.512	23%	0.234	S	C	.	.	S	Bend	trans	-145.5	161.1	175.2	0	0	0	0	0	109.3	A119 H141	A119-A121 WeakPolarHBondContact CB-O 3.26Å; A119-A121 PolarHBondContact O-N 3.15Å; A121-H141 WeakPolarHBondContact CA-ND1 3.44Å
122	R	98.7	Very high	98.5	Very high	150 Å²	150	48.9 Å²	48.9	57%	0.566	26%	0.263	S	S	*	.			trans	-62.8	135.2	172.1	-66.7	178.4	-63.2	175.7	3.8	110.4	E117 H141	E117-R122 VanDerWaalsContact OE1-CA 3.3Å; E117-R122 WeakPolarHBondContact OE1-CA 3.49Å; R122-H141 HydrophobicContact CG-CB 4.32Å
123	S	98.6	Very high	98.3	Very high	27 Å²	27	47.2 Å²	47.2	19%	0.189	26%	0.256	C	S	.	.			trans	-80.6	149.5	174.2	71.6	0	0	0	0	111.2	E117 L125 V126 S127	E117-S123 PolarHBondContact OE1-N 2.82Å; E117-S123 PolarHBondContact OE1-OG 2.79Å; E117-S123 VanDerWaalsContact OE2-CB 3.29Å; E117-S123 WeakPolarHBondContact OE2-CB 3.21Å; E117-S123 PolarHBondContact OE2-OG 3.45Å; S123-L125 VanDerWaalsContact C-N 3.29Å; S123-L125 PolarHBondContact O-N 3.36Å; S123-V126 WeakPolarHBondContact OG-CB 3.47Å; S123-V126 WeakPolarHBondContact OG-CG2 3.43Å; S123-V126 PolarHBondContact OG-N 3.32Å; S123-S127 WeakPolarHBondContact O-CB 3.34Å; S123-S127 PolarHBondContact O-N 2.85Å; S123-S127 PolarHBondContact O-OG 2.98Å
124	E	98.5	Very high	97.9	Very high	138 Å²	138	50.3 Å²	50.3	65%	0.645	29%	0.288	S	S	*	.	H	α-helix	trans	-64.9	-36.1	173.6	-64.6	-175.8	-179.9	0	0	112.2	S127 R128	E124-S127 PolarHBondContact O-N 2.98Å; E124-R128 WeakPolarHBondContact O-CB 3.23Å; E124-R128 WeakPolarHBondContact O-CG 3.3Å; E124-R128 PolarHBondContact O-N 2.89Å; E124-R128 IonicContact OE2-CZ 3.68Å; E124-R128 IonicContact OE2-NH1 3.65Å; E124-R128 PolarHBondContact OE2-NH1 2.79Å
125	L	98.7	Very high	97.7	Very high	31 Å²	31	51.1 Å²	51.1	16%	0.162	29%	0.292	C	S	.	.	H	α-helix	trans	-55.6	-55	177.5	-178.6	161.1	0	0	0	109.9	K95 S123 R128 F129 E322	K95-L125 HydrophobicContact CB-CD1 4.39Å; K95-L125 HydrophobicContact CB-CD2 4.22Å; K95-L125 HydrophobicContact CD-CD1 4.47Å; K95-L125 HydrophobicContact CD-CG 4.48Å; K95-L125 HydrophobicContact CG-CD2 4.45Å; S123-L125 VanDerWaalsContact C-N 3.29Å; S123-L125 PolarHBondContact O-N 3.36Å; L125-R128 PolarHBondContact O-N 3.4Å; L125-F129 WeakPolarHBondContact O-CB 3.42Å; L125-F129 PolarHBondContact O-N 2.97Å; L125-E322 HydrophobicContact CD1-CG 3.98Å; L125-E322 HydrophobicContact CG-CG 4.33Å
126	V	98.8	Very high	97.7	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-68.2	-38.3	-178	176.8	0	0	0	0	111.2	L98 L115 E117 S123 F129 L130 H139	L98-V126 HydrophobicContact CD1-CG2 4.07Å; L115-V126 HydrophobicContact CD2-CG1 3.43Å; L115-V126 VanDerWaalsContact CD2-CG1 3.43Å; L115-V126 HydrophobicContact CG-CG1 4.28Å; E117-V126 HydrophobicContact CG-CB 4.41Å; E117-V126 HydrophobicContact CG-CG1 4.3Å; E117-V126 HydrophobicContact CG-CG2 4.23Å; E117-V126 WeakPolarHBondContact OE2-CG2 3.4Å; S123-V126 WeakPolarHBondContact OG-CB 3.47Å; S123-V126 WeakPolarHBondContact OG-CG2 3.43Å; S123-V126 PolarHBondContact OG-N 3.32Å; V126-F129 PolarHBondContact O-N 2.81Å; V126-L130 HydrophobicContact CG1-CD1 4.11Å; V126-L130 HydrophobicContact CG1-CG 4.29Å; V126-L130 PolarHBondContact O-N 3.35Å; V126-H139 WeakPolarHBondContact CG1-NE2 3.27Å
127	S	98.6	Very high	97.6	Very high	44 Å²	44	57.2 Å²	57.2	31%	0.308	33%	0.332	S	S	.	.	H	α-helix	trans	-59.7	-50	176.9	-56.4	0	0	0	0	111.7	S123 E124 F129 A131 H139	S123-S127 WeakPolarHBondContact O-CB 3.34Å; S123-S127 PolarHBondContact O-N 2.85Å; S123-S127 PolarHBondContact O-OG 2.98Å; E124-S127 PolarHBondContact O-N 2.98Å; S127-F129 VanDerWaalsContact C-N 3.34Å; S127-A131 WeakPolarHBondContact O-CB 3.19Å; S127-A131 PolarHBondContact O-N 3.43Å; S127-A131 VanDerWaalsContact O-N 3.14Å; S127-H139 PolarHBondContact OG-CE1 2.99Å; S127-H139 VanDerWaalsContact OG-CE1 3.26Å
128	R	98.4	Very high	97.6	Very high	106 Å²	106	58.2 Å²	58.2	40%	0.4	34%	0.339	S	S	.	.	H	α-helix	trans	-67.7	-34.1	176.9	-71.9	-170.2	-63	-100.8	-3	112.7	E124 L125 R132 E322	E124-R128 WeakPolarHBondContact O-CB 3.23Å; E124-R128 WeakPolarHBondContact O-CG 3.3Å; E124-R128 PolarHBondContact O-N 2.89Å; E124-R128 IonicContact OE2-CZ 3.68Å; E124-R128 IonicContact OE2-NH1 3.65Å; E124-R128 PolarHBondContact OE2-NH1 2.79Å; L125-R128 PolarHBondContact O-N 3.4Å; R128-R132 WeakPolarHBondContact O-CG 3.32Å; R128-R132 PolarHBondContact O-N 3.08Å; R128-R132 PolarHBondContact O-NE 3Å; R128-E322 IonicContact CZ-OE2 2.82Å; R128-E322 IonicContact NE-OE2 3.86Å; R128-E322 IonicContact NH2-OE2 2.7Å; R128-E322 PolarHBondContact NH2-OE2 3Å
129	F	98.6	Very high	97.6	Very high	21 Å²	21	58.1 Å²	58.1	9%	0.092	34%	0.337	C	S	.	.	H	α-helix	trans	-63.7	-54.8	176.8	174.7	-93.1	0	0	0	110.4	L98 T99 A102 W113 L125 V126 S127 A131 R132 A133	L98-F129 HydrophobicContact CB-CD1 4.21Å; L98-F129 HydrophobicContact CB-CE1 3.68Å; L98-F129 HydrophobicContact CB-CE2 4.32Å; L98-F129 HydrophobicContact CB-CZ 3.76Å; L98-F129 HydrophobicContact CD1-CD1 4.45Å; L98-F129 VanDerWaalsContact O-CZ 3.27Å; L98-F129 WeakPolarHBondContact O-CZ 3.44Å; T99-F129 WeakPolarHBondContact OG1-CE2 3.3Å; A102-F129 HydrophobicContact CB-CE1 4.23Å; A102-F129 HydrophobicContact CB-CZ 3.77Å; W113-F129 AromaticContact CH2-CE1 3.84Å; W113-F129 HydrophobicContact CH2-CE1 3.84Å; W113-F129 AromaticContact CZ3-CE1 3.78Å; W113-F129 HydrophobicContact CZ3-CE1 3.78Å; L125-F129 WeakPolarHBondContact O-CB 3.42Å; L125-F129 PolarHBondContact O-N 2.97Å; V126-F129 PolarHBondContact O-N 2.81Å; S127-F129 VanDerWaalsContact C-N 3.34Å; F129-A131 VanDerWaalsContact C-N 3.33Å; F129-A131 PolarHBondContact O-N 2.9Å; F129-R132 CarbonylContact O-C 3.6Å; F129-R132 PolarHBondContact O-N 3.17Å; F129-R132 VanDerWaalsContact O-N 3.08Å; F129-A133 HydrophobicContact CE1-CB 4.15Å; F129-A133 HydrophobicContact CZ-CB 4.39Å; F129-A133 WeakPolarHBondContact O-CB 3.49Å; F129-A133 PolarHBondContact O-N 3.14Å
130	L	98.4	Very high	97.7	Very high	11 Å²	11	58.8 Å²	58.8	6%	0.058	34%	0.337	C	S	.	.	H	α-helix	trans	-60.9	-40.1	-179.9	-73.8	177.8	0	0	0	112.6	W113 L115 V126 R132 A133 H139	W113-L130 HydrophobicContact CD2-CD2 4.42Å; W113-L130 HydrophobicContact CE3-CD2 3.52Å; W113-L130 HydrophobicContact CZ3-CD2 3.61Å; L115-L130 HydrophobicContact CB-CD1 4.19Å; L115-L130 HydrophobicContact CB-CD2 4.49Å; L115-L130 HydrophobicContact CD2-CD1 3.98Å; L115-L130 HydrophobicContact CD2-CD2 3.86Å; L115-L130 HydrophobicContact CD2-CG 4Å; V126-L130 HydrophobicContact CG1-CD1 4.11Å; V126-L130 HydrophobicContact CG1-CG 4.29Å; V126-L130 PolarHBondContact O-N 3.35Å; L130-R132 PolarHBondContact O-N 3.14Å; L130-A133 PolarHBondContact O-N 2.8Å; L130-A133 VanDerWaalsContact O-N 3.14Å; L130-H139 HydrophobicContact CD1-CB 3.63Å
131	A	97.8	Very high	97.7	Very high	86 Å²	86	58.6 Å²	58.6	71%	0.711	32%	0.323	S	S	*	.	H	α-helix	trans	-58.3	-29	176.9	0	0	0	0	0	113.3	S127 F129	S127-A131 WeakPolarHBondContact O-CB 3.19Å; S127-A131 PolarHBondContact O-N 3.43Å; S127-A131 VanDerWaalsContact O-N 3.14Å; F129-A131 VanDerWaalsContact C-N 3.33Å; F129-A131 PolarHBondContact O-N 2.9Å
132	R	96.9	Very high	97.7	Very high	174 Å²	174	57.5 Å²	57.5	66%	0.657	31%	0.31	S	S	*	.	H	α-helix	trans	-102.6	-8.2	179.5	-63.9	-176.8	-65.5	174.4	1.1	113.6	R128 F129 L130 G134	R128-R132 WeakPolarHBondContact O-CG 3.32Å; R128-R132 PolarHBondContact O-N 3.08Å; R128-R132 PolarHBondContact O-NE 3Å; F129-R132 CarbonylContact O-C 3.6Å; F129-R132 PolarHBondContact O-N 3.17Å; F129-R132 VanDerWaalsContact O-N 3.08Å; L130-R132 PolarHBondContact O-N 3.14Å; R132-G134 VanDerWaalsContact C-N 3.27Å; R132-G134 PolarHBondContact O-N 2.94Å
133	A	93.7	Very high	97.7	Very high	5 Å²	5	53.4 Å²	53.4	4%	0.041	30%	0.302	C	S	.	.	H	α-helix	trans	-75	-16.7	-171.8	0	0	0	0	0	113.1	A102 R106 F129 L130 L135	A102-A133 HydrophobicContact CB-CB 4.49Å; R106-A133 VanDerWaalsContact CZ-O 3.27Å; R106-A133 PolarHBondContact NE-O 2.83Å; R106-A133 PolarHBondContact NH2-O 2.81Å; F129-A133 HydrophobicContact CE1-CB 4.15Å; F129-A133 HydrophobicContact CZ-CB 4.39Å; F129-A133 WeakPolarHBondContact O-CB 3.49Å; F129-A133 PolarHBondContact O-N 3.14Å; L130-A133 PolarHBondContact O-N 2.8Å; L130-A133 VanDerWaalsContact O-N 3.14Å; A133-L135 VanDerWaalsContact C-N 3.35Å; A133-L135 HydrophobicContact CB-CD2 3.29Å; A133-L135 WeakPolarHBondContact O-CD2 3.34Å; A133-L135 PolarHBondContact O-N 2.85Å
134	G	92.1	Very high	97.6	Very high	65 Å²	65	52.6 Å²	52.6	67%	0.67	30%	0.296	S	S	*	.			trans	71.9	23.9	171.7	0	0	0	0	0	114.7	R132	R132-G134 VanDerWaalsContact C-N 3.27Å; R132-G134 PolarHBondContact O-N 2.94Å
135	L	94.3	Very high	97.4	Very high	16 Å²	16	48.4 Å²	48.4	8%	0.084	28%	0.281	C	S	.	.	S	Bend	trans	-127.4	145.2	174.7	67.6	166.6	0	0	0	111.6	A102 F105 L111 W113 A133 S137	A102-L135 HydrophobicContact CB-CD2 4.37Å; F105-L135 HydrophobicContact CB-CD1 3.79Å; F105-L135 HydrophobicContact CD2-CD1 4.36Å; L111-L135 HydrophobicContact CD2-CD1 4.28Å; W113-L135 HydrophobicContact CB-CD1 3.79Å; W113-L135 HydrophobicContact CB-CG 4.45Å; W113-L135 HydrophobicContact CD2-CD1 4Å; W113-L135 HydrophobicContact CE3-CD1 3.49Å; W113-L135 VanDerWaalsContact CE3-CD1 3.49Å; W113-L135 HydrophobicContact CE3-CD2 3.9Å; W113-L135 HydrophobicContact CE3-CG 3.93Å; W113-L135 HydrophobicContact CG-CD1 4.19Å; W113-L135 HydrophobicContact CZ3-CD1 4.23Å; W113-L135 HydrophobicContact CZ3-CD2 4.11Å; A133-L135 VanDerWaalsContact C-N 3.35Å; A133-L135 HydrophobicContact CB-CD2 3.29Å; A133-L135 WeakPolarHBondContact O-CD2 3.34Å; A133-L135 PolarHBondContact O-N 2.85Å; L135-S137 PolarHBondContact O-N 2.63Å
136	P	97.8	Very high	97	Very high	85 Å²	85	58 Å²	58	55%	0.552	32%	0.315	S	S	*	.			trans	-56.9	125.4	172.6	-21	32.4	0	0	0	109.9	W113	W113-P136 PolarHBondContact N-O 2.92Å
137	S	98.4	Very high	96.5	Very high	43 Å²	43	64.8 Å²	64.8	30%	0.301	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	158.8	-175.7	57.2	0	0	0	0	113.5	W113 L135	W113-S137 CarbonylContact O-C 3.42Å; W113-S137 WeakPolarHBondContact O-CA 3.31Å; W113-S137 VanDerWaalsContact O-CB 3.28Å; W113-S137 WeakPolarHBondContact O-CB 3.34Å; L135-S137 PolarHBondContact O-N 2.63Å
138	T	98.7	Very high	96	Very high	23 Å²	23	64.7 Å²	64.7	14%	0.141	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	125	168.7	-65.2	0	0	0	0	108.2	H112 W113 L115 L140 W166	H112-T138 PolarHBondContact CE1-OG1 3.24Å; H112-T138 PolarHBondContact NE2-OG1 2.97Å; W113-T138 PolarHBondContact O-N 3.47Å; L115-T138 PolarHBondContact N-O 3.33Å; T138-L140 HydrophobicContact CG2-CD1 4.47Å; T138-L140 HydrophobicContact CG2-CD2 3.75Å; T138-L140 HydrophobicContact CG2-CG 3.9Å; T138-W166 HydrophobicContact CG2-CD2 4.12Å; T138-W166 HydrophobicContact CG2-CG 4.43Å; T138-W166 HydrophobicContact CG2-CZ2 3.84Å; T138-W166 WeakPolarHBondContact OG1-CZ2 3.14Å
139	H	98.8	Very high	95.5	Very high	30 Å²	30	65 Å²	65	14%	0.139	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	107.1	-178.8	-172.3	-174	0	0	0	110.2	E117 V126 S127 L130	E117-H139 IonicContact OE1-CD2 3.4Å; E117-H139 IonicContact OE1-CE1 3.43Å; E117-H139 PolarHBondContact OE1-CE1 3.38Å; E117-H139 IonicContact OE1-NE2 3.5Å; E117-H139 PolarHBondContact OE1-NE2 3.06Å; V126-H139 WeakPolarHBondContact CG1-NE2 3.27Å; S127-H139 PolarHBondContact OG-CE1 2.99Å; S127-H139 VanDerWaalsContact OG-CE1 3.26Å; L130-H139 HydrophobicContact CD1-CB 3.63Å
140	L	98.9	Very high	94.9	Very high	36 Å²	36	72 Å²	72	19%	0.188	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	168.1	177.4	-54.5	177.6	0	0	0	110.6	I114 L115 V116 E117 T138 W166	I114-L140 HydrophobicContact CG2-CD1 3.89Å; L115-L140 PolarHBondContact O-N 3.46Å; V116-L140 WeakPolarHBondContact CA-O 3.11Å; V116-L140 HydrophobicContact CB-CB 4.39Å; V116-L140 HydrophobicContact CG1-CB 4.01Å; V116-L140 HydrophobicContact CG2-CB 4.1Å; V116-L140 HydrophobicContact CG2-CD1 4.19Å; E117-L140 PolarHBondContact N-O 3.04Å; T138-L140 HydrophobicContact CG2-CD1 4.47Å; T138-L140 HydrophobicContact CG2-CD2 3.75Å; T138-L140 HydrophobicContact CG2-CG 3.9Å; L140-W166 HydrophobicContact CD1-CB 3.65Å; L140-W166 HydrophobicContact CD1-CG 3.92Å; L140-W166 HydrophobicContact CD2-CG 4.42Å
141	H	98.8	Very high	94	Very high	78 Å²	78	78 Å²	78	36%	0.361	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	147.7	170.7	69.5	96	0	0	0	110.3	E117 A119 A120 A121 R122	E117-H141 HydrophobicContact CB-CB 4.19Å; E117-H141 CarbonylContact O-C 3.42Å; E117-H141 WeakPolarHBondContact O-CA 3.34Å; A119-H141 PolarHBondContact O-ND1 3.47Å; A120-H141 VanDerWaalsContact C-ND1 3.35Å; A120-H141 PolarHBondContact O-CE1 3.07Å; A120-H141 PolarHBondContact O-ND1 3Å; A120-H141 VanDerWaalsContact O-ND1 3.12Å; A121-H141 WeakPolarHBondContact CA-ND1 3.44Å; R122-H141 HydrophobicContact CG-CB 4.32Å
142	V	98.6	Very high	93.1	Very high	39 Å²	39	77.4 Å²	77.4	24%	0.236	41%	0.406	C	S	.	.			trans	-157.9	126.3	169.1	57.5	0	0	0	0	108.6	V116 E117 D118 A119 E158 Q159 A162	V116-V142 HydrophobicContact CG1-CG1 4.08Å; E117-V142 PolarHBondContact O-N 3.3Å; D118-V142 WeakPolarHBondContact CA-O 3.43Å; A119-V142 CarbonylContact O-C 3.56Å; V142-E158 HydrophobicContact CG1-CB 3.87Å; V142-E158 HydrophobicContact CG2-CB 4.07Å; V142-Q159 HydrophobicContact CG1-CB 4.38Å; V142-Q159 HydrophobicContact CG1-CG 3.92Å; V142-Q159 PolarHBondContact O-NE2 3.32Å; V142-A162 HydrophobicContact CB-CB 4.44Å; V142-A162 HydrophobicContact CG1-CB 3.8Å
143	P	97.9	Very high	92.6	Very high	63 Å²	63	72.6 Å²	72.6	41%	0.409	39%	0.393	S	S	.	.	P	Polyproline II helix	trans	-77	133.5	179.7	30.1	-32.6	0	0	0	110.7	A119 A120 P145	A119-P143 WeakPolarHBondContact O-CD 3.46Å; A120-P143 HydrophobicContact CB-CG 4.48Å; P143-P145 WeakPolarHBondContact O-CD 3.28Å
144	T	96.4	Very high	92.1	Very high	10 Å²	10	74.3 Å²	74.3	6%	0.061	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-72.6	127.7	164.7	-67.5	0	0	0	0	109	D118 R146 K149 E158 Q159	D118-T144 PolarHBondContact OD1-N 3.44Å; T144-R146 PolarHBondContact O-N 3.35Å; T144-K149 HydrophobicContact CG2-CG 4.19Å; T144-K149 WeakPolarHBondContact O-CE 3.07Å; T144-E158 WeakPolarHBondContact CG2-OE2 3.39Å; T144-E158 PolarHBondContact OG1-OE2 2.92Å; T144-Q159 PolarHBondContact OG1-NE2 2.88Å; T144-Q159 PolarHBondContact OG1-OE1 3.49Å
145	P	94.1	Very high	92	Very high	50 Å²	50	78.5 Å²	78.5	33%	0.325	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-55.9	137.1	177.9	-26.6	33.2	0	0	0	112.6	P143 R147 Y148	P143-P145 WeakPolarHBondContact O-CD 3.28Å; P145-R147 HydrophobicContact CB-CG 4.27Å; P145-R147 PolarHBondContact O-N 3.03Å; P145-Y148 HydrophobicContact CB-CD2 3.78Å; P145-Y148 HydrophobicContact CB-CE2 4.16Å; P145-Y148 HydrophobicContact CG-CD2 3.94Å; P145-Y148 HydrophobicContact CG-CE2 4.16Å; P145-Y148 PolarHBondContact O-N 3.45Å
146	R	91.1	Very high	92	Very high	233 Å²	233	78.2 Å²	78.2	88%	0.879	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-50.4	-37.9	-174.4	-72.3	-173.6	176.2	178.2	-0.5	114.2	T144 Y148 K149	T144-R146 PolarHBondContact O-N 3.35Å; R146-Y148 PolarHBondContact O-N 3.37Å; R146-Y148 VanDerWaalsContact O-N 3.07Å; R146-K149 PolarHBondContact O-N 2.98Å
147	R	89.3	Confident	91.9	Very high	142 Å²	142	74.3 Å²	74.3	54%	0.536	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-57.6	-21.9	177.4	65.3	-178.3	176.6	-128.7	-3.3	114.2	P145	P145-R147 HydrophobicContact CB-CG 4.27Å; P145-R147 PolarHBondContact O-N 3.03Å
148	Y	88	Confident	91.8	Very high	42 Å²	42	73.9 Å²	73.9	17%	0.165	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	-100.2	-3.1	179.9	-57.2	-52.3	0	0	0	113.6	P145 R146 R150 L153 R264 R265	P145-Y148 HydrophobicContact CB-CD2 3.78Å; P145-Y148 HydrophobicContact CB-CE2 4.16Å; P145-Y148 HydrophobicContact CG-CD2 3.94Å; P145-Y148 HydrophobicContact CG-CE2 4.16Å; P145-Y148 PolarHBondContact O-N 3.45Å; R146-Y148 PolarHBondContact O-N 3.37Å; R146-Y148 VanDerWaalsContact O-N 3.07Å; Y148-R150 PolarHBondContact O-N 3.37Å; Y148-R150 VanDerWaalsContact O-N 3.13Å; Y148-L153 HydrophobicContact CD1-CD1 4.44Å; Y148-R264 HydrophobicContact CE1-CG 4.44Å; Y148-R265 PolarHBondContact OH-NE 2.92Å
149	K	87.1	Confident	91.8	Very high	114 Å²	114	72.9 Å²	72.9	50%	0.496	36%	0.361	S	S	.	.			trans	-87.2	55.6	174.3	-62.3	-167.5	175.5	-166.4	0	110.9	D118 T144 R146	D118-K149 WeakPolarHBondContact OD1-CE 3.3Å; D118-K149 IonicContact OD1-NZ 3.47Å; D118-K149 PolarHBondContact OD1-NZ 2.74Å; D118-K149 WeakPolarHBondContact OD2-CE 3.38Å; D118-K149 IonicContact OD2-NZ 2.64Å; D118-K149 PolarHBondContact OD2-NZ 3.21Å; T144-K149 HydrophobicContact CG2-CG 4.19Å; T144-K149 WeakPolarHBondContact O-CE 3.07Å; R146-K149 PolarHBondContact O-N 2.98Å
150	R	85.2	Confident	91.8	Very high	168 Å²	168	72 Å²	72	63%	0.634	36%	0.356	S	S	*	.	S	Bend	trans	-117.6	148.3	179.5	-62.1	-179.1	178.8	-176.7	-0.8	110.6	Y148 G152 L153	Y148-R150 PolarHBondContact O-N 3.37Å; Y148-R150 VanDerWaalsContact O-N 3.13Å; R150-G152 PolarHBondContact O-N 2.68Å; R150-L153 HydrophobicContact CB-CD1 3.96Å; R150-L153 HydrophobicContact CB-CG 4.3Å; R150-L153 HydrophobicContact CG-CD1 4.47Å; R150-L153 PolarHBondContact O-N 2.9Å
151	P	81.3	Confident	91.8	Very high	136 Å²	136	71.9 Å²	71.9	88%	0.883	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	139.6	171.9	-24.9	34.4	0	0	0	111.5	L153	P151-L153 VanDerWaalsContact C-N 3.28Å; P151-L153 PolarHBondContact O-N 3.02Å
152	G	78.7	Confident	91.8	Very high	74 Å²	74	69.4 Å²	69.4	76%	0.763	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	-7.7	179.2	0	0	0	0	0	115.7	R150	R150-G152 PolarHBondContact O-N 2.68Å
153	L	84.7	Confident	91.8	Very high	73 Å²	73	67.5 Å²	67.5	38%	0.382	34%	0.337	S	S	.	.	S	Bend	trans	-89.5	146.3	172	-64.9	-176.2	0	0	0	111.7	Y148 R150 P151 R155	Y148-L153 HydrophobicContact CD1-CD1 4.44Å; R150-L153 HydrophobicContact CB-CD1 3.96Å; R150-L153 HydrophobicContact CB-CG 4.3Å; R150-L153 HydrophobicContact CG-CD1 4.47Å; R150-L153 PolarHBondContact O-N 2.9Å; P151-L153 VanDerWaalsContact C-N 3.28Å; P151-L153 PolarHBondContact O-N 3.02Å; L153-R155 PolarHBondContact O-N 3.37Å
154	P	85.1	Confident	91.8	Very high	41 Å²	41	64.5 Å²	64.5	27%	0.266	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-62.6	130.5	176.4	24.6	-32.5	0	0	0	110.9	R264 Q272	P154-R264 PolarHBondContact O-NH1 3.11Å; P154-R264 PolarHBondContact O-NH2 3.01Å; P154-Q272 VanDerWaalsContact CB-OE1 3.26Å
155	R	88.4	Confident	91.9	Very high	152 Å²	152	66.6 Å²	66.6	57%	0.574	34%	0.336	S	S	*	.	P	Polyproline II helix	trans	-88.9	170.3	172.4	-61.1	-170.8	-66.9	173.5	2.6	109.7	Y89 L153 T157	Y89-R155 PolarHBondContact OH-NH1 3.32Å; Y89-R155 VanDerWaalsContact OH-NH1 3.09Å; L153-R155 PolarHBondContact O-N 3.37Å; R155-T157 PolarHBondContact O-N 3.26Å
156	A	94.8	Very high	92.1	Very high	11 Å²	11	66.5 Å²	66.5	9%	0.091	33%	0.329	C	S	.	.	S	Bend	trans	65.8	0.1	171.3	0	0	0	0	0	117.6	P87 E158 Q159 R160	P87-A156 HydrophobicContact CB-CB 3.44Å; P87-A156 VanDerWaalsContact CB-CB 3.44Å; P87-A156 HydrophobicContact CG-CB 3.47Å; P87-A156 VanDerWaalsContact CG-CB 3.47Å; A156-E158 PolarHBondContact O-N 2.92Å; A156-Q159 PolarHBondContact O-N 2.95Å; A156-Q159 PolarHBondContact O-OE1 2.94Å; A156-R160 HydrophobicContact CB-CG 4.47Å; A156-R160 WeakPolarHBondContact O-CG 3.07Å; A156-R160 PolarHBondContact O-N 3.03Å
157	T	95.6	Very high	92.3	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.012	29%	0.287	C	S	.	.	H	α-helix	trans	-58.4	-48.4	-177.2	-47.6	0	0	0	0	113	R155 Q159 N161 F262 R264 Q272	R155-T157 PolarHBondContact O-N 3.26Å; T157-Q159 VanDerWaalsContact C-N 3.31Å; T157-Q159 PolarHBondContact O-N 2.64Å; T157-N161 WeakPolarHBondContact O-CB 3.44Å; T157-N161 VanDerWaalsContact O-CG 3.3Å; T157-N161 PolarHBondContact O-N 3.48Å; T157-N161 VanDerWaalsContact O-N 3.11Å; T157-N161 PolarHBondContact O-ND2 3.26Å; T157-F262 HydrophobicContact CG2-CB 3.86Å; T157-R264 VanDerWaalsContact CB-NH2 3.33Å; T157-R264 HydrophobicContact CG2-CB 4.07Å; T157-R264 PolarHBondContact OG1-NH2 3.35Å; T157-Q272 PolarHBondContact OG1-NE2 3.46Å
158	E	97.2	Very high	92.6	Very high	35 Å²	35	50.3 Å²	50.3	16%	0.164	27%	0.268	C	S	.	.	H	α-helix	trans	-63.3	-40.9	178.3	-71.3	75.3	-162	0	0	111.3	V142 T144 A156 N161 A162 R264	V142-E158 HydrophobicContact CG1-CB 3.87Å; V142-E158 HydrophobicContact CG2-CB 4.07Å; T144-E158 WeakPolarHBondContact CG2-OE2 3.39Å; T144-E158 PolarHBondContact OG1-OE2 2.92Å; A156-E158 PolarHBondContact O-N 2.92Å; E158-N161 PolarHBondContact O-N 3.22Å; E158-A162 WeakPolarHBondContact O-CB 3.39Å; E158-A162 PolarHBondContact O-N 2.95Å; E158-R264 WeakPolarHBondContact OE1-CD 3.32Å; E158-R264 IonicContact OE1-CZ 3.42Å; E158-R264 IonicContact OE1-NE 3.52Å; E158-R264 PolarHBondContact OE1-NE 2.87Å; E158-R264 IonicContact OE1-NH2 2.75Å; E158-R264 PolarHBondContact OE1-NH2 2.76Å; E158-R264 IonicContact OE2-CZ 3.44Å; E158-R264 IonicContact OE2-NE 3.94Å; E158-R264 PolarHBondContact OE2-NE 2.87Å; E158-R264 IonicContact OE2-NH2 2.76Å; E158-R264 PolarHBondContact OE2-NH2 2.95Å
159	Q	98.6	Very high	93	Very high	2 Å²	2	54.9 Å²	54.9	1%	0.009	29%	0.291	C	S	.	.	H	α-helix	trans	-68.4	-44.2	-174.9	-65.6	74	25.7	0	0	111.1	P87 V116 D118 V142 T144 A156 T157 N161 A162 G163	P87-Q159 HydrophobicContact CB-CB 3.74Å; P87-Q159 HydrophobicContact CB-CG 4.45Å; V116-Q159 HydrophobicContact CB-CB 3.95Å; V116-Q159 HydrophobicContact CB-CG 4.46Å; V116-Q159 HydrophobicContact CG1-CB 3.7Å; V116-Q159 HydrophobicContact CG1-CG 3.95Å; D118-Q159 HydrophobicContact CB-CG 4.29Å; V142-Q159 HydrophobicContact CG1-CB 4.38Å; V142-Q159 HydrophobicContact CG1-CG 3.92Å; V142-Q159 PolarHBondContact O-NE2 3.32Å; T144-Q159 PolarHBondContact OG1-NE2 2.88Å; T144-Q159 PolarHBondContact OG1-OE1 3.49Å; A156-Q159 PolarHBondContact O-N 2.95Å; A156-Q159 PolarHBondContact O-OE1 2.94Å; T157-Q159 VanDerWaalsContact C-N 3.31Å; T157-Q159 PolarHBondContact O-N 2.64Å; Q159-N161 VanDerWaalsContact C-N 3.33Å; Q159-N161 PolarHBondContact O-N 3.37Å; Q159-A162 PolarHBondContact O-N 3.42Å; Q159-G163 PolarHBondContact O-N 2.8Å
160	R	98.4	Very high	93.3	Very high	10 Å²	10	54.9 Å²	54.9	4%	0.038	29%	0.288	C	S	.	.	H	α-helix	trans	-62	-41.7	173.1	-66.9	-176.6	-166.9	121.1	2.4	111.6	I85 P87 A156 G163 L164 F183 D185 F262	I85-R160 HydrophobicContact CG2-CG 4.49Å; P87-R160 HydrophobicContact CG-CG 4.48Å; A156-R160 HydrophobicContact CB-CG 4.47Å; A156-R160 WeakPolarHBondContact O-CG 3.07Å; A156-R160 PolarHBondContact O-N 3.03Å; R160-G163 PolarHBondContact O-N 3.47Å; R160-L164 PolarHBondContact O-N 3.37Å; R160-F183 HydrophobicContact CB-CD1 4.14Å; R160-F183 HydrophobicContact CB-CE1 4.02Å; R160-F183 HydrophobicContact CG-CD1 3.9Å; R160-F183 HydrophobicContact CG-CE1 4.31Å; R160-D185 IonicContact CZ-OD1 3.79Å; R160-D185 IonicContact NE-OD1 3.46Å; R160-D185 VanDerWaalsContact NH2-CG 3.35Å; R160-D185 IonicContact NH2-OD1 2.87Å; R160-D185 PolarHBondContact NH2-OD1 3.28Å; R160-D185 IonicContact NH2-OD2 2.67Å; R160-D185 PolarHBondContact NH2-OD2 3.13Å; R160-F262 HydrophobicContact CB-CD2 3.72Å; R160-F262 HydrophobicContact CB-CE2 3.74Å; R160-F262 HydrophobicContact CG-CE2 4.41Å
161	N	98.4	Very high	93.5	Very high	35 Å²	35	47.4 Å²	47.4	19%	0.187	26%	0.26	C	S	.	.	H	α-helix	trans	-66.8	-35.2	176.4	-74.6	-18.4	0	0	0	113	T157 E158 Q159 L164 A165 F262	T157-N161 WeakPolarHBondContact O-CB 3.44Å; T157-N161 VanDerWaalsContact O-CG 3.3Å; T157-N161 PolarHBondContact O-N 3.48Å; T157-N161 VanDerWaalsContact O-N 3.11Å; T157-N161 PolarHBondContact O-ND2 3.26Å; E158-N161 PolarHBondContact O-N 3.22Å; Q159-N161 VanDerWaalsContact C-N 3.33Å; Q159-N161 PolarHBondContact O-N 3.37Å; N161-L164 PolarHBondContact O-N 2.87Å; N161-A165 WeakPolarHBondContact O-CB 3.4Å; N161-A165 PolarHBondContact O-N 3.29Å; N161-F262 PolarHBondContact ND2-O 3.06Å; N161-F262 PolarHBondContact OD1-N 2.95Å
162	A	98.7	Very high	93.4	Very high	25 Å²	25	47.5 Å²	47.5	21%	0.207	25%	0.249	C	C	.	.	H	α-helix	trans	-66.1	-39.6	173.6	0	0	0	0	0	111.7	V116 V142 E158 Q159 A165 W166	V116-A162 HydrophobicContact CG1-CB 4.17Å; V142-A162 HydrophobicContact CB-CB 4.44Å; V142-A162 HydrophobicContact CG1-CB 3.8Å; E158-A162 WeakPolarHBondContact O-CB 3.39Å; E158-A162 PolarHBondContact O-N 2.95Å; Q159-A162 PolarHBondContact O-N 3.42Å; A162-A165 PolarHBondContact O-N 2.89Å; A162-W166 WeakPolarHBondContact O-CB 3.46Å; A162-W166 PolarHBondContact O-N 2.9Å
163	G	98.7	Very high	93.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-62.3	-43.2	171.9	0	0	0	0	0	112.7	I85 Q159 R160 W166 L167	I85-G163 VanDerWaalsContact CD1-C 3.48Å; Q159-G163 PolarHBondContact O-N 2.8Å; R160-G163 PolarHBondContact O-N 3.47Å; G163-W166 PolarHBondContact O-N 3.21Å; G163-L167 WeakPolarHBondContact O-CB 3.2Å; G163-L167 PolarHBondContact O-N 2.9Å
164	L	98.4	Very high	92.7	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-60	-45.1	173.4	-76.1	171.3	0	0	0	112.3	R160 N161 L167 R168 L181 F183 I254 F262 F276	R160-L164 PolarHBondContact O-N 3.37Å; N161-L164 PolarHBondContact O-N 2.87Å; L164-L167 PolarHBondContact O-N 2.94Å; L164-R168 WeakPolarHBondContact O-CG 3.4Å; L164-R168 PolarHBondContact O-N 2.87Å; L164-L181 HydrophobicContact CD2-CD2 3.42Å; L164-L181 VanDerWaalsContact CD2-CD2 3.42Å; L164-F183 HydrophobicContact CD1-CZ 4.3Å; L164-F183 HydrophobicContact CD2-CZ 4.06Å; L164-F183 HydrophobicContact CG-CE1 4.38Å; L164-F183 HydrophobicContact CG-CZ 4.16Å; L164-I254 HydrophobicContact CD2-CD1 3.97Å; L164-I254 HydrophobicContact CD2-CG2 3.88Å; L164-F262 HydrophobicContact CD1-CD2 4.17Å; L164-F262 HydrophobicContact CD1-CE2 4.19Å; L164-F276 HydrophobicContact CD1-CE2 3.93Å; L164-F276 HydrophobicContact CD1-CZ 4.46Å
165	A	98.3	Very high	92	Very high	54 Å²	54	61.8 Å²	61.8	45%	0.446	28%	0.28	S	S	.	.	H	α-helix	trans	-63.2	-45.9	179.5	0	0	0	0	0	111.5	N161 A162 L167 R168 Q169	N161-A165 WeakPolarHBondContact O-CB 3.4Å; N161-A165 PolarHBondContact O-N 3.29Å; A162-A165 PolarHBondContact O-N 2.89Å; A165-L167 VanDerWaalsContact C-N 3.34Å; A165-L167 PolarHBondContact O-N 3.16Å; A165-R168 PolarHBondContact O-N 2.9Å; A165-Q169 WeakPolarHBondContact O-CB 3.44Å; A165-Q169 PolarHBondContact O-N 2.8Å
166	W	98	Very high	91	Very high	47 Å²	47	58.2 Å²	58.2	18%	0.178	28%	0.283	C	S	.	.	H	α-helix	trans	-59	-45.4	175.5	177.4	86.7	0	0	0	111.6	Y83 H112 I114 T138 L140 A162 G163 R168 Q169 R170	Y83-W166 HydrophobicContact CD1-CZ3 4.4Å; Y83-W166 HydrophobicContact CE1-CZ3 4.49Å; H112-W166 AromaticContact CE1-CH2 3.92Å; H112-W166 AromaticContact NE2-CH2 3.55Å; I114-W166 HydrophobicContact CD1-CE3 3.62Å; I114-W166 HydrophobicContact CD1-CZ3 3.55Å; I114-W166 HydrophobicContact CG1-CE3 4.14Å; I114-W166 HydrophobicContact CG1-CZ3 3.93Å; T138-W166 HydrophobicContact CG2-CD2 4.12Å; T138-W166 HydrophobicContact CG2-CG 4.43Å; T138-W166 HydrophobicContact CG2-CZ2 3.84Å; T138-W166 WeakPolarHBondContact OG1-CZ2 3.14Å; L140-W166 HydrophobicContact CD1-CB 3.65Å; L140-W166 HydrophobicContact CD1-CG 3.92Å; L140-W166 HydrophobicContact CD2-CG 4.42Å; A162-W166 WeakPolarHBondContact O-CB 3.46Å; A162-W166 PolarHBondContact O-N 2.9Å; G163-W166 PolarHBondContact O-N 3.21Å; W166-R168 PolarHBondContact O-N 3.25Å; W166-Q169 PolarHBondContact O-N 3.36Å; W166-R170 HydrophobicContact CD2-CB 4.46Å; W166-R170 HydrophobicContact CH2-CB 4.39Å; W166-R170 HydrophobicContact CH2-CG 3.97Å; W166-R170 HydrophobicContact CZ2-CB 4.29Å; W166-R170 HydrophobicContact CZ2-CG 4.01Å; W166-R170 HydrophobicContact CZ3-CB 4.49Å; W166-R170 HydrophobicContact CZ3-CG 4.45Å; W166-R170 WeakPolarHBondContact O-CB 3.36Å; W166-R170 PolarHBondContact O-N 3.18Å
167	L	96.1	Very high	90.4	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-62.1	-43.9	-179.2	-166	67.7	0	0	0	111.2	Y83 I114 G163 L164 A165 R170 H171 L181 L251 I254	Y83-L167 HydrophobicContact CD1-CD1 3.54Å; Y83-L167 HydrophobicContact CD2-CD1 3.99Å; Y83-L167 HydrophobicContact CE1-CD1 3.83Å; Y83-L167 HydrophobicContact CE2-CD1 4.26Å; Y83-L167 HydrophobicContact CG-CD1 3.63Å; I114-L167 HydrophobicContact CD1-CD1 4.36Å; G163-L167 WeakPolarHBondContact O-CB 3.2Å; G163-L167 PolarHBondContact O-N 2.9Å; L164-L167 PolarHBondContact O-N 2.94Å; A165-L167 VanDerWaalsContact C-N 3.34Å; A165-L167 PolarHBondContact O-N 3.16Å; L167-R170 PolarHBondContact O-N 3.07Å; L167-H171 PolarHBondContact O-CD2 3.31Å; L167-H171 VanDerWaalsContact O-CD2 3.23Å; L167-H171 PolarHBondContact O-N 2.9Å; L167-L181 HydrophobicContact CD2-CB 4.35Å; L167-L181 HydrophobicContact CD2-CD1 4.02Å; L167-L181 HydrophobicContact CD2-CD2 4.31Å; L167-L181 HydrophobicContact CD2-CG 4.45Å; L167-L251 HydrophobicContact CD1-CD1 4.07Å; L167-L251 HydrophobicContact CD2-CD1 3.57Å; L167-L251 HydrophobicContact CG-CD1 3.63Å; L167-I254 HydrophobicContact CD2-CG2 4.36Å
168	R	95.8	Very high	90.2	Very high	35 Å²	35	64.1 Å²	64.1	13%	0.132	31%	0.314	C	S	.	.	H	α-helix	trans	-60.8	-48.3	175.4	-73	169.8	177.5	149.1	8.4	112.1	L164 A165 W166 R170 H171 Q172 I254 L255 N257 P258 A260	L164-R168 WeakPolarHBondContact O-CG 3.4Å; L164-R168 PolarHBondContact O-N 2.87Å; A165-R168 PolarHBondContact O-N 2.9Å; W166-R168 PolarHBondContact O-N 3.25Å; R168-R170 PolarHBondContact O-N 3.26Å; R168-H171 PolarHBondContact O-N 2.98Å; R168-Q172 PolarHBondContact O-N 3.03Å; R168-I254 HydrophobicContact CG-CG2 4.43Å; R168-I254 PolarHBondContact NE-O 3Å; R168-L255 HydrophobicContact CG-CD2 4.24Å; R168-N257 PolarHBondContact NH2-O 3.25Å; R168-P258 VanDerWaalsContact CZ-O 3.23Å; R168-P258 PolarHBondContact NH1-O 2.92Å; R168-A260 VanDerWaalsContact CZ-O 3.28Å; R168-A260 PolarHBondContact NH1-O 2.87Å; R168-A260 PolarHBondContact NH2-O 3.47Å
169	Q	95	Very high	90.1	Very high	138 Å²	138	63 Å²	63	65%	0.645	31%	0.311	S	S	*	.	H	α-helix	trans	-61.6	-45	178.9	-174	-173.2	9.9	0	0	111.4	A165 W166 H171 Q172	A165-Q169 WeakPolarHBondContact O-CB 3.44Å; A165-Q169 PolarHBondContact O-N 2.8Å; W166-Q169 PolarHBondContact O-N 3.36Å; Q169-H171 PolarHBondContact O-N 3.37Å; Q169-Q172 PolarHBondContact O-N 2.89Å
170	R	93.4	Very high	90.1	Very high	115 Å²	115	62.9 Å²	62.9	43%	0.434	31%	0.311	S	S	.	.	H	α-helix	trans	-62	-29.3	-177.6	179	58.7	-175	69.5	3.1	113.1	W166 L167 R168	W166-R170 HydrophobicContact CD2-CB 4.46Å; W166-R170 HydrophobicContact CH2-CB 4.39Å; W166-R170 HydrophobicContact CH2-CG 3.97Å; W166-R170 HydrophobicContact CZ2-CB 4.29Å; W166-R170 HydrophobicContact CZ2-CG 4.01Å; W166-R170 HydrophobicContact CZ3-CB 4.49Å; W166-R170 HydrophobicContact CZ3-CG 4.45Å; W166-R170 WeakPolarHBondContact O-CB 3.36Å; W166-R170 PolarHBondContact O-N 3.18Å; L167-R170 PolarHBondContact O-N 3.07Å; R168-R170 PolarHBondContact O-N 3.26Å
171	H	90.8	Very high	90.1	Very high	11 Å²	11	62.4 Å²	62.4	5%	0.051	31%	0.309	C	S	.	.	H	α-helix	trans	-107.6	-0.4	-176.8	-69.8	-75.1	0	0	0	114.6	Y83 L167 R168 Q169 H173 Q174 L255	Y83-H171 AromaticContact CZ-NE2 3.56Å; Y83-H171 PolarHBondContact OH-CE1 2.7Å; Y83-H171 PolarHBondContact OH-NE2 2.63Å; L167-H171 PolarHBondContact O-CD2 3.31Å; L167-H171 VanDerWaalsContact O-CD2 3.23Å; L167-H171 PolarHBondContact O-N 2.9Å; R168-H171 PolarHBondContact O-N 2.98Å; Q169-H171 PolarHBondContact O-N 3.37Å; H171-H173 PolarHBondContact O-N 3.06Å; H171-H173 VanDerWaalsContact O-N 3.1Å; H171-Q174 PolarHBondContact O-N 3.38Å; H171-L255 HydrophobicContact CB-CD1 3.8Å; H171-L255 HydrophobicContact CB-CD2 3.97Å
172	Q	79.4	Confident	90.1	Very high	137 Å²	137	60.8 Å²	60.8	64%	0.64	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-30.8	-175.5	-173.8	172.4	-8.9	0	0	114.3	R168 Q169	R168-Q172 PolarHBondContact O-N 3.03Å; Q169-Q172 PolarHBondContact O-N 2.89Å
173	H	74.1	Confident	90.1	Very high	171 Å²	171	59.6 Å²	59.6	79%	0.792	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.8	12.9	-177.1	-59.6	-65.6	0	0	0	113.5	H171	H171-H173 PolarHBondContact O-N 3.06Å; H171-H173 VanDerWaalsContact O-N 3.1Å
174	Q	74.3	Confident	90.1	Very high	91 Å²	91	59.6 Å²	59.6	43%	0.425	29%	0.29	S	S	.	.	S	Bend	trans	-107.1	145.2	-178.2	-60.4	-160.2	-22.5	0	0	110.8	H171 A176	H171-Q174 PolarHBondContact O-N 3.38Å; Q174-A176 PolarHBondContact O-N 2.97Å
175	R	70.3	Confident	90.1	Very high	226 Å²	226	61.1 Å²	61.1	85%	0.853	30%	0.298	S	S	*	.			trans	-54.6	134.9	166.7	-171.8	172.1	177.6	161.9	-0.7	108	Q177	R175-Q177 PolarHBondContact O-N 3.33Å
176	A	67.6	Low	90.1	Very high	78 Å²	78	59 Å²	59	65%	0.645	28%	0.279	S	S	*	.			trans	-53.2	111.4	-177.1	0	0	0	0	0	110	Q174	Q174-A176 PolarHBondContact O-N 2.97Å
177	Q	82.2	Confident	90	Very high	80 Å²	80	57.6 Å²	57.6	37%	0.374	28%	0.275	S	S	.	.			trans	-89.7	143.3	174.7	-66	-63.8	-5.5	0	0	109	R175 G179	R175-Q177 PolarHBondContact O-N 3.33Å; Q177-G179 PolarHBondContact O-N 3.31Å
178	P	90.6	Very high	90.2	Very high	57 Å²	57	57.9 Å²	57.9	37%	0.37	28%	0.277	S	S	.	.			trans	-63.8	128.1	173.4	28	-32.8	0	0	0	109.2	Q78 P80 T81	Q78-P178 HydrophobicContact CB-CG 4.34Å; P80-P178 WeakPolarHBondContact CA-O 3.14Å; P80-P178 HydrophobicContact CB-CB 4.1Å; P80-P178 HydrophobicContact CG-CB 4.08Å; T81-P178 PolarHBondContact N-O 3.18Å
179	G	95.9	Very high	90.3	Very high	10 Å²	10	58.9 Å²	58.9	10%	0.103	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.3	161.5	179.6	0	0	0	0	0	111.9	T81 Q177 L251	T81-G179 CarbonylContact O-C 3.53Å; T81-G179 WeakPolarHBondContact O-CA 3.46Å; Q177-G179 PolarHBondContact O-N 3.31Å; G179-L251 WeakPolarHBondContact O-CB 3.4Å; G179-L251 PolarHBondContact O-N 3.36Å
180	V	98.2	Very high	90.5	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.006	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	138.7	178.2	62.6	0	0	0	0	109	T81 I82 Y83 M198 T201 A248 V249	T81-V180 PolarHBondContact O-N 3.1Å; I82-V180 CarbonylContact C-O 3.58Å; I82-V180 WeakPolarHBondContact CA-O 3.22Å; I82-V180 HydrophobicContact CB-CG1 4.19Å; I82-V180 HydrophobicContact CG1-CG1 3.45Å; I82-V180 VanDerWaalsContact CG1-CG1 3.45Å; Y83-V180 PolarHBondContact N-O 2.89Å; V180-M198 HydrophobicContact CG1-CG 4.4Å; V180-T201 HydrophobicContact CG2-CG2 4.45Å; V180-A248 HydrophobicContact CG2-CB 3.7Å; V180-V249 CarbonylContact C-O 3.57Å; V180-V249 WeakPolarHBondContact CA-O 3.29Å; V180-V249 WeakPolarHBondContact CG2-O 3.3Å
181	L	98.2	Very high	90.8	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	133.1	175.6	175.6	67.6	0	0	0	109.9	Y83 I85 L164 L167 F183 A248 V249 I254	Y83-L181 WeakPolarHBondContact O-CA 3.42Å; Y83-L181 WeakPolarHBondContact O-CD1 3.41Å; I85-L181 HydrophobicContact CB-CD1 4.4Å; I85-L181 HydrophobicContact CD1-CD1 3.28Å; I85-L181 HydrophobicContact CD1-CD2 4.19Å; I85-L181 HydrophobicContact CD1-CG 4.29Å; I85-L181 HydrophobicContact CG1-CD1 3.56Å; L164-L181 HydrophobicContact CD2-CD2 3.42Å; L164-L181 VanDerWaalsContact CD2-CD2 3.42Å; L167-L181 HydrophobicContact CD2-CB 4.35Å; L167-L181 HydrophobicContact CD2-CD1 4.02Å; L167-L181 HydrophobicContact CD2-CD2 4.31Å; L167-L181 HydrophobicContact CD2-CG 4.45Å; L181-F183 HydrophobicContact CD2-CE1 4.23Å; L181-F183 HydrophobicContact CD2-CE2 4.08Å; L181-F183 HydrophobicContact CD2-CZ 3.61Å; L181-F183 HydrophobicContact CG-CE2 4.49Å; L181-F183 HydrophobicContact CG-CZ 4.27Å; L181-A248 WeakPolarHBondContact O-CA 3.31Å; L181-A248 VanDerWaalsContact O-CB 3.31Å; L181-A248 WeakPolarHBondContact O-CB 3.19Å; L181-V249 PolarHBondContact N-O 3.4Å; L181-V249 PolarHBondContact O-N 3.42Å; L181-I254 HydrophobicContact CB-CG1 4.32Å; L181-I254 HydrophobicContact CD2-CD1 3.79Å; L181-I254 HydrophobicContact CD2-CG1 3.82Å
182	F	98.4	Very high	91.1	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	135.6	175.6	179.9	-128.7	0	0	0	110.8	Y83 A84 I85 A184 Y190 L194 M198 W207 A245 F247 A248	Y83-F182 PolarHBondContact O-N 2.65Å; A84-F182 CarbonylContact C-O 3.59Å; A84-F182 WeakPolarHBondContact CA-O 3.13Å; I85-F182 PolarHBondContact N-O 2.94Å; F182-A184 HydrophobicContact CD1-CB 3.89Å; F182-A184 HydrophobicContact CE1-CB 3.73Å; F182-Y190 AromaticContact CE1-CD1 3.87Å; F182-Y190 HydrophobicContact CE1-CD1 3.87Å; F182-Y190 AromaticContact CE1-CE1 3.54Å; F182-Y190 HydrophobicContact CE1-CE1 3.54Å; F182-Y190 HydrophobicContact CZ-CD1 4.03Å; F182-Y190 AromaticContact CZ-CE1 3.5Å; F182-Y190 HydrophobicContact CZ-CE1 3.5Å; F182-L194 HydrophobicContact CE1-CD2 4.36Å; F182-L194 HydrophobicContact CZ-CD2 4.14Å; F182-M198 HydrophobicContact CB-CE 4.33Å; F182-M198 HydrophobicContact CB-SD 3.76Å; F182-M198 HydrophobicContact CD1-CE 3.73Å; F182-M198 HydrophobicContact CD1-SD 4.12Å; F182-M198 HydrophobicContact CD2-CE 4.05Å; F182-M198 HydrophobicContact CD2-SD 4.48Å; F182-M198 HydrophobicContact CE1-CE 3.97Å; F182-M198 HydrophobicContact CE2-CE 4.31Å; F182-M198 HydrophobicContact CG-CE 3.76Å; F182-M198 HydrophobicContact CG-SD 3.87Å; F182-M198 HydrophobicContact CZ-CE 4.25Å; F182-W207 HydrophobicContact CD2-CH2 4.4Å; F182-W207 AromaticContact CD2-CZ2 3.98Å; F182-W207 HydrophobicContact CD2-CZ2 3.98Å; F182-W207 HydrophobicContact CE2-CH2 4.46Å; F182-W207 AromaticContact CE2-CZ2 3.62Å; F182-W207 HydrophobicContact CE2-CZ2 3.62Å; F182-W207 HydrophobicContact CZ-CZ2 4.34Å; F182-A245 WeakPolarHBondContact CE2-O 3.34Å; F182-F247 VanDerWaalsContact CD2-O 3.31Å; F182-F247 WeakPolarHBondContact CD2-O 3.3Å; F182-A248 HydrophobicContact CB-CB 4.39Å; F182-A248 HydrophobicContact CD2-CB 4.3Å
183	F	98.6	Very high	92.1	Very high	1 Å²	1	48.7 Å²	48.7	0%	0.004	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	112.2	175.2	-62	-74.2	0	0	0	109.2	I85 R160 L164 L181 M244 F247 F262 F276	I85-F183 HydrophobicContact CB-CD1 3.89Å; I85-F183 HydrophobicContact CB-CE1 4.19Å; I85-F183 HydrophobicContact CD1-CD1 4.3Å; I85-F183 HydrophobicContact CD1-CE1 3.71Å; I85-F183 HydrophobicContact CG2-CD1 4Å; I85-F183 HydrophobicContact CG2-CE1 4.27Å; R160-F183 HydrophobicContact CB-CD1 4.14Å; R160-F183 HydrophobicContact CB-CE1 4.02Å; R160-F183 HydrophobicContact CG-CD1 3.9Å; R160-F183 HydrophobicContact CG-CE1 4.31Å; L164-F183 HydrophobicContact CD1-CZ 4.3Å; L164-F183 HydrophobicContact CD2-CZ 4.06Å; L164-F183 HydrophobicContact CG-CE1 4.38Å; L164-F183 HydrophobicContact CG-CZ 4.16Å; L181-F183 HydrophobicContact CD2-CE1 4.23Å; L181-F183 HydrophobicContact CD2-CE2 4.08Å; L181-F183 HydrophobicContact CD2-CZ 3.61Å; L181-F183 HydrophobicContact CG-CE2 4.49Å; L181-F183 HydrophobicContact CG-CZ 4.27Å; F183-M244 HydrophobicContact CB-CG 3.71Å; F183-M244 HydrophobicContact CB-SD 3.81Å; F183-M244 HydrophobicContact CD2-SD 3.88Å; F183-M244 HydrophobicContact CG-CG 4.44Å; F183-M244 HydrophobicContact CG-SD 3.88Å; F183-F247 HydrophobicContact CD2-CE2 4.03Å; F183-F247 HydrophobicContact CD2-CZ 4.1Å; F183-F247 HydrophobicContact CE2-CE2 4.14Å; F183-F247 HydrophobicContact CE2-CZ 4.4Å; F183-F262 HydrophobicContact CD1-CE2 4.2Å; F183-F262 HydrophobicContact CD2-CE2 4.36Å; F183-F262 AromaticContact CD2-CZ 3.96Å; F183-F262 HydrophobicContact CD2-CZ 3.96Å; F183-F262 AromaticContact CE1-CE2 3.62Å; F183-F262 HydrophobicContact CE1-CE2 3.62Å; F183-F262 HydrophobicContact CE1-CZ 4.19Å; F183-F262 AromaticContact CE2-CE2 3.81Å; F183-F262 HydrophobicContact CE2-CE2 3.81Å; F183-F262 AromaticContact CE2-CZ 3.59Å; F183-F262 HydrophobicContact CE2-CZ 3.59Å; F183-F262 HydrophobicContact CG-CZ 4.41Å; F183-F262 AromaticContact CZ-CE2 3.4Å; F183-F262 HydrophobicContact CZ-CE2 3.4Å; F183-F262 VanDerWaalsContact CZ-CE2 3.4Å; F183-F262 AromaticContact CZ-CZ 3.72Å; F183-F262 HydrophobicContact CZ-CZ 3.72Å; F183-F276 HydrophobicContact CE2-CE1 4.09Å; F183-F276 HydrophobicContact CE2-CZ 4.35Å; F183-F276 HydrophobicContact CZ-CZ 4.45Å
184	A	98.3	Very high	93.2	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.212	C	C	.	.			trans	-122.8	99.8	-173.6	0	0	0	0	0	110.8	I85 T86 F105 F182 Y190	I85-A184 PolarHBondContact O-N 3Å; T86-A184 WeakPolarHBondContact CA-O 3.29Å; T86-A184 VanDerWaalsContact CB-O 3.24Å; T86-A184 WeakPolarHBondContact CB-O 3.45Å; T86-A184 VanDerWaalsContact CG2-O 3.27Å; T86-A184 WeakPolarHBondContact CG2-O 3.41Å; T86-A184 PolarHBondContact OG1-O 2.84Å; F105-A184 HydrophobicContact CZ-CB 3.94Å; F182-A184 HydrophobicContact CD1-CB 3.89Å; F182-A184 HydrophobicContact CE1-CB 3.73Å; A184-Y190 WeakPolarHBondContact CA-OH 3.39Å; A184-Y190 HydrophobicContact CB-CE1 4.42Å; A184-Y190 HydrophobicContact CB-CE2 4.05Å; A184-Y190 WeakPolarHBondContact CB-OH 3.09Å
185	D	98	Very high	94.4	Very high	31 Å²	31	36.3 Å²	36.3	17%	0.166	19%	0.192	C	C	.	.			trans	-63.7	148.7	176	-76.3	8.7	0	0	0	110.6	P87 R160 D187 N188 Y190	P87-D185 WeakPolarHBondContact CG-OD1 3.27Å; R160-D185 IonicContact CZ-OD1 3.79Å; R160-D185 IonicContact NE-OD1 3.46Å; R160-D185 VanDerWaalsContact NH2-CG 3.35Å; R160-D185 IonicContact NH2-OD1 2.87Å; R160-D185 PolarHBondContact NH2-OD1 3.28Å; R160-D185 IonicContact NH2-OD2 2.67Å; R160-D185 PolarHBondContact NH2-OD2 3.13Å; D185-D187 VanDerWaalsContact C-N 3.25Å; D185-D187 PolarHBondContact O-N 3.25Å; D185-N188 PolarHBondContact O-N 3.28Å; D185-Y190 PolarHBondContact N-OH 2.65Å; D185-Y190 PolarHBondContact O-OH 2.89Å
186	D	97.9	Very high	95.8	Very high	9 Å²	9	30.9 Å²	30.9	5%	0.048	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-14.9	-167.3	65.9	-1	0	0	0	115.1	T86 T88 R91 L98	T86-D186 HydrophobicContact CG2-CB 3.81Å; T88-D186 WeakPolarHBondContact CB-OD2 3.42Å; T88-D186 PolarHBondContact OG1-OD2 2.85Å; R91-D186 IonicContact CZ-OD1 2.69Å; R91-D186 IonicContact CZ-OD2 3.39Å; R91-D186 IonicContact NH1-OD1 2.88Å; R91-D186 IonicContact NH1-OD2 3.19Å; R91-D186 PolarHBondContact NH1-OD2 3.5Å; R91-D186 IonicContact NH2-OD1 3.86Å; R91-D186 PolarHBondContact NH2-OD1 3.32Å; R91-D186 IonicContact NH2-OD2 2.65Å; R91-D186 PolarHBondContact NH2-OD2 3.17Å; L98-D186 HydrophobicContact CD2-CB 4.05Å
187	D	97.8	Very high	97.2	Very high	18 Å²	18	29.7 Å²	29.7	10%	0.096	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-4.5	-177	64.6	-2.4	0	0	0	114.9	E97 R100 D185 T301	E97-D187 WeakPolarHBondContact OE2-CA 3.31Å; R100-D187 PolarHBondContact NH2-O 3.24Å; R100-D187 VanDerWaalsContact NH2-O 3.12Å; D185-D187 VanDerWaalsContact C-N 3.25Å; D185-D187 PolarHBondContact O-N 3.25Å; D187-T301 PolarHBondContact O-OG1 3.41Å
188	N	98.7	Very high	98	Very high	6 Å²	6	25.9 Å²	25.9	3%	0.032	14%	0.14	C	C	.	.			trans	-76	159.5	178	-80.7	-155	0	0	0	111.4	D185 Y190 A245 T301	D185-N188 PolarHBondContact O-N 3.28Å; N188-Y190 HydrophobicContact CB-CE1 4.17Å; N188-Y190 HydrophobicContact CB-CE2 3.58Å; N188-Y190 WeakPolarHBondContact CB-OH 3.49Å; N188-Y190 PolarHBondContact OD1-OH 3.4Å; N188-A245 WeakPolarHBondContact OD1-CB 3.22Å; N188-T301 WeakPolarHBondContact CA-OG1 3.3Å
189	T	98.9	Very high	98.4	Very high	56 Å²	56	23.6 Å²	23.6	34%	0.344	12%	0.124	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	132.1	176.8	-59	0	0	0	0	110.2	V298 W299 T301	T189-V298 WeakPolarHBondContact O-CA 3.25Å; T189-W299 HydrophobicContact CG2-CE3 4.07Å; T189-W299 PolarHBondContact N-O 2.6Å; T189-W299 PolarHBondContact O-N 3.12Å; T189-T301 PolarHBondContact N-OG1 3.27Å; T189-T301 PolarHBondContact OG1-OG1 2.75Å
190	Y	98.8	Very high	98.5	Very high	11 Å²	11	27.4 Å²	27.4	4%	0.043	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	128.4	-173.8	-57.2	-78	0	0	0	111.6	L101 F105 F182 A184 D185 N188 L194 F195 V298	L101-Y190 HydrophobicContact CD1-CD2 3.61Å; L101-Y190 HydrophobicContact CD1-CE2 3.76Å; F105-Y190 HydrophobicContact CE1-CD2 4.39Å; F182-Y190 AromaticContact CE1-CD1 3.87Å; F182-Y190 HydrophobicContact CE1-CD1 3.87Å; F182-Y190 AromaticContact CE1-CE1 3.54Å; F182-Y190 HydrophobicContact CE1-CE1 3.54Å; F182-Y190 HydrophobicContact CZ-CD1 4.03Å; F182-Y190 AromaticContact CZ-CE1 3.5Å; F182-Y190 HydrophobicContact CZ-CE1 3.5Å; A184-Y190 WeakPolarHBondContact CA-OH 3.39Å; A184-Y190 HydrophobicContact CB-CE1 4.42Å; A184-Y190 HydrophobicContact CB-CE2 4.05Å; A184-Y190 WeakPolarHBondContact CB-OH 3.09Å; D185-Y190 PolarHBondContact N-OH 2.65Å; D185-Y190 PolarHBondContact O-OH 2.89Å; N188-Y190 HydrophobicContact CB-CE1 4.17Å; N188-Y190 HydrophobicContact CB-CE2 3.58Å; N188-Y190 WeakPolarHBondContact CB-OH 3.49Å; N188-Y190 PolarHBondContact OD1-OH 3.4Å; Y190-L194 HydrophobicContact CD1-CD2 3.74Å; Y190-F195 HydrophobicContact CG-CZ 4.27Å; Y190-V298 HydrophobicContact CD1-CB 4.17Å; Y190-V298 HydrophobicContact CD1-CG2 3.48Å; Y190-V298 VanDerWaalsContact CD1-CG2 3.48Å; Y190-V298 HydrophobicContact CE1-CB 4.46Å; Y190-V298 HydrophobicContact CE1-CG2 3.38Å
191	S	98.8	Very high	98.5	Very high	35 Å²	35	27.9 Å²	27.9	25%	0.245	15%	0.148	C	C	.	.			trans	-74.5	145.9	168.4	177.8	0	0	0	0	110.8	E193 L194 F195 L297	S191-E193 PolarHBondContact O-N 3.04Å; S191-E193 PolarHBondContact OG-N 2.72Å; S191-L194 VanDerWaalsContact O-CB 3.24Å; S191-L194 WeakPolarHBondContact O-CB 3.14Å; S191-L194 PolarHBondContact O-N 2.96Å; S191-F195 WeakPolarHBondContact O-CD2 3.49Å; S191-F195 WeakPolarHBondContact O-CE2 3.44Å; S191-L297 VanDerWaalsContact CB-O 3.27Å; S191-L297 WeakPolarHBondContact CB-O 3.35Å; S191-L297 PolarHBondContact N-O 3.4Å
192	L	98.9	Very high	98.5	Very high	73 Å²	73	37 Å²	37	38%	0.382	18%	0.183	S	C	.	.	H	α-helix	trans	-60.8	-31.5	173.8	-63.2	-179	0	0	0	112.6	T104 Q107 V108 L194 F195	T104-L192 HydrophobicContact CG2-CD2 3.94Å; Q107-L192 HydrophobicContact CB-CD1 4.18Å; Q107-L192 HydrophobicContact CB-CD2 3.86Å; V108-L192 HydrophobicContact CG2-CD2 4.11Å; L192-L194 PolarHBondContact O-N 3.1Å; L192-F195 PolarHBondContact O-N 3.31Å
193	E	98.8	Very high	98.4	Very high	68 Å²	68	41.2 Å²	41.2	32%	0.318	20%	0.201	S	C	.	.	H	α-helix	trans	-60.3	-34.6	177.8	-171.4	178.4	156	0	0	112	S191 F195 Q196 E197 K295 L297	S191-E193 PolarHBondContact O-N 3.04Å; S191-E193 PolarHBondContact OG-N 2.72Å; E193-F195 PolarHBondContact O-N 2.92Å; E193-Q196 PolarHBondContact O-N 3.11Å; E193-E197 PolarHBondContact O-N 2.88Å; E193-E197 VanDerWaalsContact O-N 3.09Å; E193-K295 IonicContact OE1-NZ 2.65Å; E193-K295 PolarHBondContact OE1-NZ 3.23Å; E193-K295 IonicContact OE2-NZ 3.06Å; E193-K295 PolarHBondContact OE2-NZ 2.97Å; E193-L297 HydrophobicContact CB-CD1 4.39Å; E193-L297 HydrophobicContact CB-CD2 4.2Å; E193-L297 HydrophobicContact CG-CD1 4.08Å; E193-L297 HydrophobicContact CG-CD2 4.24Å
194	L	98.9	Very high	98.4	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-57.2	-39.3	178.4	-173.3	71.8	0	0	0	112.2	F182 Y190 S191 L192 Q196 E197 M198 W207 L297 V298	F182-L194 HydrophobicContact CE1-CD2 4.36Å; F182-L194 HydrophobicContact CZ-CD2 4.14Å; Y190-L194 HydrophobicContact CD1-CD2 3.74Å; S191-L194 VanDerWaalsContact O-CB 3.24Å; S191-L194 WeakPolarHBondContact O-CB 3.14Å; S191-L194 PolarHBondContact O-N 2.96Å; L192-L194 PolarHBondContact O-N 3.1Å; L194-Q196 VanDerWaalsContact C-N 3.27Å; L194-Q196 PolarHBondContact O-N 3.25Å; L194-E197 WeakPolarHBondContact O-CB 3.37Å; L194-E197 PolarHBondContact O-N 2.89Å; L194-M198 HydrophobicContact CD2-CE 3.91Å; L194-M198 HydrophobicContact CG-CE 3.7Å; L194-M198 PolarHBondContact O-N 3.32Å; L194-W207 HydrophobicContact CD1-CD2 3.82Å; L194-W207 HydrophobicContact CD1-CE3 4.46Å; L194-W207 HydrophobicContact CD1-CG 3.97Å; L194-W207 HydrophobicContact CD1-CZ2 4.07Å; L194-L297 HydrophobicContact CB-CB 4.05Å; L194-L297 HydrophobicContact CD1-CB 3.81Å; L194-L297 HydrophobicContact CD1-CD1 4.49Å; L194-V298 HydrophobicContact CD2-CB 3.92Å; L194-V298 HydrophobicContact CD2-CG2 4.49Å
195	F	98.8	Very high	98.5	Very high	1 Å²	1	41.2 Å²	41.2	0%	0.004	20%	0.201	C	C	.	.	H	α-helix	trans	-71.8	-24.2	-178.5	-59.8	-84	0	0	0	112.3	I82 T104 F105 V108 L111 Y190 S191 L192 E193 M198 R199	I82-F195 HydrophobicContact CD1-CB 3.78Å; I82-F195 HydrophobicContact CD1-CD1 3.92Å; I82-F195 HydrophobicContact CD1-CG 4.34Å; I82-F195 WeakPolarHBondContact CD1-O 3.38Å; T104-F195 HydrophobicContact CG2-CE2 4.14Å; F105-F195 HydrophobicContact CD1-CE1 4.2Å; F105-F195 AromaticContact CD1-CZ 3.86Å; F105-F195 HydrophobicContact CD1-CZ 3.86Å; F105-F195 AromaticContact CE1-CE1 3.85Å; F105-F195 HydrophobicContact CE1-CE1 3.85Å; F105-F195 AromaticContact CE1-CZ 3.55Å; F105-F195 HydrophobicContact CE1-CZ 3.55Å; V108-F195 HydrophobicContact CB-CG 4.45Å; V108-F195 HydrophobicContact CG1-CB 3.67Å; V108-F195 HydrophobicContact CG1-CD1 4.05Å; V108-F195 HydrophobicContact CG1-CG 3.86Å; V108-F195 HydrophobicContact CG2-CB 4.15Å; V108-F195 HydrophobicContact CG2-CD1 4.11Å; V108-F195 HydrophobicContact CG2-CD2 3.63Å; V108-F195 HydrophobicContact CG2-CE1 4.47Å; V108-F195 HydrophobicContact CG2-CE2 4.03Å; V108-F195 HydrophobicContact CG2-CG 3.68Å; V108-F195 HydrophobicContact CG2-CZ 4.45Å; L111-F195 HydrophobicContact CD1-CD1 4.16Å; L111-F195 HydrophobicContact CD1-CE1 4.06Å; Y190-F195 HydrophobicContact CG-CZ 4.27Å; S191-F195 WeakPolarHBondContact O-CD2 3.49Å; S191-F195 WeakPolarHBondContact O-CE2 3.44Å; L192-F195 PolarHBondContact O-N 3.31Å; E193-F195 PolarHBondContact O-N 2.92Å; F195-M198 HydrophobicContact CD1-CE 4.16Å; F195-M198 HydrophobicContact CD1-SD 4.23Å; F195-M198 HydrophobicContact CE1-CE 4.49Å; F195-R199 WeakPolarHBondContact O-CB 3.17Å; F195-R199 PolarHBondContact O-N 3.48Å
196	Q	98.5	Very high	98.5	Very high	113 Å²	113	39.7 Å²	39.7	53%	0.528	19%	0.193	S	C	.	.	H	α-helix	trans	-76.8	-41	171.5	-59.5	-58.2	-11.6	0	0	110.8	E193 L194 M198 R199	E193-Q196 PolarHBondContact O-N 3.11Å; L194-Q196 VanDerWaalsContact C-N 3.27Å; L194-Q196 PolarHBondContact O-N 3.25Å; Q196-M198 PolarHBondContact O-N 3.45Å; Q196-R199 VanDerWaalsContact O-CB 3.32Å; Q196-R199 WeakPolarHBondContact O-CB 3.27Å; Q196-R199 PolarHBondContact O-N 3.21Å
197	E	98.8	Very high	98.6	Very high	52 Å²	52	39.3 Å²	39.3	24%	0.243	19%	0.191	C	C	.	.	H	α-helix	trans	-58.3	-48.3	176.6	-71.4	-66.1	113.4	0	0	112.5	E193 L194 R199 T200 K289 A290 L297	E193-E197 PolarHBondContact O-N 2.88Å; E193-E197 VanDerWaalsContact O-N 3.09Å; L194-E197 WeakPolarHBondContact O-CB 3.37Å; L194-E197 PolarHBondContact O-N 2.89Å; E197-R199 VanDerWaalsContact C-N 3.32Å; E197-R199 PolarHBondContact O-N 2.65Å; E197-T200 PolarHBondContact O-OG1 2.67Å; E197-K289 HydrophobicContact CB-CB 4.2Å; E197-K289 WeakPolarHBondContact O-CD 3.49Å; E197-K289 VanDerWaalsContact O-CE 3.27Å; E197-K289 WeakPolarHBondContact O-CE 3.19Å; E197-K289 PolarHBondContact O-NZ 3.34Å; E197-K289 WeakPolarHBondContact OE2-CB 3.24Å; E197-A290 PolarHBondContact OE2-N 2.55Å; E197-L297 HydrophobicContact CG-CD1 3.9Å
198	M	98.7	Very high	98.6	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-75.2	-18.3	-179.1	76.9	178.1	64.4	0	0	113.7	I82 V180 F182 L194 F195 Q196 T200 T201 W207 A248	I82-M198 HydrophobicContact CD1-CG 3.85Å; I82-M198 HydrophobicContact CD1-SD 3.9Å; I82-M198 HydrophobicContact CG1-CG 4.33Å; I82-M198 HydrophobicContact CG1-SD 4.3Å; I82-M198 HydrophobicContact CG2-SD 4.06Å; V180-M198 HydrophobicContact CG1-CG 4.4Å; F182-M198 HydrophobicContact CB-CE 4.33Å; F182-M198 HydrophobicContact CB-SD 3.76Å; F182-M198 HydrophobicContact CD1-CE 3.73Å; F182-M198 HydrophobicContact CD1-SD 4.12Å; F182-M198 HydrophobicContact CD2-CE 4.05Å; F182-M198 HydrophobicContact CD2-SD 4.48Å; F182-M198 HydrophobicContact CE1-CE 3.97Å; F182-M198 HydrophobicContact CE2-CE 4.31Å; F182-M198 HydrophobicContact CG-CE 3.76Å; F182-M198 HydrophobicContact CG-SD 3.87Å; F182-M198 HydrophobicContact CZ-CE 4.25Å; L194-M198 HydrophobicContact CD2-CE 3.91Å; L194-M198 HydrophobicContact CG-CE 3.7Å; L194-M198 PolarHBondContact O-N 3.32Å; F195-M198 HydrophobicContact CD1-CE 4.16Å; F195-M198 HydrophobicContact CD1-SD 4.23Å; F195-M198 HydrophobicContact CE1-CE 4.49Å; Q196-M198 PolarHBondContact O-N 3.45Å; M198-T200 PolarHBondContact O-N 3.45Å; M198-T200 VanDerWaalsContact O-N 3.11Å; M198-T201 WeakPolarHBondContact O-CB 3.22Å; M198-T201 PolarHBondContact O-N 3.09Å; M198-T201 PolarHBondContact O-OG1 3.11Å; M198-W207 HydrophobicContact CB-CH2 3.58Å; M198-W207 HydrophobicContact CB-CZ3 3.71Å; M198-W207 HydrophobicContact CE-CH2 3.85Å; M198-W207 HydrophobicContact CE-CZ2 4.03Å; M198-A248 HydrophobicContact CB-CB 4.03Å
199	R	98.4	Very high	98.6	Very high	9 Å²	9	38.4 Å²	38.4	3%	0.034	19%	0.186	C	C	.	.	H	α-helix	trans	-57	-33.4	-175.3	-166.8	69.3	57.8	163.6	8.4	112.5	L79 P80 I82 A109 Q110 F195 Q196 E197	L79-R199 HydrophobicContact CD1-CG 4.19Å; P80-R199 HydrophobicContact CB-CG 4.37Å; P80-R199 HydrophobicContact CG-CG 4.27Å; P80-R199 WeakPolarHBondContact O-CD 3.37Å; P80-R199 PolarHBondContact O-NH1 3.48Å; I82-R199 VanDerWaalsContact CG1-CZ 3.45Å; A109-R199 VanDerWaalsContact O-CZ 3.22Å; A109-R199 PolarHBondContact O-NH1 2.83Å; A109-R199 PolarHBondContact O-NH2 3.11Å; Q110-R199 PolarHBondContact O-NH1 3.49Å; F195-R199 WeakPolarHBondContact O-CB 3.17Å; F195-R199 PolarHBondContact O-N 3.48Å; Q196-R199 VanDerWaalsContact O-CB 3.32Å; Q196-R199 WeakPolarHBondContact O-CB 3.27Å; Q196-R199 PolarHBondContact O-N 3.21Å; E197-R199 VanDerWaalsContact C-N 3.32Å; E197-R199 PolarHBondContact O-N 2.65Å
200	T	97.8	Very high	98.6	Very high	91 Å²	91	35.8 Å²	35.8	56%	0.558	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.3	11.1	-171.3	57.1	0	0	0	0	113.4	E197 M198 R202 K289	E197-T200 PolarHBondContact O-OG1 2.67Å; M198-T200 PolarHBondContact O-N 3.45Å; M198-T200 VanDerWaalsContact O-N 3.11Å; T200-R202 PolarHBondContact O-N 3.16Å; T200-K289 PolarHBondContact OG1-NZ 2.93Å
201	T	98.6	Very high	98.5	Very high	11 Å²	11	40 Å²	40	7%	0.067	19%	0.193	C	C	.	.			trans	-62.7	124.2	-179.6	-61	0	0	0	0	111.7	V180 M198 S205	V180-T201 HydrophobicContact CG2-CG2 4.45Å; M198-T201 WeakPolarHBondContact O-CB 3.22Å; M198-T201 PolarHBondContact O-N 3.09Å; M198-T201 PolarHBondContact O-OG1 3.11Å; T201-S205 WeakPolarHBondContact OG1-CB 3.49Å; T201-S205 PolarHBondContact OG1-OG 3Å
202	R	97.5	Very high	98.4	Very high	190 Å²	190	39.1 Å²	39.1	72%	0.717	19%	0.186	S	C	*	.	S	Bend	trans	-95.7	-41.2	178.2	-60.3	179.6	-70.9	-128.6	-1.3	112.1	T200 S250 E287	T200-R202 PolarHBondContact O-N 3.16Å; R202-S250 WeakPolarHBondContact O-CB 3.43Å; R202-S250 PolarHBondContact O-OG 2.79Å; R202-E287 WeakPolarHBondContact CA-OE1 3.39Å; R202-E287 VanDerWaalsContact CB-OE1 3.29Å; R202-E287 WeakPolarHBondContact CB-OE1 3.42Å; R202-E287 PolarHBondContact N-OE1 2.75Å; R202-E287 PolarHBondContact N-OE2 3.13Å
203	K	97.7	Very high	98	Very high	90 Å²	90	37.2 Å²	37.2	39%	0.391	18%	0.184	S	C	.	.	S	Bend	trans	-116.5	-87.3	172.7	-70	-172.8	175.2	-177.5	0	110.7	S250 V253 E285 E287	K203-S250 PolarHBondContact O-N 3.33Å; K203-V253 HydrophobicContact CB-CG2 4.35Å; K203-V253 HydrophobicContact CG-CG2 4.39Å; K203-E285 HydrophobicContact CD-CB 4.1Å; K203-E285 HydrophobicContact CD-CG 4.26Å; K203-E285 IonicContact NZ-OE1 2.6Å; K203-E285 PolarHBondContact NZ-OE1 3.06Å; K203-E287 PolarHBondContact N-OE1 3.48Å
204	V	98.8	Very high	97.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	123.6	179.1	179.6	0	0	0	0	108.2	F247 A248 V249 L277 I280 T281 L286 E287	V204-F247 HydrophobicContact CG1-CB 4.49Å; V204-A248 CarbonylContact C-O 3.59Å; V204-A248 WeakPolarHBondContact CA-O 3.42Å; V204-V249 HydrophobicContact CG2-CG1 4.14Å; V204-V249 HydrophobicContact CG2-CG2 4.21Å; V204-L277 HydrophobicContact CG1-CD2 3.98Å; V204-I280 HydrophobicContact CG2-CD1 4.24Å; V204-I280 HydrophobicContact CG2-CG1 4.47Å; V204-T281 HydrophobicContact CB-CG2 4.06Å; V204-T281 HydrophobicContact CG1-CG2 4.42Å; V204-T281 HydrophobicContact CG2-CG2 3.71Å; V204-L286 HydrophobicContact CB-CD2 3.84Å; V204-L286 HydrophobicContact CG1-CD2 3.64Å; V204-L286 WeakPolarHBondContact O-CA 3.46Å; V204-E287 PolarHBondContact O-N 3.09Å
205	S	98.9	Very high	97.6	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	145.6	177.3	55.2	0	0	0	0	111.1	T201 W207 F247 A248 E287	T201-S205 WeakPolarHBondContact OG1-CB 3.49Å; T201-S205 PolarHBondContact OG1-OG 3Å; S205-W207 VanDerWaalsContact OG-CZ3 3.24Å; S205-W207 WeakPolarHBondContact OG-CZ3 3.49Å; S205-F247 CarbonylContact O-C 3.54Å; S205-F247 WeakPolarHBondContact O-CA 3.42Å; S205-F247 WeakPolarHBondContact O-CB 3.34Å; S205-A248 PolarHBondContact N-O 2.52Å; S205-A248 PolarHBondContact O-N 2.94Å; S205-A248 PolarHBondContact OG-O 3.22Å; S205-E287 CarbonylContact C-O 3.59Å; S205-E287 VanDerWaalsContact CA-O 3.24Å; S205-E287 WeakPolarHBondContact CA-O 3.45Å
206	V	98.9	Very high	97.6	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	152.4	-178.9	-65.2	0	0	0	0	112.4	P220 V227 I242 G246 F247 L286 E287 K289	V206-P220 HydrophobicContact CB-CG 3.85Å; V206-P220 HydrophobicContact CG2-CB 4.15Å; V206-P220 HydrophobicContact CG2-CG 3.63Å; V206-V227 HydrophobicContact CG2-CG2 3.85Å; V206-I242 HydrophobicContact CB-CD1 3.87Å; V206-I242 HydrophobicContact CG1-CD1 3.84Å; V206-G246 WeakPolarHBondContact CA-O 3.34Å; V206-F247 HydrophobicContact CG1-CB 4Å; V206-L286 HydrophobicContact CG1-CD1 4.15Å; V206-L286 HydrophobicContact CG1-CD2 4.01Å; V206-L286 HydrophobicContact CG1-CG 4.49Å; V206-L286 HydrophobicContact CG2-CB 4.21Å; V206-L286 HydrophobicContact CG2-CD1 4.42Å; V206-E287 PolarHBondContact N-O 3.47Å; V206-K289 PolarHBondContact O-N 3.02Å
207	W	98.9	Very high	97.6	Very high	1 Å²	1	51.2 Å²	51.2	0%	0.004	26%	0.257	C	S	.	.			trans	-153.7	168	-179.6	47.4	77.7	0	0	0	112.6	F182 L194 M198 S205 A245 G246 A248 K289 A290	F182-W207 HydrophobicContact CD2-CH2 4.4Å; F182-W207 AromaticContact CD2-CZ2 3.98Å; F182-W207 HydrophobicContact CD2-CZ2 3.98Å; F182-W207 HydrophobicContact CE2-CH2 4.46Å; F182-W207 AromaticContact CE2-CZ2 3.62Å; F182-W207 HydrophobicContact CE2-CZ2 3.62Å; F182-W207 HydrophobicContact CZ-CZ2 4.34Å; L194-W207 HydrophobicContact CD1-CD2 3.82Å; L194-W207 HydrophobicContact CD1-CE3 4.46Å; L194-W207 HydrophobicContact CD1-CG 3.97Å; L194-W207 HydrophobicContact CD1-CZ2 4.07Å; M198-W207 HydrophobicContact CB-CH2 3.58Å; M198-W207 HydrophobicContact CB-CZ3 3.71Å; M198-W207 HydrophobicContact CE-CH2 3.85Å; M198-W207 HydrophobicContact CE-CZ2 4.03Å; S205-W207 VanDerWaalsContact OG-CZ3 3.24Å; S205-W207 WeakPolarHBondContact OG-CZ3 3.49Å; W207-A245 PolarHBondContact NE1-O 3.06Å; W207-G246 PolarHBondContact N-O 2.76Å; W207-A248 HydrophobicContact CH2-CB 3.49Å; W207-A248 VanDerWaalsContact CH2-CB 3.49Å; W207-A248 HydrophobicContact CZ2-CB 4.4Å; W207-A248 HydrophobicContact CZ3-CB 4.16Å; W207-K289 HydrophobicContact CB-CB 4.43Å; W207-K289 HydrophobicContact CE3-CB 3.98Å; W207-K289 HydrophobicContact CE3-CG 4Å; W207-K289 HydrophobicContact CZ3-CG 4.37Å; W207-A290 HydrophobicContact CB-CB 4.07Å
208	P	98.8	Very high	97.6	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.013	25%	0.248	C	C	.	.			trans	-66	144.7	173	-22.5	35.7	0	0	0	113.2	E218 R219 C293 K295 V296	P208-E218 VanDerWaalsContact CA-O 3.3Å; P208-E218 WeakPolarHBondContact CA-O 3.38Å; P208-R219 HydrophobicContact CB-CB 3.83Å; P208-R219 HydrophobicContact CG-CB 3.79Å; P208-C293 VanDerWaalsContact CG-C 3.44Å; P208-C293 HydrophobicContact CG-CB 3.98Å; P208-C293 VanDerWaalsContact CG-O 3.23Å; P208-C293 WeakPolarHBondContact CG-O 3.22Å; P208-K295 WeakPolarHBondContact CD-O 3.34Å; P208-K295 WeakPolarHBondContact CG-O 3.28Å; P208-V296 HydrophobicContact CB-CG2 4.11Å
209	V	98.8	Very high	97.5	Very high	3 Å²	3	52.7 Å²	52.7	2%	0.018	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	127.6	174.4	-177.3	0	0	0	0	109.3	V212 Y217 E218 D243 V298 H300	V209-V212 HydrophobicContact CB-CG1 3.97Å; V209-V212 HydrophobicContact CG1-CB 4.24Å; V209-V212 HydrophobicContact CG1-CG1 3.95Å; V209-Y217 CarbonylContact O-C 3.57Å; V209-Y217 WeakPolarHBondContact O-CA 3.47Å; V209-Y217 VanDerWaalsContact O-CB 3.3Å; V209-Y217 WeakPolarHBondContact O-CB 3.38Å; V209-E218 PolarHBondContact N-O 3.48Å; V209-E218 PolarHBondContact O-N 3.36Å; V209-D243 HydrophobicContact CG1-CB 4.44Å; V209-D243 HydrophobicContact CG2-CB 4.32Å; V209-V298 HydrophobicContact CB-CG1 4.3Å; V209-V298 HydrophobicContact CG1-CG1 4.3Å; V209-V298 HydrophobicContact CG2-CG1 3.88Å; V209-H300 HydrophobicContact CG1-CB 4.31Å
210	G	98.6	Very high	97.5	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.01	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	150.7	176.9	0	0	0	0	0	113	V212 R216 V298 H300	G210-V212 PolarHBondContact O-N 3.31Å; G210-R216 WeakPolarHBondContact CA-O 3.21Å; G210-V298 PolarHBondContact N-O 3.36Å; G210-H300 PolarHBondContact O-N 3.35Å
211	L	97.6	Very high	97.6	Very high	100 Å²	100	50.7 Å²	50.7	52%	0.524	25%	0.248	S	C	.	.	S	Bend	trans	60.1	36.3	171.1	-48	179	0	0	0	114.8	R216 T301	L211-R216 PolarHBondContact N-O 2.62Å; L211-T301 HydrophobicContact CD1-CG2 4.39Å
212	V	95.6	Very high	97.6	Very high	16 Å²	16	51.6 Å²	51.6	10%	0.097	25%	0.253	C	S	.	.			trans	-124.4	160.9	-178.3	73.6	0	0	0	0	111.6	V209 G210 G214 R215 E218 D243 H300	V209-V212 HydrophobicContact CB-CG1 3.97Å; V209-V212 HydrophobicContact CG1-CB 4.24Å; V209-V212 HydrophobicContact CG1-CG1 3.95Å; G210-V212 PolarHBondContact O-N 3.31Å; V212-G214 PolarHBondContact O-N 3.36Å; V212-G214 VanDerWaalsContact O-N 3.1Å; V212-R215 PolarHBondContact O-N 2.82Å; V212-E218 HydrophobicContact CG1-CB 3.83Å; V212-E218 HydrophobicContact CG1-CG 3.76Å; V212-D243 HydrophobicContact CG1-CB 4.46Å; V212-D243 HydrophobicContact CG2-CB 3.89Å; V212-H300 HydrophobicContact CB-CB 4.21Å
213	G	91.8	Very high	97.6	Very high	33 Å²	33	48.7 Å²	48.7	34%	0.34	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	22.8	175.6	0	0	0	0	0	114.9	R215	G213-R215 VanDerWaalsContact C-N 3.26Å; G213-R215 PolarHBondContact O-N 3.48Å
214	G	93.1	Very high	97.5	Very high	88 Å²	88	52.4 Å²	52.4	91%	0.907	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	21.4	-174.6	0	0	0	0	0	113.8	V212	V212-G214 PolarHBondContact O-N 3.36Å; V212-G214 VanDerWaalsContact O-N 3.1Å
215	R	95.9	Very high	97.4	Very high	95 Å²	95	54 Å²	54	36%	0.358	29%	0.289	S	S	.	.	S	Bend	trans	-126.7	168.3	-179.6	-67.5	-170.9	170	-172.4	3.5	111.8	V212 G213 Y217 Y231 T232 G233	V212-R215 PolarHBondContact O-N 2.82Å; G213-R215 VanDerWaalsContact C-N 3.26Å; G213-R215 PolarHBondContact O-N 3.48Å; R215-Y217 WeakPolarHBondContact CB-O 3.4Å; R215-Y217 PolarHBondContact O-N 3.36Å; R215-Y231 VanDerWaalsContact NH1-CE2 3.25Å; R215-Y231 PolarHBondContact NH1-OH 3.11Å; R215-T232 PolarHBondContact NH1-O 3.05Å; R215-T232 PolarHBondContact NH2-O 3.2Å; R215-G233 VanDerWaalsContact CZ-CA 3.49Å
216	R	97.8	Very high	97.3	Very high	210 Å²	210	59.2 Å²	59.2	79%	0.792	31%	0.311	S	S	*	.	S	Bend	trans	-58.6	-37.9	170.2	-69.2	-178.4	66	-160.2	0.3	111.5	G210 L211	G210-R216 WeakPolarHBondContact CA-O 3.21Å; L211-R216 PolarHBondContact N-O 2.62Å
217	Y	98.4	Very high	97.3	Very high	83 Å²	83	59.6 Å²	59.6	33%	0.325	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	161	172.9	58.6	-93	0	0	0	110.3	V209 R215 R219 Y231 V296	V209-Y217 CarbonylContact O-C 3.57Å; V209-Y217 WeakPolarHBondContact O-CA 3.47Å; V209-Y217 VanDerWaalsContact O-CB 3.3Å; V209-Y217 WeakPolarHBondContact O-CB 3.38Å; R215-Y217 WeakPolarHBondContact CB-O 3.4Å; R215-Y217 PolarHBondContact O-N 3.36Å; Y217-R219 HydrophobicContact CD2-CB 4.46Å; Y217-R219 HydrophobicContact CD2-CG 4.35Å; Y217-R219 HydrophobicContact CE2-CG 4.2Å; Y217-Y231 HydrophobicContact CD2-CD1 4.23Å; Y217-Y231 HydrophobicContact CD2-CE1 4.25Å; Y217-Y231 AromaticContact CE2-CD1 3.95Å; Y217-Y231 HydrophobicContact CE2-CD1 3.95Å; Y217-Y231 AromaticContact CE2-CE1 3.87Å; Y217-Y231 HydrophobicContact CE2-CE1 3.87Å; Y217-V296 HydrophobicContact CG-CG2 4.33Å
218	E	98.4	Very high	97.2	Very high	13 Å²	13	63.4 Å²	63.4	6%	0.061	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	151.7	161.2	-64.2	-168.1	143.4	0	0	109.1	P208 V209 V212 Y231 T232 G233	P208-E218 VanDerWaalsContact CA-O 3.3Å; P208-E218 WeakPolarHBondContact CA-O 3.38Å; V209-E218 PolarHBondContact N-O 3.48Å; V209-E218 PolarHBondContact O-N 3.36Å; V212-E218 HydrophobicContact CG1-CB 3.83Å; V212-E218 HydrophobicContact CG1-CG 3.76Å; E218-Y231 VanDerWaalsContact CA-O 3.29Å; E218-Y231 WeakPolarHBondContact CA-O 3.38Å; E218-Y231 WeakPolarHBondContact CB-O 3.47Å; E218-T232 VanDerWaalsContact CD-OG1 3.25Å; E218-T232 WeakPolarHBondContact OE1-CA 3.45Å; E218-T232 VanDerWaalsContact OE1-CB 3.22Å; E218-T232 WeakPolarHBondContact OE1-CB 3.49Å; E218-T232 PolarHBondContact OE1-OG1 2.72Å; E218-G233 PolarHBondContact OE1-N 2.7Å
219	R	98.4	Very high	97.1	Very high	70 Å²	70	64.1 Å²	64.1	26%	0.264	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	154.1	-179.2	66.1	171.5	-170	96.9	-6.2	113.6	P208 Y217 Y231 C293	P208-R219 HydrophobicContact CB-CB 3.83Å; P208-R219 HydrophobicContact CG-CB 3.79Å; Y217-R219 HydrophobicContact CD2-CB 4.46Å; Y217-R219 HydrophobicContact CD2-CG 4.35Å; Y217-R219 HydrophobicContact CE2-CG 4.2Å; R219-Y231 HydrophobicContact CG-CD1 4.29Å; R219-Y231 HydrophobicContact CG-CG 4.35Å; R219-Y231 PolarHBondContact N-O 2.82Å; R219-Y231 PolarHBondContact O-N 3.3Å; R219-C293 VanDerWaalsContact CD-O 3.3Å; R219-C293 WeakPolarHBondContact CD-O 3.36Å
220	P	98.4	Very high	97.1	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	141.3	159.6	-14.9	27.7	0	0	0	110.9	V206 V222 V227 W230 I242 C293	V206-P220 HydrophobicContact CB-CG 3.85Å; V206-P220 HydrophobicContact CG2-CB 4.15Å; V206-P220 HydrophobicContact CG2-CG 3.63Å; P220-V222 HydrophobicContact CB-CG2 4.4Å; P220-V227 HydrophobicContact CB-CG1 4.08Å; P220-V227 HydrophobicContact CB-CG2 4.17Å; P220-W230 HydrophobicContact CB-CE3 4.22Å; P220-W230 HydrophobicContact CB-CZ3 4.01Å; P220-W230 HydrophobicContact CG-CE3 4.35Å; P220-W230 HydrophobicContact CG-CZ3 3.89Å; P220-I242 HydrophobicContact CG-CD1 4.48Å; P220-C293 HydrophobicContact CB-CB 4.28Å; P220-C293 HydrophobicContact CG-CB 4.28Å; P220-C293 VanDerWaalsContact CG-SG 3.58Å
221	L	98.4	Very high	97	Very high	59 Å²	59	69.7 Å²	69.7	31%	0.309	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	129	165.8	-61	178.6	0	0	0	108.1	V227 V228 G229	L221-V227 CarbonylContact O-C 3.59Å; L221-V227 WeakPolarHBondContact O-CA 3.49Å; L221-V228 HydrophobicContact CB-CG2 4.15Å; L221-V228 PolarHBondContact O-N 2.95Å; L221-G229 PolarHBondContact N-O 3.39Å
222	V	98.6	Very high	96.9	Very high	30 Å²	30	65.5 Å²	65.5	18%	0.182	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	128.3	-172.2	-176.9	0	0	0	0	109.6	P220 K226 V227 P288 N292 C293	P220-V222 HydrophobicContact CB-CG2 4.4Å; V222-K226 CarbonylContact C-O 3.56Å; V222-K226 VanDerWaalsContact CA-O 3.24Å; V222-K226 WeakPolarHBondContact CA-O 3.32Å; V222-V227 HydrophobicContact CG2-CG2 4.49Å; V222-P288 HydrophobicContact CG1-CB 4.09Å; V222-P288 HydrophobicContact CG1-CG 3.94Å; V222-P288 HydrophobicContact CG2-CB 3.67Å; V222-P288 HydrophobicContact CG2-CG 4.37Å; V222-N292 HydrophobicContact CG1-CB 4.2Å; V222-C293 HydrophobicContact CG2-CB 3.91Å
223	E	98.1	Very high	96.3	Very high	128 Å²	128	66.6 Å²	66.6	60%	0.598	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.2	132.5	172.5	-69.2	-179.9	-170.1	0	0	108.6	G225 K226 V228	E223-G225 PolarHBondContact O-N 2.78Å; E223-G225 VanDerWaalsContact O-N 3.08Å; E223-K226 PolarHBondContact N-O 2.77Å; E223-K226 PolarHBondContact O-N 3.22Å; E223-V228 HydrophobicContact CB-CG1 4.02Å; E223-V228 HydrophobicContact CB-CG2 4.26Å; E223-V228 HydrophobicContact CG-CG1 4.49Å; E223-V228 HydrophobicContact CG-CG2 3.88Å
224	N	96.4	Very high	95.8	Very high	168 Å²	168	70.2 Å²	70.2	90%	0.898	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	37.5	-179.8	-57.3	-41	0	0	0	114	K226	N224-K226 VanDerWaalsContact C-N 3.27Å; N224-K226 PolarHBondContact O-N 3.32Å
225	G	95.2	Very high	95.2	Very high	35 Å²	35	69.3 Å²	69.3	36%	0.361	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	12.4	-179.6	0	0	0	0	0	115	E223 P288	E223-G225 PolarHBondContact O-N 2.78Å; E223-G225 VanDerWaalsContact O-N 3.08Å; G225-P288 WeakPolarHBondContact O-CG 3.49Å
226	K	98.1	Very high	94.6	Very high	109 Å²	109	67.7 Å²	67.7	47%	0.474	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	142.6	178.6	-67.3	-62.5	-169.4	174.2	0	111.4	V222 E223 N224 V228 E284	V222-K226 CarbonylContact C-O 3.56Å; V222-K226 VanDerWaalsContact CA-O 3.24Å; V222-K226 WeakPolarHBondContact CA-O 3.32Å; E223-K226 PolarHBondContact N-O 2.77Å; E223-K226 PolarHBondContact O-N 3.22Å; N224-K226 VanDerWaalsContact C-N 3.27Å; N224-K226 PolarHBondContact O-N 3.32Å; K226-V228 PolarHBondContact O-N 2.99Å; K226-E284 PolarHBondContact NZ-O 2.89Å
227	V	98.2	Very high	94	Very high	7 Å²	7	63.4 Å²	63.4	4%	0.042	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	125.9	173.4	-178.8	0	0	0	0	108.5	V206 P220 L221 V222 W230 V283 L286	V206-V227 HydrophobicContact CG2-CG2 3.85Å; P220-V227 HydrophobicContact CB-CG1 4.08Å; P220-V227 HydrophobicContact CB-CG2 4.17Å; L221-V227 CarbonylContact O-C 3.59Å; L221-V227 WeakPolarHBondContact O-CA 3.49Å; V222-V227 HydrophobicContact CG2-CG2 4.49Å; V227-W230 HydrophobicContact CG1-CH2 4.35Å; V227-W230 HydrophobicContact CG1-CZ2 4.33Å; V227-V283 HydrophobicContact CB-CG1 4.06Å; V227-V283 HydrophobicContact CG1-CG1 3.91Å; V227-V283 WeakPolarHBondContact O-CG1 3.42Å; V227-L286 HydrophobicContact CB-CB 4.36Å; V227-L286 HydrophobicContact CB-CD1 4.21Å; V227-L286 HydrophobicContact CG1-CD1 4.2Å; V227-L286 HydrophobicContact CG2-CB 3.81Å; V227-L286 HydrophobicContact CG2-CD1 4.13Å
228	V	97.1	Very high	93.6	Very high	81 Å²	81	60 Å²	60	49%	0.491	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	-7.4	-179.5	-62.1	0	0	0	0	113	L221 E223 K226	L221-V228 HydrophobicContact CB-CG2 4.15Å; L221-V228 PolarHBondContact O-N 2.95Å; E223-V228 HydrophobicContact CB-CG1 4.02Å; E223-V228 HydrophobicContact CB-CG2 4.26Å; E223-V228 HydrophobicContact CG-CG1 4.49Å; E223-V228 HydrophobicContact CG-CG2 3.88Å; K226-V228 PolarHBondContact O-N 2.99Å
229	G	96.8	Very high	93.4	Very high	17 Å²	17	61.6 Å²	61.6	18%	0.175	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.1	-165.3	-179.7	0	0	0	0	0	112.6	L221	L221-G229 PolarHBondContact N-O 3.39Å
230	W	98.1	Very high	93.3	Very high	28 Å²	28	58.5 Å²	58.5	11%	0.106	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	129.8	-172.5	-51.1	100.4	0	0	0	111.2	P220 V227 T232 P239 F240 A241 I242 L286	P220-W230 HydrophobicContact CB-CE3 4.22Å; P220-W230 HydrophobicContact CB-CZ3 4.01Å; P220-W230 HydrophobicContact CG-CE3 4.35Å; P220-W230 HydrophobicContact CG-CZ3 3.89Å; V227-W230 HydrophobicContact CG1-CH2 4.35Å; V227-W230 HydrophobicContact CG1-CZ2 4.33Å; W230-T232 HydrophobicContact CB-CG2 4.2Å; W230-T232 PolarHBondContact O-N 2.95Å; W230-P239 PolarHBondContact NE1-O 3.47Å; W230-P239 VanDerWaalsContact NE1-O 3.16Å; W230-F240 HydrophobicContact CH2-CD1 4.21Å; W230-F240 HydrophobicContact CZ2-CB 4.12Å; W230-F240 AromaticContact CZ2-CD1 3.85Å; W230-F240 HydrophobicContact CZ2-CD1 3.85Å; W230-F240 HydrophobicContact CZ2-CG 4.35Å; W230-A241 HydrophobicContact CB-CB 3.74Å; W230-A241 HydrophobicContact CD2-CB 4.25Å; W230-A241 HydrophobicContact CG-CB 3.64Å; W230-I242 HydrophobicContact CE3-CB 4.23Å; W230-I242 HydrophobicContact CH2-CB 4.37Å; W230-I242 HydrophobicContact CZ3-CB 3.79Å; W230-I242 HydrophobicContact CZ3-CD1 3.97Å; W230-I242 HydrophobicContact CZ3-CG1 4.2Å; W230-I242 HydrophobicContact CZ3-CG2 4.5Å; W230-L286 HydrophobicContact CH2-CD1 3.64Å; W230-L286 HydrophobicContact CZ2-CD1 3.93Å
231	Y	97.5	Very high	93.2	Very high	93 Å²	93	58.6 Å²	58.6	37%	0.365	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	98.3	165.5	179.1	-96.5	0	0	0	108.5	R215 Y217 E218 R219	R215-Y231 VanDerWaalsContact NH1-CE2 3.25Å; R215-Y231 PolarHBondContact NH1-OH 3.11Å; Y217-Y231 HydrophobicContact CD2-CD1 4.23Å; Y217-Y231 HydrophobicContact CD2-CE1 4.25Å; Y217-Y231 AromaticContact CE2-CD1 3.95Å; Y217-Y231 HydrophobicContact CE2-CD1 3.95Å; Y217-Y231 AromaticContact CE2-CE1 3.87Å; Y217-Y231 HydrophobicContact CE2-CE1 3.87Å; E218-Y231 VanDerWaalsContact CA-O 3.29Å; E218-Y231 WeakPolarHBondContact CA-O 3.38Å; E218-Y231 WeakPolarHBondContact CB-O 3.47Å; R219-Y231 HydrophobicContact CG-CD1 4.29Å; R219-Y231 HydrophobicContact CG-CG 4.35Å; R219-Y231 PolarHBondContact N-O 2.82Å; R219-Y231 PolarHBondContact O-N 3.3Å
232	T	94.9	Very high	93.1	Very high	12 Å²	12	56.1 Å²	56.1	7%	0.074	31%	0.306	C	S	.	.			trans	-137.6	150.8	-177.6	171.8	0	0	0	0	110.8	R215 E218 W230 W234 A236 A241	R215-T232 PolarHBondContact NH1-O 3.05Å; R215-T232 PolarHBondContact NH2-O 3.2Å; E218-T232 VanDerWaalsContact CD-OG1 3.25Å; E218-T232 WeakPolarHBondContact OE1-CA 3.45Å; E218-T232 VanDerWaalsContact OE1-CB 3.22Å; E218-T232 WeakPolarHBondContact OE1-CB 3.49Å; E218-T232 PolarHBondContact OE1-OG1 2.72Å; W230-T232 HydrophobicContact CB-CG2 4.2Å; W230-T232 PolarHBondContact O-N 2.95Å; T232-W234 PolarHBondContact OG1-N 2.91Å; T232-W234 VanDerWaalsContact OG1-N 3.09Å; T232-W234 PolarHBondContact OG1-O 3.28Å; T232-W234 VanDerWaalsContact OG1-O 3.11Å; T232-A236 HydrophobicContact CG2-CB 3.65Å; T232-A241 HydrophobicContact CG2-CB 3.8Å
233	G	83.8	Confident	93	Very high	40 Å²	40	56 Å²	56	41%	0.412	30%	0.304	S	S	.	.	S	Bend	trans	-86.2	-11.1	172.6	0	0	0	0	0	113.8	R215 E218	R215-G233 VanDerWaalsContact CZ-CA 3.49Å; E218-G233 PolarHBondContact OE1-N 2.7Å
234	W	80.8	Confident	92.9	Very high	109 Å²	109	50.1 Å²	50.1	41%	0.413	28%	0.276	S	S	.	.	S	Bend	trans	-142.4	114.8	-165.8	-173	86.5	0	0	0	111.3	T232 R238 P269 G270	T232-W234 PolarHBondContact OG1-N 2.91Å; T232-W234 VanDerWaalsContact OG1-N 3.09Å; T232-W234 PolarHBondContact OG1-O 3.28Å; T232-W234 VanDerWaalsContact OG1-O 3.11Å; W234-R238 PolarHBondContact O-NH2 2.95Å; W234-P269 WeakPolarHBondContact CH2-O 3.42Å; W234-G270 VanDerWaalsContact CH2-CA 3.45Å
235	R	79.9	Confident	93	Very high	68 Å²	68	42.2 Å²	42.2	26%	0.257	23%	0.234	S	C	.	.			trans	49.7	70.6	179.5	-60.8	-169.8	66.2	-179.2	2.4	113.5	D237 R238	R235-D237 VanDerWaalsContact C-OD1 3.28Å; R235-D237 VanDerWaalsContact CA-OD1 3.25Å; R235-D237 WeakPolarHBondContact CA-OD1 3.39Å; R235-D237 WeakPolarHBondContact CB-OD1 3.3Å; R235-D237 IonicContact NH2-OD2 3.85Å; R235-D237 PolarHBondContact O-N 3.23Å; R235-R238 HydrophobicContact CB-CG 3.79Å; R235-R238 VanDerWaalsContact O-CG 3.27Å; R235-R238 WeakPolarHBondContact O-CG 3.49Å; R235-R238 PolarHBondContact O-N 3.46Å; R235-R238 PolarHBondContact O-NE 3.44Å
236	A	82.5	Confident	93.1	Very high	62 Å²	62	40.5 Å²	40.5	51%	0.512	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-16.8	175.6	0	0	0	0	0	113.4	T232 R238	T232-A236 HydrophobicContact CG2-CB 3.65Å; A236-R238 PolarHBondContact O-N 2.81Å
237	D	85.4	Confident	93.1	Very high	120 Å²	120	35.3 Å²	35.3	64%	0.642	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-10.4	175.4	62.4	-55.6	0	0	0	113.5	R235	R235-D237 VanDerWaalsContact C-OD1 3.28Å; R235-D237 VanDerWaalsContact CA-OD1 3.25Å; R235-D237 WeakPolarHBondContact CA-OD1 3.39Å; R235-D237 WeakPolarHBondContact CB-OD1 3.3Å; R235-D237 IonicContact NH2-OD2 3.85Å; R235-D237 PolarHBondContact O-N 3.23Å
238	R	91	Very high	93.2	Very high	12 Å²	12	35 Å²	35	5%	0.045	19%	0.193	C	C	.	.	S	Bend	trans	-66.5	138.6	178.2	-65.1	-175.6	-69.7	143.8	1.6	110.5	W234 R235 A236 F240 A241 G270 M271	W234-R238 PolarHBondContact O-NH2 2.95Å; R235-R238 HydrophobicContact CB-CG 3.79Å; R235-R238 VanDerWaalsContact O-CG 3.27Å; R235-R238 WeakPolarHBondContact O-CG 3.49Å; R235-R238 PolarHBondContact O-N 3.46Å; R235-R238 PolarHBondContact O-NE 3.44Å; A236-R238 PolarHBondContact O-N 2.81Å; R238-F240 PolarHBondContact O-N 3.36Å; R238-A241 HydrophobicContact CB-CB 4.08Å; R238-G270 VanDerWaalsContact CD-O 3.28Å; R238-G270 WeakPolarHBondContact CD-O 3.44Å; R238-G270 PolarHBondContact NH1-O 3.43Å; R238-M271 HydrophobicContact CB-SD 4.24Å; R238-M271 VanDerWaalsContact CD-SD 3.5Å; R238-M271 HydrophobicContact CG-SD 3.45Å; R238-M271 WeakPolarHBondContact CG-SD 3.42Å
239	P	92.9	Very high	93.3	Very high	45 Å²	45	31.1 Å²	31.1	29%	0.292	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-40	178.2	-31.3	40.4	0	0	0	113.1	W230 K278	W230-P239 PolarHBondContact NE1-O 3.47Å; W230-P239 VanDerWaalsContact NE1-O 3.16Å; P239-K278 HydrophobicContact CB-CD 3.91Å; P239-K278 HydrophobicContact CB-CG 4.02Å; P239-K278 HydrophobicContact CG-CD 3.78Å; P239-K278 HydrophobicContact CG-CG 4.44Å
240	F	96.9	Very high	93.3	Very high	5 Å²	5	30.6 Å²	30.6	2%	0.022	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127	88.2	172.1	-57.5	-93	0	0	0	109.1	W230 R238 I242 S274 L277 K278 T281 V283 L286	W230-F240 HydrophobicContact CH2-CD1 4.21Å; W230-F240 HydrophobicContact CZ2-CB 4.12Å; W230-F240 AromaticContact CZ2-CD1 3.85Å; W230-F240 HydrophobicContact CZ2-CD1 3.85Å; W230-F240 HydrophobicContact CZ2-CG 4.35Å; R238-F240 PolarHBondContact O-N 3.36Å; F240-I242 HydrophobicContact CB-CG2 4.45Å; F240-I242 PolarHBondContact O-N 3.38Å; F240-S274 VanDerWaalsContact C-OG 3.32Å; F240-S274 PolarHBondContact N-OG 3.25Å; F240-S274 VanDerWaalsContact N-OG 3.07Å; F240-S274 PolarHBondContact O-OG 3.49Å; F240-L277 HydrophobicContact CB-CB 4.27Å; F240-L277 HydrophobicContact CB-CD1 3.66Å; F240-L277 HydrophobicContact CD1-CB 4.01Å; F240-L277 HydrophobicContact CD1-CD1 3.88Å; F240-L277 HydrophobicContact CD2-CB 3.58Å; F240-L277 HydrophobicContact CE1-CB 4.23Å; F240-L277 HydrophobicContact CE2-CB 3.83Å; F240-L277 HydrophobicContact CG-CB 3.69Å; F240-L277 HydrophobicContact CG-CD1 3.77Å; F240-L277 HydrophobicContact CG-CG 4.39Å; F240-L277 HydrophobicContact CZ-CB 4.15Å; F240-K278 HydrophobicContact CD2-CG 3.94Å; F240-K278 HydrophobicContact CE2-CB 4.35Å; F240-K278 HydrophobicContact CE2-CG 3.65Å; F240-T281 HydrophobicContact CE1-CG2 4.01Å; F240-T281 HydrophobicContact CZ-CG2 4Å; F240-V283 HydrophobicContact CD1-CG2 4.44Å; F240-V283 HydrophobicContact CE1-CG2 4Å; F240-V283 HydrophobicContact CZ-CG2 4.25Å; F240-L286 HydrophobicContact CD1-CD1 4.02Å; F240-L286 HydrophobicContact CE1-CD1 3.93Å; F240-L286 HydrophobicContact CE1-CD2 4.06Å; F240-L286 HydrophobicContact CE1-CG 4.22Å
241	A	96.3	Very high	93.2	Very high	2 Å²	2	29.3 Å²	29.3	2%	0.017	16%	0.158	C	C	.	.			trans	-83.3	68.7	179.2	0	0	0	0	0	111	W230 T232 R238	W230-A241 HydrophobicContact CB-CB 3.74Å; W230-A241 HydrophobicContact CD2-CB 4.25Å; W230-A241 HydrophobicContact CG-CB 3.64Å; T232-A241 HydrophobicContact CG2-CB 3.8Å; R238-A241 HydrophobicContact CB-CB 4.08Å
242	I	96.8	Very high	93.1	Very high	8 Å²	8	31.2 Å²	31.2	4%	0.041	17%	0.17	C	C	.	.			trans	-134.4	153.9	-177.8	-158.6	174.5	0	0	0	110.3	V206 P220 W230 F240 G246 F247 L277	V206-I242 HydrophobicContact CB-CD1 3.87Å; V206-I242 HydrophobicContact CG1-CD1 3.84Å; P220-I242 HydrophobicContact CG-CD1 4.48Å; W230-I242 HydrophobicContact CE3-CB 4.23Å; W230-I242 HydrophobicContact CH2-CB 4.37Å; W230-I242 HydrophobicContact CZ3-CB 3.79Å; W230-I242 HydrophobicContact CZ3-CD1 3.97Å; W230-I242 HydrophobicContact CZ3-CG1 4.2Å; W230-I242 HydrophobicContact CZ3-CG2 4.5Å; F240-I242 HydrophobicContact CB-CG2 4.45Å; F240-I242 PolarHBondContact O-N 3.38Å; I242-G246 WeakPolarHBondContact CD1-O 3.27Å; I242-F247 HydrophobicContact CD1-CB 4.42Å; I242-F247 HydrophobicContact CG2-CD1 4.05Å; I242-L277 HydrophobicContact CG2-CD1 4Å
243	D	96.1	Very high	93.2	Very high	26 Å²	26	31.5 Å²	31.5	14%	0.139	17%	0.172	C	C	.	.			trans	-79.1	157.8	172.3	-178.5	-99.6	0	0	0	112	V209 V212 A245 G246 H300	V209-D243 HydrophobicContact CG1-CB 4.44Å; V209-D243 HydrophobicContact CG2-CB 4.32Å; V212-D243 HydrophobicContact CG1-CB 4.46Å; V212-D243 HydrophobicContact CG2-CB 3.89Å; D243-A245 PolarHBondContact O-N 3.03Å; D243-A245 WeakPolarHBondContact OD1-CB 3.41Å; D243-A245 PolarHBondContact OD1-N 2.9Å; D243-G246 PolarHBondContact O-N 3.12Å; D243-H300 IonicContact OD1-CD2 3.56Å; D243-H300 IonicContact OD2-CD2 2.72Å
244	M	96.4	Very high	93.8	Very high	5 Å²	5	29.6 Å²	29.6	3%	0.025	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-54.3	-37.4	177.8	-171.1	67.9	59.7	0	0	113.2	F183 G246 F247 F262 Q272 E273	F183-M244 HydrophobicContact CB-CG 3.71Å; F183-M244 HydrophobicContact CB-SD 3.81Å; F183-M244 HydrophobicContact CD2-SD 3.88Å; F183-M244 HydrophobicContact CG-CG 4.44Å; F183-M244 HydrophobicContact CG-SD 3.88Å; M244-G246 PolarHBondContact O-N 2.74Å; M244-F247 HydrophobicContact SD-CE1 4.27Å; M244-F247 HydrophobicContact SD-CZ 4.04Å; M244-F262 HydrophobicContact CE-CD1 4.1Å; M244-F262 HydrophobicContact CE-CE1 3.43Å; M244-F262 VanDerWaalsContact CE-CE1 3.43Å; M244-F262 HydrophobicContact CE-CZ 3.72Å; M244-F262 HydrophobicContact SD-CE1 3.78Å; M244-F262 HydrophobicContact SD-CE2 4.41Å; M244-F262 HydrophobicContact SD-CZ 3.49Å; M244-F262 WeakPolarHBondContact SD-CZ 3.17Å; M244-Q272 HydrophobicContact CE-CG 4.48Å; M244-E273 HydrophobicContact CB-CG 4.34Å; M244-E273 HydrophobicContact CE-CG 3.98Å; M244-E273 WeakPolarHBondContact CE-OE1 3.22Å
245	A	97.6	Very high	94.5	Very high	2 Å²	2	26.9 Å²	26.9	2%	0.017	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-79	-3.1	179.3	0	0	0	0	0	113.3	F182 N188 W207 D243 V298	F182-A245 WeakPolarHBondContact CE2-O 3.34Å; N188-A245 WeakPolarHBondContact OD1-CB 3.22Å; W207-A245 PolarHBondContact NE1-O 3.06Å; D243-A245 PolarHBondContact O-N 3.03Å; D243-A245 WeakPolarHBondContact OD1-CB 3.41Å; D243-A245 PolarHBondContact OD1-N 2.9Å; A245-V298 HydrophobicContact CB-CG2 3.95Å
246	G	98.4	Very high	95.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.161	C	C	.	.	G	3₁₀ helix	trans	-90	-3.1	-173.4	0	0	0	0	0	115.6	V206 W207 I242 D243 M244	V206-G246 WeakPolarHBondContact CA-O 3.34Å; W207-G246 PolarHBondContact N-O 2.76Å; I242-G246 WeakPolarHBondContact CD1-O 3.27Å; D243-G246 PolarHBondContact O-N 3.12Å; M244-G246 PolarHBondContact O-N 2.74Å
247	F	98.8	Very high	95.9	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	159.5	-177	70.4	-90.1	0	0	0	113.6	F182 F183 V204 S205 V206 I242 M244 V249 E273 F276 L277	F182-F247 VanDerWaalsContact CD2-O 3.31Å; F182-F247 WeakPolarHBondContact CD2-O 3.3Å; F183-F247 HydrophobicContact CD2-CE2 4.03Å; F183-F247 HydrophobicContact CD2-CZ 4.1Å; F183-F247 HydrophobicContact CE2-CE2 4.14Å; F183-F247 HydrophobicContact CE2-CZ 4.4Å; V204-F247 HydrophobicContact CG1-CB 4.49Å; S205-F247 CarbonylContact O-C 3.54Å; S205-F247 WeakPolarHBondContact O-CA 3.42Å; S205-F247 WeakPolarHBondContact O-CB 3.34Å; V206-F247 HydrophobicContact CG1-CB 4Å; I242-F247 HydrophobicContact CD1-CB 4.42Å; I242-F247 HydrophobicContact CG2-CD1 4.05Å; M244-F247 HydrophobicContact SD-CE1 4.27Å; M244-F247 HydrophobicContact SD-CZ 4.04Å; F247-V249 HydrophobicContact CD2-CG2 3.96Å; F247-V249 HydrophobicContact CE2-CG2 4.03Å; F247-E273 HydrophobicContact CE1-CB 4.32Å; F247-E273 HydrophobicContact CE1-CG 4.21Å; F247-F276 HydrophobicContact CE2-CD1 4.21Å; F247-F276 HydrophobicContact CE2-CE1 4.07Å; F247-F276 HydrophobicContact CZ-CD1 4.22Å; F247-F276 HydrophobicContact CZ-CE1 4.48Å; F247-L277 HydrophobicContact CD1-CD1 4.15Å; F247-L277 HydrophobicContact CD2-CD2 3.83Å; F247-L277 HydrophobicContact CE1-CD1 4.24Å; F247-L277 HydrophobicContact CE2-CD2 3.83Å; F247-L277 HydrophobicContact CE2-CG 4.44Å; F247-L277 HydrophobicContact CG-CD1 4.34Å; F247-L277 HydrophobicContact CG-CD2 4.32Å; F247-L277 HydrophobicContact CZ-CD2 4.29Å; F247-L277 HydrophobicContact CZ-CG 4.41Å
248	A	98.9	Very high	96.4	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	157.3	167.3	0	0	0	0	0	110.7	V180 L181 F182 M198 V204 S205 W207	V180-A248 HydrophobicContact CG2-CB 3.7Å; L181-A248 WeakPolarHBondContact O-CA 3.31Å; L181-A248 VanDerWaalsContact O-CB 3.31Å; L181-A248 WeakPolarHBondContact O-CB 3.19Å; F182-A248 HydrophobicContact CB-CB 4.39Å; F182-A248 HydrophobicContact CD2-CB 4.3Å; M198-A248 HydrophobicContact CB-CB 4.03Å; V204-A248 CarbonylContact C-O 3.59Å; V204-A248 WeakPolarHBondContact CA-O 3.42Å; S205-A248 PolarHBondContact N-O 2.52Å; S205-A248 PolarHBondContact O-N 2.94Å; S205-A248 PolarHBondContact OG-O 3.22Å; W207-A248 HydrophobicContact CH2-CB 3.49Å; W207-A248 VanDerWaalsContact CH2-CB 3.49Å; W207-A248 HydrophobicContact CZ2-CB 4.4Å; W207-A248 HydrophobicContact CZ3-CB 4.16Å
249	V	98.8	Very high	96.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	134.6	-172.3	-174.2	0	0	0	0	109.3	V180 L181 V204 F247 V253 I254 F276 I280	V180-V249 CarbonylContact C-O 3.57Å; V180-V249 WeakPolarHBondContact CA-O 3.29Å; V180-V249 WeakPolarHBondContact CG2-O 3.3Å; L181-V249 PolarHBondContact N-O 3.4Å; L181-V249 PolarHBondContact O-N 3.42Å; V204-V249 HydrophobicContact CG2-CG1 4.14Å; V204-V249 HydrophobicContact CG2-CG2 4.21Å; F247-V249 HydrophobicContact CD2-CG2 3.96Å; F247-V249 HydrophobicContact CE2-CG2 4.03Å; V249-V253 HydrophobicContact CG1-CB 3.82Å; V249-V253 HydrophobicContact CG1-CG1 3.64Å; V249-I254 HydrophobicContact CB-CD1 3.98Å; V249-I254 HydrophobicContact CB-CG1 4.15Å; V249-I254 HydrophobicContact CG1-CD1 3.59Å; V249-I254 HydrophobicContact CG1-CG1 3.73Å; V249-I254 HydrophobicContact CG2-CD1 4.46Å; V249-F276 HydrophobicContact CG2-CE1 4.24Å; V249-I280 HydrophobicContact CB-CD1 4.49Å; V249-I280 HydrophobicContact CG1-CD1 3.8Å; V249-I280 HydrophobicContact CG2-CD1 3.83Å
250	S	97.9	Very high	96.9	Very high	5 Å²	5	31.9 Å²	31.9	4%	0.035	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	144.1	174.5	75.1	0	0	0	0	110.9	R202 K203 Q252 V253 I254	R202-S250 WeakPolarHBondContact O-CB 3.43Å; R202-S250 PolarHBondContact O-OG 2.79Å; K203-S250 PolarHBondContact O-N 3.33Å; S250-Q252 PolarHBondContact O-N 3.19Å; S250-V253 PolarHBondContact O-N 2.69Å; S250-V253 VanDerWaalsContact O-N 3.09Å; S250-V253 WeakPolarHBondContact OG-CG2 3.36Å; S250-V253 PolarHBondContact OG-N 3.27Å; S250-I254 PolarHBondContact O-N 2.92Å
251	L	96.6	Very high	96.9	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-56.7	-38.7	178.2	177.3	61.4	0	0	0	110.6	Y83 L167 G179 V253 I254 L255	Y83-L251 HydrophobicContact CE2-CD2 4.04Å; L167-L251 HydrophobicContact CD1-CD1 4.07Å; L167-L251 HydrophobicContact CD2-CD1 3.57Å; L167-L251 HydrophobicContact CG-CD1 3.63Å; G179-L251 WeakPolarHBondContact O-CB 3.4Å; G179-L251 PolarHBondContact O-N 3.36Å; L251-V253 PolarHBondContact O-N 3.27Å; L251-I254 PolarHBondContact O-N 3.06Å; L251-I254 VanDerWaalsContact O-N 3.16Å; L251-L255 HydrophobicContact CD1-CD1 4.14Å; L251-L255 HydrophobicContact CD1-CD2 4.33Å; L251-L255 HydrophobicContact CD1-CG 4.02Å; L251-L255 HydrophobicContact CD2-CD1 4.47Å; L251-L255 HydrophobicContact CG-CD1 3.91Å; L251-L255 HydrophobicContact CG-CG 4.21Å; L251-L255 VanDerWaalsContact O-CG 3.3Å; L251-L255 WeakPolarHBondContact O-CG 3.39Å; L251-L255 PolarHBondContact O-N 3.34Å
252	Q	94.9	Very high	96.8	Very high	133 Å²	133	34.2 Å²	34.2	62%	0.621	18%	0.184	S	C	*	.	H	α-helix	trans	-56.2	-47.9	176.4	-172.6	-178.8	16.3	0	0	111.9	S250 I254 L255 S256	S250-Q252 PolarHBondContact O-N 3.19Å; Q252-I254 VanDerWaalsContact C-N 3.32Å; Q252-I254 PolarHBondContact O-N 2.81Å; Q252-L255 PolarHBondContact O-N 2.93Å; Q252-S256 WeakPolarHBondContact O-CB 3.33Å; Q252-S256 PolarHBondContact O-N 3.44Å; Q252-S256 PolarHBondContact O-OG 3.14Å; Q252-S256 VanDerWaalsContact O-OG 3.1Å
253	V	96.8	Very high	96.5	Very high	19 Å²	19	38.4 Å²	38.4	12%	0.115	20%	0.202	C	C	.	.	H	α-helix	trans	-61.3	-40.8	177.9	167.8	0	0	0	0	111.3	K203 V249 S250 L251 L255 N257 I280	K203-V253 HydrophobicContact CB-CG2 4.35Å; K203-V253 HydrophobicContact CG-CG2 4.39Å; V249-V253 HydrophobicContact CG1-CB 3.82Å; V249-V253 HydrophobicContact CG1-CG1 3.64Å; S250-V253 PolarHBondContact O-N 2.69Å; S250-V253 VanDerWaalsContact O-N 3.09Å; S250-V253 WeakPolarHBondContact OG-CG2 3.36Å; S250-V253 PolarHBondContact OG-N 3.27Å; L251-V253 PolarHBondContact O-N 3.27Å; V253-L255 PolarHBondContact O-N 3.45Å; V253-N257 WeakPolarHBondContact O-CB 3.44Å; V253-N257 PolarHBondContact O-N 3.09Å; V253-N257 PolarHBondContact O-ND2 2.88Å; V253-I280 HydrophobicContact CG1-CB 3.75Å; V253-I280 HydrophobicContact CG1-CD1 4.24Å; V253-I280 HydrophobicContact CG1-CG1 4.34Å; V253-I280 HydrophobicContact CG1-CG2 4.48Å
254	I	96.6	Very high	95.9	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-63.6	-40	177.6	-62.9	-62.5	0	0	0	112.4	L164 L167 R168 L181 V249 S250 L251 Q252 N257 F276	L164-I254 HydrophobicContact CD2-CD1 3.97Å; L164-I254 HydrophobicContact CD2-CG2 3.88Å; L167-I254 HydrophobicContact CD2-CG2 4.36Å; R168-I254 HydrophobicContact CG-CG2 4.43Å; R168-I254 PolarHBondContact NE-O 3Å; L181-I254 HydrophobicContact CB-CG1 4.32Å; L181-I254 HydrophobicContact CD2-CD1 3.79Å; L181-I254 HydrophobicContact CD2-CG1 3.82Å; V249-I254 HydrophobicContact CB-CD1 3.98Å; V249-I254 HydrophobicContact CB-CG1 4.15Å; V249-I254 HydrophobicContact CG1-CD1 3.59Å; V249-I254 HydrophobicContact CG1-CG1 3.73Å; V249-I254 HydrophobicContact CG2-CD1 4.46Å; S250-I254 PolarHBondContact O-N 2.92Å; L251-I254 PolarHBondContact O-N 3.06Å; L251-I254 VanDerWaalsContact O-N 3.16Å; Q252-I254 VanDerWaalsContact C-N 3.32Å; Q252-I254 PolarHBondContact O-N 2.81Å; I254-N257 CarbonylContact O-C 3.57Å; I254-F276 HydrophobicContact CD1-CZ 3.84Å
255	L	95.2	Very high	94.9	Very high	52 Å²	52	47.7 Å²	47.7	27%	0.272	24%	0.235	S	C	.	.	H	α-helix	trans	-74.9	-37.8	180	-63.6	179.7	0	0	0	112.2	R168 H171 L251 Q252 V253 N257	R168-L255 HydrophobicContact CG-CD2 4.24Å; H171-L255 HydrophobicContact CB-CD1 3.8Å; H171-L255 HydrophobicContact CB-CD2 3.97Å; L251-L255 HydrophobicContact CD1-CD1 4.14Å; L251-L255 HydrophobicContact CD1-CD2 4.33Å; L251-L255 HydrophobicContact CD1-CG 4.02Å; L251-L255 HydrophobicContact CD2-CD1 4.47Å; L251-L255 HydrophobicContact CG-CD1 3.91Å; L251-L255 HydrophobicContact CG-CG 4.21Å; L251-L255 VanDerWaalsContact O-CG 3.3Å; L251-L255 WeakPolarHBondContact O-CG 3.39Å; L251-L255 PolarHBondContact O-N 3.34Å; Q252-L255 PolarHBondContact O-N 2.93Å; V253-L255 PolarHBondContact O-N 3.45Å; L255-N257 PolarHBondContact O-N 3.36Å
256	S	95	Very high	93.5	Very high	84 Å²	84	51.5 Å²	51.5	59%	0.587	27%	0.274	S	S	*	.	H	α-helix	trans	-68.6	-18.8	175.5	-65.3	0	0	0	0	113.3	Q252 P258	Q252-S256 WeakPolarHBondContact O-CB 3.33Å; Q252-S256 PolarHBondContact O-N 3.44Å; Q252-S256 PolarHBondContact O-OG 3.14Å; Q252-S256 VanDerWaalsContact O-OG 3.1Å; S256-P258 VanDerWaalsContact O-CD 3.26Å; S256-P258 WeakPolarHBondContact O-CD 3.45Å
257	N	96.8	Very high	92.4	Very high	53 Å²	53	52.6 Å²	52.6	28%	0.283	28%	0.282	S	S	.	.			trans	-118.4	65.9	179.5	-63.7	-80.4	0	0	0	111.3	R168 V253 I254 L255 K259 A260 I280	R168-N257 PolarHBondContact NH2-O 3.25Å; V253-N257 WeakPolarHBondContact O-CB 3.44Å; V253-N257 PolarHBondContact O-N 3.09Å; V253-N257 PolarHBondContact O-ND2 2.88Å; I254-N257 CarbonylContact O-C 3.57Å; L255-N257 PolarHBondContact O-N 3.36Å; N257-K259 PolarHBondContact O-N 3.44Å; N257-K259 VanDerWaalsContact O-N 3.11Å; N257-A260 HydrophobicContact CB-CB 3.96Å; N257-A260 WeakPolarHBondContact O-CB 3.35Å; N257-A260 PolarHBondContact O-N 3.34Å; N257-I280 HydrophobicContact CB-CG2 3.89Å
258	P	95.5	Very high	91.3	Very high	84 Å²	84	57.6 Å²	57.6	55%	0.545	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-20.5	-171.1	26.7	-35.8	0	0	0	114	R168 S256	R168-P258 VanDerWaalsContact CZ-O 3.23Å; R168-P258 PolarHBondContact NH1-O 2.92Å; S256-P258 VanDerWaalsContact O-CD 3.26Å; S256-P258 WeakPolarHBondContact O-CD 3.45Å
259	K	96.8	Very high	90.2	Very high	187 Å²	187	61.7 Å²	61.7	81%	0.813	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-13.2	177.3	-63.4	-178.5	-178.9	177.2	0	113.3	N257 V261	N257-K259 PolarHBondContact O-N 3.44Å; N257-K259 VanDerWaalsContact O-N 3.11Å; K259-V261 PolarHBondContact O-N 2.79Å
260	A	97.2	Very high	89.3	Confident	3 Å²	3	63.2 Å²	63.2	3%	0.025	35%	0.347	C	S	.	.			trans	-71.2	117.7	-177.3	0	0	0	0	0	110.9	R168 N257 F276 Q279 I280	R168-A260 VanDerWaalsContact CZ-O 3.28Å; R168-A260 PolarHBondContact NH1-O 2.87Å; R168-A260 PolarHBondContact NH2-O 3.47Å; N257-A260 HydrophobicContact CB-CB 3.96Å; N257-A260 WeakPolarHBondContact O-CB 3.35Å; N257-A260 PolarHBondContact O-N 3.34Å; A260-F276 HydrophobicContact CB-CE2 4.43Å; A260-Q279 HydrophobicContact CB-CB 3.93Å; A260-I280 HydrophobicContact CB-CG2 3.46Å; A260-I280 VanDerWaalsContact CB-CG2 3.46Å
261	V	97.1	Very high	88.9	Confident	54 Å²	54	64 Å²	64	33%	0.327	35%	0.351	S	S	.	.			trans	-142.6	161	178.9	-66.8	0	0	0	0	110	K259 K263 Q279	K259-V261 PolarHBondContact O-N 2.79Å; V261-K263 PolarHBondContact O-N 2.77Å; V261-Q279 PolarHBondContact O-NE2 3.42Å; V261-Q279 VanDerWaalsContact O-NE2 3.13Å
262	F	95.7	Very high	88.7	Confident	3 Å²	3	64.3 Å²	64.3	1%	0.013	35%	0.352	C	S	.	.			trans	-68.9	124.9	170.1	-67.3	-72.8	0	0	0	110	T157 R160 N161 L164 F183 M244 Q272 F276	T157-F262 HydrophobicContact CG2-CB 3.86Å; R160-F262 HydrophobicContact CB-CD2 3.72Å; R160-F262 HydrophobicContact CB-CE2 3.74Å; R160-F262 HydrophobicContact CG-CE2 4.41Å; N161-F262 PolarHBondContact ND2-O 3.06Å; N161-F262 PolarHBondContact OD1-N 2.95Å; L164-F262 HydrophobicContact CD1-CD2 4.17Å; L164-F262 HydrophobicContact CD1-CE2 4.19Å; F183-F262 HydrophobicContact CD1-CE2 4.2Å; F183-F262 HydrophobicContact CD2-CE2 4.36Å; F183-F262 AromaticContact CD2-CZ 3.96Å; F183-F262 HydrophobicContact CD2-CZ 3.96Å; F183-F262 AromaticContact CE1-CE2 3.62Å; F183-F262 HydrophobicContact CE1-CE2 3.62Å; F183-F262 HydrophobicContact CE1-CZ 4.19Å; F183-F262 AromaticContact CE2-CE2 3.81Å; F183-F262 HydrophobicContact CE2-CE2 3.81Å; F183-F262 AromaticContact CE2-CZ 3.59Å; F183-F262 HydrophobicContact CE2-CZ 3.59Å; F183-F262 HydrophobicContact CG-CZ 4.41Å; F183-F262 AromaticContact CZ-CE2 3.4Å; F183-F262 HydrophobicContact CZ-CE2 3.4Å; F183-F262 VanDerWaalsContact CZ-CE2 3.4Å; F183-F262 AromaticContact CZ-CZ 3.72Å; F183-F262 HydrophobicContact CZ-CZ 3.72Å; M244-F262 HydrophobicContact CE-CD1 4.1Å; M244-F262 HydrophobicContact CE-CE1 3.43Å; M244-F262 VanDerWaalsContact CE-CE1 3.43Å; M244-F262 HydrophobicContact CE-CZ 3.72Å; M244-F262 HydrophobicContact SD-CE1 3.78Å; M244-F262 HydrophobicContact SD-CE2 4.41Å; M244-F262 HydrophobicContact SD-CZ 3.49Å; M244-F262 WeakPolarHBondContact SD-CZ 3.17Å; F262-Q272 HydrophobicContact CB-CG 4.09Å; F262-Q272 HydrophobicContact CD1-CG 3.63Å; F262-Q272 WeakPolarHBondContact CD1-O 3.38Å; F262-Q272 HydrophobicContact CE1-CG 4.46Å; F262-Q272 HydrophobicContact CG-CG 4.2Å; F262-F276 HydrophobicContact CD1-CB 3.55Å; F262-F276 HydrophobicContact CD1-CD2 4.32Å; F262-F276 AromaticContact CD1-CG 3.92Å; F262-F276 HydrophobicContact CD1-CG 3.92Å; F262-F276 HydrophobicContact CE1-CB 3.5Å; F262-F276 AromaticContact CE1-CD1 3.81Å; F262-F276 HydrophobicContact CE1-CD1 3.81Å; F262-F276 HydrophobicContact CE1-CD2 4.24Å; F262-F276 AromaticContact CE1-CG 3.59Å; F262-F276 HydrophobicContact CE1-CG 3.59Å; F262-F276 HydrophobicContact CG-CB 4.43Å; F262-F276 HydrophobicContact CZ-CB 4.34Å; F262-F276 AromaticContact CZ-CD1 3.89Å; F262-F276 HydrophobicContact CZ-CD1 3.89Å; F262-F276 HydrophobicContact CZ-CD2 4.34Å; F262-F276 HydrophobicContact CZ-CE1 4.26Å; F262-F276 AromaticContact CZ-CG 3.93Å; F262-F276 HydrophobicContact CZ-CG 3.93Å
263	K	89.3	Confident	88.7	Confident	96 Å²	96	59 Å²	59	42%	0.417	33%	0.327	S	S	.	.			trans	-82.2	127.9	179.4	-65.9	-177	-178	175.9	0	110.1	V261 D275	V261-K263 PolarHBondContact O-N 2.77Å; K263-D275 HydrophobicContact CD-CB 4.4Å
264	R	82.9	Confident	88.6	Confident	40 Å²	40	58.1 Å²	58.1	15%	0.151	32%	0.322	C	S	.	.	S	Bend	trans	-89.8	-45.9	169.8	-177.6	167.9	-72.7	-75.6	11.2	112.5	Y148 P154 T157 E158	Y148-R264 HydrophobicContact CE1-CG 4.44Å; P154-R264 PolarHBondContact O-NH1 3.11Å; P154-R264 PolarHBondContact O-NH2 3.01Å; T157-R264 VanDerWaalsContact CB-NH2 3.33Å; T157-R264 HydrophobicContact CG2-CB 4.07Å; T157-R264 PolarHBondContact OG1-NH2 3.35Å; E158-R264 WeakPolarHBondContact OE1-CD 3.32Å; E158-R264 IonicContact OE1-CZ 3.42Å; E158-R264 IonicContact OE1-NE 3.52Å; E158-R264 PolarHBondContact OE1-NE 2.87Å; E158-R264 IonicContact OE1-NH2 2.75Å; E158-R264 PolarHBondContact OE1-NH2 2.76Å; E158-R264 IonicContact OE2-CZ 3.44Å; E158-R264 IonicContact OE2-NE 3.94Å; E158-R264 PolarHBondContact OE2-NE 2.87Å; E158-R264 IonicContact OE2-NH2 2.76Å; E158-R264 PolarHBondContact OE2-NH2 2.95Å
265	R	77.1	Confident	88.5	Confident	186 Å²	186	59.4 Å²	59.4	70%	0.702	33%	0.329	S	S	*	.	S	Bend	trans	-90.1	137	-179.9	-67	-174.8	178.9	-171.3	-1.7	109.6	Y148 S267	Y148-R265 PolarHBondContact OH-NE 2.92Å; R265-S267 PolarHBondContact O-N 2.67Å
266	G	67.9	Low	88.6	Confident	82 Å²	82	57 Å²	57	85%	0.845	32%	0.316	S	S	*	.	S	Bend	trans	81.8	-13.5	177.6	0	0	0	0	0	115.2	Q268	G266-Q268 PolarHBondContact O-N 3.5Å
267	S	73.8	Confident	88.7	Confident	22 Å²	22	53 Å²	53	15%	0.154	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-72.1	123.8	169.1	178.1	0	0	0	0	108.6	R265 M271 Q272 D275	R265-S267 PolarHBondContact O-N 2.67Å; S267-M271 WeakPolarHBondContact OG-CB 3.44Å; S267-Q272 PolarHBondContact OG-N 3.3Å; S267-D275 WeakPolarHBondContact CB-OD2 3.37Å
268	Q	76.5	Confident	88.7	Confident	106 Å²	106	56.4 Å²	56.4	50%	0.495	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-63.1	158	166.2	-60.1	172.1	-5.8	0	0	108.8	G266 G270 M271	G266-Q268 PolarHBondContact O-N 3.5Å; Q268-G270 PolarHBondContact O-N 3.31Å; Q268-M271 HydrophobicContact CB-CB 4.41Å; Q268-M271 HydrophobicContact CB-CG 3.73Å; Q268-M271 WeakPolarHBondContact O-CB 3.4Å; Q268-M271 PolarHBondContact O-N 3.43Å; Q268-M271 VanDerWaalsContact O-N 3.09Å
269	P	76.8	Confident	88.8	Confident	86 Å²	86	55.2 Å²	55.2	56%	0.558	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.4	139.2	168	-27.3	35.8	0	0	0	109.6	W234 M271	W234-P269 WeakPolarHBondContact CH2-O 3.42Å; P269-M271 PolarHBondContact O-N 2.64Å; P269-M271 VanDerWaalsContact O-N 3.14Å
270	G	79.8	Confident	88.9	Confident	32 Å²	32	47.1 Å²	47.1	33%	0.33	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	17.9	-178.4	0	0	0	0	0	117.4	W234 R238 Q268	W234-G270 VanDerWaalsContact CH2-CA 3.45Å; R238-G270 VanDerWaalsContact CD-O 3.28Å; R238-G270 WeakPolarHBondContact CD-O 3.44Å; R238-G270 PolarHBondContact NH1-O 3.43Å; Q268-G270 PolarHBondContact O-N 3.31Å
271	M	89.3	Confident	88.9	Confident	21 Å²	21	47.5 Å²	47.5	10%	0.103	26%	0.255	C	S	.	.			trans	-96.1	-1.9	170.5	-70	-63.4	-66.9	0	0	113.4	R238 S267 Q268 P269 E273 S274 D275	R238-M271 HydrophobicContact CB-SD 4.24Å; R238-M271 VanDerWaalsContact CD-SD 3.5Å; R238-M271 HydrophobicContact CG-SD 3.45Å; R238-M271 WeakPolarHBondContact CG-SD 3.42Å; S267-M271 WeakPolarHBondContact OG-CB 3.44Å; Q268-M271 HydrophobicContact CB-CB 4.41Å; Q268-M271 HydrophobicContact CB-CG 3.73Å; Q268-M271 WeakPolarHBondContact O-CB 3.4Å; Q268-M271 PolarHBondContact O-N 3.43Å; Q268-M271 VanDerWaalsContact O-N 3.09Å; P269-M271 PolarHBondContact O-N 2.64Å; P269-M271 VanDerWaalsContact O-N 3.14Å; M271-E273 VanDerWaalsContact C-N 3.34Å; M271-E273 PolarHBondContact O-N 3.36Å; M271-S274 PolarHBondContact O-N 3.33Å; M271-D275 WeakPolarHBondContact O-CB 3.48Å; M271-D275 PolarHBondContact O-N 3.42Å
272	Q	91.7	Very high	89	Confident	8 Å²	8	48 Å²	48	4%	0.037	26%	0.259	C	S	.	.	H	α-helix	trans	-60.9	-42.8	-170.4	-173.3	177.5	5.2	0	0	112.1	P154 T157 M244 F262 S267 F276	P154-Q272 VanDerWaalsContact CB-OE1 3.26Å; T157-Q272 PolarHBondContact OG1-NE2 3.46Å; M244-Q272 HydrophobicContact CE-CG 4.48Å; F262-Q272 HydrophobicContact CB-CG 4.09Å; F262-Q272 HydrophobicContact CD1-CG 3.63Å; F262-Q272 WeakPolarHBondContact CD1-O 3.38Å; F262-Q272 HydrophobicContact CE1-CG 4.46Å; F262-Q272 HydrophobicContact CG-CG 4.2Å; S267-Q272 PolarHBondContact OG-N 3.3Å; Q272-F276 PolarHBondContact O-N 3.47Å
273	E	94.6	Very high	89.1	Confident	21 Å²	21	49.4 Å²	49.4	10%	0.098	27%	0.267	C	S	.	.	H	α-helix	trans	-65.4	-50.8	176.3	-62	70.4	-155.7	0	0	110.5	M244 F247 M271 D275 F276 L277	M244-E273 HydrophobicContact CB-CG 4.34Å; M244-E273 HydrophobicContact CE-CG 3.98Å; M244-E273 WeakPolarHBondContact CE-OE1 3.22Å; F247-E273 HydrophobicContact CE1-CB 4.32Å; F247-E273 HydrophobicContact CE1-CG 4.21Å; M271-E273 VanDerWaalsContact C-N 3.34Å; M271-E273 PolarHBondContact O-N 3.36Å; E273-D275 PolarHBondContact O-N 3.44Å; E273-F276 PolarHBondContact O-N 2.98Å; E273-L277 WeakPolarHBondContact O-CB 3.41Å; E273-L277 WeakPolarHBondContact O-CG 3.25Å; E273-L277 PolarHBondContact O-N 3.43Å
274	S	94.6	Very high	89.4	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-58.4	-48.3	178.4	-84.9	0	0	0	0	112.6	F240 M271 F276 L277 K278	F240-S274 VanDerWaalsContact C-OG 3.32Å; F240-S274 PolarHBondContact N-OG 3.25Å; F240-S274 VanDerWaalsContact N-OG 3.07Å; F240-S274 PolarHBondContact O-OG 3.49Å; M271-S274 PolarHBondContact O-N 3.33Å; S274-F276 PolarHBondContact O-N 3.35Å; S274-L277 PolarHBondContact O-N 3.36Å; S274-K278 WeakPolarHBondContact O-CB 3.49Å; S274-K278 WeakPolarHBondContact O-CG 3.16Å; S274-K278 PolarHBondContact O-N 3.43Å
275	D	94.9	Very high	90.2	Very high	28 Å²	28	51.7 Å²	51.7	15%	0.15	28%	0.281	C	S	.	.	H	α-helix	trans	-61.8	-35.2	-179.3	-79.9	-5.8	0	0	0	111.4	K263 S267 M271 E273 Q279	K263-D275 HydrophobicContact CD-CB 4.4Å; S267-D275 WeakPolarHBondContact CB-OD2 3.37Å; M271-D275 WeakPolarHBondContact O-CB 3.48Å; M271-D275 PolarHBondContact O-N 3.42Å; E273-D275 PolarHBondContact O-N 3.44Å; D275-Q279 WeakPolarHBondContact O-CG 3.23Å; D275-Q279 PolarHBondContact O-NE2 3.09Å
276	F	97.1	Very high	91.2	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-71.7	-51.9	174.4	175.5	-106	0	0	0	112.1	L164 F183 F247 V249 I254 A260 F262 Q272 E273 S274 K278 Q279 I280	L164-F276 HydrophobicContact CD1-CE2 3.93Å; L164-F276 HydrophobicContact CD1-CZ 4.46Å; F183-F276 HydrophobicContact CE2-CE1 4.09Å; F183-F276 HydrophobicContact CE2-CZ 4.35Å; F183-F276 HydrophobicContact CZ-CZ 4.45Å; F247-F276 HydrophobicContact CE2-CD1 4.21Å; F247-F276 HydrophobicContact CE2-CE1 4.07Å; F247-F276 HydrophobicContact CZ-CD1 4.22Å; F247-F276 HydrophobicContact CZ-CE1 4.48Å; V249-F276 HydrophobicContact CG2-CE1 4.24Å; I254-F276 HydrophobicContact CD1-CZ 3.84Å; A260-F276 HydrophobicContact CB-CE2 4.43Å; F262-F276 HydrophobicContact CD1-CB 3.55Å; F262-F276 HydrophobicContact CD1-CD2 4.32Å; F262-F276 AromaticContact CD1-CG 3.92Å; F262-F276 HydrophobicContact CD1-CG 3.92Å; F262-F276 HydrophobicContact CE1-CB 3.5Å; F262-F276 AromaticContact CE1-CD1 3.81Å; F262-F276 HydrophobicContact CE1-CD1 3.81Å; F262-F276 HydrophobicContact CE1-CD2 4.24Å; F262-F276 AromaticContact CE1-CG 3.59Å; F262-F276 HydrophobicContact CE1-CG 3.59Å; F262-F276 HydrophobicContact CG-CB 4.43Å; F262-F276 HydrophobicContact CZ-CB 4.34Å; F262-F276 AromaticContact CZ-CD1 3.89Å; F262-F276 HydrophobicContact CZ-CD1 3.89Å; F262-F276 HydrophobicContact CZ-CD2 4.34Å; F262-F276 HydrophobicContact CZ-CE1 4.26Å; F262-F276 AromaticContact CZ-CG 3.93Å; F262-F276 HydrophobicContact CZ-CG 3.93Å; Q272-F276 PolarHBondContact O-N 3.47Å; E273-F276 PolarHBondContact O-N 2.98Å; S274-F276 PolarHBondContact O-N 3.35Å; F276-K278 VanDerWaalsContact C-N 3.34Å; F276-K278 PolarHBondContact O-N 2.86Å; F276-Q279 WeakPolarHBondContact O-CB 3.2Å; F276-Q279 PolarHBondContact O-N 3.04Å; F276-I280 HydrophobicContact CD1-CD1 4.24Å; F276-I280 HydrophobicContact CE1-CD1 3.62Å; F276-I280 HydrophobicContact CZ-CD1 3.89Å
277	L	97.9	Very high	92.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.4	-37.5	-175.4	-71.7	174.8	0	0	0	112.8	V204 F240 I242 F247 E273 S274 Q279 I280 T281	V204-L277 HydrophobicContact CG1-CD2 3.98Å; F240-L277 HydrophobicContact CB-CB 4.27Å; F240-L277 HydrophobicContact CB-CD1 3.66Å; F240-L277 HydrophobicContact CD1-CB 4.01Å; F240-L277 HydrophobicContact CD1-CD1 3.88Å; F240-L277 HydrophobicContact CD2-CB 3.58Å; F240-L277 HydrophobicContact CE1-CB 4.23Å; F240-L277 HydrophobicContact CE2-CB 3.83Å; F240-L277 HydrophobicContact CG-CB 3.69Å; F240-L277 HydrophobicContact CG-CD1 3.77Å; F240-L277 HydrophobicContact CG-CG 4.39Å; F240-L277 HydrophobicContact CZ-CB 4.15Å; I242-L277 HydrophobicContact CG2-CD1 4Å; F247-L277 HydrophobicContact CD1-CD1 4.15Å; F247-L277 HydrophobicContact CD2-CD2 3.83Å; F247-L277 HydrophobicContact CE1-CD1 4.24Å; F247-L277 HydrophobicContact CE2-CD2 3.83Å; F247-L277 HydrophobicContact CE2-CG 4.44Å; F247-L277 HydrophobicContact CG-CD1 4.34Å; F247-L277 HydrophobicContact CG-CD2 4.32Å; F247-L277 HydrophobicContact CZ-CD2 4.29Å; F247-L277 HydrophobicContact CZ-CG 4.41Å; E273-L277 WeakPolarHBondContact O-CB 3.41Å; E273-L277 WeakPolarHBondContact O-CG 3.25Å; E273-L277 PolarHBondContact O-N 3.43Å; S274-L277 PolarHBondContact O-N 3.36Å; L277-Q279 PolarHBondContact O-N 3.25Å; L277-Q279 VanDerWaalsContact O-N 3.07Å; L277-I280 HydrophobicContact CD2-CD1 4.12Å; L277-I280 HydrophobicContact CD2-CG1 4.46Å; L277-I280 WeakPolarHBondContact O-CG1 3.1Å; L277-I280 PolarHBondContact O-N 2.76Å; L277-T281 PolarHBondContact O-N 2.98Å
278	K	97	Very high	93.9	Very high	125 Å²	125	40.3 Å²	40.3	54%	0.543	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-21	174.4	-73.6	178.8	92.5	175.7	0	114.1	P239 F240 S274 F276	P239-K278 HydrophobicContact CB-CD 3.91Å; P239-K278 HydrophobicContact CB-CG 4.02Å; P239-K278 HydrophobicContact CG-CD 3.78Å; P239-K278 HydrophobicContact CG-CG 4.44Å; F240-K278 HydrophobicContact CD2-CG 3.94Å; F240-K278 HydrophobicContact CE2-CB 4.35Å; F240-K278 HydrophobicContact CE2-CG 3.65Å; S274-K278 WeakPolarHBondContact O-CB 3.49Å; S274-K278 WeakPolarHBondContact O-CG 3.16Å; S274-K278 PolarHBondContact O-N 3.43Å; F276-K278 VanDerWaalsContact C-N 3.34Å; F276-K278 PolarHBondContact O-N 2.86Å
279	Q	97.5	Very high	94.9	Very high	60 Å²	60	36.4 Å²	36.4	28%	0.28	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-12.8	179.3	-63.4	170.7	75.1	0	0	112.6	A260 V261 D275 F276 L277	A260-Q279 HydrophobicContact CB-CB 3.93Å; V261-Q279 PolarHBondContact O-NE2 3.42Å; V261-Q279 VanDerWaalsContact O-NE2 3.13Å; D275-Q279 WeakPolarHBondContact O-CG 3.23Å; D275-Q279 PolarHBondContact O-NE2 3.09Å; F276-Q279 WeakPolarHBondContact O-CB 3.2Å; F276-Q279 PolarHBondContact O-N 3.04Å; L277-Q279 PolarHBondContact O-N 3.25Å; L277-Q279 VanDerWaalsContact O-N 3.07Å
280	I	97.9	Very high	95.9	Very high	16 Å²	16	32.4 Å²	32.4	8%	0.082	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.7	-14.9	-167	67	174.1	0	0	0	114.7	V204 V249 V253 N257 A260 F276 L277	V204-I280 HydrophobicContact CG2-CD1 4.24Å; V204-I280 HydrophobicContact CG2-CG1 4.47Å; V249-I280 HydrophobicContact CB-CD1 4.49Å; V249-I280 HydrophobicContact CG1-CD1 3.8Å; V249-I280 HydrophobicContact CG2-CD1 3.83Å; V253-I280 HydrophobicContact CG1-CB 3.75Å; V253-I280 HydrophobicContact CG1-CD1 4.24Å; V253-I280 HydrophobicContact CG1-CG1 4.34Å; V253-I280 HydrophobicContact CG1-CG2 4.48Å; N257-I280 HydrophobicContact CB-CG2 3.89Å; A260-I280 HydrophobicContact CB-CG2 3.46Å; A260-I280 VanDerWaalsContact CB-CG2 3.46Å; F276-I280 HydrophobicContact CD1-CD1 4.24Å; F276-I280 HydrophobicContact CE1-CD1 3.62Å; F276-I280 HydrophobicContact CZ-CD1 3.89Å; L277-I280 HydrophobicContact CD2-CD1 4.12Å; L277-I280 HydrophobicContact CD2-CG1 4.46Å; L277-I280 WeakPolarHBondContact O-CG1 3.1Å; L277-I280 PolarHBondContact O-N 2.76Å
281	T	98.4	Very high	96.8	Very high	11 Å²	11	35.8 Å²	35.8	7%	0.067	18%	0.179	C	C	.	.			trans	-160	171.7	-179.3	-158.8	0	0	0	0	112.1	V204 F240 L277 E285 L286	V204-T281 HydrophobicContact CB-CG2 4.06Å; V204-T281 HydrophobicContact CG1-CG2 4.42Å; V204-T281 HydrophobicContact CG2-CG2 3.71Å; F240-T281 HydrophobicContact CE1-CG2 4.01Å; F240-T281 HydrophobicContact CZ-CG2 4Å; L277-T281 PolarHBondContact O-N 2.98Å; T281-E285 WeakPolarHBondContact CA-OE2 3.38Å; T281-E285 VanDerWaalsContact OG1-CB 3.31Å; T281-E285 WeakPolarHBondContact OG1-CB 3.28Å; T281-E285 PolarHBondContact OG1-OE2 3.26Å; T281-L286 HydrophobicContact CG2-CD2 3.9Å
282	T	98.1	Very high	97.3	Very high	66 Å²	66	39.1 Å²	39.1	41%	0.405	20%	0.198	S	C	.	.			trans	-114	169.1	167.4	74.7	0	0	0	0	111.4	E284 E285	T282-E284 VanDerWaalsContact C-N 3.27Å; T282-E284 WeakPolarHBondContact CB-OE2 3.45Å; T282-E284 PolarHBondContact O-N 3.44Å; T282-E284 PolarHBondContact OG1-OE2 2.89Å; T282-E285 PolarHBondContact N-OE2 3.34Å; T282-E285 VanDerWaalsContact N-OE2 3.11Å; T282-E285 PolarHBondContact O-N 3.47Å; T282-E285 WeakPolarHBondContact OG1-CG 3.21Å
283	V	97.6	Very high	97.6	Very high	32 Å²	32	38.7 Å²	38.7	19%	0.194	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-63.9	-34.6	-177.9	176.2	0	0	0	0	111.5	V227 F240 E285 L286	V227-V283 HydrophobicContact CB-CG1 4.06Å; V227-V283 HydrophobicContact CG1-CG1 3.91Å; V227-V283 WeakPolarHBondContact O-CG1 3.42Å; F240-V283 HydrophobicContact CD1-CG2 4.44Å; F240-V283 HydrophobicContact CE1-CG2 4Å; F240-V283 HydrophobicContact CZ-CG2 4.25Å; V283-E285 PolarHBondContact O-N 3.03Å; V283-L286 HydrophobicContact CG1-CD1 4.4Å; V283-L286 WeakPolarHBondContact O-CB 3.43Å; V283-L286 WeakPolarHBondContact O-CG 3.42Å; V283-L286 PolarHBondContact O-N 3.04Å
284	E	96.9	Very high	97.8	Very high	120 Å²	120	42.9 Å²	42.9	56%	0.561	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-71.8	-21.5	-177.1	-52	72	-151	0	0	112.8	K226 T282	K226-E284 PolarHBondContact NZ-O 2.89Å; T282-E284 VanDerWaalsContact C-N 3.27Å; T282-E284 WeakPolarHBondContact CB-OE2 3.45Å; T282-E284 PolarHBondContact O-N 3.44Å; T282-E284 PolarHBondContact OG1-OE2 2.89Å
285	E	98.1	Very high	98	Very high	64 Å²	64	46.6 Å²	46.6	30%	0.299	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-87.5	-11.1	177.7	-67.9	-177	137.8	0	0	113.2	K203 T281 T282 V283	K203-E285 HydrophobicContact CD-CB 4.1Å; K203-E285 HydrophobicContact CD-CG 4.26Å; K203-E285 IonicContact NZ-OE1 2.6Å; K203-E285 PolarHBondContact NZ-OE1 3.06Å; T281-E285 WeakPolarHBondContact CA-OE2 3.38Å; T281-E285 VanDerWaalsContact OG1-CB 3.31Å; T281-E285 WeakPolarHBondContact OG1-CB 3.28Å; T281-E285 PolarHBondContact OG1-OE2 3.26Å; T282-E285 PolarHBondContact N-OE2 3.34Å; T282-E285 VanDerWaalsContact N-OE2 3.11Å; T282-E285 PolarHBondContact O-N 3.47Å; T282-E285 WeakPolarHBondContact OG1-CG 3.21Å; V283-E285 PolarHBondContact O-N 3.03Å
286	L	98.8	Very high	98.2	Very high	3 Å²	3	47.2 Å²	47.2	2%	0.016	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	139	179.2	-63.1	179.2	0	0	0	111.2	V204 V206 V227 W230 F240 T281 V283 P288	V204-L286 HydrophobicContact CB-CD2 3.84Å; V204-L286 HydrophobicContact CG1-CD2 3.64Å; V204-L286 WeakPolarHBondContact O-CA 3.46Å; V206-L286 HydrophobicContact CG1-CD1 4.15Å; V206-L286 HydrophobicContact CG1-CD2 4.01Å; V206-L286 HydrophobicContact CG1-CG 4.49Å; V206-L286 HydrophobicContact CG2-CB 4.21Å; V206-L286 HydrophobicContact CG2-CD1 4.42Å; V227-L286 HydrophobicContact CB-CB 4.36Å; V227-L286 HydrophobicContact CB-CD1 4.21Å; V227-L286 HydrophobicContact CG1-CD1 4.2Å; V227-L286 HydrophobicContact CG2-CB 3.81Å; V227-L286 HydrophobicContact CG2-CD1 4.13Å; W230-L286 HydrophobicContact CH2-CD1 3.64Å; W230-L286 HydrophobicContact CZ2-CD1 3.93Å; F240-L286 HydrophobicContact CD1-CD1 4.02Å; F240-L286 HydrophobicContact CE1-CD1 3.93Å; F240-L286 HydrophobicContact CE1-CD2 4.06Å; F240-L286 HydrophobicContact CE1-CG 4.22Å; T281-L286 HydrophobicContact CG2-CD2 3.9Å; V283-L286 HydrophobicContact CG1-CD1 4.4Å; V283-L286 WeakPolarHBondContact O-CB 3.43Å; V283-L286 WeakPolarHBondContact O-CG 3.42Å; V283-L286 PolarHBondContact O-N 3.04Å; L286-P288 WeakPolarHBondContact O-CD 3.4Å
287	E	98.8	Very high	98.2	Very high	24 Å²	24	47.4 Å²	47.4	11%	0.112	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	101.9	178.2	-62.9	170.5	-143.5	0	0	109.3	R202 K203 V204 S205 V206 K289	R202-E287 WeakPolarHBondContact CA-OE1 3.39Å; R202-E287 VanDerWaalsContact CB-OE1 3.29Å; R202-E287 WeakPolarHBondContact CB-OE1 3.42Å; R202-E287 PolarHBondContact N-OE1 2.75Å; R202-E287 PolarHBondContact N-OE2 3.13Å; K203-E287 PolarHBondContact N-OE1 3.48Å; V204-E287 PolarHBondContact O-N 3.09Å; S205-E287 CarbonylContact C-O 3.59Å; S205-E287 VanDerWaalsContact CA-O 3.24Å; S205-E287 WeakPolarHBondContact CA-O 3.45Å; V206-E287 PolarHBondContact N-O 3.47Å; E287-K289 PolarHBondContact O-N 3.07Å; E287-K289 IonicContact OE2-NZ 3.78Å
288	P	98.7	Very high	98.3	Very high	23 Å²	23	47.4 Å²	47.4	15%	0.149	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	130.3	177.2	28.2	-33.7	0	0	0	110.5	V222 G225 L286	V222-P288 HydrophobicContact CG1-CB 4.09Å; V222-P288 HydrophobicContact CG1-CG 3.94Å; V222-P288 HydrophobicContact CG2-CB 3.67Å; V222-P288 HydrophobicContact CG2-CG 4.37Å; G225-P288 WeakPolarHBondContact O-CG 3.49Å; L286-P288 WeakPolarHBondContact O-CD 3.4Å
289	K	98.8	Very high	98.4	Very high	25 Å²	25	45.6 Å²	45.6	11%	0.109	24%	0.235	C	C	.	.			trans	-113.5	-173.6	177.2	-60.5	-63.3	-178.4	174.6	0	110.5	E197 T200 V206 W207 E287 N291 C293	E197-K289 HydrophobicContact CB-CB 4.2Å; E197-K289 WeakPolarHBondContact O-CD 3.49Å; E197-K289 VanDerWaalsContact O-CE 3.27Å; E197-K289 WeakPolarHBondContact O-CE 3.19Å; E197-K289 PolarHBondContact O-NZ 3.34Å; E197-K289 WeakPolarHBondContact OE2-CB 3.24Å; T200-K289 PolarHBondContact OG1-NZ 2.93Å; V206-K289 PolarHBondContact O-N 3.02Å; W207-K289 HydrophobicContact CB-CB 4.43Å; W207-K289 HydrophobicContact CE3-CB 3.98Å; W207-K289 HydrophobicContact CE3-CG 4Å; W207-K289 HydrophobicContact CZ3-CG 4.37Å; E287-K289 PolarHBondContact O-N 3.07Å; E287-K289 IonicContact OE2-NZ 3.78Å; K289-N291 PolarHBondContact O-N 3.13Å; K289-C293 WeakPolarHBondContact O-CA 3.48Å; K289-C293 PolarHBondContact O-N 3.49Å
290	A	98.5	Very high	98.4	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.008	23%	0.23	C	C	.	.	H	α-helix	trans	55.4	55.4	173.9	0	0	0	0	0	112.1	E197 W207 C293 T294 K295 L297	E197-A290 PolarHBondContact OE2-N 2.55Å; W207-A290 HydrophobicContact CB-CB 4.07Å; A290-C293 PolarHBondContact O-N 3.4Å; A290-T294 PolarHBondContact O-N 3.49Å; A290-K295 HydrophobicContact CB-CB 4.3Å; A290-K295 WeakPolarHBondContact CB-O 3.27Å; A290-K295 PolarHBondContact O-N 3.5Å; A290-K295 VanDerWaalsContact O-N 3.11Å; A290-L297 HydrophobicContact CB-CD1 3.77Å; A290-L297 HydrophobicContact CB-CG 4.2Å
291	N	98.3	Very high	98.4	Very high	103 Å²	103	45.5 Å²	45.5	55%	0.551	24%	0.236	S	C	*	.	H	α-helix	trans	54.1	61.4	-177.3	-63.8	-27.2	0	0	0	112.7	K289 C293 T294	K289-N291 PolarHBondContact O-N 3.13Å; N291-C293 VanDerWaalsContact C-N 3.27Å; N291-C293 PolarHBondContact O-N 3.31Å; N291-T294 WeakPolarHBondContact CB-OG1 3.14Å; N291-T294 WeakPolarHBondContact O-CB 3.34Å; N291-T294 WeakPolarHBondContact O-CG2 3.37Å; N291-T294 PolarHBondContact O-N 3.05Å; N291-T294 PolarHBondContact O-OG1 3.15Å
292	N	98.3	Very high	98.3	Very high	91 Å²	91	54.4 Å²	54.4	49%	0.487	27%	0.268	S	S	.	.	H	α-helix	trans	52.9	44.6	-175.9	-69.9	-37.3	0	0	0	112.9	V222 T294	V222-N292 HydrophobicContact CG1-CB 4.2Å; N292-T294 VanDerWaalsContact C-N 3.31Å; N292-T294 PolarHBondContact O-N 3.31Å
293	C	98.6	Very high	98.2	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	59.8	36.4	179.2	-57.6	0	0	0	0	114.2	P208 R219 P220 V222 K289 A290 N291	P208-C293 VanDerWaalsContact CG-C 3.44Å; P208-C293 HydrophobicContact CG-CB 3.98Å; P208-C293 VanDerWaalsContact CG-O 3.23Å; P208-C293 WeakPolarHBondContact CG-O 3.22Å; R219-C293 VanDerWaalsContact CD-O 3.3Å; R219-C293 WeakPolarHBondContact CD-O 3.36Å; P220-C293 HydrophobicContact CB-CB 4.28Å; P220-C293 HydrophobicContact CG-CB 4.28Å; P220-C293 VanDerWaalsContact CG-SG 3.58Å; V222-C293 HydrophobicContact CG2-CB 3.91Å; K289-C293 WeakPolarHBondContact O-CA 3.48Å; K289-C293 PolarHBondContact O-N 3.49Å; A290-C293 PolarHBondContact O-N 3.4Å; N291-C293 VanDerWaalsContact C-N 3.27Å; N291-C293 PolarHBondContact O-N 3.31Å
294	T	98.6	Very high	98.2	Very high	109 Å²	109	61 Å²	61	67%	0.669	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	-8.4	177.3	62.9	0	0	0	0	113.7	A290 N291 N292	A290-T294 PolarHBondContact O-N 3.49Å; N291-T294 WeakPolarHBondContact CB-OG1 3.14Å; N291-T294 WeakPolarHBondContact O-CB 3.34Å; N291-T294 WeakPolarHBondContact O-CG2 3.37Å; N291-T294 PolarHBondContact O-N 3.05Å; N291-T294 PolarHBondContact O-OG1 3.15Å; N292-T294 VanDerWaalsContact C-N 3.31Å; N292-T294 PolarHBondContact O-N 3.31Å
295	K	98.8	Very high	98.1	Very high	78 Å²	78	65 Å²	65	34%	0.339	31%	0.312	S	S	.	.	S	Bend	trans	-117.3	135.8	-179.8	-167.6	174.2	177.8	-173.3	0	111.7	E193 P208 A290 L297	E193-K295 IonicContact OE1-NZ 2.65Å; E193-K295 PolarHBondContact OE1-NZ 3.23Å; E193-K295 IonicContact OE2-NZ 3.06Å; E193-K295 PolarHBondContact OE2-NZ 2.97Å; P208-K295 WeakPolarHBondContact CD-O 3.34Å; P208-K295 WeakPolarHBondContact CG-O 3.28Å; A290-K295 HydrophobicContact CB-CB 4.3Å; A290-K295 WeakPolarHBondContact CB-O 3.27Å; A290-K295 PolarHBondContact O-N 3.5Å; A290-K295 VanDerWaalsContact O-N 3.11Å; K295-L297 HydrophobicContact CD-CD2 3.83Å; K295-L297 HydrophobicContact CG-CD2 3.88Å; K295-L297 HydrophobicContact CG-CG 4.3Å
296	V	98.8	Very high	98.1	Very high	40 Å²	40	64.8 Å²	64.8	24%	0.242	32%	0.316	C	S	.	.			trans	-90.2	119.9	174	-179.5	0	0	0	0	109	P208 Y217 V298 W299	P208-V296 HydrophobicContact CB-CG2 4.11Å; Y217-V296 HydrophobicContact CG-CG2 4.33Å; V296-V298 VanDerWaalsContact CG1-O 3.31Å; V296-V298 WeakPolarHBondContact CG1-O 3.41Å; V296-W299 HydrophobicContact CG1-CD2 4.37Å; V296-W299 HydrophobicContact CG1-CZ2 4.14Å
297	L	98.9	Very high	98	Very high	4 Å²	4	71.2 Å²	71.2	2%	0.021	35%	0.35	C	S	.	.			trans	-120.3	-1.8	-178.2	-61.5	-179.5	0	0	0	113.3	S191 E193 L194 E197 A290 K295	S191-L297 VanDerWaalsContact CB-O 3.27Å; S191-L297 WeakPolarHBondContact CB-O 3.35Å; S191-L297 PolarHBondContact N-O 3.4Å; E193-L297 HydrophobicContact CB-CD1 4.39Å; E193-L297 HydrophobicContact CB-CD2 4.2Å; E193-L297 HydrophobicContact CG-CD1 4.08Å; E193-L297 HydrophobicContact CG-CD2 4.24Å; L194-L297 HydrophobicContact CB-CB 4.05Å; L194-L297 HydrophobicContact CD1-CB 3.81Å; L194-L297 HydrophobicContact CD1-CD1 4.49Å; E197-L297 HydrophobicContact CG-CD1 3.9Å; A290-L297 HydrophobicContact CB-CD1 3.77Å; A290-L297 HydrophobicContact CB-CG 4.2Å; K295-L297 HydrophobicContact CD-CD2 3.83Å; K295-L297 HydrophobicContact CG-CD2 3.88Å; K295-L297 HydrophobicContact CG-CG 4.3Å
298	V	98.9	Very high	97.9	Very high	0 Å²	0	74.5 Å²	74.5	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	143	178.7	56.2	0	0	0	0	109.7	T189 Y190 L194 V209 G210 A245 V296	T189-V298 WeakPolarHBondContact O-CA 3.25Å; Y190-V298 HydrophobicContact CD1-CB 4.17Å; Y190-V298 HydrophobicContact CD1-CG2 3.48Å; Y190-V298 VanDerWaalsContact CD1-CG2 3.48Å; Y190-V298 HydrophobicContact CE1-CB 4.46Å; Y190-V298 HydrophobicContact CE1-CG2 3.38Å; L194-V298 HydrophobicContact CD2-CB 3.92Å; L194-V298 HydrophobicContact CD2-CG2 4.49Å; V209-V298 HydrophobicContact CB-CG1 4.3Å; V209-V298 HydrophobicContact CG1-CG1 4.3Å; V209-V298 HydrophobicContact CG2-CG1 3.88Å; G210-V298 PolarHBondContact N-O 3.36Å; A245-V298 HydrophobicContact CB-CG2 3.95Å; V296-V298 VanDerWaalsContact CG1-O 3.31Å; V296-V298 WeakPolarHBondContact CG1-O 3.41Å
299	W	98.8	Very high	97.9	Very high	88 Å²	88	77.2 Å²	77.2	33%	0.333	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	131.9	179.6	-58.9	-99.5	0	0	0	110.4	T189 V296 T301	T189-W299 HydrophobicContact CG2-CE3 4.07Å; T189-W299 PolarHBondContact N-O 2.6Å; T189-W299 PolarHBondContact O-N 3.12Å; V296-W299 HydrophobicContact CG1-CD2 4.37Å; V296-W299 HydrophobicContact CG1-CZ2 4.14Å; W299-T301 HydrophobicContact CB-CG2 4.18Å; W299-T301 PolarHBondContact O-N 3.14Å
300	H	97.9	Very high	97.8	Very high	41 Å²	41	83.7 Å²	83.7	19%	0.19	43%	0.428	C	S	.	.			trans	-80.2	60.8	174.9	-163.3	-49	0	0	0	110.6	V209 G210 V212 D243	V209-H300 HydrophobicContact CG1-CB 4.31Å; G210-H300 PolarHBondContact O-N 3.35Å; V212-H300 HydrophobicContact CB-CB 4.21Å; D243-H300 IonicContact OD1-CD2 3.56Å; D243-H300 IonicContact OD2-CD2 2.72Å
301	T	98.1	Very high	97.7	Very high	32 Å²	32	89.2 Å²	89.2	20%	0.196	45%	0.454	C	S	.	.			trans	-63.6	152.2	176.2	42.9	0	0	0	0	111.5	D187 N188 T189 L211 W299	D187-T301 PolarHBondContact O-OG1 3.41Å; N188-T301 WeakPolarHBondContact CA-OG1 3.3Å; T189-T301 PolarHBondContact N-OG1 3.27Å; T189-T301 PolarHBondContact OG1-OG1 2.75Å; L211-T301 HydrophobicContact CD1-CG2 4.39Å; W299-T301 HydrophobicContact CB-CG2 4.18Å; W299-T301 PolarHBondContact O-N 3.14Å
302	R	95.9	Very high	97.5	Very high	198 Å²	198	87.1 Å²	87.1	75%	0.747	45%	0.445	S	S	*	.			trans	-136.7	131.6	172.9	-74.1	-173.3	-77.9	168.5	-4.9	108.8
303	T	96.9	Very high	97.3	Very high	66 Å²	66	91.2 Å²	91.2	41%	0.405	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-81.2	137.8	174.1	-58.2	0	0	0	0	109.7	V93 E97 R100	V93-T303 HydrophobicContact CB-CG2 4.35Å; V93-T303 HydrophobicContact CG1-CG2 3.86Å; V93-T303 HydrophobicContact CG2-CG2 4.46Å; E97-T303 WeakPolarHBondContact OE1-CB 3.43Å; E97-T303 PolarHBondContact OE1-OG1 3.15Å; R100-T303 PolarHBondContact NH2-OG1 2.9Å
304	E	97.1	Very high	97	Very high	171 Å²	171	101.4 Å²	101.4	80%	0.799	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-60.6	158	176.9	-63.9	-170.9	151.1	0	0	111.7	V306	E304-V306 PolarHBondContact O-N 3.1Å
305	K	95.9	Very high	96.8	Very high	203 Å²	203	107.2 Å²	107.2	88%	0.883	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-69.4	125.3	174.3	-169.8	-178.8	-178.3	-174.2	0	108.9	N307	K305-N307 PolarHBondContact O-N 3.46Å
306	V	97.1	Very high	96.6	Very high	61 Å²	61	109.2 Å²	109.2	37%	0.37	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-59.6	129.8	178.4	-171.6	0	0	0	0	110.5	P92 V93 E304 L308	P92-V306 HydrophobicContact CB-CB 4.18Å; P92-V306 HydrophobicContact CB-CG2 3.75Å; V93-V306 HydrophobicContact CG1-CG2 3.38Å; E304-V306 PolarHBondContact O-N 3.1Å; V306-L308 HydrophobicContact CB-CG 4.48Å; V306-L308 HydrophobicContact CG1-CD2 3.78Å; V306-L308 HydrophobicContact CG1-CG 3.88Å; V306-L308 PolarHBondContact O-N 3.21Å
307	N	97.6	Very high	96.5	Very high	137 Å²	137	112.4 Å²	112.4	73%	0.733	54%	0.538	S	S	*	.			trans	-84.8	105.4	171.4	-178.5	9.7	0	0	0	109.9	K305 A309	K305-N307 PolarHBondContact O-N 3.46Å; N307-A309 VanDerWaalsContact OD1-CB 3.22Å; N307-A309 WeakPolarHBondContact OD1-CB 3.46Å; N307-A309 PolarHBondContact OD1-N 3.44Å; N307-A309 VanDerWaalsContact OD1-N 3.09Å
308	L	96.7	Very high	96.4	Very high	93 Å²	93	118.8 Å²	118.8	49%	0.487	58%	0.577	S	S	.	*			trans	-107.8	33.4	176.8	-64.9	177.4	0	0	0	111.7	P92 V306 N310 E311	P92-L308 HydrophobicContact CG-CD1 4.46Å; V306-L308 HydrophobicContact CB-CG 4.48Å; V306-L308 HydrophobicContact CG1-CD2 3.78Å; V306-L308 HydrophobicContact CG1-CG 3.88Å; V306-L308 PolarHBondContact O-N 3.21Å; L308-N310 PolarHBondContact O-N 3.45Å; L308-E311 HydrophobicContact CB-CB 4.15Å; L308-E311 WeakPolarHBondContact O-CB 3.4Å; L308-E311 PolarHBondContact O-N 3.49Å; L308-E311 VanDerWaalsContact O-N 3.14Å
309	A	97.4	Very high	96.3	Very high	80 Å²	80	123.1 Å²	123.1	66%	0.661	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-29.4	-178.3	0	0	0	0	0	113.5	N307	N307-A309 VanDerWaalsContact OD1-CB 3.22Å; N307-A309 WeakPolarHBondContact OD1-CB 3.46Å; N307-A309 PolarHBondContact OD1-N 3.44Å; N307-A309 VanDerWaalsContact OD1-N 3.09Å
310	N	96.8	Very high	96.2	Very high	161 Å²	161	129 Å²	129	86%	0.861	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	11	-179.9	-61.9	-28.2	0	0	0	113.3	L308 P312	L308-N310 PolarHBondContact O-N 3.45Å; N310-P312 WeakPolarHBondContact O-CD 3.26Å
311	E	95.9	Very high	96.2	Very high	118 Å²	118	132.7 Å²	132.7	55%	0.551	65%	0.651	S	S	*	*			trans	-66.4	116.4	176.7	-170.3	67.9	-160.4	0	0	109.5	L308 K313	L308-E311 HydrophobicContact CB-CB 4.15Å; L308-E311 WeakPolarHBondContact O-CB 3.4Å; L308-E311 PolarHBondContact O-N 3.49Å; L308-E311 VanDerWaalsContact O-N 3.14Å; E311-K313 PolarHBondContact O-N 3.32Å
312	P	95.1	Very high	96.2	Very high	58 Å²	58	134.1 Å²	134.1	38%	0.377	66%	0.656	S	S	.	*			trans	-66.6	130.1	-175.6	26.8	-33.1	0	0	0	110.4	N310 R315 L316	N310-P312 WeakPolarHBondContact O-CD 3.26Å; P312-R315 VanDerWaalsContact CB-O 3.3Å; P312-R315 WeakPolarHBondContact CB-O 3.48Å; P312-L316 WeakPolarHBondContact O-CD2 3.31Å
313	K	93.8	Very high	96.1	Very high	178 Å²	178	130.9 Å²	130.9	77%	0.774	66%	0.658	S	S	*	*	S	Bend	trans	-88.1	-24.5	176.7	-67.2	-177.8	-178.3	175.6	0	114.1	E311	E311-K313 PolarHBondContact O-N 3.32Å
314	Y	93.3	Very high	96.1	Very high	213 Å²	213	134.2 Å²	134.2	84%	0.835	67%	0.67	S	S	*	*	S	Bend	trans	-120.4	-43.2	-170.5	-54.5	-70.5	0	0	0	112.9	L316	Y314-L316 PolarHBondContact O-N 3.46Å
315	R	93.7	Very high	96	Very high	232 Å²	232	132.2 Å²	132.2	88%	0.875	66%	0.664	S	S	*	*	S	Bend	trans	-96.2	73.6	177.5	-63.9	-176.4	-176	179	0.8	109.4	P312	P312-R315 VanDerWaalsContact CB-O 3.3Å; P312-R315 WeakPolarHBondContact CB-O 3.48Å
316	L	94.8	Very high	96	Very high	120 Å²	120	128.3 Å²	128.3	63%	0.628	65%	0.651	S	S	*	*			trans	-70.8	154.2	178.5	-58.5	179.1	0	0	0	110.7	P312 Y314	P312-L316 WeakPolarHBondContact O-CD2 3.31Å; Y314-L316 PolarHBondContact O-N 3.46Å
317	D	95.7	Very high	96	Very high	107 Å²	107	132.2 Å²	132.2	57%	0.572	67%	0.668	S	S	*	*			trans	-62.6	148.5	167.7	-169.5	6.3	0	0	0	110.2	V319	D317-V319 VanDerWaalsContact C-N 3.26Å; D317-V319 PolarHBondContact O-N 3.4Å; D317-V319 PolarHBondContact OD1-N 3.25Å
318	T	96.8	Very high	95.9	Very high	138 Å²	138	131.9 Å²	131.9	85%	0.847	66%	0.664	S	S	*	*	S	Bend	trans	-70.7	-24	176.4	58.4	0	0	0	0	112.4
319	V	97.9	Very high	95.8	Very high	91 Å²	91	134.5 Å²	134.5	55%	0.552	68%	0.676	S	S	*	*	S	Bend	trans	-106.2	127.6	179.4	-176	0	0	0	0	110	D317 I321	D317-V319 VanDerWaalsContact C-N 3.26Å; D317-V319 PolarHBondContact O-N 3.4Å; D317-V319 PolarHBondContact OD1-N 3.25Å; V319-I321 HydrophobicContact CG1-CG1 4.13Å; V319-I321 PolarHBondContact O-N 3.41Å
320	K	96.3	Very high	95.7	Very high	212 Å²	212	138.4 Å²	138.4	92%	0.922	68%	0.677	S	S	*	*			trans	-81.6	107.2	174	-173.3	-177.4	179.2	-177.5	0	110.2
321	I	97.5	Very high	95.6	Very high	117 Å²	117	136.7 Å²	136.7	60%	0.6	66%	0.663	S	S	*	*			trans	-99.2	126.9	-179.5	-59.9	172	0	0	0	110.2	V319	V319-I321 HydrophobicContact CG1-CG1 4.13Å; V319-I321 PolarHBondContact O-N 3.41Å
322	E	97.3	Very high	95.6	Very high	63 Å²	63	138.3 Å²	138.3	29%	0.294	67%	0.672	S	S	.	*			trans	-81.6	114.3	172.8	-179.1	-170.5	80.5	0	0	110.5	K95 L125 R128	K95-E322 HydrophobicContact CD-CG 4.19Å; K95-E322 WeakPolarHBondContact CE-OE1 3.47Å; K95-E322 PolarHBondContact NZ-O 2.8Å; K95-E322 IonicContact NZ-OE1 2.75Å; K95-E322 PolarHBondContact NZ-OE1 3.47Å; L125-E322 HydrophobicContact CD1-CG 3.98Å; L125-E322 HydrophobicContact CG-CG 4.33Å; R128-E322 IonicContact CZ-OE2 2.82Å; R128-E322 IonicContact NE-OE2 3.86Å; R128-E322 IonicContact NH2-OE2 2.7Å; R128-E322 PolarHBondContact NH2-OE2 3Å
323	V	94.8	Very high	95.6	Very high	130 Å²	130	145.5 Å²	145.5	79%	0.788	70%	0.699	S	S	*	*			trans	-94.8	0	174.3	-177.6	0	0	0	0	111.8	K95	K95-V323 WeakPolarHBondContact CB-OXT 3.3Å; K95-V323 WeakPolarHBondContact CD-OXT 3.44Å

Retrieved 323 of 323 residues in 59.4 ms (Link to these results)

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