A0A077Z1P6_TRITR Loading...

Abhydrolase 6 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z1P6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 378 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	33.5	Very low	29.3	Very low	243 Å²	243	153.3 Å²	153.3	100%	1.197	85%	0.852	S	S	*	*				0	93.2	0	-78.5	179.8	-169.9	0	0	105.7
2	D	31	Very low	28.9	Very low	168 Å²	168	147.3 Å²	147.3	90%	0.898	84%	0.837	S	S	*	*			trans	-71.4	130.8	169.7	-69.8	-47.7	0	0	0	108.6
3	S	34.3	Very low	28.9	Very low	114 Å²	114	146.4 Å²	146.4	80%	0.797	84%	0.837	S	S	*	*			trans	-134.3	102.9	159.5	59.3	0	0	0	0	108.2
4	N	32.5	Very low	29.4	Very low	150 Å²	150	142.4 Å²	142.4	80%	0.802	83%	0.83	S	S	*	*			trans	-30.6	138.5	156.6	-64.6	-39.3	0	0	0	112.5
5	E	32	Very low	30.3	Very low	197 Å²	197	142.9 Å²	142.9	92%	0.921	82%	0.822	S	S	*	*				-174.7	146.5	100.2	-98.5	177.9	178.9	0	0	113.1
6	M	25.3	Very low	32	Very low	183 Å²	183	139.3 Å²	139.3	90%	0.901	81%	0.807	S	S	*	*			trans	-76.4	176.9	-170.6	-95.3	-103.3	-152.6	0	0	113.6
7	P	38.5	Very low	33.1	Very low	118 Å²	118	134.6 Å²	134.6	77%	0.766	78%	0.784	S	S	*	*			trans	-96.3	166.6	-153.7	38.9	-35.3	0	0	0	113.9
8	G	22.9	Very low	34.3	Very low	59 Å²	59	131.2 Å²	131.2	61%	0.608	76%	0.762	S	S	*	*			trans	138.8	92.6	147.8	0	0	0	0	0	114.6
9	F	24.2	Very low	35.9	Very low	204 Å²	204	129.6 Å²	129.6	90%	0.895	75%	0.754	S	S	*	*			trans	-152.5	85.6	138.9	-100.4	-77.8	0	0	0	107.8	C11	F9-C11 PolarHBondContact O-N 3.08Å
10	V	21.5	Very low	36.9	Very low	148 Å²	148	124.8 Å²	124.8	90%	0.897	73%	0.727	S	S	*	*			trans	-74.3	80.2	156.6	-178.1	0	0	0	0	105.6	A12	V10-A12 PolarHBondContact O-N 2.69Å
11	C	26.3	Very low	37.7	Very low	102 Å²	102	123.8 Å²	123.8	69%	0.689	72%	0.723	S	S	*	*			trans	-75.5	103.9	162.8	-166.9	0	0	0	0	105.5	F9 T13	F9-C11 PolarHBondContact O-N 3.08Å; C11-T13 PolarHBondContact O-N 3.2Å
12	A	24.5	Very low	38.5	Very low	81 Å²	81	115.5 Å²	115.5	67%	0.669	69%	0.685	S	S	*	*			trans	-47.3	106.7	172.9	0	0	0	0	0	109.1	V10 A14	V10-A12 PolarHBondContact O-N 2.69Å; A12-A14 PolarHBondContact O-N 2.89Å
13	T	28.5	Very low	39.5	Very low	136 Å²	136	111.6 Å²	111.6	83%	0.834	69%	0.685	S	S	*	*			trans	-70	84.3	164.5	50.2	0	0	0	0	106.1	C11 E15	C11-T13 PolarHBondContact O-N 3.2Å; T13-E15 PolarHBondContact O-N 3.3Å
14	A	36.3	Very low	40.6	Very low	90 Å²	90	113.6 Å²	113.6	74%	0.744	69%	0.687	S	S	*	*			trans	-61.5	105.9	168.9	0	0	0	0	0	107.5	A12 S16	A12-A14 PolarHBondContact O-N 2.89Å; A14-S16 PolarHBondContact O-N 3.23Å
15	E	42.6	Very low	41.5	Very low	151 Å²	151	109.2 Å²	109.2	71%	0.706	68%	0.677	S	S	*	*			trans	-27.8	108.8	179.1	-64	168.6	156.8	0	0	114.2	T13 S17 R32	T13-E15 PolarHBondContact O-N 3.3Å; E15-S17 PolarHBondContact O-N 3.2Å; E15-R32 PolarHBondContact O-NE 3.07Å
16	S	57.8	Low	42.2	Very low	85 Å²	85	106.9 Å²	106.9	59%	0.594	67%	0.666	S	S	*	*			trans	-78.5	-0.9	179	56.4	0	0	0	0	114.4	A14 S31 R32	A14-S16 PolarHBondContact O-N 3.23Å; S16-S31 WeakPolarHBondContact O-CA 3.14Å; S16-R32 PolarHBondContact O-N 3.28Å
17	S	50.9	Low	43.5	Very low	59 Å²	59	104.3 Å²	104.3	41%	0.413	66%	0.655	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.3	138.5	-161.3	-39.8	0	0	0	0	110.6	E15	E15-S17 PolarHBondContact O-N 3.2Å
18	L	55.2	Low	44.1	Very low	73 Å²	73	100.4 Å²	100.4	38%	0.382	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.1	139.2	171.5	-76.5	165	0	0	0	109.5	V30 R32 A35	L18-V30 PolarHBondContact N-O 3.18Å; L18-V30 PolarHBondContact O-N 2.92Å; L18-R32 HydrophobicContact CD1-CG 3.82Å; L18-R32 HydrophobicContact CG-CG 3.85Å; L18-A35 HydrophobicContact CD1-CB 3.9Å
19	V	64.5	Low	45.8	Very low	102 Å²	102	102.5 Å²	102.5	62%	0.618	63%	0.631	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.3	120.9	173.4	-175.8	0	0	0	0	107.8	I27 V29	V19-I27 HydrophobicContact CG1-CG2 3.47Å; V19-I27 VanDerWaalsContact CG1-CG2 3.47Å; V19-V29 HydrophobicContact CG2-CG2 4.47Å
20	T	55.1	Low	47.1	Very low	33 Å²	33	94 Å²	94	20%	0.202	60%	0.596	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-129	138.1	174.7	59.3	0	0	0	0	111.5	S28 R38	T20-S28 PolarHBondContact N-O 3.24Å; T20-S28 PolarHBondContact O-N 2.91Å; T20-S28 PolarHBondContact O-OG 3.2Å; T20-S28 PolarHBondContact OG1-OG 2.95Å; T20-R38 PolarHBondContact OG1-NH1 3.02Å
21	T	53.3	Low	49.1	Very low	104 Å²	104	88.8 Å²	88.8	64%	0.638	57%	0.566	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-94.9	128.8	177	19.4	0	0	0	0	110.5	Q26 I27	T21-Q26 WeakPolarHBondContact CA-O 3.44Å; T21-I27 HydrophobicContact CG2-CG1 3.99Å
22	T	52	Low	50.7	Low	68 Å²	68	90.9 Å²	90.9	42%	0.417	56%	0.56	S	S	.	*			trans	-83.3	163.6	173.7	61.4	0	0	0	0	111	N24 G25 Q26	T22-N24 PolarHBondContact O-N 3.16Å; T22-G25 PolarHBondContact O-N 3.01Å; T22-Q26 PolarHBondContact N-O 2.96Å
23	G	51	Low	52.3	Low	87 Å²	87	89.2 Å²	89.2	90%	0.897	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-12.1	-176.7	0	0	0	0	0	116.1
24	N	58.5	Low	53.6	Low	156 Å²	156	88.1 Å²	88.1	83%	0.834	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.5	14.2	175.9	-65.3	-2.3	0	0	0	113.3	T22 Q26	T22-N24 PolarHBondContact O-N 3.16Å; N24-Q26 PolarHBondContact O-N 3.45Å
25	G	51.6	Low	54.5	Low	58 Å²	58	84.2 Å²	84.2	60%	0.598	50%	0.499	S	S	*	.	S	Bend	trans	81	9.1	173.1	0	0	0	0	0	116.1	T22	T22-G25 PolarHBondContact O-N 3.01Å
26	Q	45.4	Very low	55.2	Low	148 Å²	148	82.6 Å²	82.6	69%	0.692	49%	0.486	S	S	*	.			trans	-84.1	135.5	174.3	-78.2	-176.2	-21	0	0	111.9	T21 T22 N24	T21-Q26 WeakPolarHBondContact CA-O 3.44Å; T22-Q26 PolarHBondContact N-O 2.96Å; N24-Q26 PolarHBondContact O-N 3.45Å
27	I	52.4	Low	55	Low	128 Å²	128	82.2 Å²	82.2	66%	0.656	48%	0.477	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	124.2	177	-61.2	172.1	0	0	0	109	V19 T21	V19-I27 HydrophobicContact CG1-CG2 3.47Å; V19-I27 VanDerWaalsContact CG1-CG2 3.47Å; T21-I27 HydrophobicContact CG2-CG1 3.99Å
28	S	51.2	Low	55	Low	37 Å²	37	85.6 Å²	85.6	26%	0.259	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	135	172.8	67.8	0	0	0	0	111	T20	T20-S28 PolarHBondContact N-O 3.24Å; T20-S28 PolarHBondContact O-N 2.91Å; T20-S28 PolarHBondContact O-OG 3.2Å; T20-S28 PolarHBondContact OG1-OG 2.95Å
29	V	59.4	Low	54.8	Low	103 Å²	103	86.9 Å²	86.9	62%	0.624	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	116.2	172.5	-178.3	0	0	0	0	107.6	V19	V19-V29 HydrophobicContact CG2-CG2 4.47Å
30	V	50.8	Low	54.1	Low	24 Å²	24	91.5 Å²	91.5	15%	0.145	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	139.9	-175.5	-178.4	0	0	0	0	107.8	L18 Q34 A35	L18-V30 PolarHBondContact N-O 3.18Å; L18-V30 PolarHBondContact O-N 2.92Å; V30-Q34 HydrophobicContact CG1-CB 3.19Å; V30-Q34 HydrophobicContact CG1-CG 4.27Å; V30-A35 HydrophobicContact CG1-CB 4.46Å
31	S	64.5	Low	54	Low	40 Å²	40	93.6 Å²	93.6	28%	0.28	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	149.6	175.8	63.7	0	0	0	0	110.6	S16 A33 Q34 A35	S16-S31 WeakPolarHBondContact O-CA 3.14Å; S31-A33 PolarHBondContact O-N 2.78Å; S31-A33 VanDerWaalsContact O-N 3.12Å; S31-Q34 VanDerWaalsContact N-OE1 3.12Å; S31-Q34 PolarHBondContact O-N 3.43Å; S31-Q34 WeakPolarHBondContact OG-CB 3.45Å; S31-Q34 VanDerWaalsContact OG-CG 3.28Å; S31-Q34 WeakPolarHBondContact OG-CG 3.43Å; S31-Q34 PolarHBondContact OG-N 3.16Å; S31-Q34 VanDerWaalsContact OG-N 3.15Å; S31-Q34 PolarHBondContact OG-OE1 2.81Å; S31-A35 PolarHBondContact O-N 2.74Å
32	R	59.7	Low	54.1	Low	145 Å²	145	93 Å²	93	55%	0.547	50%	0.495	S	S	.	.	H	α-helix	trans	-52.5	-35.4	173.5	-81.5	-175.1	177.4	-170.4	2.3	112	E15 S16 L18 W36	E15-R32 PolarHBondContact O-NE 3.07Å; S16-R32 PolarHBondContact O-N 3.28Å; L18-R32 HydrophobicContact CD1-CG 3.82Å; L18-R32 HydrophobicContact CG-CG 3.85Å; R32-W36 WeakPolarHBondContact O-CB 3.23Å; R32-W36 PolarHBondContact O-N 3.5Å
33	A	57.6	Low	54.6	Low	46 Å²	46	92 Å²	92	38%	0.38	49%	0.489	S	S	.	.	H	α-helix	trans	-63.1	-46.1	175.5	0	0	0	0	0	112.6	S31 W36 I37	S31-A33 PolarHBondContact O-N 2.78Å; S31-A33 VanDerWaalsContact O-N 3.12Å; A33-W36 PolarHBondContact O-N 3.27Å; A33-I37 VanDerWaalsContact O-CG1 3.26Å; A33-I37 WeakPolarHBondContact O-CG1 3.44Å; A33-I37 PolarHBondContact O-N 2.91Å
34	Q	55.3	Low	55.7	Low	114 Å²	114	90.2 Å²	90.2	53%	0.533	46%	0.457	S	S	.	.	H	α-helix	trans	-69.6	-38.7	177.8	-77.3	165.6	-38.5	0	0	112.5	V30 S31 W36 I37 R38	V30-Q34 HydrophobicContact CG1-CB 3.19Å; V30-Q34 HydrophobicContact CG1-CG 4.27Å; S31-Q34 VanDerWaalsContact N-OE1 3.12Å; S31-Q34 PolarHBondContact O-N 3.43Å; S31-Q34 WeakPolarHBondContact OG-CB 3.45Å; S31-Q34 VanDerWaalsContact OG-CG 3.28Å; S31-Q34 WeakPolarHBondContact OG-CG 3.43Å; S31-Q34 PolarHBondContact OG-N 3.16Å; S31-Q34 VanDerWaalsContact OG-N 3.15Å; S31-Q34 PolarHBondContact OG-OE1 2.81Å; Q34-W36 VanDerWaalsContact C-N 3.33Å; Q34-I37 PolarHBondContact O-N 3.47Å; Q34-R38 WeakPolarHBondContact O-CB 3.33Å; Q34-R38 PolarHBondContact O-N 3.38Å
35	A	55	Low	56.7	Low	7 Å²	7	89.9 Å²	89.9	6%	0.058	44%	0.444	C	S	.	.	H	α-helix	trans	-65	-38.5	174.3	0	0	0	0	0	111.5	L18 V30 S31 R38 D39	L18-A35 HydrophobicContact CD1-CB 3.9Å; V30-A35 HydrophobicContact CG1-CB 4.46Å; S31-A35 PolarHBondContact O-N 2.74Å; A35-R38 PolarHBondContact O-N 3.15Å; A35-D39 WeakPolarHBondContact O-CB 2.98Å; A35-D39 PolarHBondContact O-N 2.84Å
36	W	58	Low	58.4	Low	118 Å²	118	89.9 Å²	89.9	45%	0.447	44%	0.435	S	S	.	.	H	α-helix	trans	-64.5	-42.5	174.5	-171.7	96.2	0	0	0	112.4	R32 A33 Q34 R40 W41 P246	R32-W36 WeakPolarHBondContact O-CB 3.23Å; R32-W36 PolarHBondContact O-N 3.5Å; A33-W36 PolarHBondContact O-N 3.27Å; Q34-W36 VanDerWaalsContact C-N 3.33Å; W36-R40 PolarHBondContact O-N 3.16Å; W36-W41 HydrophobicContact CZ3-CB 4.23Å; W36-W41 AromaticContact CZ3-CD1 3.76Å; W36-W41 HydrophobicContact CZ3-CG 4.34Å; W36-W41 PolarHBondContact O-N 3.37Å; W36-P246 HydrophobicContact CE3-CB 4.4Å; W36-P246 HydrophobicContact CE3-CG 3.91Å; W36-P246 HydrophobicContact CH2-CB 3.45Å; W36-P246 VanDerWaalsContact CH2-CB 3.45Å; W36-P246 HydrophobicContact CH2-CG 3.81Å; W36-P246 HydrophobicContact CZ2-CB 4.33Å; W36-P246 HydrophobicContact CZ3-CB 3.49Å; W36-P246 VanDerWaalsContact CZ3-CB 3.49Å; W36-P246 HydrophobicContact CZ3-CG 3.25Å
37	I	54	Low	60.5	Low	76 Å²	76	87.3 Å²	87.3	39%	0.39	42%	0.422	S	S	.	.	H	α-helix	trans	-63.1	-46	174	-68.9	164.2	0	0	0	110.7	A33 Q34 W41	A33-I37 VanDerWaalsContact O-CG1 3.26Å; A33-I37 WeakPolarHBondContact O-CG1 3.44Å; A33-I37 PolarHBondContact O-N 2.91Å; Q34-I37 PolarHBondContact O-N 3.47Å; I37-W41 VanDerWaalsContact O-CB 3.25Å; I37-W41 WeakPolarHBondContact O-CB 3.43Å; I37-W41 PolarHBondContact O-N 3.22Å
38	R	50.8	Low	62.4	Low	130 Å²	130	83.5 Å²	83.5	49%	0.491	41%	0.405	S	S	.	.	H	α-helix	trans	-67.6	-43.9	-175.3	-168.2	-171.7	70.9	-163.7	-4.5	113.2	T20 Q34 A35	T20-R38 PolarHBondContact OG1-NH1 3.02Å; Q34-R38 WeakPolarHBondContact O-CB 3.33Å; Q34-R38 PolarHBondContact O-N 3.38Å; A35-R38 PolarHBondContact O-N 3.15Å
39	D	50.3	Low	64.4	Low	100 Å²	100	81.8 Å²	81.8	54%	0.535	39%	0.393	S	S	.	.	H	α-helix	trans	-101	-12.6	-165.6	-60.3	-20.6	0	0	0	113.6	A35	A35-D39 WeakPolarHBondContact O-CB 2.98Å; A35-D39 PolarHBondContact O-N 2.84Å
40	R	49.8	Very low	66.1	Low	199 Å²	199	80.9 Å²	80.9	75%	0.751	38%	0.382	S	S	*	.	H	α-helix	trans	-137.7	-14.7	-174.5	-74.4	-173.7	173.1	-167.3	-1.7	116.4	W36 V42	W36-R40 PolarHBondContact O-N 3.16Å; R40-V42 PolarHBondContact O-N 3.4Å; R40-V42 VanDerWaalsContact O-N 3.09Å
41	W	53.7	Low	68.1	Low	78 Å²	78	84.7 Å²	84.7	30%	0.295	40%	0.398	S	S	.	.			trans	-81.4	99.4	-175.3	-172.7	79.1	0	0	0	111.1	W36 I37 P43	W36-W41 HydrophobicContact CZ3-CB 4.23Å; W36-W41 AromaticContact CZ3-CD1 3.76Å; W36-W41 HydrophobicContact CZ3-CG 4.34Å; W36-W41 PolarHBondContact O-N 3.37Å; I37-W41 VanDerWaalsContact O-CB 3.25Å; I37-W41 WeakPolarHBondContact O-CB 3.43Å; I37-W41 PolarHBondContact O-N 3.22Å; W41-P43 VanDerWaalsContact CE2-CA 3.46Å; W41-P43 HydrophobicContact CE3-CG 4.19Å; W41-P43 HydrophobicContact CH2-CB 3.49Å; W41-P43 VanDerWaalsContact CH2-CB 3.49Å; W41-P43 HydrophobicContact CH2-CG 3.48Å; W41-P43 VanDerWaalsContact CH2-CG 3.48Å; W41-P43 VanDerWaalsContact CZ2-CA 3.48Å; W41-P43 HydrophobicContact CZ2-CB 3.39Å; W41-P43 HydrophobicContact CZ2-CG 3.9Å; W41-P43 HydrophobicContact CZ3-CB 4.11Å; W41-P43 HydrophobicContact CZ3-CG 3.63Å
42	V	54.3	Low	69.4	Low	92 Å²	92	83.2 Å²	83.2	56%	0.558	39%	0.388	S	S	*	.			trans	-90.8	122.6	149.7	-174.5	0	0	0	0	105.1	R40 F44	R40-V42 PolarHBondContact O-N 3.4Å; R40-V42 VanDerWaalsContact O-N 3.09Å; V42-F44 WeakPolarHBondContact CG1-O 3.49Å; V42-F44 PolarHBondContact O-N 2.97Å
43	P	62.6	Low	71.1	Confident	46 Å²	46	76.3 Å²	76.3	30%	0.299	36%	0.362	S	S	.	.	S	Bend	trans	-50.4	-29.7	-172.6	-9	1	0	0	0	114.1	W41 A282	W41-P43 VanDerWaalsContact CE2-CA 3.46Å; W41-P43 HydrophobicContact CE3-CG 4.19Å; W41-P43 HydrophobicContact CH2-CB 3.49Å; W41-P43 VanDerWaalsContact CH2-CB 3.49Å; W41-P43 HydrophobicContact CH2-CG 3.48Å; W41-P43 VanDerWaalsContact CH2-CG 3.48Å; W41-P43 VanDerWaalsContact CZ2-CA 3.48Å; W41-P43 HydrophobicContact CZ2-CB 3.39Å; W41-P43 HydrophobicContact CZ2-CG 3.9Å; W41-P43 HydrophobicContact CZ3-CB 4.11Å; W41-P43 HydrophobicContact CZ3-CG 3.63Å; P43-A282 WeakPolarHBondContact O-CB 3.37Å
44	F	74.2	Confident	72.7	Confident	50 Å²	50	79.5 Å²	79.5	22%	0.219	37%	0.37	C	S	.	.			trans	-146.3	144.8	-171.7	168.9	-103.7	0	0	0	111.8	V42 S46 L49 Q283	V42-F44 WeakPolarHBondContact CG1-O 3.49Å; V42-F44 PolarHBondContact O-N 2.97Å; F44-S46 VanDerWaalsContact CZ-CA 3.42Å; F44-L49 HydrophobicContact CE2-CB 3.79Å; F44-L49 HydrophobicContact CE2-CD2 4.07Å; F44-L49 HydrophobicContact CZ-CB 4.49Å; F44-Q283 HydrophobicContact CB-CG 3.91Å; F44-Q283 HydrophobicContact CD1-CG 3.55Å; F44-Q283 HydrophobicContact CD2-CB 4.49Å; F44-Q283 HydrophobicContact CD2-CG 3.09Å; F44-Q283 HydrophobicContact CE1-CG 3.7Å; F44-Q283 VanDerWaalsContact CE1-OE1 3.23Å; F44-Q283 HydrophobicContact CE2-CG 3.25Å; F44-Q283 VanDerWaalsContact CE2-NE2 3.3Å; F44-Q283 HydrophobicContact CG-CB 4.39Å; F44-Q283 HydrophobicContact CG-CG 3.22Å; F44-Q283 HydrophobicContact CZ-CG 3.54Å
45	R	81	Confident	74.4	Confident	148 Å²	148	79.4 Å²	79.4	56%	0.558	37%	0.367	S	S	*	.			trans	-131.9	133.8	163.8	-71.2	-172.4	-177.3	-151.1	-0.4	108.3	E47 V48 L49	R45-E47 PolarHBondContact O-N 3Å; R45-V48 HydrophobicContact CB-CB 4.35Å; R45-V48 HydrophobicContact CB-CG2 3.81Å; R45-V48 PolarHBondContact O-N 3.36Å; R45-V48 VanDerWaalsContact O-N 3.11Å; R45-L49 PolarHBondContact O-N 2.92Å
46	S	86.1	Confident	76.2	Confident	59 Å²	59	79 Å²	79	41%	0.413	37%	0.365	S	S	.	.	H	α-helix	trans	-54	-39.5	177.5	23.7	0	0	0	0	112.1	F44 V48 L49 E50	F44-S46 VanDerWaalsContact CZ-CA 3.42Å; S46-V48 VanDerWaalsContact C-N 3.28Å; S46-V48 PolarHBondContact O-N 3.19Å; S46-L49 PolarHBondContact O-N 3.39Å; S46-E50 WeakPolarHBondContact O-CB 3.45Å; S46-E50 PolarHBondContact O-N 3.11Å
47	E	90.7	Very high	77.7	Confident	93 Å²	93	74 Å²	74	44%	0.435	35%	0.347	S	S	.	.	H	α-helix	trans	-68.6	-29.7	-176	-54.4	69.1	-132.5	0	0	111.4	R45 Q51	R45-E47 PolarHBondContact O-N 3Å; E47-Q51 WeakPolarHBondContact O-CB 3.33Å; E47-Q51 WeakPolarHBondContact O-CG 3.41Å; E47-Q51 PolarHBondContact O-N 3.34Å
48	V	91.2	Very high	79	Confident	49 Å²	49	71 Å²	71	30%	0.297	33%	0.334	S	S	.	.	H	α-helix	trans	-76.2	-39.8	-179.7	-179.4	0	0	0	0	110.7	R45 S46 E50 Q51 A52 H279	R45-V48 HydrophobicContact CB-CB 4.35Å; R45-V48 HydrophobicContact CB-CG2 3.81Å; R45-V48 PolarHBondContact O-N 3.36Å; R45-V48 VanDerWaalsContact O-N 3.11Å; S46-V48 VanDerWaalsContact C-N 3.28Å; S46-V48 PolarHBondContact O-N 3.19Å; V48-E50 VanDerWaalsContact C-N 3.34Å; V48-Q51 PolarHBondContact O-N 3.43Å; V48-A52 WeakPolarHBondContact O-CB 3.19Å; V48-A52 PolarHBondContact O-N 2.82Å; V48-H279 WeakPolarHBondContact CG1-CE1 3.48Å; V48-H279 VanDerWaalsContact CG1-NE2 3.32Å; V48-H279 WeakPolarHBondContact CG1-NE2 3.34Å
49	L	94.2	Very high	79.8	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.005	35%	0.353	C	S	.	.	H	α-helix	trans	-66.1	-40.6	172.1	175.8	55.8	0	0	0	111.3	F44 R45 S46 Q51 A52 E53 G138 R139 Y276 H279	F44-L49 HydrophobicContact CE2-CB 3.79Å; F44-L49 HydrophobicContact CE2-CD2 4.07Å; F44-L49 HydrophobicContact CZ-CB 4.49Å; R45-L49 PolarHBondContact O-N 2.92Å; S46-L49 PolarHBondContact O-N 3.39Å; L49-Q51 PolarHBondContact O-N 3.38Å; L49-A52 PolarHBondContact O-N 3.4Å; L49-E53 WeakPolarHBondContact O-CB 3.34Å; L49-E53 PolarHBondContact O-N 2.83Å; L49-G138 WeakPolarHBondContact CD2-O 3.44Å; L49-R139 HydrophobicContact CD2-CB 4.46Å; L49-R139 HydrophobicContact CD2-CG 3.47Å; L49-R139 VanDerWaalsContact CD2-CG 3.47Å; L49-R139 HydrophobicContact CG-CG 3.67Å; L49-Y276 HydrophobicContact CD1-CD2 3.78Å; L49-Y276 HydrophobicContact CD1-CE2 3.81Å; L49-H279 HydrophobicContact CB-CB 4.01Å; L49-H279 HydrophobicContact CD1-CB 3.87Å; L49-H279 HydrophobicContact CG-CB 4.48Å
50	E	93.9	Very high	80.3	Confident	84 Å²	84	71.5 Å²	71.5	39%	0.393	37%	0.368	S	S	.	.	H	α-helix	trans	-56.6	-49	173.4	174.4	158.4	-130.5	0	0	111.8	S46 V48 A52 E53 E54 R139	S46-E50 WeakPolarHBondContact O-CB 3.45Å; S46-E50 PolarHBondContact O-N 3.11Å; V48-E50 VanDerWaalsContact C-N 3.34Å; E50-A52 PolarHBondContact O-N 3.45Å; E50-E53 PolarHBondContact O-N 2.71Å; E50-E54 WeakPolarHBondContact O-CB 3.32Å; E50-E54 PolarHBondContact O-N 3.41Å; E50-R139 IonicContact OE1-CZ 2.87Å; E50-R139 IonicContact OE1-NH2 3.52Å; E50-R139 PolarHBondContact OE1-NH2 3.19Å; E50-R139 IonicContact OE2-NH2 3.63Å
51	Q	92.5	Very high	80.5	Confident	103 Å²	103	63.1 Å²	63.1	48%	0.481	34%	0.339	S	S	.	.	H	α-helix	trans	-63.3	-39.1	175.8	-73.4	169.4	17.3	0	0	112.7	E47 V48 L49 E53 E54 K55	E47-Q51 WeakPolarHBondContact O-CB 3.33Å; E47-Q51 WeakPolarHBondContact O-CG 3.41Å; E47-Q51 PolarHBondContact O-N 3.34Å; V48-Q51 PolarHBondContact O-N 3.43Å; L49-Q51 PolarHBondContact O-N 3.38Å; Q51-E53 VanDerWaalsContact C-N 3.3Å; Q51-E53 PolarHBondContact O-N 3Å; Q51-E54 PolarHBondContact O-N 2.66Å; Q51-K55 WeakPolarHBondContact O-CB 3.34Å; Q51-K55 WeakPolarHBondContact O-CG 3.32Å; Q51-K55 PolarHBondContact O-N 2.98Å
52	A	92.9	Very high	80.4	Confident	9 Å²	9	64.7 Å²	64.7	7%	0.074	35%	0.352	C	S	.	.	H	α-helix	trans	-63.9	-38	177.1	0	0	0	0	0	111.5	V48 L49 E50 Y276	V48-A52 WeakPolarHBondContact O-CB 3.19Å; V48-A52 PolarHBondContact O-N 2.82Å; L49-A52 PolarHBondContact O-N 3.4Å; E50-A52 PolarHBondContact O-N 3.45Å; A52-Y276 HydrophobicContact CB-CD2 4.47Å
53	E	94.3	Very high	80.7	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-73.7	-42.2	176.2	-169.1	171.6	77.5	0	0	112.8	L49 E50 Q51 K55 L56 L57 Q71 W84 A114 R139 Y276	L49-E53 WeakPolarHBondContact O-CB 3.34Å; L49-E53 PolarHBondContact O-N 2.83Å; E50-E53 PolarHBondContact O-N 2.71Å; Q51-E53 VanDerWaalsContact C-N 3.3Å; Q51-E53 PolarHBondContact O-N 3Å; E53-K55 PolarHBondContact O-N 2.94Å; E53-L56 WeakPolarHBondContact O-CA 3.31Å; E53-L56 WeakPolarHBondContact O-CB 3.22Å; E53-L56 PolarHBondContact O-N 3.48Å; E53-L57 HydrophobicContact CG-CD1 4.09Å; E53-L57 HydrophobicContact CG-CG 4.44Å; E53-L57 PolarHBondContact O-N 3.46Å; E53-Q71 VanDerWaalsContact CD-NE2 3.34Å; E53-Q71 PolarHBondContact OE1-NE2 2.65Å; E53-W84 PolarHBondContact OE1-NE1 3.23Å; E53-A114 HydrophobicContact CG-CB 4.09Å; E53-R139 WeakPolarHBondContact OE1-CD 2.89Å; E53-R139 IonicContact OE1-CZ 2.74Å; E53-R139 IonicContact OE1-NE 2.85Å; E53-R139 IonicContact OE1-NH1 3.07Å; E53-R139 PolarHBondContact OE1-NH1 3.1Å; E53-Y276 HydrophobicContact CB-CD2 4.06Å; E53-Y276 HydrophobicContact CB-CE2 3.71Å; E53-Y276 HydrophobicContact CG-CE2 3.81Å; E53-Y276 WeakPolarHBondContact OE2-CE2 3.32Å; E53-Y276 PolarHBondContact OE2-OH 2.85Å
54	E	92.1	Very high	81.2	Confident	114 Å²	114	68.5 Å²	68.5	53%	0.533	36%	0.361	S	S	.	.	H	α-helix	trans	-59.9	-34.4	174.9	-174.1	178.6	-166.7	0	0	110.7	E50 Q51 L56 G58 V61	E50-E54 WeakPolarHBondContact O-CB 3.32Å; E50-E54 PolarHBondContact O-N 3.41Å; Q51-E54 PolarHBondContact O-N 2.66Å; E54-L56 PolarHBondContact O-N 2.86Å; E54-G58 WeakPolarHBondContact O-CA 3.23Å; E54-G58 PolarHBondContact O-N 2.8Å; E54-V61 WeakPolarHBondContact O-CG2 3.45Å
55	K	91.4	Very high	81.8	Confident	111 Å²	111	67.2 Å²	67.2	48%	0.483	36%	0.356	S	S	.	.	H	α-helix	trans	-68.9	-8	171.1	-75.1	175.4	-174.4	-179.6	0	114.8	Q51 E53 V61 L272	Q51-K55 WeakPolarHBondContact O-CB 3.34Å; Q51-K55 WeakPolarHBondContact O-CG 3.32Å; Q51-K55 PolarHBondContact O-N 2.98Å; E53-K55 PolarHBondContact O-N 2.94Å; K55-V61 VanDerWaalsContact CA-CG2 3.45Å; K55-V61 WeakPolarHBondContact O-CG1 3.38Å; K55-V61 WeakPolarHBondContact O-CG2 3.09Å; K55-L272 HydrophobicContact CB-CD2 4.19Å; K55-L272 HydrophobicContact CD-CD2 4.03Å
56	L	91.4	Very high	82.2	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-106.7	-36.4	173	-66	177.7	0	0	0	112.4	E53 E54 L63 A114 F264 L272 I273 Y276	E53-L56 WeakPolarHBondContact O-CA 3.31Å; E53-L56 WeakPolarHBondContact O-CB 3.22Å; E53-L56 PolarHBondContact O-N 3.48Å; E54-L56 PolarHBondContact O-N 2.86Å; L56-L63 VanDerWaalsContact O-CD1 3.23Å; L56-L63 WeakPolarHBondContact O-CD1 3.05Å; L56-A114 HydrophobicContact CD1-CB 4.41Å; L56-F264 HydrophobicContact CD2-CE2 4.26Å; L56-F264 HydrophobicContact CD2-CZ 4.48Å; L56-L272 HydrophobicContact CD2-CB 3.58Å; L56-L272 HydrophobicContact CG-CB 4.46Å; L56-I273 HydrophobicContact CD1-CD1 4.13Å; L56-I273 HydrophobicContact CD2-CD1 3.74Å; L56-Y276 HydrophobicContact CD1-CD1 3.83Å; L56-Y276 HydrophobicContact CD1-CD2 4.14Å; L56-Y276 HydrophobicContact CD1-CG 3.58Å
57	L	91.5	Very high	82.6	Confident	13 Å²	13	66.3 Å²	66.3	7%	0.068	35%	0.345	C	S	.	.	H	α-helix	trans	-114.2	-10.2	-170.4	-57.9	-173.5	0	0	0	114.6	E53 L65 T86 A114 M117 F120	E53-L57 HydrophobicContact CG-CD1 4.09Å; E53-L57 HydrophobicContact CG-CG 4.44Å; E53-L57 PolarHBondContact O-N 3.46Å; L57-L65 HydrophobicContact CD2-CD1 4.19Å; L57-T86 HydrophobicContact CD1-CG2 4.07Å; L57-A114 HydrophobicContact CD1-CB 3.7Å; L57-A114 HydrophobicContact CD2-CB 4.13Å; L57-A114 HydrophobicContact CG-CB 3.9Å; L57-M117 HydrophobicContact CD2-CB 4.02Å; L57-F120 HydrophobicContact CD1-CE2 4.35Å; L57-F120 HydrophobicContact CD2-CD2 4.25Å; L57-F120 HydrophobicContact CD2-CE2 3.67Å
58	G	80.7	Confident	82.7	Confident	12 Å²	12	66.4 Å²	66.4	12%	0.124	34%	0.344	C	S	.	.	S	Bend	trans	-77.3	160.4	-175.6	0	0	0	0	0	113.5	E54 A60 V61	E54-G58 WeakPolarHBondContact O-CA 3.23Å; E54-G58 PolarHBondContact O-N 2.8Å; G58-A60 PolarHBondContact O-N 2.93Å; G58-V61 WeakPolarHBondContact O-CB 2.96Å; G58-V61 WeakPolarHBondContact O-CG2 3.31Å; G58-V61 PolarHBondContact O-N 3.21Å
59	P	67.4	Low	82.9	Confident	138 Å²	138	65.6 Å²	65.6	90%	0.896	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-20.8	-178.7	28.5	-35.3	0	0	0	113.4	V61	P59-V61 VanDerWaalsContact C-N 3.27Å
60	A	60.3	Low	82.9	Confident	103 Å²	103	70.8 Å²	70.8	85%	0.851	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-3.5	179	0	0	0	0	0	113.4	G58	G58-A60 PolarHBondContact O-N 2.93Å
61	V	55.2	Low	83	Confident	22 Å²	22	69.8 Å²	69.8	13%	0.133	35%	0.354	C	S	.	.	S	Bend	trans	-86.3	147.1	-176.1	-177.9	0	0	0	0	110.5	E54 K55 G58 P59 L63	E54-V61 WeakPolarHBondContact O-CG2 3.45Å; K55-V61 VanDerWaalsContact CA-CG2 3.45Å; K55-V61 WeakPolarHBondContact O-CG1 3.38Å; K55-V61 WeakPolarHBondContact O-CG2 3.09Å; G58-V61 WeakPolarHBondContact O-CB 2.96Å; G58-V61 WeakPolarHBondContact O-CG2 3.31Å; G58-V61 PolarHBondContact O-N 3.21Å; P59-V61 VanDerWaalsContact C-N 3.27Å; V61-L63 HydrophobicContact CG1-CB 4.18Å; V61-L63 HydrophobicContact CG1-CD1 4.18Å; V61-L63 HydrophobicContact CG1-CG 4.37Å; V61-L63 CarbonylContact O-C 3.57Å; V61-L63 PolarHBondContact O-N 3.25Å
62	L	51	Low	83.3	Confident	111 Å²	111	67.7 Å²	67.7	58%	0.581	34%	0.344	S	S	*	.	S	Bend	trans	-55.7	7.1	171.3	-64.6	164.1	0	0	0	115.8	R269	L62-R269 HydrophobicContact CB-CG 4.36Å; L62-R269 HydrophobicContact CD1-CG 3.56Å; L62-R269 PolarHBondContact O-NH1 3.28Å
63	L	61.1	Low	83.5	Confident	36 Å²	36	70.7 Å²	70.7	19%	0.188	35%	0.354	C	S	.	.			trans	-108.8	99.6	171.2	-75.5	159.6	0	0	0	106.9	L56 V61 L65 M117 F264	L56-L63 VanDerWaalsContact O-CD1 3.23Å; L56-L63 WeakPolarHBondContact O-CD1 3.05Å; V61-L63 HydrophobicContact CG1-CB 4.18Å; V61-L63 HydrophobicContact CG1-CD1 4.18Å; V61-L63 HydrophobicContact CG1-CG 4.37Å; V61-L63 CarbonylContact O-C 3.57Å; V61-L63 PolarHBondContact O-N 3.25Å; L63-L65 PolarHBondContact O-N 2.87Å; L63-M117 HydrophobicContact CD1-CE 3.13Å; L63-M117 HydrophobicContact CD1-SD 3.61Å; L63-M117 HydrophobicContact CD2-CE 3.39Å; L63-M117 HydrophobicContact CG-CE 3.85Å; L63-F264 HydrophobicContact CD1-CE1 3.89Å; L63-F264 HydrophobicContact CD1-CZ 3.59Å; L63-F264 HydrophobicContact CD2-CE1 3.67Å; L63-F264 HydrophobicContact CD2-CZ 4.24Å; L63-F264 HydrophobicContact CG-CE1 3.72Å; L63-F264 HydrophobicContact CG-CZ 3.96Å
64	E	71.9	Confident	83.8	Confident	182 Å²	182	70.7 Å²	70.7	85%	0.85	35%	0.354	S	S	*	.			trans	-68.6	68.3	167.6	-63.5	-179.9	-178.6	0	0	109.2	R66	E64-R66 PolarHBondContact O-N 3.07Å
65	L	86.4	Confident	84.1	Confident	23 Å²	23	67.7 Å²	67.7	12%	0.12	34%	0.344	C	S	.	.			trans	-54.8	113.8	168.7	-77.9	177.9	0	0	0	107	L57 L63 S67 V69 F120	L57-L65 HydrophobicContact CD2-CD1 4.19Å; L63-L65 PolarHBondContact O-N 2.87Å; L65-S67 PolarHBondContact O-N 2.77Å; L65-V69 HydrophobicContact CD1-CG2 3.8Å; L65-F120 HydrophobicContact CD1-CD2 4.17Å; L65-F120 HydrophobicContact CD2-CB 4.18Å
66	R	90.5	Very high	84.4	Confident	183 Å²	183	62.5 Å²	62.5	69%	0.691	32%	0.322	S	S	*	.			trans	-73.1	-25.8	-177.1	-64.7	175.5	-67.3	-180	0.7	110.1	E64 R91 D121	E64-R66 PolarHBondContact O-N 3.07Å; R66-R91 WeakPolarHBondContact O-CD 3.34Å; R66-R91 VanDerWaalsContact O-CG 3.23Å; R66-R91 WeakPolarHBondContact O-CG 3.38Å; R66-R91 PolarHBondContact O-NE 3.03Å; R66-D121 WeakPolarHBondContact CB-OD2 3.4Å; R66-D121 IonicContact CZ-OD2 2.89Å; R66-D121 PolarHBondContact N-OD1 3.49Å; R66-D121 PolarHBondContact N-OD2 3.43Å; R66-D121 VanDerWaalsContact N-OD2 3.16Å; R66-D121 IonicContact NE-OD2 3.49Å; R66-D121 PolarHBondContact NE-OD2 2.77Å; R66-D121 IonicContact NH2-OD2 3.81Å
67	S	93.4	Very high	84.7	Confident	6 Å²	6	63.9 Å²	63.9	4%	0.042	33%	0.329	C	S	.	.	S	Bend	trans	-72.7	157.3	172	-68.3	0	0	0	0	113	L65 S89 R91 D121	L65-S67 PolarHBondContact O-N 2.77Å; S67-S89 CarbonylContact C-O 3.47Å; S67-S89 WeakPolarHBondContact CA-O 3.21Å; S67-S89 WeakPolarHBondContact CB-O 3.24Å; S67-R91 PolarHBondContact O-NH2 3.36Å; S67-R91 VanDerWaalsContact O-NH2 3.16Å; S67-D121 PolarHBondContact N-OD1 2.81Å
68	F	93.6	Very high	84.9	Confident	95 Å²	95	71.1 Å²	71.1	42%	0.417	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	135.7	164.7	178.1	-103.4	0	0	0	109.4	R70 V88 S89 R91	F68-R70 HydrophobicContact CE1-CB 3.7Å; F68-R70 HydrophobicContact CE1-CG 3.94Å; F68-R70 HydrophobicContact CZ-CB 4.09Å; F68-V88 VanDerWaalsContact O-CA 3.31Å; F68-V88 WeakPolarHBondContact O-CA 3.37Å; F68-S89 PolarHBondContact N-O 2.8Å; F68-S89 PolarHBondContact O-N 2.88Å; F68-R91 HydrophobicContact CB-CG 4.39Å
69	V	94.6	Very high	85.6	Confident	32 Å²	32	73.1 Å²	73.1	19%	0.194	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	128.7	177	-176.9	0	0	0	0	108.6	L65 Q71 T86 V87 V88	L65-V69 HydrophobicContact CD1-CG2 3.8Å; V69-Q71 HydrophobicContact CG1-CG 4.43Å; V69-T86 HydrophobicContact CG1-CG2 3.68Å; V69-V87 WeakPolarHBondContact CA-O 3.35Å; V69-V88 HydrophobicContact CG2-CG1 4.38Å; V69-V88 HydrophobicContact CG2-CG2 4.33Å
70	R	95	Very high	87.1	Confident	110 Å²	110	71.8 Å²	71.8	42%	0.415	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	152.2	167.9	62	175.6	-178.1	135.6	-1.5	109.3	F68 V87	F68-R70 HydrophobicContact CE1-CB 3.7Å; F68-R70 HydrophobicContact CE1-CG 3.94Å; F68-R70 HydrophobicContact CZ-CB 4.09Å; R70-V87 HydrophobicContact CG-CB 3.66Å; R70-V87 HydrophobicContact CG-CG2 4.12Å; R70-V87 PolarHBondContact N-O 2.83Å; R70-V87 PolarHBondContact O-N 3.35Å
71	Q	96.4	Very high	88.9	Confident	62 Å²	62	67.4 Å²	67.4	29%	0.29	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	146.2	179.4	-51	178.7	-75.7	0	0	110.4	E53 V69 W84 T85 T86	E53-Q71 VanDerWaalsContact CD-NE2 3.34Å; E53-Q71 PolarHBondContact OE1-NE2 2.65Å; V69-Q71 HydrophobicContact CG1-CG 4.43Å; Q71-W84 HydrophobicContact CB-CH2 3.66Å; Q71-W84 HydrophobicContact CB-CZ2 3.21Å; Q71-W84 HydrophobicContact CG-CZ2 4.05Å; Q71-T85 VanDerWaalsContact CA-O 3.32Å; Q71-T85 WeakPolarHBondContact CA-O 3.37Å; Q71-T86 HydrophobicContact CG-CG2 4.19Å; Q71-T86 PolarHBondContact NE2-OG1 3.24Å; Q71-T86 VanDerWaalsContact NE2-OG1 3.12Å
72	Q	97.6	Very high	91	Very high	59 Å²	59	72.3 Å²	72.3	28%	0.276	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	153	-177	59.9	-176.6	-12.6	0	0	111.7	V74 T85	Q72-V74 HydrophobicContact CG-CG2 4.35Å; Q72-T85 PolarHBondContact N-O 3.33Å; Q72-T85 PolarHBondContact O-N 3.22Å
73	Y	98.6	Very high	93.2	Very high	72 Å²	72	67 Å²	67	28%	0.282	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	131.6	164.9	-73.5	-70.6	0	0	0	110.2	R82 L83 W84 R139	Y73-R82 HydrophobicContact CD1-CB 4.1Å; Y73-R82 VanDerWaalsContact CD1-CD 3.42Å; Y73-R82 HydrophobicContact CD1-CG 3.55Å; Y73-R82 HydrophobicContact CE1-CG 4.15Å; Y73-R82 HydrophobicContact CG-CG 4.18Å; Y73-L83 WeakPolarHBondContact CA-O 3.26Å; Y73-W84 HydrophobicContact CD1-CB 4.35Å; Y73-W84 AromaticContact CD1-CE3 3.57Å; Y73-W84 HydrophobicContact CD1-CE3 3.57Å; Y73-W84 HydrophobicContact CD1-CZ3 4.28Å; Y73-W84 AromaticContact CD2-CE3 3.68Å; Y73-W84 HydrophobicContact CD2-CE3 3.68Å; Y73-W84 AromaticContact CD2-CZ3 3.5Å; Y73-W84 HydrophobicContact CD2-CZ3 3.5Å; Y73-W84 VanDerWaalsContact CD2-CZ3 3.5Å; Y73-W84 HydrophobicContact CE1-CB 4.1Å; Y73-W84 HydrophobicContact CE1-CD2 4.21Å; Y73-W84 AromaticContact CE1-CE3 3.49Å; Y73-W84 HydrophobicContact CE1-CE3 3.49Å; Y73-W84 VanDerWaalsContact CE1-CE3 3.49Å; Y73-W84 HydrophobicContact CE1-CZ3 4.22Å; Y73-W84 AromaticContact CE2-CE3 3.58Å; Y73-W84 HydrophobicContact CE2-CE3 3.58Å; Y73-W84 HydrophobicContact CE2-CH2 4.44Å; Y73-W84 AromaticContact CE2-CZ3 3.4Å; Y73-W84 HydrophobicContact CE2-CZ3 3.4Å; Y73-W84 VanDerWaalsContact CE2-CZ3 3.4Å; Y73-W84 AromaticContact CG-CE3 3.66Å; Y73-W84 HydrophobicContact CG-CE3 3.66Å; Y73-W84 AromaticContact CG-CZ3 3.94Å; Y73-W84 HydrophobicContact CG-CZ3 3.94Å; Y73-W84 AromaticContact CZ-CE3 3.48Å; Y73-W84 VanDerWaalsContact CZ-CE3 3.48Å; Y73-W84 AromaticContact CZ-CZ3 3.78Å; Y73-R139 WeakPolarHBondContact CE1-O 3.45Å
74	V	98.7	Very high	95	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	121.1	174	171	0	0	0	0	108.6	Q72 V76 R82 L83 W163 Y166 V167	Q72-V74 HydrophobicContact CG-CG2 4.35Å; V74-V76 HydrophobicContact CG1-CG1 4.47Å; V74-R82 CarbonylContact O-C 3.53Å; V74-R82 WeakPolarHBondContact O-CA 3.3Å; V74-L83 PolarHBondContact N-O 3.35Å; V74-L83 PolarHBondContact O-N 3.18Å; V74-W163 HydrophobicContact CG1-CB 4.25Å; V74-W163 HydrophobicContact CG1-CG 4.12Å; V74-Y166 HydrophobicContact CB-CD1 4.32Å; V74-Y166 HydrophobicContact CG1-CD1 3.54Å; V74-Y166 HydrophobicContact CG1-CE1 4.34Å; V74-Y166 HydrophobicContact CG1-CG 3.8Å; V74-Y166 HydrophobicContact CG2-CD1 4.24Å; V74-V167 HydrophobicContact CG1-CG2 4.46Å; V74-V167 HydrophobicContact CG2-CG2 4.06Å
75	P	98.6	Very high	96.3	Very high	51 Å²	51	57.4 Å²	57.4	33%	0.331	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	139.6	178.9	30	-34.4	0	0	0	111.1	C81 Y166	P75-C81 WeakPolarHBondContact CA-O 3.41Å; P75-Y166 VanDerWaalsContact CD-CZ 3.5Å; P75-Y166 HydrophobicContact CG-CD2 3.59Å; P75-Y166 HydrophobicContact CG-CE1 4.46Å; P75-Y166 HydrophobicContact CG-CE2 3.29Å; P75-Y166 HydrophobicContact CG-CG 4.29Å
76	V	98.6	Very high	96.9	Very high	2 Å²	2	56.3 Å²	56.3	1%	0.012	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	168.3	179.8	-59.8	0	0	0	0	109.8	V74 N78 G79 T80 C81 L83 S159 D162 W163	V74-V76 HydrophobicContact CG1-CG1 4.47Å; V76-N78 PolarHBondContact O-N 2.85Å; V76-G79 PolarHBondContact O-N 3.2Å; V76-T80 PolarHBondContact O-N 3.1Å; V76-C81 HydrophobicContact CG2-CB 3.74Å; V76-C81 PolarHBondContact N-O 3.21Å; V76-C81 PolarHBondContact O-N 2.94Å; V76-C81 VanDerWaalsContact O-N 3.15Å; V76-L83 HydrophobicContact CG1-CD1 4.11Å; V76-L83 HydrophobicContact CG1-CG 3.88Å; V76-L83 HydrophobicContact CG2-CD2 4.26Å; V76-L83 HydrophobicContact CG2-CG 3.95Å; V76-S159 WeakPolarHBondContact CG1-O 3.47Å; V76-D162 HydrophobicContact CB-CB 3.85Å; V76-D162 HydrophobicContact CG1-CB 3.88Å; V76-W163 HydrophobicContact CG1-CB 4.07Å
77	L	97.4	Very high	97.2	Very high	30 Å²	30	47.7 Å²	47.7	16%	0.157	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.8	55.5	-179	-54.5	179.8	0	0	0	111.1	G79 T80 C81 L135 Q158 D162	L77-G79 PolarHBondContact O-N 3.39Å; L77-T80 WeakPolarHBondContact O-CB 3.05Å; L77-T80 WeakPolarHBondContact O-CG2 3.31Å; L77-T80 PolarHBondContact O-N 3.42Å; L77-T80 VanDerWaalsContact O-N 3.13Å; L77-T80 PolarHBondContact O-OG1 2.94Å; L77-C81 HydrophobicContact CB-CB 4.34Å; L77-C81 HydrophobicContact CD1-CB 4.12Å; L77-C81 HydrophobicContact CG-CB 4.44Å; L77-L135 HydrophobicContact CD1-CD2 3.82Å; L77-Q158 HydrophobicContact CD2-CB 4.08Å; L77-Q158 HydrophobicContact CD2-CG 3.76Å; L77-D162 WeakPolarHBondContact CA-OD2 3.3Å; L77-D162 PolarHBondContact N-OD2 2.88Å
78	N	95.5	Very high	97.4	Very high	165 Å²	165	47.4 Å²	47.4	88%	0.882	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.5	30.6	-176.2	-60	-27.9	0	0	0	114.2	V76 T80	V76-N78 PolarHBondContact O-N 2.85Å; N78-T80 VanDerWaalsContact C-N 3.26Å; N78-T80 PolarHBondContact O-N 3.22Å
79	G	96.5	Very high	97.6	Very high	54 Å²	54	44.1 Å²	44.1	56%	0.557	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.4	2.6	179.4	0	0	0	0	0	114.7	V76 L77 C81	V76-G79 PolarHBondContact O-N 3.2Å; L77-G79 PolarHBondContact O-N 3.39Å; G79-C81 VanDerWaalsContact C-N 3.27Å
80	T	97.6	Very high	97.6	Very high	110 Å²	110	43.8 Å²	43.8	68%	0.675	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-25.6	174	63.7	0	0	0	0	112.2	V76 L77 N78	V76-T80 PolarHBondContact O-N 3.1Å; L77-T80 WeakPolarHBondContact O-CB 3.05Å; L77-T80 WeakPolarHBondContact O-CG2 3.31Å; L77-T80 PolarHBondContact O-N 3.42Å; L77-T80 VanDerWaalsContact O-N 3.13Å; L77-T80 PolarHBondContact O-OG1 2.94Å; N78-T80 VanDerWaalsContact C-N 3.26Å; N78-T80 PolarHBondContact O-N 3.22Å
81	C	98.6	Very high	97.6	Very high	11 Å²	11	46.2 Å²	46.2	7%	0.074	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	166.6	177.9	-72.7	0	0	0	0	110.7	P75 V76 L77 G79 L135 S141	P75-C81 WeakPolarHBondContact CA-O 3.41Å; V76-C81 HydrophobicContact CG2-CB 3.74Å; V76-C81 PolarHBondContact N-O 3.21Å; V76-C81 PolarHBondContact O-N 2.94Å; V76-C81 VanDerWaalsContact O-N 3.15Å; L77-C81 HydrophobicContact CB-CB 4.34Å; L77-C81 HydrophobicContact CD1-CB 4.12Å; L77-C81 HydrophobicContact CG-CB 4.44Å; G79-C81 VanDerWaalsContact C-N 3.27Å; C81-L135 HydrophobicContact CB-CD1 3.98Å; C81-S141 WeakPolarHBondContact CA-OG 3.48Å
82	R	98.6	Very high	97.4	Very high	125 Å²	125	48.2 Å²	48.2	47%	0.472	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	139.8	173.8	59.4	-170.7	-173.5	-176.9	0.5	110.6	Y73 V74 S141	Y73-R82 HydrophobicContact CD1-CB 4.1Å; Y73-R82 VanDerWaalsContact CD1-CD 3.42Å; Y73-R82 HydrophobicContact CD1-CG 3.55Å; Y73-R82 HydrophobicContact CE1-CG 4.15Å; Y73-R82 HydrophobicContact CG-CG 4.18Å; V74-R82 CarbonylContact O-C 3.53Å; V74-R82 WeakPolarHBondContact O-CA 3.3Å; R82-S141 PolarHBondContact N-OG 2.92Å; R82-S141 PolarHBondContact O-N 3.21Å
83	L	98.8	Very high	97.3	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	129.3	170.9	-60	-172.3	0	0	0	110	Y73 V74 V76 I132 L135 S140 L160 W163	Y73-L83 WeakPolarHBondContact CA-O 3.26Å; V74-L83 PolarHBondContact N-O 3.35Å; V74-L83 PolarHBondContact O-N 3.18Å; V76-L83 HydrophobicContact CG1-CD1 4.11Å; V76-L83 HydrophobicContact CG1-CG 3.88Å; V76-L83 HydrophobicContact CG2-CD2 4.26Å; V76-L83 HydrophobicContact CG2-CG 3.95Å; L83-I132 HydrophobicContact CB-CG2 4.12Å; L83-I132 HydrophobicContact CD1-CG2 3.87Å; L83-L135 HydrophobicContact CD2-CB 3.94Å; L83-L135 HydrophobicContact CD2-CD1 3.96Å; L83-S140 VanDerWaalsContact CA-OG 3.31Å; L83-S140 WeakPolarHBondContact CA-OG 3.36Å; L83-L160 HydrophobicContact CD1-CD2 4.48Å; L83-W163 HydrophobicContact CD1-CB 3.97Å; L83-W163 HydrophobicContact CD1-CG 4.31Å
84	W	98.6	Very high	97	Very high	16 Å²	16	47.7 Å²	47.7	6%	0.061	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	125.7	169.2	-174	-117.2	0	0	0	109.4	E53 Q71 Y73 D133 R139 S140	E53-W84 PolarHBondContact OE1-NE1 3.23Å; Q71-W84 HydrophobicContact CB-CH2 3.66Å; Q71-W84 HydrophobicContact CB-CZ2 3.21Å; Q71-W84 HydrophobicContact CG-CZ2 4.05Å; Y73-W84 HydrophobicContact CD1-CB 4.35Å; Y73-W84 AromaticContact CD1-CE3 3.57Å; Y73-W84 HydrophobicContact CD1-CE3 3.57Å; Y73-W84 HydrophobicContact CD1-CZ3 4.28Å; Y73-W84 AromaticContact CD2-CE3 3.68Å; Y73-W84 HydrophobicContact CD2-CE3 3.68Å; Y73-W84 AromaticContact CD2-CZ3 3.5Å; Y73-W84 HydrophobicContact CD2-CZ3 3.5Å; Y73-W84 VanDerWaalsContact CD2-CZ3 3.5Å; Y73-W84 HydrophobicContact CE1-CB 4.1Å; Y73-W84 HydrophobicContact CE1-CD2 4.21Å; Y73-W84 AromaticContact CE1-CE3 3.49Å; Y73-W84 HydrophobicContact CE1-CE3 3.49Å; Y73-W84 VanDerWaalsContact CE1-CE3 3.49Å; Y73-W84 HydrophobicContact CE1-CZ3 4.22Å; Y73-W84 AromaticContact CE2-CE3 3.58Å; Y73-W84 HydrophobicContact CE2-CE3 3.58Å; Y73-W84 HydrophobicContact CE2-CH2 4.44Å; Y73-W84 AromaticContact CE2-CZ3 3.4Å; Y73-W84 HydrophobicContact CE2-CZ3 3.4Å; Y73-W84 VanDerWaalsContact CE2-CZ3 3.4Å; Y73-W84 AromaticContact CG-CE3 3.66Å; Y73-W84 HydrophobicContact CG-CE3 3.66Å; Y73-W84 AromaticContact CG-CZ3 3.94Å; Y73-W84 HydrophobicContact CG-CZ3 3.94Å; Y73-W84 AromaticContact CZ-CE3 3.48Å; Y73-W84 VanDerWaalsContact CZ-CE3 3.48Å; Y73-W84 AromaticContact CZ-CZ3 3.78Å; W84-D133 HydrophobicContact CB-CB 4.05Å; W84-D133 PolarHBondContact O-N 3.12Å; W84-R139 HydrophobicContact CB-CB 3.77Å; W84-R139 HydrophobicContact CD2-CB 4.26Å; W84-R139 HydrophobicContact CG-CB 3.68Å; W84-R139 VanDerWaalsContact CZ2-CZ 3.43Å; W84-S140 PolarHBondContact N-OG 3.07Å
85	T	98.7	Very high	96.7	Very high	0 Å²	0	56 Å²	56	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	118.7	-172	-55.4	0	0	0	0	109.4	Q71 Q72 V87 Y130 I132 W163	Q71-T85 VanDerWaalsContact CA-O 3.32Å; Q71-T85 WeakPolarHBondContact CA-O 3.37Å; Q72-T85 PolarHBondContact N-O 3.33Å; Q72-T85 PolarHBondContact O-N 3.22Å; T85-V87 HydrophobicContact CG2-CG2 4.17Å; T85-Y130 HydrophobicContact CG2-CD1 3.92Å; T85-I132 HydrophobicContact CG2-CG1 4.48Å; T85-W163 HydrophobicContact CG2-CZ2 3.9Å; T85-W163 PolarHBondContact OG1-NE1 3.48Å
86	T	98.1	Very high	96.5	Very high	0 Å²	0	57 Å²	57	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	124.7	168.3	-61.9	0	0	0	0	108.6	L57 V69 Q71 V88 F120 Y130 A131	L57-T86 HydrophobicContact CD1-CG2 4.07Å; V69-T86 HydrophobicContact CG1-CG2 3.68Å; Q71-T86 HydrophobicContact CG-CG2 4.19Å; Q71-T86 PolarHBondContact NE2-OG1 3.24Å; Q71-T86 VanDerWaalsContact NE2-OG1 3.12Å; T86-V88 HydrophobicContact CG2-CG2 4.02Å; T86-F120 HydrophobicContact CG2-CE2 4.24Å; T86-F120 HydrophobicContact CG2-CZ 4.23Å; T86-Y130 CarbonylContact O-C 3.56Å; T86-Y130 WeakPolarHBondContact O-CA 3.34Å; T86-A131 PolarHBondContact N-O 2.77Å; T86-A131 PolarHBondContact O-N 3.04Å
87	V	98.1	Very high	96.3	Very high	2 Å²	2	57.8 Å²	57.8	1%	0.012	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	124.9	176.1	-166.6	0	0	0	0	108.5	V69 R70 T85 V128 V129 Y130	V69-V87 WeakPolarHBondContact CA-O 3.35Å; R70-V87 HydrophobicContact CG-CB 3.66Å; R70-V87 HydrophobicContact CG-CG2 4.12Å; R70-V87 PolarHBondContact N-O 2.83Å; R70-V87 PolarHBondContact O-N 3.35Å; T85-V87 HydrophobicContact CG2-CG2 4.17Å; V87-V128 HydrophobicContact CG1-CG1 3.51Å; V87-V129 CarbonylContact C-O 3.56Å; V87-V129 WeakPolarHBondContact CA-O 3.46Å; V87-Y130 HydrophobicContact CB-CD1 4.28Å; V87-Y130 HydrophobicContact CB-CE1 4.25Å; V87-Y130 HydrophobicContact CG1-CD1 3.98Å; V87-Y130 HydrophobicContact CG1-CE1 3.65Å; V87-Y130 HydrophobicContact CG2-CD1 3.69Å; V87-Y130 HydrophobicContact CG2-CE1 3.66Å
88	V	97.3	Very high	96	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	131.6	-179.5	-171.1	0	0	0	0	109	F68 V69 T86 F120 A124 V129	F68-V88 VanDerWaalsContact O-CA 3.31Å; F68-V88 WeakPolarHBondContact O-CA 3.37Å; V69-V88 HydrophobicContact CG2-CG1 4.38Å; V69-V88 HydrophobicContact CG2-CG2 4.33Å; T86-V88 HydrophobicContact CG2-CG2 4.02Å; V88-F120 HydrophobicContact CG1-CB 4.01Å; V88-F120 HydrophobicContact CG1-CG 4.35Å; V88-F120 HydrophobicContact CG2-CB 4.35Å; V88-F120 HydrophobicContact CG2-CD1 3.94Å; V88-F120 HydrophobicContact CG2-CD2 3.8Å; V88-F120 HydrophobicContact CG2-CE1 4.12Å; V88-F120 HydrophobicContact CG2-CE2 4.01Å; V88-F120 HydrophobicContact CG2-CG 3.78Å; V88-F120 HydrophobicContact CG2-CZ 4.17Å; V88-A124 HydrophobicContact CB-CB 4.13Å; V88-A124 HydrophobicContact CG1-CB 3.57Å; V88-V129 HydrophobicContact CB-CB 4.25Å; V88-V129 PolarHBondContact N-O 3.03Å; V88-V129 PolarHBondContact O-N 3.38Å
89	S	96.8	Very high	95.9	Very high	26 Å²	26	58.4 Å²	58.4	18%	0.182	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	148.5	179.4	57.4	0	0	0	0	112.8	S67 F68 Y97	S67-S89 CarbonylContact C-O 3.47Å; S67-S89 WeakPolarHBondContact CA-O 3.21Å; S67-S89 WeakPolarHBondContact CB-O 3.24Å; F68-S89 PolarHBondContact N-O 2.8Å; F68-S89 PolarHBondContact O-N 2.88Å; S89-Y97 WeakPolarHBondContact CA-OH 3.44Å
90	S	96.2	Very high	95.8	Very high	25 Å²	25	60.4 Å²	60.4	18%	0.175	34%	0.34	C	S	.	.			trans	-55.2	141.2	171	-177.7	0	0	0	0	111.7	S92 Y97 A124	S90-S92 VanDerWaalsContact C-N 3.3Å; S90-S92 VanDerWaalsContact OG-C 3.23Å; S90-S92 PolarHBondContact OG-N 2.92Å; S90-S92 VanDerWaalsContact OG-N 3.08Å; S90-S92 PolarHBondContact OG-O 3Å; S90-Y97 PolarHBondContact N-OH 3.02Å; S90-A124 WeakPolarHBondContact CB-O 3.12Å; S90-A124 PolarHBondContact N-O 2.82Å
91	R	93.6	Very high	95.7	Very high	161 Å²	161	56.9 Å²	56.9	61%	0.608	32%	0.319	S	S	*	.	S	Bend	trans	-78.9	-16.6	169.5	-67	-176.8	-168.4	-99.3	-2	112.8	R66 S67 F68	R66-R91 WeakPolarHBondContact O-CD 3.34Å; R66-R91 VanDerWaalsContact O-CG 3.23Å; R66-R91 WeakPolarHBondContact O-CG 3.38Å; R66-R91 PolarHBondContact O-NE 3.03Å; S67-R91 PolarHBondContact O-NH2 3.36Å; S67-R91 VanDerWaalsContact O-NH2 3.16Å; F68-R91 HydrophobicContact CB-CG 4.39Å
92	S	93.8	Very high	95.7	Very high	104 Å²	104	57.2 Å²	57.2	73%	0.727	32%	0.321	S	S	*	.	S	Bend	trans	-131.4	68.8	178.3	-56.2	0	0	0	0	108.7	S90	S90-S92 VanDerWaalsContact C-N 3.3Å; S90-S92 VanDerWaalsContact OG-C 3.23Å; S90-S92 PolarHBondContact OG-N 2.92Å; S90-S92 VanDerWaalsContact OG-N 3.08Å; S90-S92 PolarHBondContact OG-O 3Å
93	P	93.7	Very high	95.7	Very high	74 Å²	74	51.3 Å²	51.3	48%	0.481	30%	0.298	S	S	.	.			trans	-66.8	138.3	179.4	28.9	-34.1	0	0	0	110.5	Y97	P93-Y97 HydrophobicContact CB-CD1 3.78Å; P93-Y97 HydrophobicContact CB-CD2 3.85Å; P93-Y97 HydrophobicContact CB-CE1 4.41Å; P93-Y97 HydrophobicContact CB-CE2 4.43Å; P93-Y97 HydrophobicContact CB-CG 3.48Å; P93-Y97 VanDerWaalsContact CB-CG 3.48Å
94	G	93.1	Very high	95.7	Very high	46 Å²	46	51.3 Å²	51.3	47%	0.474	30%	0.299	S	S	.	.			trans	-75.2	172.2	168.5	0	0	0	0	0	112.3	D96 Y97	G94-D96 VanDerWaalsContact C-N 3.26Å; G94-D96 PolarHBondContact O-N 3.1Å; G94-Y97 WeakPolarHBondContact O-CB 3.39Å; G94-Y97 PolarHBondContact O-N 2.9Å
95	D	93.1	Very high	95.7	Very high	174 Å²	174	50.6 Å²	50.6	93%	0.93	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-32.4	-173.3	-64.4	-23.3	0	0	0	113.9
96	D	93.3	Very high	95.7	Very high	72 Å²	72	50.6 Å²	50.6	39%	0.385	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	2.6	-179.5	73.6	-12.5	0	0	0	114	G94 S98 S99 R100	G94-D96 VanDerWaalsContact C-N 3.26Å; G94-D96 PolarHBondContact O-N 3.1Å; D96-S98 VanDerWaalsContact C-N 3.32Å; D96-S98 PolarHBondContact O-N 3.26Å; D96-S99 PolarHBondContact O-N 3.36Å; D96-S99 PolarHBondContact O-OG 2.85Å; D96-R100 VanDerWaalsContact CG-NE 3.25Å; D96-R100 WeakPolarHBondContact O-CG 3.27Å; D96-R100 PolarHBondContact O-N 3.23Å; D96-R100 IonicContact OD1-NE 3.7Å; D96-R100 PolarHBondContact OD1-NE 3.15Å; D96-R100 IonicContact OD1-NH2 3.95Å; D96-R100 IonicContact OD2-CZ 3.16Å; D96-R100 IonicContact OD2-NE 3.74Å; D96-R100 PolarHBondContact OD2-NE 2.97Å; D96-R100 IonicContact OD2-NH2 2.69Å; D96-R100 PolarHBondContact OD2-NH2 3.32Å
97	Y	95.2	Very high	95.7	Very high	18 Å²	18	50.6 Å²	50.6	7%	0.071	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-39.4	-171.6	-174.8	-83.3	0	0	0	113.1	S89 S90 P93 G94 S99 A124 H126 R127 V128	S89-Y97 WeakPolarHBondContact CA-OH 3.44Å; S90-Y97 PolarHBondContact N-OH 3.02Å; P93-Y97 HydrophobicContact CB-CD1 3.78Å; P93-Y97 HydrophobicContact CB-CD2 3.85Å; P93-Y97 HydrophobicContact CB-CE1 4.41Å; P93-Y97 HydrophobicContact CB-CE2 4.43Å; P93-Y97 HydrophobicContact CB-CG 3.48Å; P93-Y97 VanDerWaalsContact CB-CG 3.48Å; G94-Y97 WeakPolarHBondContact O-CB 3.39Å; G94-Y97 PolarHBondContact O-N 2.9Å; Y97-S99 VanDerWaalsContact C-N 3.34Å; Y97-A124 WeakPolarHBondContact CE2-O 3.36Å; Y97-A124 PolarHBondContact OH-O 3.29Å; Y97-H126 VanDerWaalsContact CD2-C 3.4Å; Y97-R127 PolarHBondContact OH-O 3.02Å; Y97-V128 HydrophobicContact CE1-CG2 3.76Å; Y97-V128 PolarHBondContact OH-N 2.97Å
98	S	91.6	Very high	95.7	Very high	112 Å²	112	50.8 Å²	50.8	78%	0.783	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-20.9	-178.1	59.9	0	0	0	0	113.4	D96	D96-S98 VanDerWaalsContact C-N 3.32Å; D96-S98 PolarHBondContact O-N 3.26Å
99	S	92.1	Very high	95.5	Very high	96 Å²	96	53.9 Å²	53.9	67%	0.671	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-15.3	178	64.9	0	0	0	0	112.9	D96 Y97	D96-S99 PolarHBondContact O-N 3.36Å; D96-S99 PolarHBondContact O-OG 2.85Å; Y97-S99 VanDerWaalsContact C-N 3.34Å
100	R	94.7	Very high	95.1	Very high	97 Å²	97	53 Å²	53	37%	0.366	31%	0.309	S	S	.	.	S	Bend	trans	-68.4	134.5	175.5	-76	173	178.5	-85.8	-2	111.3	D96 H126 R127	D96-R100 VanDerWaalsContact CG-NE 3.25Å; D96-R100 WeakPolarHBondContact O-CG 3.27Å; D96-R100 PolarHBondContact O-N 3.23Å; D96-R100 IonicContact OD1-NE 3.7Å; D96-R100 PolarHBondContact OD1-NE 3.15Å; D96-R100 IonicContact OD1-NH2 3.95Å; D96-R100 IonicContact OD2-CZ 3.16Å; D96-R100 IonicContact OD2-NE 3.74Å; D96-R100 PolarHBondContact OD2-NE 2.97Å; D96-R100 IonicContact OD2-NH2 2.69Å; D96-R100 PolarHBondContact OD2-NH2 3.32Å; R100-H126 WeakPolarHBondContact CD-O 3.32Å; R100-R127 HydrophobicContact CB-CB 4.15Å
101	T	96.4	Very high	94.9	Very high	36 Å²	36	52 Å²	52	22%	0.221	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-57.4	125.1	178.2	-53.7	0	0	0	0	110.5	K171 N196	T101-K171 HydrophobicContact CG2-CB 4.3Å; T101-N196 HydrophobicContact CG2-CB 4.02Å
102	P	97.9	Very high	95.1	Very high	18 Å²	18	44.3 Å²	44.3	12%	0.117	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-67	152.9	-179.9	28.2	-35.9	0	0	0	111.8	V128 Y130 L169 K171 I172 T173	P102-V128 VanDerWaalsContact CA-O 3.28Å; P102-V128 WeakPolarHBondContact CA-O 3.46Å; P102-V128 HydrophobicContact CB-CB 4.39Å; P102-V128 WeakPolarHBondContact CB-O 3.34Å; P102-Y130 HydrophobicContact CB-CD2 3.96Å; P102-Y130 HydrophobicContact CB-CE2 3.68Å; P102-Y130 HydrophobicContact CG-CE2 4.33Å; P102-L169 HydrophobicContact CG-CD1 3.94Å; P102-L169 HydrophobicContact CG-CD2 4.08Å; P102-L169 HydrophobicContact CG-CG 4.47Å; P102-K171 WeakPolarHBondContact CD-O 3.44Å; P102-I172 HydrophobicContact CG-CG2 4.27Å; P102-T173 PolarHBondContact O-N 3.08Å
103	L	98.5	Very high	95.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	131.5	175.7	179.7	64.4	0	0	0	109.8	L105 L123 R127 V128 V129 Y130 T173 L175 I370 L374	L103-L105 HydrophobicContact CD1-CD2 4.32Å; L103-L105 HydrophobicContact CD2-CD2 3.73Å; L103-L105 HydrophobicContact CG-CD2 3.68Å; L103-L123 HydrophobicContact CD2-CB 4.11Å; L103-L123 HydrophobicContact CD2-CD1 3.83Å; L103-L123 HydrophobicContact CD2-CD2 4.28Å; L103-L123 HydrophobicContact CD2-CG 4.3Å; L103-R127 HydrophobicContact CB-CG 4.43Å; L103-V128 PolarHBondContact N-O 3.43Å; L103-V129 HydrophobicContact CB-CG2 4.3Å; L103-V129 HydrophobicContact CD2-CG2 4.44Å; L103-V129 CarbonylContact O-C 3.51Å; L103-V129 VanDerWaalsContact O-CA 3.31Å; L103-V129 WeakPolarHBondContact O-CA 3.43Å; L103-Y130 PolarHBondContact O-N 3.26Å; L103-T173 HydrophobicContact CD1-CG2 3.73Å; L103-L175 HydrophobicContact CD1-CB 3.87Å; L103-I370 HydrophobicContact CD2-CG2 4.25Å; L103-L374 HydrophobicContact CD1-CD2 4.39Å; L103-L374 HydrophobicContact CD2-CD1 4.21Å
104	V	98.9	Very high	95.3	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.006	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	120.2	180	-179	0	0	0	0	109.1	L106 Y130 I132 W163 I172 T173 L174 L175	V104-L106 HydrophobicContact CG1-CD2 4.13Å; V104-Y130 CarbonylContact C-O 3.56Å; V104-Y130 VanDerWaalsContact CA-O 3.29Å; V104-Y130 WeakPolarHBondContact CA-O 3.47Å; V104-Y130 HydrophobicContact CG2-CD2 4.4Å; V104-I132 HydrophobicContact CG1-CD1 3.49Å; V104-I132 VanDerWaalsContact CG1-CD1 3.49Å; V104-I132 HydrophobicContact CG1-CG1 4.16Å; V104-W163 HydrophobicContact CG1-CH2 4.18Å; V104-W163 HydrophobicContact CG1-CZ3 4.16Å; V104-W163 HydrophobicContact CG2-CH2 3.74Å; V104-W163 HydrophobicContact CG2-CZ3 3.85Å; V104-I172 HydrophobicContact CG2-CB 3.91Å; V104-I172 HydrophobicContact CG2-CD1 4.19Å; V104-I172 HydrophobicContact CG2-CG2 3.94Å; V104-T173 PolarHBondContact N-O 2.98Å; V104-L174 HydrophobicContact CB-CD2 4.01Å; V104-L174 HydrophobicContact CG1-CD2 4.07Å; V104-L175 PolarHBondContact O-N 3.31Å
105	L	98.9	Very high	95.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	123.3	-174.6	-49	-173.9	0	0	0	110.5	L103 W116 F120 L123 V129 Y130 A131 I132 L175	L103-L105 HydrophobicContact CD1-CD2 4.32Å; L103-L105 HydrophobicContact CD2-CD2 3.73Å; L103-L105 HydrophobicContact CG-CD2 3.68Å; L105-W116 HydrophobicContact CB-CD2 4.17Å; L105-W116 HydrophobicContact CB-CG 4.08Å; L105-W116 HydrophobicContact CD1-CB 3.68Å; L105-W116 HydrophobicContact CD1-CD2 3.92Å; L105-W116 HydrophobicContact CD1-CE3 4.28Å; L105-W116 HydrophobicContact CD1-CG 3.66Å; L105-F120 HydrophobicContact CD1-CD1 4.37Å; L105-F120 HydrophobicContact CD1-CE1 4.07Å; L105-L123 HydrophobicContact CD1-CD1 4.45Å; L105-L123 HydrophobicContact CD2-CD1 4.43Å; L105-V129 HydrophobicContact CD1-CG1 3.54Å; L105-V129 HydrophobicContact CD2-CG1 4.41Å; L105-V129 HydrophobicContact CG-CG1 3.73Å; L105-Y130 PolarHBondContact N-O 3.25Å; L105-A131 HydrophobicContact CB-CB 4.17Å; L105-A131 HydrophobicContact CD1-CB 4.39Å; L105-I132 PolarHBondContact O-N 2.82Å; L105-L175 CarbonylContact C-O 3.56Å; L105-L175 WeakPolarHBondContact CA-O 3.28Å; L105-L175 HydrophobicContact CD2-CB 3.74Å; L105-L175 HydrophobicContact CD2-CD2 3.65Å; L105-L175 HydrophobicContact CD2-CG 3.98Å
106	L	98.9	Very high	95.7	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	119.7	176.3	-51.9	-172.7	0	0	0	109.8	V104 I132 V134 L160 L174 L175 H177 I183 A184	V104-L106 HydrophobicContact CG1-CD2 4.13Å; L106-I132 HydrophobicContact CD2-CB 4.11Å; L106-I132 HydrophobicContact CD2-CD1 4.18Å; L106-V134 HydrophobicContact CB-CG1 4.1Å; L106-V134 HydrophobicContact CD2-CG1 4.04Å; L106-V134 HydrophobicContact CG-CG1 4.49Å; L106-L160 HydrophobicContact CD1-CD1 3.67Å; L106-L160 HydrophobicContact CD2-CD2 3.91Å; L106-L174 HydrophobicContact CD1-CD2 4.42Å; L106-L175 PolarHBondContact N-O 3.31Å; L106-H177 PolarHBondContact O-N 2.78Å; L106-I183 HydrophobicContact CD1-CB 4.48Å; L106-I183 HydrophobicContact CD1-CG2 4.13Å; L106-A184 HydrophobicContact CD1-CB 3.96Å
107	H	98.6	Very high	95.7	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.005	14%	0.135	C	C	.	.			trans	-75.9	163.4	-179.6	68.3	74.6	0	0	0	112.7	G111 I132 D133 V134 F137 G180	H107-G111 VanDerWaalsContact CE1-C 3.48Å; H107-G111 PolarHBondContact CE1-O 2.81Å; H107-G111 WeakPolarHBondContact ND1-CA 3.21Å; H107-G111 PolarHBondContact ND1-O 2.78Å; H107-I132 PolarHBondContact CD2-O 3.02Å; H107-I132 VanDerWaalsContact CD2-O 3.28Å; H107-D133 WeakPolarHBondContact NE2-CA 3.29Å; H107-V134 PolarHBondContact NE2-N 3.19Å; H107-F137 VanDerWaalsContact CE1-CB 3.46Å; H107-F137 WeakPolarHBondContact CE1-CB 3.49Å; H107-F137 AromaticContact CE1-CG 3.93Å; H107-G180 WeakPolarHBondContact O-CA 3.11Å; H107-G180 PolarHBondContact O-N 2.84Å
108	G	96.7	Very high	95.7	Very high	6 Å²	6	26.4 Å²	26.4	6%	0.062	15%	0.149	C	C	.	.			trans	-79.5	-177.9	174.5	0	0	0	0	0	114.5	G110 G111 H177	G108-G110 PolarHBondContact O-N 3.26Å; G108-G111 PolarHBondContact O-N 2.85Å; G108-G111 VanDerWaalsContact O-N 3.09Å; G108-H177 VanDerWaalsContact CA-O 3.26Å; G108-H177 WeakPolarHBondContact CA-O 3.42Å; G108-H177 PolarHBondContact N-O 3.06Å
109	L	93.9	Very high	96	Very high	65 Å²	65	21 Å²	21	34%	0.34	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	130.5	179.8	-178.4	68.7	0	0	0	111.9	G111 F137 L179 L238 F291	L109-G111 PolarHBondContact O-N 2.9Å; L109-F137 HydrophobicContact CD1-CE1 3.66Å; L109-F137 HydrophobicContact CD1-CZ 3.56Å; L109-L179 HydrophobicContact CB-CB 4.45Å; L109-L179 HydrophobicContact CB-CD2 4.27Å; L109-L179 HydrophobicContact CD1-CD2 4.1Å; L109-L238 HydrophobicContact CG-CD1 4.42Å; L109-F291 HydrophobicContact CD1-CB 3.93Å; L109-F291 HydrophobicContact CD1-CD1 4.12Å; L109-F291 HydrophobicContact CD1-CD2 4.29Å; L109-F291 HydrophobicContact CD1-CG 3.85Å; L109-F291 HydrophobicContact CD2-CD1 3.85Å; L109-F291 HydrophobicContact CD2-CE1 3.81Å; L109-F291 HydrophobicContact CD2-CG 4.32Å; L109-F291 HydrophobicContact CD2-CZ 4.23Å
110	G	88.8	Confident	96.2	Very high	6 Å²	6	16.5 Å²	16.5	6%	0.062	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.3	9	178.3	0	0	0	0	0	115.2	G108 N281	G108-G110 PolarHBondContact O-N 3.26Å; G110-N281 WeakPolarHBondContact CA-OD1 3.45Å; G110-N281 PolarHBondContact O-ND2 3.26Å
111	G	91.8	Very high	96.2	Very high	4 Å²	4	13.3 Å²	13.3	4%	0.041	7%	0.07	C	C	.	.			trans	-84.9	-175.2	175.4	0	0	0	0	0	114.1	H107 G108 L109	H107-G111 VanDerWaalsContact CE1-C 3.48Å; H107-G111 PolarHBondContact CE1-O 2.81Å; H107-G111 WeakPolarHBondContact ND1-CA 3.21Å; H107-G111 PolarHBondContact ND1-O 2.78Å; G108-G111 PolarHBondContact O-N 2.85Å; G108-G111 VanDerWaalsContact O-N 3.09Å; L109-G111 PolarHBondContact O-N 2.9Å
112	G	96.7	Very high	96.2	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.071	C	C	.	.			trans	-149.1	165.2	164.8	0	0	0	0	0	108.8	A114 L115 Y276	G112-A114 PolarHBondContact O-N 2.93Å; G112-L115 WeakPolarHBondContact O-CB 3.47Å; G112-L115 PolarHBondContact O-N 2.76Å; G112-L115 VanDerWaalsContact O-N 3.07Å; G112-Y276 WeakPolarHBondContact CA-OH 3.46Å
113	G	97	Very high	96.2	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.066	C	C	.	.	G	3₁₀ helix	trans	-59.4	-27.6	-175.5	0	0	0	0	0	113.3	L115 W116 F120 D133	G113-L115 PolarHBondContact O-N 2.98Å; G113-W116 WeakPolarHBondContact O-CB 3.27Å; G113-W116 PolarHBondContact O-N 3.3Å; G113-F120 WeakPolarHBondContact O-CZ 3.22Å; G113-D133 WeakPolarHBondContact CA-OD1 3.27Å; G113-D133 PolarHBondContact N-OD1 3.3Å
114	A	95.7	Very high	96.1	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.066	C	C	.	.	G	3₁₀ helix	trans	-65	-19.9	177.2	0	0	0	0	0	113.4	E53 L56 L57 G112 W116 M117 Y276	E53-A114 HydrophobicContact CG-CB 4.09Å; L56-A114 HydrophobicContact CD1-CB 4.41Å; L57-A114 HydrophobicContact CD1-CB 3.7Å; L57-A114 HydrophobicContact CD2-CB 4.13Å; L57-A114 HydrophobicContact CG-CB 3.9Å; G112-A114 PolarHBondContact O-N 2.93Å; A114-W116 PolarHBondContact O-N 2.79Å; A114-W116 VanDerWaalsContact O-N 3.1Å; A114-M117 VanDerWaalsContact O-CB 3.27Å; A114-M117 WeakPolarHBondContact O-CB 3.41Å; A114-M117 WeakPolarHBondContact O-CG 3.31Å; A114-M117 PolarHBondContact O-N 2.83Å; A114-Y276 HydrophobicContact CB-CE1 3.75Å; A114-Y276 HydrophobicContact CB-CE2 4.13Å; A114-Y276 VanDerWaalsContact CB-CZ 3.5Å; A114-Y276 WeakPolarHBondContact CB-OH 3.39Å; A114-Y276 PolarHBondContact N-OH 3.06Å
115	L	96.5	Very high	96	Very high	11 Å²	11	13.9 Å²	13.9	6%	0.058	8%	0.08	C	C	.	.	G	3₁₀ helix	trans	-64	-15.6	175.9	-63.7	-176.6	0	0	0	113.1	G112 G113 M117 F263 Y276 I277 Y359	G112-L115 WeakPolarHBondContact O-CB 3.47Å; G112-L115 PolarHBondContact O-N 2.76Å; G112-L115 VanDerWaalsContact O-N 3.07Å; G113-L115 PolarHBondContact O-N 2.98Å; L115-M117 PolarHBondContact O-N 3.5Å; L115-F263 HydrophobicContact CB-CZ 4.32Å; L115-F263 HydrophobicContact CD2-CZ 3.91Å; L115-F263 VanDerWaalsContact O-CE1 3.27Å; L115-F263 WeakPolarHBondContact O-CE1 3.49Å; L115-Y276 HydrophobicContact CD2-CD1 4.02Å; L115-Y276 HydrophobicContact CD2-CE1 4.12Å; L115-Y276 HydrophobicContact CG-CE1 4.14Å; L115-I277 HydrophobicContact CD2-CD1 4.23Å; L115-I277 HydrophobicContact CD2-CG1 4.07Å; L115-Y359 HydrophobicContact CB-CE2 4.36Å; L115-Y359 WeakPolarHBondContact O-CE2 3.48Å
116	W	97.4	Very high	95.8	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.008	10%	0.102	C	C	.	.	G	3₁₀ helix	trans	-82.6	5.7	173.7	-66.4	107.3	0	0	0	114	L105 G113 A114 R118 N119 F120 L175 H177 Y359 F366	L105-W116 HydrophobicContact CB-CD2 4.17Å; L105-W116 HydrophobicContact CB-CG 4.08Å; L105-W116 HydrophobicContact CD1-CB 3.68Å; L105-W116 HydrophobicContact CD1-CD2 3.92Å; L105-W116 HydrophobicContact CD1-CE3 4.28Å; L105-W116 HydrophobicContact CD1-CG 3.66Å; G113-W116 WeakPolarHBondContact O-CB 3.27Å; G113-W116 PolarHBondContact O-N 3.3Å; A114-W116 PolarHBondContact O-N 2.79Å; A114-W116 VanDerWaalsContact O-N 3.1Å; W116-R118 PolarHBondContact O-N 2.79Å; W116-R118 VanDerWaalsContact O-N 3.1Å; W116-N119 HydrophobicContact CE3-CB 4.44Å; W116-N119 WeakPolarHBondContact O-CA 3.42Å; W116-N119 WeakPolarHBondContact O-CB 3.2Å; W116-N119 PolarHBondContact O-N 2.88Å; W116-N119 PolarHBondContact O-OD1 3Å; W116-F120 HydrophobicContact CB-CD1 4.03Å; W116-F120 HydrophobicContact CB-CE1 3.4Å; W116-F120 VanDerWaalsContact CB-CE1 3.4Å; W116-F120 HydrophobicContact CB-CZ 4Å; W116-F120 VanDerWaalsContact O-CD1 3.27Å; W116-F120 WeakPolarHBondContact O-CD1 3.07Å; W116-F120 PolarHBondContact O-N 3.36Å; W116-L175 HydrophobicContact CH2-CD2 4.28Å; W116-L175 HydrophobicContact CH2-CG 4.13Å; W116-L175 HydrophobicContact CZ3-CD2 4.15Å; W116-L175 HydrophobicContact CZ3-CG 4.5Å; W116-H177 HydrophobicContact CH2-CB 3.81Å; W116-H177 HydrophobicContact CZ2-CB 3.61Å; W116-Y359 AromaticContact CE3-CD2 3.96Å; W116-Y359 HydrophobicContact CE3-CD2 3.96Å; W116-Y359 AromaticContact CE3-CG 3.97Å; W116-Y359 HydrophobicContact CE3-CG 3.97Å; W116-Y359 HydrophobicContact CH2-CD1 4.22Å; W116-Y359 HydrophobicContact CH2-CG 4.17Å; W116-Y359 HydrophobicContact CZ3-CD1 4.15Å; W116-Y359 HydrophobicContact CZ3-CD2 4.12Å; W116-Y359 AromaticContact CZ3-CG 3.64Å; W116-Y359 HydrophobicContact CZ3-CG 3.64Å; W116-F366 HydrophobicContact CH2-CZ 4.46Å; W116-F366 AromaticContact CZ3-CE1 3.89Å; W116-F366 HydrophobicContact CZ3-CE1 3.89Å; W116-F366 AromaticContact CZ3-CZ 4Å; W116-F366 HydrophobicContact CZ3-CZ 4Å
117	M	94.6	Very high	95.7	Very high	6 Å²	6	19.5 Å²	19.5	3%	0.03	11%	0.105	C	C	.	.	H	α-helix	trans	-53.9	-33.1	-175	54.4	156.5	-77.6	0	0	115	L57 L63 A114 L115 N119 F120 F263 F264 I273	L57-M117 HydrophobicContact CD2-CB 4.02Å; L63-M117 HydrophobicContact CD1-CE 3.13Å; L63-M117 HydrophobicContact CD1-SD 3.61Å; L63-M117 HydrophobicContact CD2-CE 3.39Å; L63-M117 HydrophobicContact CG-CE 3.85Å; A114-M117 VanDerWaalsContact O-CB 3.27Å; A114-M117 WeakPolarHBondContact O-CB 3.41Å; A114-M117 WeakPolarHBondContact O-CG 3.31Å; A114-M117 PolarHBondContact O-N 2.83Å; L115-M117 PolarHBondContact O-N 3.5Å; M117-N119 PolarHBondContact O-N 3.18Å; M117-F120 HydrophobicContact CB-CD2 4.35Å; M117-F120 HydrophobicContact CB-CE2 4.43Å; M117-F263 HydrophobicContact CE-CD1 4.34Å; M117-F263 HydrophobicContact CG-CD1 3.87Å; M117-F263 HydrophobicContact CG-CE1 3.95Å; M117-F263 HydrophobicContact SD-CD1 3.82Å; M117-F263 HydrophobicContact SD-CE1 4.39Å; M117-F264 HydrophobicContact CE-CE1 4.25Å; M117-F264 HydrophobicContact CE-CZ 3.98Å; M117-F264 HydrophobicContact SD-CE2 4.49Å; M117-F264 HydrophobicContact SD-CZ 4.17Å; M117-I273 HydrophobicContact SD-CD1 4.28Å
118	R	95	Very high	95.6	Very high	93 Å²	93	21 Å²	21	35%	0.351	12%	0.115	S	C	.	.	H	α-helix	trans	-70.6	-10.4	177.3	-70.2	-69.3	-58.9	-114.1	-3.7	113.2	W116 F263 T360 A363 N367	W116-R118 PolarHBondContact O-N 2.79Å; W116-R118 VanDerWaalsContact O-N 3.1Å; R118-F263 HydrophobicContact CG-CD1 3.92Å; R118-F263 HydrophobicContact CG-CE1 4.45Å; R118-F263 PolarHBondContact NH1-O 2.96Å; R118-T360 HydrophobicContact CB-CG2 4.34Å; R118-T360 HydrophobicContact CG-CG2 4.18Å; R118-A363 HydrophobicContact CB-CB 3.94Å; R118-N367 PolarHBondContact O-ND2 3.39Å
119	N	97.5	Very high	95.7	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-110.9	-20.8	-175.4	-47.7	98.8	0	0	0	112	W116 M117 D121 A122 L123 Y359 F366 N367	W116-N119 HydrophobicContact CE3-CB 4.44Å; W116-N119 WeakPolarHBondContact O-CA 3.42Å; W116-N119 WeakPolarHBondContact O-CB 3.2Å; W116-N119 PolarHBondContact O-N 2.88Å; W116-N119 PolarHBondContact O-OD1 3Å; M117-N119 PolarHBondContact O-N 3.18Å; N119-D121 PolarHBondContact O-N 2.81Å; N119-A122 PolarHBondContact O-N 2.83Å; N119-L123 HydrophobicContact CB-CD1 3.67Å; N119-L123 HydrophobicContact CB-CG 4.23Å; N119-L123 WeakPolarHBondContact O-CB 3.32Å; N119-L123 WeakPolarHBondContact O-CG 3.46Å; N119-L123 PolarHBondContact O-N 3.29Å; N119-Y359 PolarHBondContact ND2-O 2.81Å; N119-Y359 PolarHBondContact OD1-O 3.45Å; N119-F366 WeakPolarHBondContact ND2-CD1 3.16Å; N119-N367 WeakPolarHBondContact CA-OD1 3.23Å; N119-N367 VanDerWaalsContact CB-OD1 3.26Å; N119-N367 WeakPolarHBondContact CB-OD1 3.26Å; N119-N367 PolarHBondContact ND2-OD1 2.82Å
120	F	96.3	Very high	96	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-51.6	-57.8	-173.2	-77.7	-7.9	0	0	0	114.4	L57 L65 T86 V88 L105 G113 W116 M117 A122 L123 A124 A131	L57-F120 HydrophobicContact CD1-CE2 4.35Å; L57-F120 HydrophobicContact CD2-CD2 4.25Å; L57-F120 HydrophobicContact CD2-CE2 3.67Å; L65-F120 HydrophobicContact CD1-CD2 4.17Å; L65-F120 HydrophobicContact CD2-CB 4.18Å; T86-F120 HydrophobicContact CG2-CE2 4.24Å; T86-F120 HydrophobicContact CG2-CZ 4.23Å; V88-F120 HydrophobicContact CG1-CB 4.01Å; V88-F120 HydrophobicContact CG1-CG 4.35Å; V88-F120 HydrophobicContact CG2-CB 4.35Å; V88-F120 HydrophobicContact CG2-CD1 3.94Å; V88-F120 HydrophobicContact CG2-CD2 3.8Å; V88-F120 HydrophobicContact CG2-CE1 4.12Å; V88-F120 HydrophobicContact CG2-CE2 4.01Å; V88-F120 HydrophobicContact CG2-CG 3.78Å; V88-F120 HydrophobicContact CG2-CZ 4.17Å; L105-F120 HydrophobicContact CD1-CD1 4.37Å; L105-F120 HydrophobicContact CD1-CE1 4.07Å; G113-F120 WeakPolarHBondContact O-CZ 3.22Å; W116-F120 HydrophobicContact CB-CD1 4.03Å; W116-F120 HydrophobicContact CB-CE1 3.4Å; W116-F120 VanDerWaalsContact CB-CE1 3.4Å; W116-F120 HydrophobicContact CB-CZ 4Å; W116-F120 VanDerWaalsContact O-CD1 3.27Å; W116-F120 WeakPolarHBondContact O-CD1 3.07Å; W116-F120 PolarHBondContact O-N 3.36Å; M117-F120 HydrophobicContact CB-CD2 4.35Å; M117-F120 HydrophobicContact CB-CE2 4.43Å; F120-A122 PolarHBondContact O-N 2.82Å; F120-L123 PolarHBondContact O-N 2.74Å; F120-A124 WeakPolarHBondContact O-CB 3.43Å; F120-A124 PolarHBondContact O-N 2.88Å; F120-A131 HydrophobicContact CE1-CB 3.87Å; F120-A131 HydrophobicContact CZ-CB 3.94Å
121	D	95.2	Very high	96.4	Very high	30 Å²	30	18.2 Å²	18.2	16%	0.16	10%	0.096	C	C	.	.	H	α-helix	trans	-59.2	-46.8	-176.2	-80.4	-2.7	0	0	0	112.6	R66 S67 N119 A125	R66-D121 WeakPolarHBondContact CB-OD2 3.4Å; R66-D121 IonicContact CZ-OD2 2.89Å; R66-D121 PolarHBondContact N-OD1 3.49Å; R66-D121 PolarHBondContact N-OD2 3.43Å; R66-D121 VanDerWaalsContact N-OD2 3.16Å; R66-D121 IonicContact NE-OD2 3.49Å; R66-D121 PolarHBondContact NE-OD2 2.77Å; R66-D121 IonicContact NH2-OD2 3.81Å; S67-D121 PolarHBondContact N-OD1 2.81Å; N119-D121 PolarHBondContact O-N 2.81Å; D121-A125 PolarHBondContact O-N 2.94Å; D121-A125 VanDerWaalsContact O-N 3.11Å
122	A	96.4	Very high	96.8	Very high	31 Å²	31	18 Å²	18	26%	0.256	9%	0.094	S	C	.	.	H	α-helix	trans	-70.8	-35.8	-175.7	0	0	0	0	0	112.5	N119 F120 N367 N371	N119-A122 PolarHBondContact O-N 2.83Å; F120-A122 PolarHBondContact O-N 2.82Å; A122-N367 HydrophobicContact CB-CB 3.68Å; A122-N371 PolarHBondContact O-ND2 3.5Å
123	L	97.6	Very high	96.9	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-80	-33	178.7	-62.4	-178.4	0	0	0	112	L103 L105 N119 F120 A125 V129 L175 I370	L103-L123 HydrophobicContact CD2-CB 4.11Å; L103-L123 HydrophobicContact CD2-CD1 3.83Å; L103-L123 HydrophobicContact CD2-CD2 4.28Å; L103-L123 HydrophobicContact CD2-CG 4.3Å; L105-L123 HydrophobicContact CD1-CD1 4.45Å; L105-L123 HydrophobicContact CD2-CD1 4.43Å; N119-L123 HydrophobicContact CB-CD1 3.67Å; N119-L123 HydrophobicContact CB-CG 4.23Å; N119-L123 WeakPolarHBondContact O-CB 3.32Å; N119-L123 WeakPolarHBondContact O-CG 3.46Å; N119-L123 PolarHBondContact O-N 3.29Å; F120-L123 PolarHBondContact O-N 2.74Å; L123-A125 VanDerWaalsContact C-N 3.33Å; L123-V129 HydrophobicContact CB-CG2 3.84Å; L123-L175 HydrophobicContact CD1-CD2 4.47Å; L123-I370 HydrophobicContact CD2-CB 3.75Å; L123-I370 HydrophobicContact CD2-CG1 4.44Å; L123-I370 HydrophobicContact CD2-CG2 3.44Å; L123-I370 VanDerWaalsContact CD2-CG2 3.44Å
124	A	96.9	Very high	96.9	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-85.8	-1.8	179.5	0	0	0	0	0	113.9	V88 S90 Y97 F120 H126 R127 V129	V88-A124 HydrophobicContact CB-CB 4.13Å; V88-A124 HydrophobicContact CG1-CB 3.57Å; S90-A124 WeakPolarHBondContact CB-O 3.12Å; S90-A124 PolarHBondContact N-O 2.82Å; Y97-A124 WeakPolarHBondContact CE2-O 3.36Å; Y97-A124 PolarHBondContact OH-O 3.29Å; F120-A124 WeakPolarHBondContact O-CB 3.43Å; F120-A124 PolarHBondContact O-N 2.88Å; A124-H126 PolarHBondContact O-N 2.58Å; A124-R127 VanDerWaalsContact CA-O 3.31Å; A124-R127 WeakPolarHBondContact CA-O 3.38Å; A124-V129 HydrophobicContact CB-CB 4.41Å; A124-V129 HydrophobicContact CB-CG2 3.89Å
125	A	95.9	Very high	97.1	Very high	37 Å²	37	18.2 Å²	18.2	31%	0.306	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-33.8	177.3	0	0	0	0	0	112.6	D121 L123	D121-A125 PolarHBondContact O-N 2.94Å; D121-A125 VanDerWaalsContact O-N 3.11Å; L123-A125 VanDerWaalsContact C-N 3.33Å
126	H	93.9	Very high	97.1	Very high	102 Å²	102	17.8 Å²	17.8	47%	0.472	9%	0.093	S	C	.	.	S	Bend	trans	-121.7	-6.9	-172.5	-57.4	-63.4	0	0	0	114.8	Y97 R100 A124	Y97-H126 VanDerWaalsContact CD2-C 3.4Å; R100-H126 WeakPolarHBondContact CD-O 3.32Å; A124-H126 PolarHBondContact O-N 2.58Å
127	R	96.7	Very high	97.1	Very high	16 Å²	16	17.9 Å²	17.9	6%	0.06	9%	0.093	C	C	.	.	S	Bend	trans	-159.2	160.4	-177.9	67.1	-162.7	72.8	-153.7	6.5	110.8	Y97 R100 L103 A124 V129 L374	Y97-R127 PolarHBondContact OH-O 3.02Å; R100-R127 HydrophobicContact CB-CB 4.15Å; L103-R127 HydrophobicContact CB-CG 4.43Å; A124-R127 VanDerWaalsContact CA-O 3.31Å; A124-R127 WeakPolarHBondContact CA-O 3.38Å; R127-V129 PolarHBondContact O-N 3.33Å; R127-L374 VanDerWaalsContact NH2-CB 3.35Å
128	V	97.9	Very high	97.2	Very high	33 Å²	33	17.6 Å²	17.6	20%	0.2	9%	0.092	C	C	.	.			trans	-67.2	133.4	171.2	-175.5	0	0	0	0	110	V87 Y97 P102 L103 Y130	V87-V128 HydrophobicContact CG1-CG1 3.51Å; Y97-V128 HydrophobicContact CE1-CG2 3.76Å; Y97-V128 PolarHBondContact OH-N 2.97Å; P102-V128 VanDerWaalsContact CA-O 3.28Å; P102-V128 WeakPolarHBondContact CA-O 3.46Å; P102-V128 HydrophobicContact CB-CB 4.39Å; P102-V128 WeakPolarHBondContact CB-O 3.34Å; L103-V128 PolarHBondContact N-O 3.43Å; V128-Y130 HydrophobicContact CB-CE2 4.12Å; V128-Y130 HydrophobicContact CG1-CD2 4.06Å; V128-Y130 HydrophobicContact CG1-CE1 4.33Å; V128-Y130 HydrophobicContact CG1-CE2 3.46Å; V128-Y130 VanDerWaalsContact CG1-CE2 3.46Å
129	V	98.5	Very high	97.3	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.079	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	132.8	174.2	178.2	0	0	0	0	109.1	V87 V88 L103 L105 L123 A124 R127	V87-V129 CarbonylContact C-O 3.56Å; V87-V129 WeakPolarHBondContact CA-O 3.46Å; V88-V129 HydrophobicContact CB-CB 4.25Å; V88-V129 PolarHBondContact N-O 3.03Å; V88-V129 PolarHBondContact O-N 3.38Å; L103-V129 HydrophobicContact CB-CG2 4.3Å; L103-V129 HydrophobicContact CD2-CG2 4.44Å; L103-V129 CarbonylContact O-C 3.51Å; L103-V129 VanDerWaalsContact O-CA 3.31Å; L103-V129 WeakPolarHBondContact O-CA 3.43Å; L105-V129 HydrophobicContact CD1-CG1 3.54Å; L105-V129 HydrophobicContact CD2-CG1 4.41Å; L105-V129 HydrophobicContact CG-CG1 3.73Å; L123-V129 HydrophobicContact CB-CG2 3.84Å; A124-V129 HydrophobicContact CB-CB 4.41Å; A124-V129 HydrophobicContact CB-CG2 3.89Å; R127-V129 PolarHBondContact O-N 3.33Å
130	Y	98.8	Very high	97.3	Very high	18 Å²	18	14.3 Å²	14.3	7%	0.071	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	114.6	173.8	-64.3	-89.3	0	0	0	108.8	T85 T86 V87 P102 L103 V104 L105 V128 W163 V167 L169	T85-Y130 HydrophobicContact CG2-CD1 3.92Å; T86-Y130 CarbonylContact O-C 3.56Å; T86-Y130 WeakPolarHBondContact O-CA 3.34Å; V87-Y130 HydrophobicContact CB-CD1 4.28Å; V87-Y130 HydrophobicContact CB-CE1 4.25Å; V87-Y130 HydrophobicContact CG1-CD1 3.98Å; V87-Y130 HydrophobicContact CG1-CE1 3.65Å; V87-Y130 HydrophobicContact CG2-CD1 3.69Å; V87-Y130 HydrophobicContact CG2-CE1 3.66Å; P102-Y130 HydrophobicContact CB-CD2 3.96Å; P102-Y130 HydrophobicContact CB-CE2 3.68Å; P102-Y130 HydrophobicContact CG-CE2 4.33Å; L103-Y130 PolarHBondContact O-N 3.26Å; V104-Y130 CarbonylContact C-O 3.56Å; V104-Y130 VanDerWaalsContact CA-O 3.29Å; V104-Y130 WeakPolarHBondContact CA-O 3.47Å; V104-Y130 HydrophobicContact CG2-CD2 4.4Å; L105-Y130 PolarHBondContact N-O 3.25Å; V128-Y130 HydrophobicContact CB-CE2 4.12Å; V128-Y130 HydrophobicContact CG1-CD2 4.06Å; V128-Y130 HydrophobicContact CG1-CE1 4.33Å; V128-Y130 HydrophobicContact CG1-CE2 3.46Å; V128-Y130 VanDerWaalsContact CG1-CE2 3.46Å; Y130-W163 HydrophobicContact CD1-CH2 4.01Å; Y130-W163 AromaticContact CD1-CZ2 3.61Å; Y130-W163 HydrophobicContact CD1-CZ2 3.61Å; Y130-W163 HydrophobicContact CD2-CH2 4.13Å; Y130-W163 HydrophobicContact CE1-CZ2 4.37Å; Y130-W163 AromaticContact CG-CH2 3.7Å; Y130-W163 HydrophobicContact CG-CH2 3.7Å; Y130-W163 AromaticContact CG-CZ2 3.72Å; Y130-W163 HydrophobicContact CG-CZ2 3.72Å; Y130-V167 HydrophobicContact CE1-CG1 3.81Å; Y130-L169 HydrophobicContact CD2-CD1 4.15Å; Y130-L169 HydrophobicContact CE2-CD1 3.74Å; Y130-L169 HydrophobicContact CE2-CD2 4.43Å
131	A	98.7	Very high	97.4	Very high	0 Å²	0	15.6 Å²	15.6	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	119.7	168.6	0	0	0	0	0	109.3	T86 L105 F120	T86-A131 PolarHBondContact N-O 2.77Å; T86-A131 PolarHBondContact O-N 3.04Å; L105-A131 HydrophobicContact CB-CB 4.17Å; L105-A131 HydrophobicContact CD1-CB 4.39Å; F120-A131 HydrophobicContact CE1-CB 3.87Å; F120-A131 HydrophobicContact CZ-CB 3.94Å
132	I	98.8	Very high	97.4	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	130.9	-174.9	-57.6	173.4	0	0	0	108.9	L83 T85 V104 L105 L106 H107 V134 L160 W163	L83-I132 HydrophobicContact CB-CG2 4.12Å; L83-I132 HydrophobicContact CD1-CG2 3.87Å; T85-I132 HydrophobicContact CG2-CG1 4.48Å; V104-I132 HydrophobicContact CG1-CD1 3.49Å; V104-I132 VanDerWaalsContact CG1-CD1 3.49Å; V104-I132 HydrophobicContact CG1-CG1 4.16Å; L105-I132 PolarHBondContact O-N 2.82Å; L106-I132 HydrophobicContact CD2-CB 4.11Å; L106-I132 HydrophobicContact CD2-CD1 4.18Å; H107-I132 PolarHBondContact CD2-O 3.02Å; H107-I132 VanDerWaalsContact CD2-O 3.28Å; I132-V134 PolarHBondContact O-N 3.23Å; I132-L160 HydrophobicContact CD1-CD2 3.92Å; I132-W163 HydrophobicContact CD1-CD2 3.47Å; I132-W163 VanDerWaalsContact CD1-CD2 3.47Å; I132-W163 HydrophobicContact CD1-CE3 3.69Å; I132-W163 HydrophobicContact CD1-CG 4.08Å; I132-W163 HydrophobicContact CD1-CH2 3.9Å; I132-W163 HydrophobicContact CD1-CZ2 3.64Å; I132-W163 HydrophobicContact CD1-CZ3 3.91Å; I132-W163 HydrophobicContact CG1-CD2 4.42Å; I132-W163 HydrophobicContact CG1-CZ2 4Å
133	D	98.8	Very high	97.4	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.086	C	C	.	.			trans	-73.4	108.9	161.4	-70.4	10.7	0	0	0	107.2	W84 H107 G113 G138 R139 S140	W84-D133 HydrophobicContact CB-CB 4.05Å; W84-D133 PolarHBondContact O-N 3.12Å; H107-D133 WeakPolarHBondContact NE2-CA 3.29Å; G113-D133 WeakPolarHBondContact CA-OD1 3.27Å; G113-D133 PolarHBondContact N-OD1 3.3Å; D133-G138 VanDerWaalsContact OD2-CA 3.3Å; D133-G138 WeakPolarHBondContact OD2-CA 3.42Å; D133-R139 PolarHBondContact OD2-N 3.12Å; D133-S140 VanDerWaalsContact CB-OG 3.28Å; D133-S140 WeakPolarHBondContact CB-OG 3.2Å; D133-S140 WeakPolarHBondContact O-CB 3.39Å; D133-S140 PolarHBondContact O-OG 3.16Å
134	V	98.6	Very high	97.2	Very high	3 Å²	3	21.6 Å²	21.6	2%	0.018	13%	0.125	C	C	.	.			trans	-65.5	149.3	-175.7	-55.9	0	0	0	0	110.2	L106 H107 I132 G136 F137 I183	L106-V134 HydrophobicContact CB-CG1 4.1Å; L106-V134 HydrophobicContact CD2-CG1 4.04Å; L106-V134 HydrophobicContact CG-CG1 4.49Å; H107-V134 PolarHBondContact NE2-N 3.19Å; I132-V134 PolarHBondContact O-N 3.23Å; V134-G136 PolarHBondContact O-N 3.4Å; V134-F137 HydrophobicContact CG2-CB 4.42Å; V134-F137 HydrophobicContact CG2-CD2 3.47Å; V134-F137 VanDerWaalsContact CG2-CD2 3.47Å; V134-F137 HydrophobicContact CG2-CE2 4.1Å; V134-F137 HydrophobicContact CG2-CG 4.3Å; V134-F137 PolarHBondContact O-N 2.88Å; V134-I183 HydrophobicContact CB-CD1 4.39Å; V134-I183 HydrophobicContact CG2-CD1 4.16Å
135	L	98.5	Very high	97	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.3	132.7	-176.1	-169.8	70.8	0	0	0	110.8	L77 C81 L83 P143 F145 W156	L77-L135 HydrophobicContact CD1-CD2 3.82Å; C81-L135 HydrophobicContact CB-CD1 3.98Å; L83-L135 HydrophobicContact CD2-CB 3.94Å; L83-L135 HydrophobicContact CD2-CD1 3.96Å; L135-P143 HydrophobicContact CD1-CG 4Å; L135-P143 HydrophobicContact CD2-CG 3.88Å; L135-P143 HydrophobicContact CG-CG 3.92Å; L135-F145 HydrophobicContact CB-CZ 4.09Å; L135-F145 HydrophobicContact CD2-CE1 4.06Å; L135-F145 HydrophobicContact CD2-CZ 3.81Å; L135-F145 HydrophobicContact CG-CE2 4.45Å; L135-F145 HydrophobicContact CG-CZ 3.87Å; L135-W156 PolarHBondContact O-NE1 3.46Å
136	G	97.2	Very high	96.6	Very high	2 Å²	2	21.9 Å²	21.9	2%	0.021	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.2	-6.3	-176.2	0	0	0	0	0	115.7	V134 S141 R142 S286 G287	V134-G136 PolarHBondContact O-N 3.4Å; G136-S141 WeakPolarHBondContact CA-O 3.35Å; G136-S141 PolarHBondContact N-O 2.83Å; G136-R142 PolarHBondContact O-NE 2.78Å; G136-S286 WeakPolarHBondContact CA-OG 3.15Å; G136-G287 PolarHBondContact O-N 3.04Å
137	F	97.5	Very high	96.3	Very high	4 Å²	4	23.7 Å²	23.7	2%	0.018	14%	0.137	C	C	.	.	S	Bend	trans	-129.4	170.5	-176.3	-61.6	-81.9	0	0	0	113.7	H107 L109 V134 R139 S140 W156 L179 G287 E288	H107-F137 VanDerWaalsContact CE1-CB 3.46Å; H107-F137 WeakPolarHBondContact CE1-CB 3.49Å; H107-F137 AromaticContact CE1-CG 3.93Å; L109-F137 HydrophobicContact CD1-CE1 3.66Å; L109-F137 HydrophobicContact CD1-CZ 3.56Å; V134-F137 HydrophobicContact CG2-CB 4.42Å; V134-F137 HydrophobicContact CG2-CD2 3.47Å; V134-F137 VanDerWaalsContact CG2-CD2 3.47Å; V134-F137 HydrophobicContact CG2-CE2 4.1Å; V134-F137 HydrophobicContact CG2-CG 4.3Å; V134-F137 PolarHBondContact O-N 2.88Å; F137-R139 PolarHBondContact O-N 3.31Å; F137-S140 WeakPolarHBondContact O-CB 3.43Å; F137-S140 PolarHBondContact O-N 3.28Å; F137-W156 HydrophobicContact CE2-CZ2 4.07Å; F137-L179 HydrophobicContact CE2-CD2 3.93Å; F137-L179 HydrophobicContact CZ-CD2 3.94Å; F137-G287 VanDerWaalsContact CZ-CA 3.49Å; F137-G287 VanDerWaalsContact CZ-O 3.28Å; F137-G287 WeakPolarHBondContact CZ-O 3.45Å; F137-E288 HydrophobicContact CE1-CG 4.35Å
138	G	96.1	Very high	96.1	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	-127.4	177.9	0	0	0	0	0	112.3	L49 D133 R142 Q283	L49-G138 WeakPolarHBondContact CD2-O 3.44Å; D133-G138 VanDerWaalsContact OD2-CA 3.3Å; D133-G138 WeakPolarHBondContact OD2-CA 3.42Å; G138-R142 PolarHBondContact O-NH1 3.37Å; G138-R142 PolarHBondContact O-NH2 3.07Å; G138-R142 VanDerWaalsContact O-NH2 3.09Å; G138-Q283 PolarHBondContact O-NE2 2.79Å
139	R	97.3	Very high	95.8	Very high	21 Å²	21	25.4 Å²	25.4	8%	0.079	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	-3.9	175.6	-64.4	179.1	67.4	-179.9	2.6	113.4	L49 E50 E53 Y73 W84 D133 F137	L49-R139 HydrophobicContact CD2-CB 4.46Å; L49-R139 HydrophobicContact CD2-CG 3.47Å; L49-R139 VanDerWaalsContact CD2-CG 3.47Å; L49-R139 HydrophobicContact CG-CG 3.67Å; E50-R139 IonicContact OE1-CZ 2.87Å; E50-R139 IonicContact OE1-NH2 3.52Å; E50-R139 PolarHBondContact OE1-NH2 3.19Å; E50-R139 IonicContact OE2-NH2 3.63Å; E53-R139 WeakPolarHBondContact OE1-CD 2.89Å; E53-R139 IonicContact OE1-CZ 2.74Å; E53-R139 IonicContact OE1-NE 2.85Å; E53-R139 IonicContact OE1-NH1 3.07Å; E53-R139 PolarHBondContact OE1-NH1 3.1Å; Y73-R139 WeakPolarHBondContact CE1-O 3.45Å; W84-R139 HydrophobicContact CB-CB 3.77Å; W84-R139 HydrophobicContact CD2-CB 4.26Å; W84-R139 HydrophobicContact CG-CB 3.68Å; W84-R139 VanDerWaalsContact CZ2-CZ 3.43Å; D133-R139 PolarHBondContact OD2-N 3.12Å; F137-R139 PolarHBondContact O-N 3.31Å
140	S	98.4	Very high	95.7	Very high	4 Å²	4	29 Å²	29	3%	0.028	16%	0.164	C	C	.	.	S	Bend	trans	-66	162.4	176	-72.5	0	0	0	0	112.7	L83 W84 D133 F137	L83-S140 VanDerWaalsContact CA-OG 3.31Å; L83-S140 WeakPolarHBondContact CA-OG 3.36Å; W84-S140 PolarHBondContact N-OG 3.07Å; D133-S140 VanDerWaalsContact CB-OG 3.28Å; D133-S140 WeakPolarHBondContact CB-OG 3.2Å; D133-S140 WeakPolarHBondContact O-CB 3.39Å; D133-S140 PolarHBondContact O-OG 3.16Å; F137-S140 WeakPolarHBondContact O-CB 3.43Å; F137-S140 PolarHBondContact O-N 3.28Å
141	S	97.8	Very high	95.6	Very high	26 Å²	26	31.4 Å²	31.4	18%	0.182	18%	0.178	C	C	.	.			trans	-53.5	144.8	172.7	-75.6	0	0	0	0	111.7	C81 R82 G136 P143	C81-S141 WeakPolarHBondContact CA-OG 3.48Å; R82-S141 PolarHBondContact N-OG 2.92Å; R82-S141 PolarHBondContact O-N 3.21Å; G136-S141 WeakPolarHBondContact CA-O 3.35Å; G136-S141 PolarHBondContact N-O 2.83Å; S141-P143 VanDerWaalsContact O-CD 3.23Å; S141-P143 WeakPolarHBondContact O-CD 3.46Å
142	R	95.4	Very high	95.5	Very high	41 Å²	41	31.4 Å²	31.4	16%	0.155	18%	0.178	C	C	.	.			trans	-116.9	67.7	179.2	-76	-175.4	163.6	73	-1.3	111.7	G136 G138 C280 Q283 L284 S286	G136-R142 PolarHBondContact O-NE 2.78Å; G138-R142 PolarHBondContact O-NH1 3.37Å; G138-R142 PolarHBondContact O-NH2 3.07Å; G138-R142 VanDerWaalsContact O-NH2 3.09Å; R142-C280 PolarHBondContact NH2-O 2.66Å; R142-Q283 VanDerWaalsContact CZ-NE2 3.35Å; R142-Q283 VanDerWaalsContact NH1-NE2 3.12Å; R142-Q283 VanDerWaalsContact NH2-NE2 3.11Å; R142-L284 WeakPolarHBondContact CD-O 3.4Å; R142-L284 PolarHBondContact NE-O 2.88Å; R142-L284 VanDerWaalsContact NE-O 3.11Å; R142-S286 VanDerWaalsContact C-OG 3.22Å; R142-S286 WeakPolarHBondContact CA-OG 3.42Å
143	P	95.8	Very high	95.4	Very high	29 Å²	29	31.5 Å²	31.5	19%	0.188	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-71.9	162.9	177.8	33.3	-35.8	0	0	0	111.2	L135 S141 F145 S286	L135-P143 HydrophobicContact CD1-CG 4Å; L135-P143 HydrophobicContact CD2-CG 3.88Å; L135-P143 HydrophobicContact CG-CG 3.92Å; S141-P143 VanDerWaalsContact O-CD 3.23Å; S141-P143 WeakPolarHBondContact O-CD 3.46Å; P143-F145 HydrophobicContact CG-CE2 4.34Å; P143-F145 PolarHBondContact O-N 2.8Å; P143-S286 WeakPolarHBondContact O-CB 3.22Å; P143-S286 PolarHBondContact O-OG 2.86Å
144	S	93.9	Very high	95.4	Very high	117 Å²	117	35.4 Å²	35.4	82%	0.818	20%	0.197	S	C	*	.	P	Polyproline II helix	trans	-67.8	127.9	158.4	-58.5	0	0	0	0	108.6
145	F	93.1	Very high	95.4	Very high	27 Å²	27	37.5 Å²	37.5	12%	0.118	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-76.9	165.3	172.1	-76.6	-108.6	0	0	0	110.5	L135 P143 A152 Q155 W156 S286 A290	L135-F145 HydrophobicContact CB-CZ 4.09Å; L135-F145 HydrophobicContact CD2-CE1 4.06Å; L135-F145 HydrophobicContact CD2-CZ 3.81Å; L135-F145 HydrophobicContact CG-CE2 4.45Å; L135-F145 HydrophobicContact CG-CZ 3.87Å; P143-F145 HydrophobicContact CG-CE2 4.34Å; P143-F145 PolarHBondContact O-N 2.8Å; F145-A152 HydrophobicContact CB-CB 4.33Å; F145-A152 HydrophobicContact CD1-CB 4.31Å; F145-Q155 HydrophobicContact CD1-CB 3.95Å; F145-Q155 HydrophobicContact CE1-CB 4.09Å; F145-W156 AromaticContact CE1-CD1 3.96Å; F145-W156 AromaticContact CE1-CD2 3.93Å; F145-W156 HydrophobicContact CE1-CD2 3.93Å; F145-W156 AromaticContact CE1-CE2 3.65Å; F145-W156 HydrophobicContact CE1-CG 4.12Å; F145-W156 HydrophobicContact CE1-CZ2 4.12Å; F145-W156 AromaticContact CE1-NE1 3.65Å; F145-W156 HydrophobicContact CZ-CD2 4.48Å; F145-W156 AromaticContact CZ-CE2 3.78Å; F145-W156 HydrophobicContact CZ-CZ2 4.14Å; F145-W156 AromaticContact CZ-NE1 3.48Å; F145-S286 WeakPolarHBondContact CD2-O 3.34Å; F145-S286 WeakPolarHBondContact CE2-OG 3.49Å; F145-A290 HydrophobicContact CB-CB 3.87Å; F145-A290 HydrophobicContact CD1-CB 3.59Å; F145-A290 HydrophobicContact CD2-CB 3.58Å; F145-A290 HydrophobicContact CE1-CB 3.92Å; F145-A290 HydrophobicContact CE2-CB 3.92Å; F145-A290 HydrophobicContact CG-CB 3.4Å; F145-A290 HydrophobicContact CZ-CB 4.08Å
146	G	86.1	Confident	95.4	Very high	17 Å²	17	37.5 Å²	37.5	18%	0.175	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-56.3	158.7	171.1	0	0	0	0	0	110.7	D148 L293	G146-D148 VanDerWaalsContact C-N 3.29Å; G146-D148 PolarHBondContact O-N 2.73Å; G146-L293 WeakPolarHBondContact O-CD1 3.45Å
147	N	88.9	Confident	95.4	Very high	140 Å²	140	37.5 Å²	37.5	75%	0.749	21%	0.206	S	C	*	.	S	Bend	trans	-85.8	5.7	-169.8	61.6	-20.8	0	0	0	114.5
148	D	91.7	Very high	95.5	Very high	53 Å²	53	41.1 Å²	41.1	28%	0.283	22%	0.223	S	C	.	.	S	Bend	trans	-136.8	168.7	175	72.7	68	0	0	0	111.9	G146 I150 L151 A152	G146-D148 VanDerWaalsContact C-N 3.29Å; G146-D148 PolarHBondContact O-N 2.73Å; D148-I150 PolarHBondContact O-N 2.76Å; D148-I150 WeakPolarHBondContact OD1-CA 3.4Å; D148-I150 WeakPolarHBondContact OD1-CB 3.33Å; D148-I150 PolarHBondContact OD1-N 3.23Å; D148-L151 PolarHBondContact OD1-N 3.09Å; D148-L151 WeakPolarHBondContact OD2-CD1 3.28Å; D148-L151 VanDerWaalsContact OD2-CG 3.3Å; D148-L151 WeakPolarHBondContact OD2-CG 3.46Å; D148-A152 VanDerWaalsContact O-CB 3.31Å; D148-A152 WeakPolarHBondContact O-CB 3.34Å; D148-A152 PolarHBondContact O-N 3.31Å
149	D	91.8	Very high	95.6	Very high	32 Å²	32	41.2 Å²	41.2	17%	0.171	22%	0.224	C	C	.	.	H	α-helix	trans	-68.7	-29.5	-174.9	52.9	-66.3	0	0	0	114.5	E153 L293 I294 K302 R303	D149-E153 WeakPolarHBondContact O-CB 3.09Å; D149-E153 PolarHBondContact O-N 2.74Å; D149-L293 WeakPolarHBondContact CB-O 3.47Å; D149-I294 HydrophobicContact CB-CB 4.35Å; D149-I294 HydrophobicContact CB-CG2 3.94Å; D149-I294 WeakPolarHBondContact O-CG2 3.45Å; D149-K302 HydrophobicContact CB-CB 4.48Å; D149-K302 HydrophobicContact CB-CD 3.76Å; D149-K302 IonicContact OD1-NZ 2.8Å; D149-R303 WeakPolarHBondContact OD2-CD 3.48Å; D149-R303 WeakPolarHBondContact OD2-CG 3.23Å
150	I	96.4	Very high	95.7	Very high	74 Å²	74	40.6 Å²	40.6	38%	0.379	22%	0.222	S	C	.	.	H	α-helix	trans	-73.5	-48.7	177.9	-61	173.7	0	0	0	109	D148 A152 E153 Q154	D148-I150 PolarHBondContact O-N 2.76Å; D148-I150 WeakPolarHBondContact OD1-CA 3.4Å; D148-I150 WeakPolarHBondContact OD1-CB 3.33Å; D148-I150 PolarHBondContact OD1-N 3.23Å; I150-A152 PolarHBondContact O-N 2.87Å; I150-E153 PolarHBondContact O-N 2.95Å; I150-Q154 HydrophobicContact CG2-CG 4.36Å; I150-Q154 WeakPolarHBondContact O-CB 3.32Å; I150-Q154 VanDerWaalsContact O-CG 3.26Å; I150-Q154 WeakPolarHBondContact O-CG 3.46Å; I150-Q154 PolarHBondContact O-N 2.97Å
151	L	96.4	Very high	95.7	Very high	69 Å²	69	40.4 Å²	40.4	36%	0.361	22%	0.221	S	C	.	.	H	α-helix	trans	-63.8	-41.3	179.1	-67.5	-179.9	0	0	0	112.1	D148 Q154 Q155	D148-L151 PolarHBondContact OD1-N 3.09Å; D148-L151 WeakPolarHBondContact OD2-CD1 3.28Å; D148-L151 VanDerWaalsContact OD2-CG 3.3Å; D148-L151 WeakPolarHBondContact OD2-CG 3.46Å; L151-Q154 PolarHBondContact O-N 3.38Å; L151-Q155 WeakPolarHBondContact O-CG 3.38Å; L151-Q155 PolarHBondContact O-N 3.12Å
152	A	96.1	Very high	95.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-62.2	-44.6	177.4	0	0	0	0	0	111.7	F145 D148 I150 Q155 W156 A290 L293 I294	F145-A152 HydrophobicContact CB-CB 4.33Å; F145-A152 HydrophobicContact CD1-CB 4.31Å; D148-A152 VanDerWaalsContact O-CB 3.31Å; D148-A152 WeakPolarHBondContact O-CB 3.34Å; D148-A152 PolarHBondContact O-N 3.31Å; I150-A152 PolarHBondContact O-N 2.87Å; A152-Q155 PolarHBondContact O-N 2.84Å; A152-W156 PolarHBondContact O-N 2.95Å; A152-A290 HydrophobicContact CB-CB 4.45Å; A152-L293 HydrophobicContact CB-CB 4.46Å; A152-L293 HydrophobicContact CB-CD1 4.4Å; A152-I294 HydrophobicContact CB-CG2 4.15Å
153	E	98	Very high	95.9	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.009	21%	0.212	C	C	.	.	H	α-helix	trans	-62.1	-47.7	174.4	-177.9	-178.5	98.4	0	0	112.2	D149 I150 Q155 W156 V157 Y182 A186 R303 R308	D149-E153 WeakPolarHBondContact O-CB 3.09Å; D149-E153 PolarHBondContact O-N 2.74Å; I150-E153 PolarHBondContact O-N 2.95Å; E153-Q155 PolarHBondContact O-N 2.86Å; E153-W156 WeakPolarHBondContact O-CB 3.43Å; E153-W156 PolarHBondContact O-N 3.11Å; E153-V157 HydrophobicContact CG-CG2 4.48Å; E153-V157 PolarHBondContact O-N 3.25Å; E153-Y182 HydrophobicContact CG-CE1 4.25Å; E153-Y182 WeakPolarHBondContact OE2-CE1 3.29Å; E153-Y182 PolarHBondContact OE2-OH 2.8Å; E153-A186 HydrophobicContact CG-CB 3.77Å; E153-R303 VanDerWaalsContact CD-NH1 3.25Å; E153-R303 IonicContact OE1-CZ 3.47Å; E153-R303 IonicContact OE1-NH1 3.69Å; E153-R303 PolarHBondContact OE1-NH1 2.68Å; E153-R303 IonicContact OE1-NH2 3.31Å; E153-R303 IonicContact OE2-NH1 2.78Å; E153-R303 PolarHBondContact OE2-NH1 3.24Å; E153-R308 VanDerWaalsContact CD-NH1 3.35Å; E153-R308 IonicContact OE1-CZ 3.63Å; E153-R308 IonicContact OE1-NH1 2.81Å; E153-R308 PolarHBondContact OE1-NH1 3.02Å; E153-R308 IonicContact OE1-NH2 3.62Å; E153-R308 PolarHBondContact OE1-NH2 3.06Å; E153-R308 IonicContact OE2-CZ 3.83Å; E153-R308 IonicContact OE2-NH1 3.82Å; E153-R308 PolarHBondContact OE2-NH1 3.35Å; E153-R308 IonicContact OE2-NH2 2.58Å
154	Q	98	Very high	96.1	Very high	83 Å²	83	37.9 Å²	37.9	39%	0.388	21%	0.205	S	C	.	.	H	α-helix	trans	-60	-33.9	179.9	-77.9	176.4	-15.5	0	0	112.2	I150 L151 V157 Q158	I150-Q154 HydrophobicContact CG2-CG 4.36Å; I150-Q154 WeakPolarHBondContact O-CB 3.32Å; I150-Q154 VanDerWaalsContact O-CG 3.26Å; I150-Q154 WeakPolarHBondContact O-CG 3.46Å; I150-Q154 PolarHBondContact O-N 2.97Å; L151-Q154 PolarHBondContact O-N 3.38Å; Q154-V157 PolarHBondContact O-N 3.48Å; Q154-Q158 VanDerWaalsContact O-CB 3.24Å; Q154-Q158 WeakPolarHBondContact O-CB 3.27Å; Q154-Q158 PolarHBondContact O-N 3.5Å
155	Q	98.3	Very high	96.3	Very high	46 Å²	46	39 Å²	39	22%	0.215	19%	0.192	C	C	.	.	H	α-helix	trans	-66	-38.7	174.7	-77.2	177.6	-67.5	0	0	112.9	F145 L151 A152 E153 S159	F145-Q155 HydrophobicContact CD1-CB 3.95Å; F145-Q155 HydrophobicContact CE1-CB 4.09Å; L151-Q155 WeakPolarHBondContact O-CG 3.38Å; L151-Q155 PolarHBondContact O-N 3.12Å; A152-Q155 PolarHBondContact O-N 2.84Å; E153-Q155 PolarHBondContact O-N 2.86Å; Q155-S159 VanDerWaalsContact O-CB 3.29Å; Q155-S159 WeakPolarHBondContact O-CB 3.5Å; Q155-S159 PolarHBondContact O-N 2.91Å; Q155-S159 PolarHBondContact O-OG 2.75Å
156	W	98.5	Very high	96.6	Very high	1 Å²	1	44 Å²	44	0%	0.004	21%	0.211	C	C	.	.	H	α-helix	trans	-63.9	-47	171.9	-80.3	-50.7	0	0	0	111.2	L135 F137 F145 A152 E153 Q158 S159 L160 I183 A290 I294	L135-W156 PolarHBondContact O-NE1 3.46Å; F137-W156 HydrophobicContact CE2-CZ2 4.07Å; F145-W156 AromaticContact CE1-CD1 3.96Å; F145-W156 AromaticContact CE1-CD2 3.93Å; F145-W156 HydrophobicContact CE1-CD2 3.93Å; F145-W156 AromaticContact CE1-CE2 3.65Å; F145-W156 HydrophobicContact CE1-CG 4.12Å; F145-W156 HydrophobicContact CE1-CZ2 4.12Å; F145-W156 AromaticContact CE1-NE1 3.65Å; F145-W156 HydrophobicContact CZ-CD2 4.48Å; F145-W156 AromaticContact CZ-CE2 3.78Å; F145-W156 HydrophobicContact CZ-CZ2 4.14Å; F145-W156 AromaticContact CZ-NE1 3.48Å; A152-W156 PolarHBondContact O-N 2.95Å; E153-W156 WeakPolarHBondContact O-CB 3.43Å; E153-W156 PolarHBondContact O-N 3.11Å; W156-Q158 PolarHBondContact O-N 3Å; W156-S159 PolarHBondContact O-N 3.13Å; W156-S159 PolarHBondContact O-OG 3.33Å; W156-L160 PolarHBondContact O-N 2.91Å; W156-L160 VanDerWaalsContact O-N 3.08Å; W156-I183 HydrophobicContact CB-CD1 4.36Å; W156-I183 HydrophobicContact CB-CG1 4.23Å; W156-I183 HydrophobicContact CB-CG2 3.89Å; W156-I183 HydrophobicContact CD2-CD1 3.72Å; W156-I183 HydrophobicContact CD2-CG1 4.02Å; W156-I183 HydrophobicContact CE3-CD1 4.2Å; W156-I183 HydrophobicContact CE3-CG1 4.1Å; W156-I183 HydrophobicContact CG-CD1 3.8Å; W156-I183 HydrophobicContact CG-CG1 4.1Å; W156-I183 HydrophobicContact CG-CG2 4.45Å; W156-A290 HydrophobicContact CH2-CB 3.43Å; W156-A290 VanDerWaalsContact CH2-CB 3.43Å; W156-A290 HydrophobicContact CZ2-CB 3.59Å; W156-A290 HydrophobicContact CZ3-CB 4.2Å; W156-I294 HydrophobicContact CH2-CD1 4.38Å; W156-I294 HydrophobicContact CZ3-CD1 3.81Å; W156-I294 HydrophobicContact CZ3-CG1 4.39Å; W156-I294 HydrophobicContact CZ3-CG2 4.41Å
157	V	98.7	Very high	97.1	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.006	21%	0.21	C	C	.	.	H	α-helix	trans	-58.5	-50.3	178.4	175.2	0	0	0	0	111.2	E153 Q154 S159 L160 E161 A186 Y187 E190	E153-V157 HydrophobicContact CG-CG2 4.48Å; E153-V157 PolarHBondContact O-N 3.25Å; Q154-V157 PolarHBondContact O-N 3.48Å; V157-S159 VanDerWaalsContact C-N 3.32Å; V157-S159 PolarHBondContact O-N 3.26Å; V157-L160 PolarHBondContact O-N 2.91Å; V157-L160 VanDerWaalsContact O-N 3.16Å; V157-E161 PolarHBondContact O-N 2.94Å; V157-A186 HydrophobicContact CG2-CB 3.72Å; V157-Y187 HydrophobicContact CG1-CD2 4.09Å; V157-E190 HydrophobicContact CG1-CB 4.12Å; V157-E190 HydrophobicContact CG1-CG 4.39Å; V157-E190 WeakPolarHBondContact CG1-OE2 3.47Å
158	Q	98.7	Very high	97.6	Very high	80 Å²	80	46.2 Å²	46.2	37%	0.374	21%	0.211	S	C	.	.	H	α-helix	trans	-61.2	-40.3	178.6	-173.3	62	53.7	0	0	111.7	L77 Q154 W156 L160 E161 D162	L77-Q158 HydrophobicContact CD2-CB 4.08Å; L77-Q158 HydrophobicContact CD2-CG 3.76Å; Q154-Q158 VanDerWaalsContact O-CB 3.24Å; Q154-Q158 WeakPolarHBondContact O-CB 3.27Å; Q154-Q158 PolarHBondContact O-N 3.5Å; W156-Q158 PolarHBondContact O-N 3Å; Q158-L160 VanDerWaalsContact C-N 3.3Å; Q158-L160 PolarHBondContact O-N 2.8Å; Q158-E161 PolarHBondContact O-N 3.44Å; Q158-D162 PolarHBondContact NE2-OD1 2.88Å; Q158-D162 WeakPolarHBondContact O-CB 3.3Å; Q158-D162 VanDerWaalsContact O-CG 3.29Å; Q158-D162 PolarHBondContact O-N 2.81Å
159	S	98.8	Very high	97.8	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.014	20%	0.203	C	C	.	.	H	α-helix	trans	-62.8	-37.3	177.5	75.4	0	0	0	0	112.5	V76 Q155 W156 V157 W163	V76-S159 WeakPolarHBondContact CG1-O 3.47Å; Q155-S159 VanDerWaalsContact O-CB 3.29Å; Q155-S159 WeakPolarHBondContact O-CB 3.5Å; Q155-S159 PolarHBondContact O-N 2.91Å; Q155-S159 PolarHBondContact O-OG 2.75Å; W156-S159 PolarHBondContact O-N 3.13Å; W156-S159 PolarHBondContact O-OG 3.33Å; V157-S159 VanDerWaalsContact C-N 3.32Å; V157-S159 PolarHBondContact O-N 3.26Å; S159-W163 VanDerWaalsContact O-CB 3.26Å; S159-W163 WeakPolarHBondContact O-CB 3.3Å; S159-W163 PolarHBondContact O-N 3.04Å
160	L	98.8	Very high	98.1	Very high	8 Å²	8	49.8 Å²	49.8	4%	0.042	23%	0.23	C	C	.	.	H	α-helix	trans	-72.2	-36.8	175.3	-71	178.9	0	0	0	112.2	L83 L106 I132 W156 V157 Q158 W163 R164 I183 Y187	L83-L160 HydrophobicContact CD1-CD2 4.48Å; L106-L160 HydrophobicContact CD1-CD1 3.67Å; L106-L160 HydrophobicContact CD2-CD2 3.91Å; I132-L160 HydrophobicContact CD1-CD2 3.92Å; W156-L160 PolarHBondContact O-N 2.91Å; W156-L160 VanDerWaalsContact O-N 3.08Å; V157-L160 PolarHBondContact O-N 2.91Å; V157-L160 VanDerWaalsContact O-N 3.16Å; Q158-L160 VanDerWaalsContact C-N 3.3Å; Q158-L160 PolarHBondContact O-N 2.8Å; L160-W163 PolarHBondContact O-N 2.95Å; L160-R164 WeakPolarHBondContact O-CB 3.34Å; L160-R164 PolarHBondContact O-N 2.86Å; L160-I183 HydrophobicContact CD1-CG2 3.54Å; L160-Y187 HydrophobicContact CB-CD2 3.67Å; L160-Y187 HydrophobicContact CB-CE2 3.98Å; L160-Y187 HydrophobicContact CB-CG 4.45Å; L160-Y187 HydrophobicContact CD1-CD2 4.41Å; L160-Y187 HydrophobicContact CD1-CG 4.46Å
161	E	98.8	Very high	98.1	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-67.3	-44.8	176.6	179.6	58.7	-178	0	0	111.7	V157 Q158 W163 R164 R165 Y187	V157-E161 PolarHBondContact O-N 2.94Å; Q158-E161 PolarHBondContact O-N 3.44Å; E161-W163 VanDerWaalsContact C-N 3.29Å; E161-W163 PolarHBondContact O-N 3.11Å; E161-R164 PolarHBondContact O-N 2.89Å; E161-R164 IonicContact OE1-CZ 2.77Å; E161-R164 IonicContact OE1-NE 3.79Å; E161-R164 IonicContact OE1-NH2 2.81Å; E161-R164 PolarHBondContact OE1-NH2 3Å; E161-R164 IonicContact OE2-CZ 3.49Å; E161-R164 IonicContact OE2-NE 2.65Å; E161-R164 PolarHBondContact OE2-NE 3.21Å; E161-R164 IonicContact OE2-NH2 3.12Å; E161-R164 PolarHBondContact OE2-NH2 3.25Å; E161-R165 WeakPolarHBondContact O-CB 3.29Å; E161-R165 VanDerWaalsContact O-CG 3.3Å; E161-R165 WeakPolarHBondContact O-CG 3.35Å; E161-R165 PolarHBondContact O-N 2.87Å; E161-R165 IonicContact OE1-CZ 3.49Å; E161-R165 IonicContact OE1-NE 2.72Å; E161-R165 PolarHBondContact OE1-NE 2.81Å; E161-R165 IonicContact OE1-NH2 3.47Å; E161-R165 PolarHBondContact OE1-NH2 2.83Å; E161-Y187 HydrophobicContact CB-CE2 3.86Å; E161-Y187 PolarHBondContact OE2-OH 3.28Å
162	D	98.8	Very high	98.2	Very high	27 Å²	27	48 Å²	48	14%	0.144	22%	0.217	C	C	.	.	H	α-helix	trans	-59.8	-43.1	174.3	-71.2	-13.4	0	0	0	111.1	V76 L77 Q158 R165 Y166	V76-D162 HydrophobicContact CB-CB 3.85Å; V76-D162 HydrophobicContact CG1-CB 3.88Å; L77-D162 WeakPolarHBondContact CA-OD2 3.3Å; L77-D162 PolarHBondContact N-OD2 2.88Å; Q158-D162 PolarHBondContact NE2-OD1 2.88Å; Q158-D162 WeakPolarHBondContact O-CB 3.3Å; Q158-D162 VanDerWaalsContact O-CG 3.29Å; Q158-D162 PolarHBondContact O-N 2.81Å; D162-R165 PolarHBondContact O-N 3.26Å; D162-Y166 WeakPolarHBondContact O-CB 3.46Å; D162-Y166 PolarHBondContact O-N 3.09Å
163	W	98.8	Very high	98.3	Very high	2 Å²	2	48 Å²	48	1%	0.008	22%	0.217	C	C	.	.	H	α-helix	trans	-59.6	-49.8	175.7	174	93.9	0	0	0	111.9	V74 V76 L83 T85 V104 Y130 I132 S159 L160 E161 R165 Y166 V167 L169	V74-W163 HydrophobicContact CG1-CB 4.25Å; V74-W163 HydrophobicContact CG1-CG 4.12Å; V76-W163 HydrophobicContact CG1-CB 4.07Å; L83-W163 HydrophobicContact CD1-CB 3.97Å; L83-W163 HydrophobicContact CD1-CG 4.31Å; T85-W163 HydrophobicContact CG2-CZ2 3.9Å; T85-W163 PolarHBondContact OG1-NE1 3.48Å; V104-W163 HydrophobicContact CG1-CH2 4.18Å; V104-W163 HydrophobicContact CG1-CZ3 4.16Å; V104-W163 HydrophobicContact CG2-CH2 3.74Å; V104-W163 HydrophobicContact CG2-CZ3 3.85Å; Y130-W163 HydrophobicContact CD1-CH2 4.01Å; Y130-W163 AromaticContact CD1-CZ2 3.61Å; Y130-W163 HydrophobicContact CD1-CZ2 3.61Å; Y130-W163 HydrophobicContact CD2-CH2 4.13Å; Y130-W163 HydrophobicContact CE1-CZ2 4.37Å; Y130-W163 AromaticContact CG-CH2 3.7Å; Y130-W163 HydrophobicContact CG-CH2 3.7Å; Y130-W163 AromaticContact CG-CZ2 3.72Å; Y130-W163 HydrophobicContact CG-CZ2 3.72Å; I132-W163 HydrophobicContact CD1-CD2 3.47Å; I132-W163 VanDerWaalsContact CD1-CD2 3.47Å; I132-W163 HydrophobicContact CD1-CE3 3.69Å; I132-W163 HydrophobicContact CD1-CG 4.08Å; I132-W163 HydrophobicContact CD1-CH2 3.9Å; I132-W163 HydrophobicContact CD1-CZ2 3.64Å; I132-W163 HydrophobicContact CD1-CZ3 3.91Å; I132-W163 HydrophobicContact CG1-CD2 4.42Å; I132-W163 HydrophobicContact CG1-CZ2 4Å; S159-W163 VanDerWaalsContact O-CB 3.26Å; S159-W163 WeakPolarHBondContact O-CB 3.3Å; S159-W163 PolarHBondContact O-N 3.04Å; L160-W163 PolarHBondContact O-N 2.95Å; E161-W163 VanDerWaalsContact C-N 3.29Å; E161-W163 PolarHBondContact O-N 3.11Å; W163-R165 VanDerWaalsContact C-N 3.32Å; W163-R165 PolarHBondContact O-N 2.84Å; W163-Y166 PolarHBondContact O-N 3.3Å; W163-V167 HydrophobicContact CD2-CG2 4.27Å; W163-V167 HydrophobicContact CZ2-CG2 4.06Å; W163-V167 WeakPolarHBondContact O-CG2 3.41Å; W163-V167 PolarHBondContact O-N 2.72Å; W163-L169 HydrophobicContact CH2-CD1 3.82Å; W163-L169 HydrophobicContact CZ3-CD1 4.03Å
164	R	98.8	Very high	98.3	Very high	14 Å²	14	48 Å²	48	5%	0.053	22%	0.217	C	C	.	.	H	α-helix	trans	-60.1	-44.4	-179.4	-175.7	-162.6	61.7	88.1	-4	110.8	L160 E161 K168 L169 I172 Y187 F194	L160-R164 WeakPolarHBondContact O-CB 3.34Å; L160-R164 PolarHBondContact O-N 2.86Å; E161-R164 PolarHBondContact O-N 2.89Å; E161-R164 IonicContact OE1-CZ 2.77Å; E161-R164 IonicContact OE1-NE 3.79Å; E161-R164 IonicContact OE1-NH2 2.81Å; E161-R164 PolarHBondContact OE1-NH2 3Å; E161-R164 IonicContact OE2-CZ 3.49Å; E161-R164 IonicContact OE2-NE 2.65Å; E161-R164 PolarHBondContact OE2-NE 3.21Å; E161-R164 IonicContact OE2-NH2 3.12Å; E161-R164 PolarHBondContact OE2-NH2 3.25Å; R164-K168 PolarHBondContact O-N 2.81Å; R164-L169 WeakPolarHBondContact CD-O 3.37Å; R164-L169 HydrophobicContact CG-CB 4.03Å; R164-L169 VanDerWaalsContact CG-O 3.3Å; R164-L169 WeakPolarHBondContact CG-O 3.48Å; R164-L169 PolarHBondContact NH1-O 2.91Å; R164-L169 PolarHBondContact O-N 2.88Å; R164-L169 VanDerWaalsContact O-N 3.11Å; R164-I172 HydrophobicContact CG-CG2 4.32Å; R164-Y187 VanDerWaalsContact CD-OH 3.22Å; R164-Y187 WeakPolarHBondContact CD-OH 3.36Å; R164-Y187 PolarHBondContact NE-OH 3.28Å; R164-Y187 VanDerWaalsContact NE-OH 3.13Å; R164-F194 VanDerWaalsContact CZ-CG 3.48Å
165	R	98.6	Very high	98.4	Very high	141 Å²	141	44 Å²	44	53%	0.532	20%	0.198	S	C	.	.	H	α-helix	trans	-62.8	-44	176.9	-72.5	176.5	-177.9	179.8	4.4	112	E161 D162 W163 K168	E161-R165 WeakPolarHBondContact O-CB 3.29Å; E161-R165 VanDerWaalsContact O-CG 3.3Å; E161-R165 WeakPolarHBondContact O-CG 3.35Å; E161-R165 PolarHBondContact O-N 2.87Å; E161-R165 IonicContact OE1-CZ 3.49Å; E161-R165 IonicContact OE1-NE 2.72Å; E161-R165 PolarHBondContact OE1-NE 2.81Å; E161-R165 IonicContact OE1-NH2 3.47Å; E161-R165 PolarHBondContact OE1-NH2 2.83Å; D162-R165 PolarHBondContact O-N 3.26Å; W163-R165 VanDerWaalsContact C-N 3.32Å; W163-R165 PolarHBondContact O-N 2.84Å; R165-K168 PolarHBondContact O-N 2.87Å; R165-K168 VanDerWaalsContact O-N 3.13Å
166	Y	98.6	Very high	98.4	Very high	132 Å²	132	41.9 Å²	41.9	52%	0.518	19%	0.188	S	C	.	.	H	α-helix	trans	-64.5	-43.7	179.4	-174.3	-87.2	0	0	0	112.2	V74 P75 D162 W163 K168	V74-Y166 HydrophobicContact CB-CD1 4.32Å; V74-Y166 HydrophobicContact CG1-CD1 3.54Å; V74-Y166 HydrophobicContact CG1-CE1 4.34Å; V74-Y166 HydrophobicContact CG1-CG 3.8Å; V74-Y166 HydrophobicContact CG2-CD1 4.24Å; P75-Y166 VanDerWaalsContact CD-CZ 3.5Å; P75-Y166 HydrophobicContact CG-CD2 3.59Å; P75-Y166 HydrophobicContact CG-CE1 4.46Å; P75-Y166 HydrophobicContact CG-CE2 3.29Å; P75-Y166 HydrophobicContact CG-CG 4.29Å; D162-Y166 WeakPolarHBondContact O-CB 3.46Å; D162-Y166 PolarHBondContact O-N 3.09Å; W163-Y166 PolarHBondContact O-N 3.3Å; Y166-K168 PolarHBondContact O-N 2.8Å
167	V	98.1	Very high	98.4	Very high	28 Å²	28	42 Å²	42	17%	0.17	19%	0.189	C	C	.	.	H	α-helix	trans	-73.2	-11.2	176.5	-176.4	0	0	0	0	111.9	V74 Y130 W163 L169	V74-V167 HydrophobicContact CG1-CG2 4.46Å; V74-V167 HydrophobicContact CG2-CG2 4.06Å; Y130-V167 HydrophobicContact CE1-CG1 3.81Å; W163-V167 HydrophobicContact CD2-CG2 4.27Å; W163-V167 HydrophobicContact CZ2-CG2 4.06Å; W163-V167 WeakPolarHBondContact O-CG2 3.41Å; W163-V167 PolarHBondContact O-N 2.72Å; V167-L169 HydrophobicContact CB-CD1 4.48Å; V167-L169 HydrophobicContact CB-CG 4.23Å; V167-L169 HydrophobicContact CG1-CD1 3.99Å; V167-L169 HydrophobicContact CG1-CD2 4.14Å; V167-L169 HydrophobicContact CG1-CG 3.82Å
168	K	98	Very high	98.3	Very high	176 Å²	176	42.4 Å²	42.4	77%	0.765	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.9	46.7	178	-53	179	-178	178.7	0	113	R164 R165 Y166	R164-K168 PolarHBondContact O-N 2.81Å; R165-K168 PolarHBondContact O-N 2.87Å; R165-K168 VanDerWaalsContact O-N 3.13Å; Y166-K168 PolarHBondContact O-N 2.8Å
169	L	97.9	Very high	98.3	Very high	23 Å²	23	38.6 Å²	38.6	12%	0.12	17%	0.174	C	C	.	.			trans	-97.7	116.2	176.5	-58.1	-179.8	0	0	0	110.5	P102 Y130 W163 R164 V167 I172	P102-L169 HydrophobicContact CG-CD1 3.94Å; P102-L169 HydrophobicContact CG-CD2 4.08Å; P102-L169 HydrophobicContact CG-CG 4.47Å; Y130-L169 HydrophobicContact CD2-CD1 4.15Å; Y130-L169 HydrophobicContact CE2-CD1 3.74Å; Y130-L169 HydrophobicContact CE2-CD2 4.43Å; W163-L169 HydrophobicContact CH2-CD1 3.82Å; W163-L169 HydrophobicContact CZ3-CD1 4.03Å; R164-L169 WeakPolarHBondContact CD-O 3.37Å; R164-L169 HydrophobicContact CG-CB 4.03Å; R164-L169 VanDerWaalsContact CG-O 3.3Å; R164-L169 WeakPolarHBondContact CG-O 3.48Å; R164-L169 PolarHBondContact NH1-O 2.91Å; R164-L169 PolarHBondContact O-N 2.88Å; R164-L169 VanDerWaalsContact O-N 3.11Å; V167-L169 HydrophobicContact CB-CD1 4.48Å; V167-L169 HydrophobicContact CB-CG 4.23Å; V167-L169 HydrophobicContact CG1-CD1 3.99Å; V167-L169 HydrophobicContact CG1-CD2 4.14Å; V167-L169 HydrophobicContact CG1-CG 3.82Å; L169-I172 HydrophobicContact CB-CG2 3.82Å; L169-I172 HydrophobicContact CD1-CG2 3.71Å; L169-I172 HydrophobicContact CG-CG2 4.42Å
170	D	96.6	Very high	98.3	Very high	136 Å²	136	38.5 Å²	38.5	73%	0.727	17%	0.173	S	C	*	.	S	Bend	trans	-70.1	-39.9	178.6	-66.7	-29.2	0	0	0	112.1	F194	D170-F194 VanDerWaalsContact O-CD1 3.3Å; D170-F194 WeakPolarHBondContact O-CD1 3.39Å
171	K	96.9	Very high	98.3	Very high	102 Å²	102	38.1 Å²	38.1	44%	0.443	17%	0.171	S	C	.	.			trans	-137.6	147.1	175.2	-74.4	-171.3	174.8	-177.1	0	111.2	T101 P102 F194	T101-K171 HydrophobicContact CG2-CB 4.3Å; P102-K171 WeakPolarHBondContact CD-O 3.44Å; K171-F194 CarbonylContact C-O 3.56Å; K171-F194 WeakPolarHBondContact CA-O 3.3Å
172	I	98.2	Very high	98.2	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.021	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	153.8	177.5	61.6	176	0	0	0	110.9	P102 V104 R164 L169 L174 Y187 F194 V195 N196	P102-I172 HydrophobicContact CG-CG2 4.27Å; V104-I172 HydrophobicContact CG2-CB 3.91Å; V104-I172 HydrophobicContact CG2-CD1 4.19Å; V104-I172 HydrophobicContact CG2-CG2 3.94Å; R164-I172 HydrophobicContact CG-CG2 4.32Å; L169-I172 HydrophobicContact CB-CG2 3.82Å; L169-I172 HydrophobicContact CD1-CG2 3.71Å; L169-I172 HydrophobicContact CG-CG2 4.42Å; I172-L174 HydrophobicContact CD1-CD1 4.46Å; I172-L174 HydrophobicContact CD1-CD2 3.8Å; I172-L174 HydrophobicContact CD1-CG 4.01Å; I172-L174 HydrophobicContact CG1-CG 4.36Å; I172-Y187 HydrophobicContact CD1-CE1 4.12Å; I172-F194 WeakPolarHBondContact CG1-O 3.2Å; I172-F194 PolarHBondContact N-O 3.5Å; I172-V195 HydrophobicContact CG1-CG2 4.47Å; I172-V195 CarbonylContact O-C 3.59Å; I172-V195 WeakPolarHBondContact O-CA 3.21Å; I172-N196 PolarHBondContact O-N 2.77Å
173	T	98.3	Very high	98.2	Very high	0 Å²	0	37 Å²	37	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	132.5	159.3	-61.1	0	0	0	0	108.5	P102 L103 V104 H197 I199 L374	P102-T173 PolarHBondContact O-N 3.08Å; L103-T173 HydrophobicContact CD1-CG2 3.73Å; V104-T173 PolarHBondContact N-O 2.98Å; T173-H197 HydrophobicContact CG2-CB 3.77Å; T173-H197 WeakPolarHBondContact CG2-O 3.48Å; T173-I199 HydrophobicContact CG2-CD1 4.1Å; T173-I199 HydrophobicContact CG2-CG1 4.39Å; T173-L374 HydrophobicContact CG2-CD2 3.36Å
174	L	98.8	Very high	98.2	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.01	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	129.2	177.9	-71.5	166.3	0	0	0	110	V104 L106 I172 A184 Y187 V195 H197 L198 I199	V104-L174 HydrophobicContact CB-CD2 4.01Å; V104-L174 HydrophobicContact CG1-CD2 4.07Å; L106-L174 HydrophobicContact CD1-CD2 4.42Å; I172-L174 HydrophobicContact CD1-CD1 4.46Å; I172-L174 HydrophobicContact CD1-CD2 3.8Å; I172-L174 HydrophobicContact CD1-CG 4.01Å; I172-L174 HydrophobicContact CG1-CG 4.36Å; L174-A184 HydrophobicContact CB-CB 4.05Å; L174-A184 HydrophobicContact CD1-CB 4.2Å; L174-Y187 HydrophobicContact CD1-CD1 3.56Å; L174-Y187 HydrophobicContact CD1-CE1 4.22Å; L174-Y187 HydrophobicContact CD1-CG 4.38Å; L174-V195 HydrophobicContact CD1-CG1 4.06Å; L174-V195 HydrophobicContact CD1-CG2 3.68Å; L174-V195 HydrophobicContact CG-CG1 4.38Å; L174-V195 HydrophobicContact CG-CG2 4.47Å; L174-H197 PolarHBondContact N-O 2.9Å; L174-L198 HydrophobicContact CB-CD1 4.05Å; L174-I199 PolarHBondContact O-N 3.4Å
175	L	98.8	Very high	98.2	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	106.4	166.3	171.7	60.6	0	0	0	108.4	L103 V104 L105 L106 W116 L123 I199 A201 F366 I370	L103-L175 HydrophobicContact CD1-CB 3.87Å; V104-L175 PolarHBondContact O-N 3.31Å; L105-L175 CarbonylContact C-O 3.56Å; L105-L175 WeakPolarHBondContact CA-O 3.28Å; L105-L175 HydrophobicContact CD2-CB 3.74Å; L105-L175 HydrophobicContact CD2-CD2 3.65Å; L105-L175 HydrophobicContact CD2-CG 3.98Å; L106-L175 PolarHBondContact N-O 3.31Å; W116-L175 HydrophobicContact CH2-CD2 4.28Å; W116-L175 HydrophobicContact CH2-CG 4.13Å; W116-L175 HydrophobicContact CZ3-CD2 4.15Å; W116-L175 HydrophobicContact CZ3-CG 4.5Å; L123-L175 HydrophobicContact CD1-CD2 4.47Å; L175-I199 WeakPolarHBondContact CA-O 3.21Å; L175-I199 HydrophobicContact CB-CB 4.36Å; L175-I199 HydrophobicContact CD1-CB 3.7Å; L175-I199 HydrophobicContact CD1-CG2 3.51Å; L175-A201 HydrophobicContact CD1-CB 4.12Å; L175-F366 HydrophobicContact CD1-CZ 4.17Å; L175-F366 HydrophobicContact CD2-CE1 4.03Å; L175-F366 HydrophobicContact CD2-CZ 3.98Å; L175-I370 HydrophobicContact CD1-CD1 3.75Å; L175-I370 HydrophobicContact CD2-CD1 3.76Å; L175-I370 HydrophobicContact CD2-CG1 4.02Å; L175-I370 HydrophobicContact CD2-CG2 4.34Å; L175-I370 HydrophobicContact CG-CD1 4.43Å
176	G	98.8	Very high	98.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	138.6	178.4	0	0	0	0	0	111.9	A181 I199 A201	G176-A181 VanDerWaalsContact O-CB 3.3Å; G176-A181 WeakPolarHBondContact O-CB 3.44Å; G176-I199 PolarHBondContact N-O 3.32Å; G176-A201 PolarHBondContact O-N 2.96Å
177	H	98.5	Very high	98.3	Very high	4 Å²	4	23.2 Å²	23.2	2%	0.019	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	130.1	169.8	172.2	-110.5	0	0	0	111.2	L106 G108 W116 L179 G180 A201 H356 Y359	L106-H177 PolarHBondContact O-N 2.78Å; G108-H177 VanDerWaalsContact CA-O 3.26Å; G108-H177 WeakPolarHBondContact CA-O 3.42Å; G108-H177 PolarHBondContact N-O 3.06Å; W116-H177 HydrophobicContact CH2-CB 3.81Å; W116-H177 HydrophobicContact CZ2-CB 3.61Å; H177-L179 PolarHBondContact O-N 3.04Å; H177-L179 VanDerWaalsContact O-N 3.13Å; H177-G180 WeakPolarHBondContact O-CA 3.44Å; H177-G180 PolarHBondContact O-N 2.99Å; H177-A201 VanDerWaalsContact CA-O 3.26Å; H177-A201 WeakPolarHBondContact CA-O 3.46Å; H177-A201 HydrophobicContact CB-CB 4.47Å; H177-A201 PolarHBondContact CD2-O 3.32Å; H177-A201 VanDerWaalsContact CD2-O 3.31Å; H177-H356 AromaticContact CE1-CD2 3.8Å; H177-H356 AromaticContact CE1-NE2 3.57Å; H177-H356 AromaticContact NE2-CD2 3.8Å; H177-H356 AromaticContact NE2-CE1 3.84Å; H177-H356 AromaticContact NE2-NE2 3.64Å; H177-H356 PolarHBondContact NE2-O 3.23Å; H177-Y359 HydrophobicContact CB-CD1 4.44Å; H177-Y359 HydrophobicContact CB-CE1 4.32Å; H177-Y359 AromaticContact CD2-CD1 3.91Å; H177-Y359 AromaticContact CD2-CE1 3.73Å; H177-Y359 AromaticContact CE1-CE1 3.73Å; H177-Y359 AromaticContact CG-CD1 3.98Å; H177-Y359 AromaticContact CG-CE1 3.59Å; H177-Y359 AromaticContact ND1-CE1 3.59Å; H177-Y359 AromaticContact NE2-CE1 3.8Å
178	S	97.1	Very high	98.3	Very high	9 Å²	9	21.9 Å²	21.9	6%	0.063	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	-117.2	172.3	-172.5	0	0	0	0	112.4	G180 A181 Y182 A201 D202 W204 H356	S178-G180 VanDerWaalsContact C-N 3.28Å; S178-G180 PolarHBondContact O-N 3.45Å; S178-A181 WeakPolarHBondContact O-CB 3.39Å; S178-A181 PolarHBondContact O-N 2.77Å; S178-Y182 PolarHBondContact O-N 3.31Å; S178-A201 PolarHBondContact N-O 3.36Å; S178-D202 WeakPolarHBondContact CA-O 3.23Å; S178-D202 PolarHBondContact N-O 2.96Å; S178-W204 PolarHBondContact O-N 3.45Å; S178-H356 VanDerWaalsContact CB-CE1 3.43Å; S178-H356 WeakPolarHBondContact CB-CE1 3.49Å; S178-H356 VanDerWaalsContact CB-NE2 3.33Å; S178-H356 WeakPolarHBondContact CB-NE2 3.11Å; S178-H356 PolarHBondContact OG-CE1 3.17Å; S178-H356 VanDerWaalsContact OG-CE1 3.23Å; S178-H356 PolarHBondContact OG-NE2 3.37Å
179	L	97.7	Very high	98.3	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-54.7	-40.5	171.3	175.4	58.3	0	0	0	112.7	L109 F137 H177 A181 Y182 I183 W204 F291 I294	L109-L179 HydrophobicContact CB-CB 4.45Å; L109-L179 HydrophobicContact CB-CD2 4.27Å; L109-L179 HydrophobicContact CD1-CD2 4.1Å; F137-L179 HydrophobicContact CE2-CD2 3.93Å; F137-L179 HydrophobicContact CZ-CD2 3.94Å; H177-L179 PolarHBondContact O-N 3.04Å; H177-L179 VanDerWaalsContact O-N 3.13Å; L179-A181 PolarHBondContact O-N 3.28Å; L179-Y182 WeakPolarHBondContact O-CB 3.42Å; L179-Y182 PolarHBondContact O-N 3.12Å; L179-Y182 VanDerWaalsContact O-N 3.11Å; L179-I183 HydrophobicContact CD1-CD1 4.13Å; L179-I183 HydrophobicContact CD1-CG1 4.22Å; L179-I183 HydrophobicContact CG-CD1 3.91Å; L179-I183 HydrophobicContact CG-CG1 4.46Å; L179-I183 WeakPolarHBondContact O-CG1 3.29Å; L179-I183 PolarHBondContact O-N 3.21Å; L179-W204 HydrophobicContact CD1-CE3 4.13Å; L179-W204 HydrophobicContact CD1-CZ3 4.1Å; L179-F291 HydrophobicContact CD1-CD2 3.75Å; L179-F291 HydrophobicContact CD1-CE2 4.14Å; L179-F291 HydrophobicContact CD2-CD2 3.88Å; L179-F291 HydrophobicContact CG-CD2 4.29Å; L179-I294 HydrophobicContact CD1-CD1 4.14Å
180	G	98.7	Very high	98.3	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-60.8	-29.8	175.4	0	0	0	0	0	112.6	H107 H177 S178 A184	H107-G180 WeakPolarHBondContact O-CA 3.11Å; H107-G180 PolarHBondContact O-N 2.84Å; H177-G180 WeakPolarHBondContact O-CA 3.44Å; H177-G180 PolarHBondContact O-N 2.99Å; S178-G180 VanDerWaalsContact C-N 3.28Å; S178-G180 PolarHBondContact O-N 3.45Å; G180-A184 VanDerWaalsContact O-CB 3.23Å; G180-A184 WeakPolarHBondContact O-CB 3.15Å; G180-A184 PolarHBondContact O-N 3.27Å
181	A	98.7	Very high	98.4	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-71.7	-38.9	174.6	0	0	0	0	0	112.1	G176 S178 L179 S185 L200 P203	G176-A181 VanDerWaalsContact O-CB 3.3Å; G176-A181 WeakPolarHBondContact O-CB 3.44Å; S178-A181 WeakPolarHBondContact O-CB 3.39Å; S178-A181 PolarHBondContact O-N 2.77Å; L179-A181 PolarHBondContact O-N 3.28Å; A181-S185 WeakPolarHBondContact O-CB 3.24Å; A181-S185 PolarHBondContact O-N 2.85Å; A181-S185 PolarHBondContact O-OG 3.11Å; A181-L200 HydrophobicContact CB-CB 4.41Å; A181-L200 HydrophobicContact CB-CD2 3.79Å; A181-L200 WeakPolarHBondContact O-CD2 3.12Å; A181-P203 HydrophobicContact CB-CB 3.49Å; A181-P203 VanDerWaalsContact CB-CB 3.49Å
182	Y	98.5	Very high	98.4	Very high	1 Å²	1	9.7 Å²	9.7	0%	0.004	5%	0.049	C	C	.	.	H	α-helix	trans	-60.6	-49.4	172.2	-177.8	-86.2	0	0	0	111	E153 S178 L179 S185 A186 W204 I294 A301 R303 M305 R308	E153-Y182 HydrophobicContact CG-CE1 4.25Å; E153-Y182 WeakPolarHBondContact OE2-CE1 3.29Å; E153-Y182 PolarHBondContact OE2-OH 2.8Å; S178-Y182 PolarHBondContact O-N 3.31Å; L179-Y182 WeakPolarHBondContact O-CB 3.42Å; L179-Y182 PolarHBondContact O-N 3.12Å; L179-Y182 VanDerWaalsContact O-N 3.11Å; Y182-S185 WeakPolarHBondContact O-CB 3.2Å; Y182-S185 PolarHBondContact O-N 3.34Å; Y182-A186 PolarHBondContact O-N 3.46Å; Y182-W204 HydrophobicContact CD1-CZ3 4.4Å; Y182-W204 HydrophobicContact CD2-CE3 4.22Å; Y182-W204 HydrophobicContact CD2-CZ3 4.02Å; Y182-W204 HydrophobicContact CE2-CZ3 4.4Å; Y182-W204 HydrophobicContact CG-CE3 4.16Å; Y182-W204 HydrophobicContact CG-CZ3 4.02Å; Y182-I294 HydrophobicContact CD1-CD1 4.08Å; Y182-I294 HydrophobicContact CE1-CD1 3.82Å; Y182-A301 HydrophobicContact CE2-CB 3.96Å; Y182-R303 PolarHBondContact OH-O 2.7Å; Y182-M305 HydrophobicContact CD1-CE 4.2Å; Y182-M305 HydrophobicContact CD2-CE 3.71Å; Y182-M305 HydrophobicContact CD2-CG 3.85Å; Y182-M305 HydrophobicContact CE1-CE 3.89Å; Y182-M305 HydrophobicContact CE2-CE 3.39Å; Y182-M305 HydrophobicContact CE2-CG 4.05Å; Y182-M305 HydrophobicContact CG-CE 4.1Å; Y182-M305 VanDerWaalsContact CZ-CE 3.47Å; Y182-R308 PolarHBondContact OH-NH1 3.3Å
183	I	98.7	Very high	98.4	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.01	8%	0.076	C	C	.	.	H	α-helix	trans	-62	-46.1	178.4	-65.8	167.4	0	0	0	110.9	L106 V134 W156 L160 L179 S185 A186 Y187	L106-I183 HydrophobicContact CD1-CB 4.48Å; L106-I183 HydrophobicContact CD1-CG2 4.13Å; V134-I183 HydrophobicContact CB-CD1 4.39Å; V134-I183 HydrophobicContact CG2-CD1 4.16Å; W156-I183 HydrophobicContact CB-CD1 4.36Å; W156-I183 HydrophobicContact CB-CG1 4.23Å; W156-I183 HydrophobicContact CB-CG2 3.89Å; W156-I183 HydrophobicContact CD2-CD1 3.72Å; W156-I183 HydrophobicContact CD2-CG1 4.02Å; W156-I183 HydrophobicContact CE3-CD1 4.2Å; W156-I183 HydrophobicContact CE3-CG1 4.1Å; W156-I183 HydrophobicContact CG-CD1 3.8Å; W156-I183 HydrophobicContact CG-CG1 4.1Å; W156-I183 HydrophobicContact CG-CG2 4.45Å; L160-I183 HydrophobicContact CD1-CG2 3.54Å; L179-I183 HydrophobicContact CD1-CD1 4.13Å; L179-I183 HydrophobicContact CD1-CG1 4.22Å; L179-I183 HydrophobicContact CG-CD1 3.91Å; L179-I183 HydrophobicContact CG-CG1 4.46Å; L179-I183 WeakPolarHBondContact O-CG1 3.29Å; L179-I183 PolarHBondContact O-N 3.21Å; I183-S185 PolarHBondContact O-N 2.91Å; I183-A186 PolarHBondContact O-N 3.03Å; I183-Y187 WeakPolarHBondContact O-CB 3.42Å; I183-Y187 PolarHBondContact O-N 3.18Å
184	A	98.9	Very high	98.4	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-58.1	-38.2	176.3	0	0	0	0	0	112.2	L106 L174 G180 A188 L198	L106-A184 HydrophobicContact CD1-CB 3.96Å; L174-A184 HydrophobicContact CB-CB 4.05Å; L174-A184 HydrophobicContact CD1-CB 4.2Å; G180-A184 VanDerWaalsContact O-CB 3.23Å; G180-A184 WeakPolarHBondContact O-CB 3.15Å; G180-A184 PolarHBondContact O-N 3.27Å; A184-A188 VanDerWaalsContact O-CB 3.32Å; A184-A188 WeakPolarHBondContact O-CB 3.28Å; A184-A188 PolarHBondContact O-N 2.88Å; A184-L198 HydrophobicContact CB-CD1 3.64Å
185	S	98.8	Very high	98.3	Very high	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-69.9	-44.1	178.3	-57.6	0	0	0	0	112.1	A181 Y182 I183 Y187 A188 L189 L200 F206	A181-S185 WeakPolarHBondContact O-CB 3.24Å; A181-S185 PolarHBondContact O-N 2.85Å; A181-S185 PolarHBondContact O-OG 3.11Å; Y182-S185 WeakPolarHBondContact O-CB 3.2Å; Y182-S185 PolarHBondContact O-N 3.34Å; I183-S185 PolarHBondContact O-N 2.91Å; S185-Y187 VanDerWaalsContact C-N 3.33Å; S185-Y187 PolarHBondContact O-N 3.16Å; S185-A188 PolarHBondContact O-N 3.13Å; S185-L189 WeakPolarHBondContact O-CG 3.47Å; S185-L189 PolarHBondContact O-N 3.46Å; S185-L200 WeakPolarHBondContact OG-CD2 3.3Å; S185-F206 WeakPolarHBondContact OG-CZ 3.43Å
186	A	98.7	Very high	98.2	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-59.5	-45.1	174.2	0	0	0	0	0	111.1	E153 V157 Y182 I183 L189 E190 M305	E153-A186 HydrophobicContact CG-CB 3.77Å; V157-A186 HydrophobicContact CG2-CB 3.72Å; Y182-A186 PolarHBondContact O-N 3.46Å; I183-A186 PolarHBondContact O-N 3.03Å; A186-L189 PolarHBondContact O-N 2.66Å; A186-E190 PolarHBondContact O-N 2.89Å; A186-M305 HydrophobicContact CB-CE 4.12Å
187	Y	98.9	Very high	98.1	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-60.6	-47.6	175.1	179.1	-86.9	0	0	0	112	V157 L160 E161 R164 I172 L174 I183 S185 L189 E190 H191 V195	V157-Y187 HydrophobicContact CG1-CD2 4.09Å; L160-Y187 HydrophobicContact CB-CD2 3.67Å; L160-Y187 HydrophobicContact CB-CE2 3.98Å; L160-Y187 HydrophobicContact CB-CG 4.45Å; L160-Y187 HydrophobicContact CD1-CD2 4.41Å; L160-Y187 HydrophobicContact CD1-CG 4.46Å; E161-Y187 HydrophobicContact CB-CE2 3.86Å; E161-Y187 PolarHBondContact OE2-OH 3.28Å; R164-Y187 VanDerWaalsContact CD-OH 3.22Å; R164-Y187 WeakPolarHBondContact CD-OH 3.36Å; R164-Y187 PolarHBondContact NE-OH 3.28Å; R164-Y187 VanDerWaalsContact NE-OH 3.13Å; I172-Y187 HydrophobicContact CD1-CE1 4.12Å; L174-Y187 HydrophobicContact CD1-CD1 3.56Å; L174-Y187 HydrophobicContact CD1-CE1 4.22Å; L174-Y187 HydrophobicContact CD1-CG 4.38Å; I183-Y187 WeakPolarHBondContact O-CB 3.42Å; I183-Y187 PolarHBondContact O-N 3.18Å; S185-Y187 VanDerWaalsContact C-N 3.33Å; S185-Y187 PolarHBondContact O-N 3.16Å; Y187-L189 VanDerWaalsContact C-N 3.25Å; Y187-L189 PolarHBondContact O-N 3.13Å; Y187-E190 PolarHBondContact O-N 3.08Å; Y187-H191 HydrophobicContact CD1-CB 4.34Å; Y187-H191 AromaticContact CD2-CD2 3.75Å; Y187-H191 HydrophobicContact CE1-CB 3.89Å; Y187-H191 HydrophobicContact CE2-CB 4.11Å; Y187-H191 AromaticContact CE2-CD2 3.45Å; Y187-H191 VanDerWaalsContact CE2-CD2 3.45Å; Y187-H191 WeakPolarHBondContact CE2-CD2 3.36Å; Y187-H191 AromaticContact CZ-CD2 3.98Å; Y187-H191 WeakPolarHBondContact O-CB 3.47Å; Y187-H191 PolarHBondContact O-N 3.5Å; Y187-V195 HydrophobicContact CD1-CG2 3.7Å; Y187-V195 HydrophobicContact CE1-CG2 3.54Å
188	A	98.7	Very high	98.1	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-61.6	-32.7	179.1	0	0	0	0	0	112.9	A184 S185 P192 V195 L198 I312 F316	A184-A188 VanDerWaalsContact O-CB 3.32Å; A184-A188 WeakPolarHBondContact O-CB 3.28Å; A184-A188 PolarHBondContact O-N 2.88Å; S185-A188 PolarHBondContact O-N 3.13Å; A188-P192 WeakPolarHBondContact O-CA 3.28Å; A188-P192 VanDerWaalsContact O-CB 3.26Å; A188-P192 WeakPolarHBondContact O-CB 3.04Å; A188-P192 WeakPolarHBondContact O-CD 3.26Å; A188-V195 HydrophobicContact CB-CG2 4.29Å; A188-L198 HydrophobicContact CB-CD1 4.49Å; A188-L198 HydrophobicContact CB-CD2 4.14Å; A188-I312 HydrophobicContact CB-CD1 4.34Å; A188-I312 WeakPolarHBondContact O-CD1 3.39Å; A188-F316 HydrophobicContact CB-CE1 4.29Å; A188-F316 HydrophobicContact CB-CZ 3.74Å
189	L	98.4	Very high	98.2	Very high	36 Å²	36	18.9 Å²	18.9	19%	0.188	10%	0.095	C	C	.	.	H	α-helix	trans	-68.5	-37.4	175.9	-76.9	166.9	0	0	0	112.7	S185 A186 Y187 M305 R308 L309 L311 I312	S185-L189 WeakPolarHBondContact O-CG 3.47Å; S185-L189 PolarHBondContact O-N 3.46Å; A186-L189 PolarHBondContact O-N 2.66Å; Y187-L189 VanDerWaalsContact C-N 3.25Å; Y187-L189 PolarHBondContact O-N 3.13Å; L189-M305 HydrophobicContact CD1-SD 4.13Å; L189-R308 HydrophobicContact CD1-CB 3.9Å; L189-L309 HydrophobicContact CG-CD2 4.49Å; L189-L311 HydrophobicContact CD2-CB 4.41Å; L189-I312 HydrophobicContact CD2-CB 4.18Å; L189-I312 HydrophobicContact CD2-CD1 4.01Å; L189-I312 HydrophobicContact CG-CD1 4.4Å
190	E	98.3	Very high	98.2	Very high	88 Å²	88	18.9 Å²	18.9	41%	0.411	10%	0.095	S	C	.	.	H	α-helix	trans	-86.5	-29.9	-179.3	-67	-172.8	-153.8	0	0	113.1	V157 A186 Y187 P192	V157-E190 HydrophobicContact CG1-CB 4.12Å; V157-E190 HydrophobicContact CG1-CG 4.39Å; V157-E190 WeakPolarHBondContact CG1-OE2 3.47Å; A186-E190 PolarHBondContact O-N 2.89Å; Y187-E190 PolarHBondContact O-N 3.08Å; E190-P192 WeakPolarHBondContact O-CD 3.35Å
191	H	98.3	Very high	98.2	Very high	33 Å²	33	18.9 Å²	18.9	15%	0.153	10%	0.095	C	C	.	.			trans	-126.9	49.1	-174.6	-64.6	-53.9	0	0	0	113.1	Y187 D193 F194	Y187-H191 HydrophobicContact CD1-CB 4.34Å; Y187-H191 AromaticContact CD2-CD2 3.75Å; Y187-H191 HydrophobicContact CE1-CB 3.89Å; Y187-H191 HydrophobicContact CE2-CB 4.11Å; Y187-H191 AromaticContact CE2-CD2 3.45Å; Y187-H191 VanDerWaalsContact CE2-CD2 3.45Å; Y187-H191 WeakPolarHBondContact CE2-CD2 3.36Å; Y187-H191 AromaticContact CZ-CD2 3.98Å; Y187-H191 WeakPolarHBondContact O-CB 3.47Å; Y187-H191 PolarHBondContact O-N 3.5Å; H191-D193 PolarHBondContact O-N 3.42Å; H191-D193 VanDerWaalsContact O-N 3.13Å; H191-F194 HydrophobicContact CB-CD2 4.05Å; H191-F194 PolarHBondContact O-N 3.21Å; H191-F194 VanDerWaalsContact O-N 3.16Å
192	P	97.5	Very high	98.2	Very high	24 Å²	24	18.9 Å²	18.9	16%	0.156	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-20.8	-170	28.6	-37.6	0	0	0	114.1	A188 E190 F194 I312 R313 F316	A188-P192 WeakPolarHBondContact O-CA 3.28Å; A188-P192 VanDerWaalsContact O-CB 3.26Å; A188-P192 WeakPolarHBondContact O-CB 3.04Å; A188-P192 WeakPolarHBondContact O-CD 3.26Å; E190-P192 WeakPolarHBondContact O-CD 3.35Å; P192-F194 VanDerWaalsContact C-N 3.29Å; P192-I312 HydrophobicContact CB-CD1 4.21Å; P192-R313 HydrophobicContact CB-CB 4.3Å; P192-R313 HydrophobicContact CB-CG 3.79Å; P192-R313 PolarHBondContact O-NE 2.79Å; P192-R313 PolarHBondContact O-NH2 3.29Å; P192-F316 HydrophobicContact CB-CD2 4.43Å; P192-F316 HydrophobicContact CB-CE2 4.25Å
193	D	96.9	Very high	98.1	Very high	110 Å²	110	18.9 Å²	18.9	59%	0.588	10%	0.095	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-22.6	-180	-65	-26.9	0	0	0	112.7	H191	H191-D193 PolarHBondContact O-N 3.42Å; H191-D193 VanDerWaalsContact O-N 3.13Å
194	F	97.9	Very high	98	Very high	67 Å²	67	19.1 Å²	19.1	29%	0.294	10%	0.096	S	C	.	.	S	Bend	trans	-97.5	-5.1	-178.9	-53.8	-55.6	0	0	0	112.9	R164 D170 K171 I172 H191 P192	R164-F194 VanDerWaalsContact CZ-CG 3.48Å; D170-F194 VanDerWaalsContact O-CD1 3.3Å; D170-F194 WeakPolarHBondContact O-CD1 3.39Å; K171-F194 CarbonylContact C-O 3.56Å; K171-F194 WeakPolarHBondContact CA-O 3.3Å; I172-F194 WeakPolarHBondContact CG1-O 3.2Å; I172-F194 PolarHBondContact N-O 3.5Å; H191-F194 HydrophobicContact CB-CD2 4.05Å; H191-F194 PolarHBondContact O-N 3.21Å; H191-F194 VanDerWaalsContact O-N 3.16Å; P192-F194 VanDerWaalsContact C-N 3.29Å
195	V	98	Very high	97.8	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	121.8	177.5	-174.2	0	0	0	0	110.4	I172 L174 Y187 A188 H197 R313 F316	I172-V195 HydrophobicContact CG1-CG2 4.47Å; I172-V195 CarbonylContact O-C 3.59Å; I172-V195 WeakPolarHBondContact O-CA 3.21Å; L174-V195 HydrophobicContact CD1-CG1 4.06Å; L174-V195 HydrophobicContact CD1-CG2 3.68Å; L174-V195 HydrophobicContact CG-CG1 4.38Å; L174-V195 HydrophobicContact CG-CG2 4.47Å; Y187-V195 HydrophobicContact CD1-CG2 3.7Å; Y187-V195 HydrophobicContact CE1-CG2 3.54Å; A188-V195 HydrophobicContact CB-CG2 4.29Å; V195-H197 WeakPolarHBondContact CG1-O 3.29Å; V195-R313 PolarHBondContact O-NH2 3Å; V195-F316 HydrophobicContact CB-CE2 3.89Å; V195-F316 HydrophobicContact CB-CZ 3.75Å; V195-F316 HydrophobicContact CG1-CE2 4.18Å; V195-F316 HydrophobicContact CG1-CZ 3.58Å; V195-F316 WeakPolarHBondContact O-CE2 3.35Å
196	N	95.7	Very high	97.6	Very high	30 Å²	30	19.4 Å²	19.4	16%	0.16	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-39	180	-160.3	46.8	0	0	0	112	T101 I172 P317 T377	T101-N196 HydrophobicContact CG2-CB 4.02Å; I172-N196 PolarHBondContact O-N 2.77Å; N196-P317 WeakPolarHBondContact O-CD 3.31Å; N196-T377 HydrophobicContact CB-CG2 4.46Å; N196-T377 VanDerWaalsContact CG-CG2 3.41Å; N196-T377 WeakPolarHBondContact ND2-CG2 3.43Å
197	H	97.7	Very high	97.2	Very high	5 Å²	5	20.8 Å²	20.8	2%	0.023	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	140.6	-179.1	-160.2	148.1	0	0	0	108.2	T173 L174 V195 P317 T319 A373 T377	T173-H197 HydrophobicContact CG2-CB 3.77Å; T173-H197 WeakPolarHBondContact CG2-O 3.48Å; L174-H197 PolarHBondContact N-O 2.9Å; V195-H197 WeakPolarHBondContact CG1-O 3.29Å; H197-P317 HydrophobicContact CB-CB 4.39Å; H197-P317 PolarHBondContact CD2-O 3.13Å; H197-P317 VanDerWaalsContact CD2-O 3.29Å; H197-T319 PolarHBondContact NE2-OG1 3.4Å; H197-A373 PolarHBondContact CE1-O 3.4Å; H197-A373 PolarHBondContact ND1-O 2.85Å; H197-T377 PolarHBondContact ND1-OG1 3.01Å
198	L	98.4	Very high	96.8	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	115.7	171.9	178.8	64.9	0	0	0	110.3	L174 A184 A188 L200 L309 F316 P317 I318 T319	L174-L198 HydrophobicContact CB-CD1 4.05Å; A184-L198 HydrophobicContact CB-CD1 3.64Å; A188-L198 HydrophobicContact CB-CD1 4.49Å; A188-L198 HydrophobicContact CB-CD2 4.14Å; L198-L200 HydrophobicContact CD1-CD2 3.79Å; L198-L200 HydrophobicContact CD2-CD1 4.25Å; L198-L200 HydrophobicContact CD2-CD2 4.09Å; L198-L200 HydrophobicContact CD2-CG 4.38Å; L198-L200 HydrophobicContact CG-CD1 4.35Å; L198-L200 HydrophobicContact CG-CD2 3.74Å; L198-L200 HydrophobicContact CG-CG 3.98Å; L198-L309 HydrophobicContact CD2-CD2 4.26Å; L198-F316 HydrophobicContact CB-CE1 3.63Å; L198-F316 HydrophobicContact CB-CZ 4.24Å; L198-F316 HydrophobicContact CD2-CE1 4.39Å; L198-P317 PolarHBondContact N-O 3.18Å; L198-I318 HydrophobicContact CB-CG1 4.47Å; L198-I318 CarbonylContact O-C 3.45Å; L198-I318 VanDerWaalsContact O-CA 3.28Å; L198-I318 WeakPolarHBondContact O-CA 3.27Å; L198-T319 PolarHBondContact O-N 3.44Å
199	I	98.6	Very high	96	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	128.4	177.8	-48	173.9	0	0	0	109	T173 L174 L175 G176 T319 I321 I370 A373 L374	T173-I199 HydrophobicContact CG2-CD1 4.1Å; T173-I199 HydrophobicContact CG2-CG1 4.39Å; L174-I199 PolarHBondContact O-N 3.4Å; L175-I199 WeakPolarHBondContact CA-O 3.21Å; L175-I199 HydrophobicContact CB-CB 4.36Å; L175-I199 HydrophobicContact CD1-CB 3.7Å; L175-I199 HydrophobicContact CD1-CG2 3.51Å; G176-I199 PolarHBondContact N-O 3.32Å; I199-T319 CarbonylContact C-O 3.5Å; I199-T319 WeakPolarHBondContact CA-O 3.5Å; I199-T319 HydrophobicContact CG2-CG2 4.39Å; I199-I321 HydrophobicContact CG2-CD1 3.71Å; I199-I321 HydrophobicContact CG2-CG1 4.42Å; I199-I370 HydrophobicContact CD1-CD1 4.23Å; I199-I370 HydrophobicContact CD1-CG2 4.25Å; I199-I370 HydrophobicContact CG2-CD1 3.59Å; I199-A373 HydrophobicContact CD1-CB 4.25Å; I199-L374 HydrophobicContact CD1-CD2 3.97Å; I199-L374 HydrophobicContact CD1-CG 4.18Å
200	L	98.7	Very high	95.2	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	97.4	-167.4	-58.9	171.6	0	0	0	109	A181 S185 L198 P203 F206 I318 T319 F320 I321	A181-L200 HydrophobicContact CB-CB 4.41Å; A181-L200 HydrophobicContact CB-CD2 3.79Å; A181-L200 WeakPolarHBondContact O-CD2 3.12Å; S185-L200 WeakPolarHBondContact OG-CD2 3.3Å; L198-L200 HydrophobicContact CD1-CD2 3.79Å; L198-L200 HydrophobicContact CD2-CD1 4.25Å; L198-L200 HydrophobicContact CD2-CD2 4.09Å; L198-L200 HydrophobicContact CD2-CG 4.38Å; L198-L200 HydrophobicContact CG-CD1 4.35Å; L198-L200 HydrophobicContact CG-CD2 3.74Å; L198-L200 HydrophobicContact CG-CG 3.98Å; L200-P203 HydrophobicContact CB-CB 4.21Å; L200-P203 HydrophobicContact CB-CG 4.19Å; L200-F206 HydrophobicContact CD1-CE1 3.6Å; L200-F206 HydrophobicContact CD1-CZ 3.47Å; L200-F206 VanDerWaalsContact CD1-CZ 3.47Å; L200-F206 HydrophobicContact CD2-CZ 4.03Å; L200-F206 HydrophobicContact CG-CZ 4.28Å; L200-I318 HydrophobicContact CD1-CG2 3.82Å; L200-T319 PolarHBondContact N-O 3.3Å; L200-F320 HydrophobicContact CB-CD1 4.08Å; L200-F320 HydrophobicContact CB-CE1 4.44Å; L200-F320 HydrophobicContact CD1-CD1 3.81Å; L200-F320 HydrophobicContact CD1-CE1 3.4Å; L200-F320 VanDerWaalsContact CD1-CE1 3.4Å; L200-F320 HydrophobicContact CD1-CE2 4.18Å; L200-F320 HydrophobicContact CD1-CG 4.38Å; L200-F320 HydrophobicContact CD1-CZ 3.6Å; L200-I321 PolarHBondContact O-N 2.85Å
201	A	98.5	Very high	94.1	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	111.8	178.8	0	0	0	0	0	110.3	L175 G176 H177 S178 V358 F366	L175-A201 HydrophobicContact CD1-CB 4.12Å; G176-A201 PolarHBondContact O-N 2.96Å; H177-A201 VanDerWaalsContact CA-O 3.26Å; H177-A201 WeakPolarHBondContact CA-O 3.46Å; H177-A201 HydrophobicContact CB-CB 4.47Å; H177-A201 PolarHBondContact CD2-O 3.32Å; H177-A201 VanDerWaalsContact CD2-O 3.31Å; S178-A201 PolarHBondContact N-O 3.36Å; A201-V358 HydrophobicContact CB-CG2 3.88Å; A201-F366 HydrophobicContact CB-CE2 3.88Å; A201-F366 HydrophobicContact CB-CZ 4Å
202	D	97.3	Very high	92.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.189	C	C	.	.	S	Bend	trans	42	59.7	179.4	-147.5	81.5	0	0	0	112.6	S178 I321 G323 S326 T328 H356 V358	S178-D202 WeakPolarHBondContact CA-O 3.23Å; S178-D202 PolarHBondContact N-O 2.96Å; D202-I321 WeakPolarHBondContact CA-O 3.15Å; D202-I321 PolarHBondContact N-O 3.1Å; D202-G323 PolarHBondContact OD1-N 3.4Å; D202-S326 VanDerWaalsContact CG-OG 3.27Å; D202-S326 WeakPolarHBondContact OD1-CB 3.3Å; D202-S326 PolarHBondContact OD1-OG 2.87Å; D202-S326 WeakPolarHBondContact OD2-CB 3.34Å; D202-S326 PolarHBondContact OD2-OG 2.58Å; D202-T328 PolarHBondContact OD1-OG1 3.15Å; D202-T328 VanDerWaalsContact OD1-OG1 3.09Å; D202-T328 WeakPolarHBondContact OD2-CG2 3.44Å; D202-T328 PolarHBondContact OD2-OG1 2.88Å; D202-H356 WeakPolarHBondContact CB-O 3.42Å; D202-H356 PolarHBondContact O-CE1 2.94Å; D202-H356 IonicContact OD2-CE1 2.72Å; D202-H356 IonicContact OD2-CG 3.62Å; D202-H356 IonicContact OD2-ND1 3.18Å; D202-H356 PolarHBondContact OD2-ND1 3.25Å; D202-V358 HydrophobicContact CB-CG1 4.25Å; D202-V358 HydrophobicContact CB-CG2 4.3Å
203	P	97.9	Very high	90.3	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.013	20%	0.202	C	C	.	.			trans	-72.4	142	-162.3	30.9	-38.9	0	0	0	113	A181 L200 F206 F320 Y322	A181-P203 HydrophobicContact CB-CB 3.49Å; A181-P203 VanDerWaalsContact CB-CB 3.49Å; L200-P203 HydrophobicContact CB-CB 4.21Å; L200-P203 HydrophobicContact CB-CG 4.19Å; P203-F206 HydrophobicContact CB-CD2 3.52Å; P203-F206 HydrophobicContact CB-CE2 3.42Å; P203-F206 VanDerWaalsContact CB-CE2 3.42Å; P203-F206 HydrophobicContact CB-CG 4.22Å; P203-F206 HydrophobicContact CB-CZ 4.01Å; P203-F206 HydrophobicContact CG-CD2 3.99Å; P203-F206 HydrophobicContact CG-CE2 4.14Å; P203-F206 HydrophobicContact CG-CG 4.18Å; P203-F206 HydrophobicContact CG-CZ 4.42Å; P203-F320 HydrophobicContact CG-CD1 4.12Å; P203-F320 HydrophobicContact CG-CE1 4.38Å; P203-Y322 HydrophobicContact CG-CE1 3.85Å
204	W	95.7	Very high	88.3	Confident	7 Å²	7	37.3 Å²	37.3	3%	0.027	20%	0.201	C	C	.	.	S	Bend	trans	-94.8	152.2	172.2	172.5	72.7	0	0	0	111.4	S178 L179 Y182 F206 F291 I294 S295 A299 A301 W327	S178-W204 PolarHBondContact O-N 3.45Å; L179-W204 HydrophobicContact CD1-CE3 4.13Å; L179-W204 HydrophobicContact CD1-CZ3 4.1Å; Y182-W204 HydrophobicContact CD1-CZ3 4.4Å; Y182-W204 HydrophobicContact CD2-CE3 4.22Å; Y182-W204 HydrophobicContact CD2-CZ3 4.02Å; Y182-W204 HydrophobicContact CE2-CZ3 4.4Å; Y182-W204 HydrophobicContact CG-CE3 4.16Å; Y182-W204 HydrophobicContact CG-CZ3 4.02Å; W204-F206 WeakPolarHBondContact O-CD2 3.22Å; W204-F291 AromaticContact CD2-CE2 3.6Å; W204-F291 HydrophobicContact CD2-CE2 3.6Å; W204-F291 AromaticContact CD2-CZ 3.98Å; W204-F291 HydrophobicContact CD2-CZ 3.98Å; W204-F291 AromaticContact CE2-CE2 3.54Å; W204-F291 AromaticContact CE2-CZ 3.53Å; W204-F291 HydrophobicContact CE3-CD2 4.47Å; W204-F291 AromaticContact CE3-CE2 3.62Å; W204-F291 HydrophobicContact CE3-CE2 3.62Å; W204-F291 HydrophobicContact CE3-CZ 4.43Å; W204-F291 HydrophobicContact CG-CE2 4.48Å; W204-F291 HydrophobicContact CH2-CD2 4.09Å; W204-F291 AromaticContact CH2-CE2 3.49Å; W204-F291 HydrophobicContact CH2-CE2 3.49Å; W204-F291 VanDerWaalsContact CH2-CE2 3.49Å; W204-F291 HydrophobicContact CH2-CZ 4.04Å; W204-F291 HydrophobicContact CZ2-CD2 4.43Å; W204-F291 AromaticContact CZ2-CE2 3.48Å; W204-F291 HydrophobicContact CZ2-CE2 3.48Å; W204-F291 VanDerWaalsContact CZ2-CE2 3.48Å; W204-F291 AromaticContact CZ2-CZ 3.55Å; W204-F291 HydrophobicContact CZ2-CZ 3.55Å; W204-F291 HydrophobicContact CZ3-CD2 4.12Å; W204-F291 AromaticContact CZ3-CE2 3.57Å; W204-F291 HydrophobicContact CZ3-CE2 3.57Å; W204-F291 HydrophobicContact CZ3-CZ 4.46Å; W204-F291 AromaticContact NE1-CZ 3.96Å; W204-I294 HydrophobicContact CH2-CD1 3.7Å; W204-I294 HydrophobicContact CH2-CG1 3.92Å; W204-I294 HydrophobicContact CZ3-CD1 3.49Å; W204-I294 VanDerWaalsContact CZ3-CD1 3.49Å; W204-I294 HydrophobicContact CZ3-CG1 4.23Å; W204-S295 WeakPolarHBondContact CH2-OG 3.49Å; W204-S295 VanDerWaalsContact CZ2-OG 3.27Å; W204-S295 WeakPolarHBondContact CZ2-OG 3.5Å; W204-A299 PolarHBondContact NE1-O 3.14Å; W204-A301 HydrophobicContact CH2-CB 3.93Å; W204-A301 HydrophobicContact CZ2-CB 4.21Å; W204-A301 HydrophobicContact CZ3-CB 4.39Å; W204-W327 AromaticContact CD1-CH2 3.56Å; W204-W327 HydrophobicContact CG-CH2 4.39Å
205	G	94.7	Very high	86	Confident	5 Å²	5	38.9 Å²	38.9	5%	0.052	22%	0.216	C	C	.	.	S	Bend	trans	78.1	21.3	172.7	0	0	0	0	0	114.5	P304 M305	G205-P304 WeakPolarHBondContact O-CA 3.45Å; G205-M305 PolarHBondContact O-N 3.23Å
206	F	94.8	Very high	83.8	Confident	1 Å²	1	41.8 Å²	41.8	0%	0.004	24%	0.24	C	C	.	.			trans	-90.4	-59.1	-179.7	-87	-111.7	0	0	0	113.7	S185 L200 P203 W204 M305 V306 L309 F320 A332	S185-F206 WeakPolarHBondContact OG-CZ 3.43Å; L200-F206 HydrophobicContact CD1-CE1 3.6Å; L200-F206 HydrophobicContact CD1-CZ 3.47Å; L200-F206 VanDerWaalsContact CD1-CZ 3.47Å; L200-F206 HydrophobicContact CD2-CZ 4.03Å; L200-F206 HydrophobicContact CG-CZ 4.28Å; P203-F206 HydrophobicContact CB-CD2 3.52Å; P203-F206 HydrophobicContact CB-CE2 3.42Å; P203-F206 VanDerWaalsContact CB-CE2 3.42Å; P203-F206 HydrophobicContact CB-CG 4.22Å; P203-F206 HydrophobicContact CB-CZ 4.01Å; P203-F206 HydrophobicContact CG-CD2 3.99Å; P203-F206 HydrophobicContact CG-CE2 4.14Å; P203-F206 HydrophobicContact CG-CG 4.18Å; P203-F206 HydrophobicContact CG-CZ 4.42Å; W204-F206 WeakPolarHBondContact O-CD2 3.22Å; F206-M305 HydrophobicContact CD1-CB 3.8Å; F206-M305 HydrophobicContact CD2-CB 3.94Å; F206-M305 HydrophobicContact CD2-CG 4.22Å; F206-M305 HydrophobicContact CE1-CB 3.81Å; F206-M305 HydrophobicContact CE2-CB 3.92Å; F206-M305 HydrophobicContact CE2-CG 3.93Å; F206-M305 HydrophobicContact CG-CB 3.89Å; F206-M305 HydrophobicContact CZ-CB 3.88Å; F206-M305 HydrophobicContact CZ-CG 4.14Å; F206-M305 PolarHBondContact O-N 3.13Å; F206-V306 VanDerWaalsContact O-CB 3.32Å; F206-V306 WeakPolarHBondContact O-CB 3.38Å; F206-V306 VanDerWaalsContact O-CG1 3.23Å; F206-V306 WeakPolarHBondContact O-CG1 3.45Å; F206-V306 PolarHBondContact O-N 2.95Å; F206-V306 VanDerWaalsContact O-N 3.09Å; F206-L309 HydrophobicContact CD1-CD1 4.15Å; F206-L309 HydrophobicContact CE1-CD1 3.3Å; F206-L309 HydrophobicContact CZ-CD1 3.96Å; F206-F320 AromaticContact CD1-CE1 3.54Å; F206-F320 HydrophobicContact CD1-CE1 3.54Å; F206-F320 HydrophobicContact CD1-CZ 4.07Å; F206-F320 HydrophobicContact CE1-CD1 4.44Å; F206-F320 AromaticContact CE1-CE1 3.29Å; F206-F320 HydrophobicContact CE1-CE1 3.29Å; F206-F320 AromaticContact CE1-CZ 3.67Å; F206-F320 HydrophobicContact CE1-CZ 3.67Å; F206-F320 HydrophobicContact CZ-CE1 4.21Å; F206-A332 HydrophobicContact CB-CB 3.93Å
207	P	91.2	Very high	81.7	Confident	28 Å²	28	44 Å²	44	18%	0.182	25%	0.252	C	S	.	.	S	Bend	trans	-67.6	142.7	179.4	28.8	-35	0	0	0	109.9	W300 A332	P207-W300 HydrophobicContact CB-CH2 4.26Å; P207-W300 HydrophobicContact CB-CZ3 3.59Å; P207-W300 HydrophobicContact CG-CE3 4.28Å; P207-W300 HydrophobicContact CG-CH2 4.14Å; P207-W300 HydrophobicContact CG-CZ3 3.47Å; P207-W300 VanDerWaalsContact CG-CZ3 3.47Å; P207-W300 VanDerWaalsContact O-CE3 3.3Å; P207-W300 WeakPolarHBondContact O-CZ3 3.48Å; P207-A332 HydrophobicContact CB-CB 3.98Å
208	A	88.8	Confident	79.5	Confident	41 Å²	41	46.2 Å²	46.2	34%	0.339	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-72.6	146.9	169.2	0	0	0	0	0	109.6	P210 W300 P304 V306	A208-P210 WeakPolarHBondContact O-CD 3.23Å; A208-W300 VanDerWaalsContact O-CZ3 3.25Å; A208-W300 WeakPolarHBondContact O-CZ3 3.27Å; A208-P304 HydrophobicContact CB-CB 4.16Å; A208-P304 HydrophobicContact CB-CG 3.84Å; A208-V306 HydrophobicContact CB-CG1 4.32Å
209	K	83.1	Confident	77.6	Confident	66 Å²	66	51 Å²	51	29%	0.287	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-58.5	125	173.9	178.6	-177.2	164	-163.1	0	109.1	V211 E214 I296 W300	K209-V211 PolarHBondContact O-N 2.73Å; K209-E214 IonicContact NZ-OE2 2.73Å; K209-E214 PolarHBondContact NZ-OE2 2.89Å; K209-I296 HydrophobicContact CB-CD1 3.99Å; K209-I296 HydrophobicContact CD-CD1 3.55Å; K209-I296 HydrophobicContact CG-CD1 4.35Å; K209-W300 HydrophobicContact CB-CB 4.09Å; K209-W300 HydrophobicContact CB-CD2 3.94Å; K209-W300 HydrophobicContact CB-CE3 4.28Å; K209-W300 HydrophobicContact CB-CG 3.81Å; K209-W300 HydrophobicContact CG-CD2 4.37Å; K209-W300 HydrophobicContact CG-CG 4.11Å
210	P	80.8	Confident	75.8	Confident	47 Å²	47	55.8 Å²	55.8	31%	0.305	33%	0.327	S	S	.	.	P	Polyproline II helix	trans	-61.4	133.2	176.5	-23.4	33.8	0	0	0	111.1	A208 D212 Q213 W300	A208-P210 WeakPolarHBondContact O-CD 3.23Å; P210-D212 PolarHBondContact O-N 2.69Å; P210-Q213 HydrophobicContact CB-CG 4.04Å; P210-Q213 HydrophobicContact CG-CG 4.31Å; P210-Q213 PolarHBondContact O-N 2.96Å; P210-W300 HydrophobicContact CG-CH2 4.23Å; P210-W300 HydrophobicContact CG-CZ2 4.29Å
211	V	74.5	Confident	74.1	Confident	133 Å²	133	59.1 Å²	59.1	81%	0.806	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-34.5	-179.3	-179.6	0	0	0	0	111.5	K209	K209-V211 PolarHBondContact O-N 2.73Å
212	D	64	Low	72.8	Confident	137 Å²	137	62.3 Å²	62.3	73%	0.733	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-14.6	-170.5	-56.7	-36.6	0	0	0	115	P210 E214	P210-D212 PolarHBondContact O-N 2.69Å; D212-E214 VanDerWaalsContact C-N 3.31Å; D212-E214 PolarHBondContact O-N 2.55Å
213	Q	54	Low	71.7	Confident	91 Å²	91	66.9 Å²	66.9	43%	0.425	39%	0.393	S	S	.	.	H	α-helix	trans	-75.8	-16.1	-172.6	-79.4	-174.3	0.3	0	0	114.3	P210	P210-Q213 HydrophobicContact CB-CG 4.04Å; P210-Q213 HydrophobicContact CG-CG 4.31Å; P210-Q213 PolarHBondContact O-N 2.96Å
214	E	53.1	Low	70	Confident	123 Å²	123	74.9 Å²	74.9	58%	0.575	42%	0.423	S	S	*	.	H	α-helix	trans	-70.3	-34	179.7	-164.6	152.4	176.5	0	0	112	K209 D212 S218	K209-E214 IonicContact NZ-OE2 2.73Å; K209-E214 PolarHBondContact NZ-OE2 2.89Å; D212-E214 VanDerWaalsContact C-N 3.31Å; D212-E214 PolarHBondContact O-N 2.55Å; E214-S218 VanDerWaalsContact O-CB 3.23Å; E214-S218 WeakPolarHBondContact O-CB 3.3Å; E214-S218 PolarHBondContact O-N 3.44Å; E214-S218 PolarHBondContact O-OG 3.22Å
215	T	50.3	Low	68.5	Low	100 Å²	100	77.1 Å²	77.1	61%	0.613	44%	0.435	S	S	*	.	H	α-helix	trans	-77.5	-32.6	-177	-45.3	0	0	0	0	112.1	T219	T215-T219 WeakPolarHBondContact O-CB 3.28Å; T215-T219 WeakPolarHBondContact O-CG2 3.37Å; T215-T219 PolarHBondContact O-OG1 3.4Å
216	A	51.4	Low	66.8	Low	61 Å²	61	81.9 Å²	81.9	50%	0.504	45%	0.451	S	S	.	.	H	α-helix	trans	-81.1	-41.8	-174.9	0	0	0	0	0	114.1	T220	A216-T220 WeakPolarHBondContact O-CG2 3.26Å; A216-T220 PolarHBondContact O-OG1 2.97Å
217	L	52.2	Low	65.2	Low	78 Å²	78	86.3 Å²	86.3	41%	0.408	47%	0.474	S	S	.	.	H	α-helix	trans	-80.7	-28.6	-178.8	-75.8	167.1	0	0	0	113	F298	L217-F298 HydrophobicContact CD1-CZ 4.36Å
218	S	52.1	Low	63.3	Low	51 Å²	51	87.8 Å²	87.8	36%	0.357	48%	0.482	S	S	.	.	H	α-helix	trans	-80.3	-23.1	-178.3	70.3	0	0	0	0	114.1	E214 R226	E214-S218 VanDerWaalsContact O-CB 3.23Å; E214-S218 WeakPolarHBondContact O-CB 3.3Å; E214-S218 PolarHBondContact O-N 3.44Å; E214-S218 PolarHBondContact O-OG 3.22Å; S218-R226 PolarHBondContact O-NH1 2.88Å
219	T	58	Low	61.7	Low	100 Å²	100	88.3 Å²	88.3	61%	0.613	48%	0.484	S	S	*	.	H	α-helix	trans	-94.4	-23.7	-176.1	56.5	0	0	0	0	113.8	T215	T215-T219 WeakPolarHBondContact O-CB 3.28Å; T215-T219 WeakPolarHBondContact O-CG2 3.37Å; T215-T219 PolarHBondContact O-OG1 3.4Å
220	T	60.6	Low	60.2	Low	101 Å²	101	93.7 Å²	93.7	62%	0.62	50%	0.502	S	S	*	.	H	α-helix	trans	-93.5	-17.6	-173.6	52.1	0	0	0	0	114.3	A216	A216-T220 WeakPolarHBondContact O-CG2 3.26Å; A216-T220 PolarHBondContact O-OG1 2.97Å
221	L	63.4	Low	58.6	Low	70 Å²	70	96.9 Å²	96.9	37%	0.366	52%	0.516	S	S	.	.	S	Bend	trans	-93.1	134	-175.9	-67.2	174.5	0	0	0	112.8	I225 R226	L221-I225 HydrophobicContact CB-CG2 4.45Å; L221-I225 HydrophobicContact CD1-CG2 4.26Å; L221-I225 HydrophobicContact CD2-CG2 4.32Å; L221-R226 HydrophobicContact CB-CG 4.23Å
222	P	71.9	Confident	57.3	Low	66 Å²	66	96.8 Å²	96.8	43%	0.429	51%	0.505	S	S	.	.			trans	-49	142.2	170.1	-27.3	31.3	0	0	0	113.2	W224 I225 R226	P222-W224 PolarHBondContact O-N 3.29Å; P222-W224 VanDerWaalsContact O-N 3.1Å; P222-I225 HydrophobicContact CB-CD1 4.49Å; P222-I225 HydrophobicContact CB-CG1 4.36Å; P222-I225 HydrophobicContact CG-CD1 4.15Å; P222-I225 WeakPolarHBondContact O-CB 3.34Å; P222-I225 PolarHBondContact O-N 3.43Å; P222-R226 PolarHBondContact O-N 3.04Å
223	T	72.5	Confident	56.6	Low	97 Å²	97	93.4 Å²	93.4	60%	0.595	49%	0.492	S	S	*	.	H	α-helix	trans	-52.6	-37.4	-175.8	-49.2	0	0	0	0	113.7	R226 I227	T223-R226 WeakPolarHBondContact O-CB 3.32Å; T223-R226 PolarHBondContact O-N 3.01Å; T223-I227 HydrophobicContact CG2-CD1 4.23Å; T223-I227 WeakPolarHBondContact O-CG1 3.4Å; T223-I227 PolarHBondContact O-N 2.87Å
224	W	62.8	Low	56.4	Low	170 Å²	170	94.7 Å²	94.7	64%	0.644	50%	0.498	S	S	*	.	H	α-helix	trans	-68.2	-35.3	178.2	74	-92.6	0	0	0	112.5	P222 R226 I227 V228	P222-W224 PolarHBondContact O-N 3.29Å; P222-W224 VanDerWaalsContact O-N 3.1Å; W224-R226 VanDerWaalsContact C-N 3.3Å; W224-R226 PolarHBondContact O-N 2.84Å; W224-I227 PolarHBondContact O-N 2.86Å; W224-V228 HydrophobicContact CE3-CG2 3.98Å; W224-V228 HydrophobicContact CZ3-CG2 4.39Å; W224-V228 WeakPolarHBondContact O-CB 3.3Å; W224-V228 VanDerWaalsContact O-CG2 3.26Å; W224-V228 WeakPolarHBondContact O-CG2 3.47Å; W224-V228 PolarHBondContact O-N 2.8Å
225	I	64.6	Low	56.6	Low	53 Å²	53	92.2 Å²	92.2	27%	0.272	49%	0.488	S	S	.	.	H	α-helix	trans	-66.8	-35.8	173.8	-61.3	-174.6	0	0	0	109.9	L221 P222 S229	L221-I225 HydrophobicContact CB-CG2 4.45Å; L221-I225 HydrophobicContact CD1-CG2 4.26Å; L221-I225 HydrophobicContact CD2-CG2 4.32Å; P222-I225 HydrophobicContact CB-CD1 4.49Å; P222-I225 HydrophobicContact CB-CG1 4.36Å; P222-I225 HydrophobicContact CG-CD1 4.15Å; P222-I225 WeakPolarHBondContact O-CB 3.34Å; P222-I225 PolarHBondContact O-N 3.43Å; I225-S229 WeakPolarHBondContact O-CA 3.43Å; I225-S229 WeakPolarHBondContact O-CB 3.31Å; I225-S229 PolarHBondContact O-N 3.41Å
226	R	58.6	Low	57.4	Low	105 Å²	105	88.3 Å²	88.3	40%	0.396	47%	0.465	S	S	.	.	H	α-helix	trans	-65.9	-39.4	174.2	-67.6	168.8	53.4	-178.8	-2.4	112.2	S218 L221 P222 T223 W224 R230	S218-R226 PolarHBondContact O-NH1 2.88Å; L221-R226 HydrophobicContact CB-CG 4.23Å; P222-R226 PolarHBondContact O-N 3.04Å; T223-R226 WeakPolarHBondContact O-CB 3.32Å; T223-R226 PolarHBondContact O-N 3.01Å; W224-R226 VanDerWaalsContact C-N 3.3Å; W224-R226 PolarHBondContact O-N 2.84Å; R226-R230 WeakPolarHBondContact O-CB 3.39Å; R226-R230 WeakPolarHBondContact O-CG 3.43Å; R226-R230 PolarHBondContact O-N 3.2Å
227	I	60.5	Low	58.4	Low	95 Å²	95	90.3 Å²	90.3	49%	0.487	47%	0.473	S	S	.	.	H	α-helix	trans	-68.7	-49.8	176	-66.8	166	0	0	0	110.2	T223 W224 R230 L231	T223-I227 HydrophobicContact CG2-CD1 4.23Å; T223-I227 WeakPolarHBondContact O-CG1 3.4Å; T223-I227 PolarHBondContact O-N 2.87Å; W224-I227 PolarHBondContact O-N 2.86Å; I227-R230 PolarHBondContact O-N 3.37Å; I227-L231 HydrophobicContact CG2-CD1 3.68Å; I227-L231 HydrophobicContact CG2-CG 4.31Å; I227-L231 WeakPolarHBondContact O-CB 3.4Å; I227-L231 VanDerWaalsContact O-CG 3.27Å; I227-L231 WeakPolarHBondContact O-CG 3.34Å; I227-L231 PolarHBondContact O-N 2.98Å
228	V	52.6	Low	59.7	Low	59 Å²	59	87.6 Å²	87.6	36%	0.358	46%	0.459	S	S	.	.	H	α-helix	trans	-60.6	-47.2	176.9	170.4	0	0	0	0	110.3	W224 R230 L231 F232	W224-V228 HydrophobicContact CE3-CG2 3.98Å; W224-V228 HydrophobicContact CZ3-CG2 4.39Å; W224-V228 WeakPolarHBondContact O-CB 3.3Å; W224-V228 VanDerWaalsContact O-CG2 3.26Å; W224-V228 WeakPolarHBondContact O-CG2 3.47Å; W224-V228 PolarHBondContact O-N 2.8Å; V228-R230 VanDerWaalsContact C-N 3.34Å; V228-R230 PolarHBondContact O-N 3.24Å; V228-L231 PolarHBondContact O-N 2.82Å; V228-F232 HydrophobicContact CB-CD2 4.47Å; V228-F232 HydrophobicContact CG1-CD2 3.58Å; V228-F232 HydrophobicContact CG1-CE2 3.97Å; V228-F232 HydrophobicContact CG1-CG 4.43Å; V228-F232 VanDerWaalsContact O-CB 3.26Å; V228-F232 WeakPolarHBondContact O-CB 3.48Å; V228-F232 WeakPolarHBondContact O-CD2 3.44Å; V228-F232 PolarHBondContact O-N 3.35Å
229	S	54.8	Low	61	Low	52 Å²	52	90.7 Å²	90.7	36%	0.364	46%	0.464	S	S	.	.	H	α-helix	trans	-60.7	-40.8	176.2	-179.1	0	0	0	0	111.7	I225 S233	I225-S229 WeakPolarHBondContact O-CA 3.43Å; I225-S229 WeakPolarHBondContact O-CB 3.31Å; I225-S229 PolarHBondContact O-N 3.41Å; S229-S233 WeakPolarHBondContact O-CA 3.49Å; S229-S233 WeakPolarHBondContact O-CB 3.46Å; S229-S233 PolarHBondContact O-N 3.39Å; S229-S233 PolarHBondContact O-OG 3.11Å
230	R	52.2	Low	61.9	Low	178 Å²	178	89.4 Å²	89.4	67%	0.672	46%	0.455	S	S	*	.	H	α-helix	trans	-68.4	-36.8	175.3	-86.5	-177.9	174.4	164.3	-3	113.2	R226 I227 V228 S233 Q234	R226-R230 WeakPolarHBondContact O-CB 3.39Å; R226-R230 WeakPolarHBondContact O-CG 3.43Å; R226-R230 PolarHBondContact O-N 3.2Å; I227-R230 PolarHBondContact O-N 3.37Å; V228-R230 VanDerWaalsContact C-N 3.34Å; V228-R230 PolarHBondContact O-N 3.24Å; R230-S233 PolarHBondContact O-OG 3.45Å; R230-Q234 VanDerWaalsContact O-CG 3.28Å; R230-Q234 WeakPolarHBondContact O-CG 3.16Å
231	L	47.1	Very low	62.9	Low	114 Å²	114	85.5 Å²	85.5	60%	0.597	43%	0.43	S	S	*	.	H	α-helix	trans	-75.9	-39.7	179.6	-69.7	172.5	0	0	0	111.4	I227 V228	I227-L231 HydrophobicContact CG2-CD1 3.68Å; I227-L231 HydrophobicContact CG2-CG 4.31Å; I227-L231 WeakPolarHBondContact O-CB 3.4Å; I227-L231 VanDerWaalsContact O-CG 3.27Å; I227-L231 WeakPolarHBondContact O-CG 3.34Å; I227-L231 PolarHBondContact O-N 2.98Å; V228-L231 PolarHBondContact O-N 2.82Å
232	F	46.4	Very low	63.9	Low	132 Å²	132	83.6 Å²	83.6	58%	0.579	42%	0.418	S	S	*	.	H	α-helix	trans	-85.4	-26	-179.5	-81.4	-94.5	0	0	0	113.5	V228 Q234 L235	V228-F232 HydrophobicContact CB-CD2 4.47Å; V228-F232 HydrophobicContact CG1-CD2 3.58Å; V228-F232 HydrophobicContact CG1-CE2 3.97Å; V228-F232 HydrophobicContact CG1-CG 4.43Å; V228-F232 VanDerWaalsContact O-CB 3.26Å; V228-F232 WeakPolarHBondContact O-CB 3.48Å; V228-F232 WeakPolarHBondContact O-CD2 3.44Å; V228-F232 PolarHBondContact O-N 3.35Å; F232-Q234 PolarHBondContact O-N 3.32Å; F232-L235 HydrophobicContact CD1-CD1 4.36Å; F232-L235 PolarHBondContact O-N 3.21Å
233	S	49.1	Very low	64.3	Low	66 Å²	66	84.9 Å²	84.9	46%	0.462	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-22.6	174.3	66.7	0	0	0	0	112.7	S229 R230	S229-S233 WeakPolarHBondContact O-CA 3.49Å; S229-S233 WeakPolarHBondContact O-CB 3.46Å; S229-S233 PolarHBondContact O-N 3.39Å; S229-S233 PolarHBondContact O-OG 3.11Å; R230-S233 PolarHBondContact O-OG 3.45Å
234	Q	50.7	Low	64.8	Low	118 Å²	118	81.5 Å²	81.5	55%	0.551	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-20.9	174.2	-53.9	-57.6	-31.8	0	0	111.9	R230 F232 S236	R230-Q234 VanDerWaalsContact O-CG 3.28Å; R230-Q234 WeakPolarHBondContact O-CG 3.16Å; F232-Q234 PolarHBondContact O-N 3.32Å; Q234-S236 PolarHBondContact O-N 2.9Å
235	L	56.4	Low	65.7	Low	70 Å²	70	73.4 Å²	73.4	37%	0.366	38%	0.376	S	S	.	.	S	Bend	trans	-84.8	93.7	174.3	-61.4	-179.1	0	0	0	108	F232 Y239	F232-L235 HydrophobicContact CD1-CD1 4.36Å; F232-L235 PolarHBondContact O-N 3.21Å; L235-Y239 HydrophobicContact CD2-CD1 3.89Å; L235-Y239 HydrophobicContact CD2-CE1 4.02Å; L235-Y239 HydrophobicContact CD2-CG 4.4Å
236	S	67.4	Low	66.6	Low	19 Å²	19	73.1 Å²	73.1	13%	0.133	38%	0.378	C	S	.	.			trans	-42.8	132	165.5	168.6	0	0	0	0	109.2	Q234 L238 Y239 E288	Q234-S236 PolarHBondContact O-N 2.9Å; S236-L238 PolarHBondContact O-N 2.95Å; S236-L238 WeakPolarHBondContact OG-CB 3.32Å; S236-L238 PolarHBondContact OG-N 3.46Å; S236-Y239 WeakPolarHBondContact O-CA 3.45Å; S236-Y239 WeakPolarHBondContact O-CB 3.49Å; S236-Y239 PolarHBondContact O-N 3.22Å; S236-E288 WeakPolarHBondContact CB-OE2 3.29Å; S236-E288 PolarHBondContact OG-OE2 3.22Å
237	P	72.6	Confident	67.9	Low	103 Å²	103	74 Å²	74	67%	0.669	39%	0.385	S	S	*	.	H	α-helix	trans	-50.5	-29.9	173.7	-29.3	35.5	0	0	0	113.1	Y239 V240 L241	P237-Y239 VanDerWaalsContact C-N 3.34Å; P237-V240 WeakPolarHBondContact O-CB 3.36Å; P237-V240 PolarHBondContact O-N 2.9Å; P237-L241 WeakPolarHBondContact O-CG 3.35Å; P237-L241 PolarHBondContact O-N 3.34Å; P237-L241 VanDerWaalsContact O-N 3.13Å
238	L	79.6	Confident	69.1	Low	21 Å²	21	69.5 Å²	69.5	11%	0.11	36%	0.362	C	S	.	.	H	α-helix	trans	-69.7	-27.9	176.2	-55.4	173.7	0	0	0	112.8	L109 S236 V240 L241 R242 N281 E288	L109-L238 HydrophobicContact CG-CD1 4.42Å; S236-L238 PolarHBondContact O-N 2.95Å; S236-L238 WeakPolarHBondContact OG-CB 3.32Å; S236-L238 PolarHBondContact OG-N 3.46Å; L238-V240 VanDerWaalsContact C-N 3.34Å; L238-L241 HydrophobicContact CD2-CD1 3.81Å; L238-L241 WeakPolarHBondContact O-CB 3.35Å; L238-L241 PolarHBondContact O-N 3.49Å; L238-R242 WeakPolarHBondContact O-CB 3.5Å; L238-R242 PolarHBondContact O-N 3.37Å; L238-N281 HydrophobicContact CB-CB 4.49Å; L238-N281 WeakPolarHBondContact CD1-OD1 3.2Å; L238-N281 HydrophobicContact CD2-CB 4Å; L238-E288 VanDerWaalsContact CB-OE2 3.25Å; L238-E288 WeakPolarHBondContact CB-OE2 3.38Å; L238-E288 VanDerWaalsContact CD1-CD 3.44Å; L238-E288 HydrophobicContact CD1-CG 3.67Å
239	Y	78.3	Confident	70.7	Confident	116 Å²	116	67.2 Å²	67.2	46%	0.455	35%	0.348	S	S	.	.	H	α-helix	trans	-60.7	-45.2	168.9	178.6	-90.7	0	0	0	111	L235 S236 P237 L241 R242 V243	L235-Y239 HydrophobicContact CD2-CD1 3.89Å; L235-Y239 HydrophobicContact CD2-CE1 4.02Å; L235-Y239 HydrophobicContact CD2-CG 4.4Å; S236-Y239 WeakPolarHBondContact O-CA 3.45Å; S236-Y239 WeakPolarHBondContact O-CB 3.49Å; S236-Y239 PolarHBondContact O-N 3.22Å; P237-Y239 VanDerWaalsContact C-N 3.34Å; Y239-L241 VanDerWaalsContact C-N 3.3Å; Y239-L241 PolarHBondContact O-N 2.97Å; Y239-R242 WeakPolarHBondContact O-CB 3.44Å; Y239-R242 PolarHBondContact O-N 2.94Å; Y239-V243 HydrophobicContact CD1-CG2 4.13Å; Y239-V243 HydrophobicContact CE1-CG2 3.65Å; Y239-V243 HydrophobicContact CE2-CG2 4.42Å; Y239-V243 WeakPolarHBondContact O-CG2 3.4Å; Y239-V243 PolarHBondContact O-N 3.5Å
240	V	78.3	Confident	72.3	Confident	72 Å²	72	67.9 Å²	67.9	44%	0.436	35%	0.353	S	S	.	.	H	α-helix	trans	-62.1	-41.2	176.5	-178.7	0	0	0	0	110.5	P237 L238 R242 V243 A244 L251	P237-V240 WeakPolarHBondContact O-CB 3.36Å; P237-V240 PolarHBondContact O-N 2.9Å; L238-V240 VanDerWaalsContact C-N 3.34Å; V240-R242 VanDerWaalsContact C-N 3.34Å; V240-R242 PolarHBondContact O-N 3.39Å; V240-V243 PolarHBondContact O-N 3.37Å; V240-A244 WeakPolarHBondContact O-CB 3.15Å; V240-A244 PolarHBondContact O-N 3.41Å; V240-L251 HydrophobicContact CG1-CD2 4.2Å
241	L	80.8	Confident	74	Confident	19 Å²	19	61.5 Å²	61.5	10%	0.099	33%	0.332	C	S	.	.	H	α-helix	trans	-60.5	-42.8	174.7	-64.9	-178.9	0	0	0	112.1	P237 L238 Y239 A244 L251 I252	P237-L241 WeakPolarHBondContact O-CG 3.35Å; P237-L241 PolarHBondContact O-N 3.34Å; P237-L241 VanDerWaalsContact O-N 3.13Å; L238-L241 HydrophobicContact CD2-CD1 3.81Å; L238-L241 WeakPolarHBondContact O-CB 3.35Å; L238-L241 PolarHBondContact O-N 3.49Å; Y239-L241 VanDerWaalsContact C-N 3.3Å; Y239-L241 PolarHBondContact O-N 2.97Å; L241-A244 WeakPolarHBondContact O-CB 3.26Å; L241-A244 PolarHBondContact O-N 3.35Å; L241-L251 HydrophobicContact CD2-CB 4.35Å; L241-L251 HydrophobicContact CD2-CD2 3.92Å; L241-L251 HydrophobicContact CD2-CG 4.01Å; L241-I252 HydrophobicContact CD1-CD1 4.01Å; L241-I252 HydrophobicContact CD1-CG1 3.75Å; L241-I252 HydrophobicContact CD2-CD1 4.43Å; L241-I252 HydrophobicContact CD2-CG1 3.52Å; L241-I252 HydrophobicContact CG-CG1 4.26Å
242	R	84.2	Confident	75.9	Confident	30 Å²	30	56.5 Å²	56.5	11%	0.113	31%	0.306	C	S	.	.	H	α-helix	trans	-64.2	-42.9	178.6	-173.9	-178.2	-64.6	104.5	2.2	112.1	L238 Y239 V240 A244 G245 N281 Q283 E288	L238-R242 WeakPolarHBondContact O-CB 3.5Å; L238-R242 PolarHBondContact O-N 3.37Å; Y239-R242 WeakPolarHBondContact O-CB 3.44Å; Y239-R242 PolarHBondContact O-N 2.94Å; V240-R242 VanDerWaalsContact C-N 3.34Å; V240-R242 PolarHBondContact O-N 3.39Å; R242-A244 VanDerWaalsContact C-N 3.3Å; R242-A244 PolarHBondContact O-N 2.96Å; R242-G245 PolarHBondContact O-N 3.05Å; R242-N281 PolarHBondContact NE-O 3.31Å; R242-N281 PolarHBondContact NH2-O 3.4Å; R242-Q283 PolarHBondContact NE-O 2.87Å; R242-Q283 PolarHBondContact NH2-O 3.18Å; R242-E288 IonicContact CZ-OE1 2.91Å; R242-E288 IonicContact NH1-OE1 3.91Å; R242-E288 IonicContact NH2-OE1 3.94Å; R242-E288 PolarHBondContact NH2-OE1 2.93Å
243	V	80.5	Confident	78	Confident	94 Å²	94	54.6 Å²	54.6	57%	0.57	30%	0.295	S	S	*	.	H	α-helix	trans	-66.3	-32.8	176.2	172.9	0	0	0	0	111.9	Y239 V240 G245	Y239-V243 HydrophobicContact CD1-CG2 4.13Å; Y239-V243 HydrophobicContact CE1-CG2 3.65Å; Y239-V243 HydrophobicContact CE2-CG2 4.42Å; Y239-V243 WeakPolarHBondContact O-CG2 3.4Å; Y239-V243 PolarHBondContact O-N 3.5Å; V240-V243 PolarHBondContact O-N 3.37Å; V243-G245 PolarHBondContact O-N 2.9Å; V243-G245 VanDerWaalsContact O-N 3.15Å
244	A	82.4	Confident	79.9	Confident	25 Å²	25	61.7 Å²	61.7	21%	0.207	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-17.6	176.7	0	0	0	0	0	113.4	V240 L241 R242 P246 F247 L251	V240-A244 WeakPolarHBondContact O-CB 3.15Å; V240-A244 PolarHBondContact O-N 3.41Å; L241-A244 WeakPolarHBondContact O-CB 3.26Å; L241-A244 PolarHBondContact O-N 3.35Å; R242-A244 VanDerWaalsContact C-N 3.3Å; R242-A244 PolarHBondContact O-N 2.96Å; A244-P246 WeakPolarHBondContact O-CD 3.33Å; A244-F247 PolarHBondContact O-N 2.92Å; A244-F247 VanDerWaalsContact O-N 3.1Å; A244-L251 HydrophobicContact CB-CD2 3.62Å
245	G	82.3	Confident	81.6	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.01	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	52.8	-125.4	173.7	0	0	0	0	0	112.1	R242 V243 F247 G248 Y278	R242-G245 PolarHBondContact O-N 3.05Å; V243-G245 PolarHBondContact O-N 2.9Å; V243-G245 VanDerWaalsContact O-N 3.15Å; G245-F247 PolarHBondContact O-N 3.17Å; G245-G248 WeakPolarHBondContact O-CA 3.43Å; G245-G248 PolarHBondContact O-N 2.71Å; G245-Y278 VanDerWaalsContact CA-OH 3.31Å; G245-Y278 WeakPolarHBondContact CA-OH 3.25Å; G245-Y278 WeakPolarHBondContact O-CE2 3.32Å; G245-Y278 PolarHBondContact O-OH 3.33Å
246	P	82.9	Confident	83.1	Confident	47 Å²	47	61.9 Å²	61.9	31%	0.305	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-59.2	-23	-177.1	28.5	-37.1	0	0	0	114.4	W36 A244 G248	W36-P246 HydrophobicContact CE3-CB 4.4Å; W36-P246 HydrophobicContact CE3-CG 3.91Å; W36-P246 HydrophobicContact CH2-CB 3.45Å; W36-P246 VanDerWaalsContact CH2-CB 3.45Å; W36-P246 HydrophobicContact CH2-CG 3.81Å; W36-P246 HydrophobicContact CZ2-CB 4.33Å; W36-P246 HydrophobicContact CZ3-CB 3.49Å; W36-P246 VanDerWaalsContact CZ3-CB 3.49Å; W36-P246 HydrophobicContact CZ3-CG 3.25Å; A244-P246 WeakPolarHBondContact O-CD 3.33Å; P246-G248 VanDerWaalsContact C-N 3.27Å
247	F	86.2	Confident	84.2	Confident	123 Å²	123	64.1 Å²	64.1	54%	0.539	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-85.2	-3.7	178	-54.2	-70.5	0	0	0	112.4	A244 G245 S250 L251	A244-F247 PolarHBondContact O-N 2.92Å; A244-F247 VanDerWaalsContact O-N 3.1Å; G245-F247 PolarHBondContact O-N 3.17Å; F247-S250 CarbonylContact O-C 3.47Å; F247-S250 WeakPolarHBondContact O-CB 3.21Å; F247-S250 PolarHBondContact O-N 3.36Å; F247-S250 VanDerWaalsContact O-N 3.13Å; F247-L251 PolarHBondContact O-N 2.65Å
248	G	86	Confident	85	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-53	-50.7	-178.2	0	0	0	0	0	114.3	G245 P246 S250 L251 I252	G245-G248 WeakPolarHBondContact O-CA 3.43Å; G245-G248 PolarHBondContact O-N 2.71Å; P246-G248 VanDerWaalsContact C-N 3.27Å; G248-S250 VanDerWaalsContact C-N 3.28Å; G248-S250 PolarHBondContact O-N 2.55Å; G248-L251 WeakPolarHBondContact O-CA 3.4Å; G248-L251 WeakPolarHBondContact O-CB 3.36Å; G248-L251 PolarHBondContact O-N 2.97Å; G248-I252 WeakPolarHBondContact O-CG1 3.45Å; G248-I252 PolarHBondContact O-N 3.05Å
249	P	86.9	Confident	85.6	Confident	12 Å²	12	61.6 Å²	61.6	8%	0.078	30%	0.304	C	S	.	.	H	α-helix	trans	-59.6	-39.1	177.1	-24	33.2	0	0	0	113	L251 I252 R253 F274 D275 Y278	P249-L251 VanDerWaalsContact C-N 3.34Å; P249-I252 PolarHBondContact O-N 3.05Å; P249-R253 PolarHBondContact O-N 3.42Å; P249-F274 HydrophobicContact CB-CB 4.4Å; P249-D275 VanDerWaalsContact CB-OD1 3.23Å; P249-D275 WeakPolarHBondContact CB-OD1 3.4Å; P249-D275 WeakPolarHBondContact CG-OD1 3.45Å; P249-Y278 HydrophobicContact CG-CD1 3.67Å; P249-Y278 HydrophobicContact CG-CE1 4.47Å; P249-Y278 HydrophobicContact CG-CG 3.73Å
250	S	88.8	Confident	86.2	Confident	66 Å²	66	56 Å²	56	46%	0.462	28%	0.282	S	S	.	.	H	α-helix	trans	-67.4	-35.7	175.5	-66.4	0	0	0	0	112	F247 G248 R253 R254	F247-S250 CarbonylContact O-C 3.47Å; F247-S250 WeakPolarHBondContact O-CB 3.21Å; F247-S250 PolarHBondContact O-N 3.36Å; F247-S250 VanDerWaalsContact O-N 3.13Å; G248-S250 VanDerWaalsContact C-N 3.28Å; G248-S250 PolarHBondContact O-N 2.55Å; S250-R253 PolarHBondContact O-N 3.23Å; S250-R254 WeakPolarHBondContact O-CB 3.21Å; S250-R254 PolarHBondContact O-N 3.2Å
251	L	87.3	Confident	87	Confident	44 Å²	44	59 Å²	59	23%	0.23	29%	0.289	C	S	.	.	H	α-helix	trans	-67.1	-43.9	175.1	-177.1	59.7	0	0	0	111.7	V240 L241 A244 F247 G248 P249 R253 R254 I255	V240-L251 HydrophobicContact CG1-CD2 4.2Å; L241-L251 HydrophobicContact CD2-CB 4.35Å; L241-L251 HydrophobicContact CD2-CD2 3.92Å; L241-L251 HydrophobicContact CD2-CG 4.01Å; A244-L251 HydrophobicContact CB-CD2 3.62Å; F247-L251 PolarHBondContact O-N 2.65Å; G248-L251 WeakPolarHBondContact O-CA 3.4Å; G248-L251 WeakPolarHBondContact O-CB 3.36Å; G248-L251 PolarHBondContact O-N 2.97Å; P249-L251 VanDerWaalsContact C-N 3.34Å; L251-R253 VanDerWaalsContact C-N 3.33Å; L251-R253 PolarHBondContact O-N 3.4Å; L251-R254 PolarHBondContact O-N 3.45Å; L251-R254 VanDerWaalsContact O-N 3.13Å; L251-I255 HydrophobicContact CD1-CD1 3.7Å; L251-I255 HydrophobicContact CD1-CG1 4.09Å; L251-I255 HydrophobicContact CG-CD1 3.82Å; L251-I255 WeakPolarHBondContact O-CG1 3.46Å; L251-I255 PolarHBondContact O-N 3.01Å
252	I	87.5	Confident	87.6	Confident	9 Å²	9	60.1 Å²	60.1	5%	0.046	29%	0.293	C	S	.	.	H	α-helix	trans	-58.8	-47.4	174.1	-60.9	170.5	0	0	0	109.7	L241 G248 P249 R254 I255 R256 F274 I277	L241-I252 HydrophobicContact CD1-CD1 4.01Å; L241-I252 HydrophobicContact CD1-CG1 3.75Å; L241-I252 HydrophobicContact CD2-CD1 4.43Å; L241-I252 HydrophobicContact CD2-CG1 3.52Å; L241-I252 HydrophobicContact CG-CG1 4.26Å; G248-I252 WeakPolarHBondContact O-CG1 3.45Å; G248-I252 PolarHBondContact O-N 3.05Å; P249-I252 PolarHBondContact O-N 3.05Å; I252-R254 PolarHBondContact O-N 3.37Å; I252-I255 PolarHBondContact O-N 3.26Å; I252-R256 CarbonylContact O-C 3.6Å; I252-R256 WeakPolarHBondContact O-CA 3.26Å; I252-R256 PolarHBondContact O-N 3.11Å; I252-F274 HydrophobicContact CB-CD1 4.25Å; I252-F274 HydrophobicContact CG2-CD1 3.68Å; I252-F274 HydrophobicContact CG2-CE1 4.21Å; I252-I277 HydrophobicContact CD1-CB 4.32Å; I252-I277 HydrophobicContact CD1-CG2 3.97Å
253	R	90.1	Very high	88	Confident	91 Å²	91	59 Å²	59	34%	0.343	29%	0.289	S	S	.	.	H	α-helix	trans	-57.8	-37.7	176.5	-173.5	-177	-45	155.3	27.8	112.5	P249 S250 L251 P257 F274	P249-R253 PolarHBondContact O-N 3.42Å; S250-R253 PolarHBondContact O-N 3.23Å; L251-R253 VanDerWaalsContact C-N 3.33Å; L251-R253 PolarHBondContact O-N 3.4Å; R253-P257 WeakPolarHBondContact O-CA 3.32Å; R253-P257 WeakPolarHBondContact O-CB 3.47Å; R253-P257 VanDerWaalsContact O-CD 3.29Å; R253-P257 WeakPolarHBondContact O-CD 3.4Å; R253-F274 HydrophobicContact CB-CD1 4.4Å; R253-F274 HydrophobicContact CB-CD2 4Å; R253-F274 HydrophobicContact CB-CE1 4.28Å; R253-F274 HydrophobicContact CB-CE2 3.89Å; R253-F274 HydrophobicContact CB-CG 4.27Å; R253-F274 HydrophobicContact CB-CZ 4.03Å; R253-F274 HydrophobicContact CG-CD2 4.18Å; R253-F274 HydrophobicContact CG-CE2 3.65Å; R253-F274 HydrophobicContact CG-CZ 3.89Å
254	R	89.7	Confident	88.6	Confident	215 Å²	215	54.9 Å²	54.9	81%	0.811	26%	0.264	S	S	*	.	H	α-helix	trans	-71.5	-40	179.4	-175.7	174.9	175.1	134.5	-0.8	112.6	S250 L251 I252	S250-R254 WeakPolarHBondContact O-CB 3.21Å; S250-R254 PolarHBondContact O-N 3.2Å; L251-R254 PolarHBondContact O-N 3.45Å; L251-R254 VanDerWaalsContact O-N 3.13Å; I252-R254 PolarHBondContact O-N 3.37Å
255	I	86.7	Confident	88.9	Confident	109 Å²	109	60.9 Å²	60.9	56%	0.559	29%	0.292	S	S	*	.	H	α-helix	trans	-82.7	-37.5	-177.2	-62.4	172.9	0	0	0	111.5	L251 I252 P257	L251-I255 HydrophobicContact CD1-CD1 3.7Å; L251-I255 HydrophobicContact CD1-CG1 4.09Å; L251-I255 HydrophobicContact CG-CD1 3.82Å; L251-I255 WeakPolarHBondContact O-CG1 3.46Å; L251-I255 PolarHBondContact O-N 3.01Å; I252-I255 PolarHBondContact O-N 3.26Å; I255-P257 VanDerWaalsContact C-CD 3.46Å
256	R	86.7	Confident	89.4	Confident	83 Å²	83	63.2 Å²	63.2	31%	0.313	31%	0.305	S	S	.	.			trans	-131.3	61.4	-177.1	-70.8	-63.4	-57.5	-78.1	-2.5	111.3	I252 D258 I259 F274 H357	I252-R256 CarbonylContact O-C 3.6Å; I252-R256 WeakPolarHBondContact O-CA 3.26Å; I252-R256 PolarHBondContact O-N 3.11Å; R256-D258 VanDerWaalsContact C-OD1 3.31Å; R256-D258 VanDerWaalsContact CA-OD1 3.3Å; R256-D258 WeakPolarHBondContact CA-OD1 3.26Å; R256-D258 IonicContact CZ-OD1 3.61Å; R256-D258 IonicContact CZ-OD2 3.58Å; R256-D258 IonicContact NE-OD1 3.62Å; R256-D258 PolarHBondContact NE-OD1 2.99Å; R256-D258 IonicContact NE-OD2 2.68Å; R256-D258 PolarHBondContact NE-OD2 3.27Å; R256-D258 IonicContact NH2-OD1 3.34Å; R256-D258 IonicContact NH2-OD2 2.66Å; R256-D258 PolarHBondContact NH2-OD2 2.95Å; R256-D258 PolarHBondContact O-N 2.72Å; R256-D258 VanDerWaalsContact O-N 3.11Å; R256-I259 HydrophobicContact CB-CB 4.48Å; R256-I259 HydrophobicContact CB-CD1 3.5Å; R256-I259 VanDerWaalsContact CB-CD1 3.5Å; R256-I259 HydrophobicContact CB-CG1 3.83Å; R256-I259 HydrophobicContact CG-CD1 3.87Å; R256-I259 HydrophobicContact CG-CG1 4.46Å; R256-I259 VanDerWaalsContact NH2-CG1 3.28Å; R256-I259 PolarHBondContact O-N 3.49Å; R256-I259 VanDerWaalsContact O-N 3.12Å; R256-F274 WeakPolarHBondContact O-CE1 3.19Å; R256-H357 PolarHBondContact NH2-CD2 3.36Å; R256-H357 PolarHBondContact NH2-NE2 3.48Å
257	P	89.8	Confident	89.8	Confident	66 Å²	66	65.4 Å²	65.4	43%	0.429	32%	0.321	S	S	.	.	H	α-helix	trans	-61.8	-19.4	177.3	26	-34.2	0	0	0	112.4	R253 I255	R253-P257 WeakPolarHBondContact O-CA 3.32Å; R253-P257 WeakPolarHBondContact O-CB 3.47Å; R253-P257 VanDerWaalsContact O-CD 3.29Å; R253-P257 WeakPolarHBondContact O-CD 3.4Å; I255-P257 VanDerWaalsContact C-CD 3.46Å
258	D	90.1	Very high	90.1	Very high	54 Å²	54	66.5 Å²	66.5	29%	0.289	33%	0.328	S	S	.	.	H	α-helix	trans	-67.7	-34.4	176.4	66.7	-61	0	0	0	112.8	R256 G260 K261 K262	R256-D258 VanDerWaalsContact C-OD1 3.31Å; R256-D258 VanDerWaalsContact CA-OD1 3.3Å; R256-D258 WeakPolarHBondContact CA-OD1 3.26Å; R256-D258 IonicContact CZ-OD1 3.61Å; R256-D258 IonicContact CZ-OD2 3.58Å; R256-D258 IonicContact NE-OD1 3.62Å; R256-D258 PolarHBondContact NE-OD1 2.99Å; R256-D258 IonicContact NE-OD2 2.68Å; R256-D258 PolarHBondContact NE-OD2 3.27Å; R256-D258 IonicContact NH2-OD1 3.34Å; R256-D258 IonicContact NH2-OD2 2.66Å; R256-D258 PolarHBondContact NH2-OD2 2.95Å; R256-D258 PolarHBondContact O-N 2.72Å; R256-D258 VanDerWaalsContact O-N 3.11Å; D258-G260 PolarHBondContact O-N 3.31Å; D258-K261 WeakPolarHBondContact O-CB 3.49Å; D258-K261 PolarHBondContact O-N 2.99Å; D258-K261 VanDerWaalsContact O-N 3.12Å; D258-K262 WeakPolarHBondContact O-CG 3.44Å; D258-K262 PolarHBondContact O-N 3.28Å; D258-K262 VanDerWaalsContact O-N 3.16Å; D258-K262 WeakPolarHBondContact OD2-CE 3.37Å; D258-K262 IonicContact OD2-NZ 3.44Å
259	I	91.4	Very high	90.3	Very high	17 Å²	17	69.6 Å²	69.6	9%	0.087	34%	0.339	C	S	.	.	H	α-helix	trans	-58.5	-51.7	-171.4	-73.4	173.9	0	0	0	111.1	R256 K261 K262 F263 I273 F274 I277	R256-I259 HydrophobicContact CB-CB 4.48Å; R256-I259 HydrophobicContact CB-CD1 3.5Å; R256-I259 VanDerWaalsContact CB-CD1 3.5Å; R256-I259 HydrophobicContact CB-CG1 3.83Å; R256-I259 HydrophobicContact CG-CD1 3.87Å; R256-I259 HydrophobicContact CG-CG1 4.46Å; R256-I259 VanDerWaalsContact NH2-CG1 3.28Å; R256-I259 PolarHBondContact O-N 3.49Å; R256-I259 VanDerWaalsContact O-N 3.12Å; I259-K261 VanDerWaalsContact C-N 3.27Å; I259-K261 PolarHBondContact O-N 3.31Å; I259-K262 WeakPolarHBondContact O-CB 3.35Å; I259-K262 PolarHBondContact O-N 3.3Å; I259-K262 VanDerWaalsContact O-N 3.12Å; I259-F263 HydrophobicContact CG2-CE2 4.37Å; I259-F263 VanDerWaalsContact O-CD2 3.28Å; I259-F263 WeakPolarHBondContact O-CD2 3.43Å; I259-I273 HydrophobicContact CG2-CG2 3.71Å; I259-F274 HydrophobicContact CB-CE1 4.23Å; I259-I277 HydrophobicContact CG2-CD1 3.55Å
260	G	92.6	Very high	90.6	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-56.7	-43.2	178.9	0	0	0	0	0	111.9	D258 K262 F263 F264	D258-G260 PolarHBondContact O-N 3.31Å; G260-K262 PolarHBondContact O-N 2.75Å; G260-F263 PolarHBondContact O-N 3.24Å; G260-F264 PolarHBondContact O-N 2.79Å
261	K	94	Very high	90.9	Very high	135 Å²	135	69.4 Å²	69.4	59%	0.587	33%	0.33	S	S	*	.	H	α-helix	trans	-62.6	-24.8	-179.2	-67.6	-178.6	178.1	-175.4	0	113.7	D258 I259 F263 F264	D258-K261 WeakPolarHBondContact O-CB 3.49Å; D258-K261 PolarHBondContact O-N 2.99Å; D258-K261 VanDerWaalsContact O-N 3.12Å; I259-K261 VanDerWaalsContact C-N 3.27Å; I259-K261 PolarHBondContact O-N 3.31Å; K261-F263 PolarHBondContact O-N 3.19Å; K261-F264 WeakPolarHBondContact CA-O 3.49Å
262	K	93.7	Very high	91.2	Very high	41 Å²	41	68.7 Å²	68.7	18%	0.178	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-20.1	175	-63.5	176.8	-167.6	-59.8	0	112.6	D258 I259 G260 H357 D361	D258-K262 WeakPolarHBondContact O-CG 3.44Å; D258-K262 PolarHBondContact O-N 3.28Å; D258-K262 VanDerWaalsContact O-N 3.16Å; D258-K262 WeakPolarHBondContact OD2-CE 3.37Å; D258-K262 IonicContact OD2-NZ 3.44Å; I259-K262 WeakPolarHBondContact O-CB 3.35Å; I259-K262 PolarHBondContact O-N 3.3Å; I259-K262 VanDerWaalsContact O-N 3.12Å; G260-K262 PolarHBondContact O-N 2.75Å; K262-H357 HydrophobicContact CD-CB 4.04Å; K262-D361 WeakPolarHBondContact CD-OD1 3.36Å; K262-D361 WeakPolarHBondContact CE-OD1 3.38Å; K262-D361 IonicContact NZ-OD1 3.17Å; K262-D361 PolarHBondContact NZ-OD1 2.91Å; K262-D361 IonicContact NZ-OD2 3.6Å
263	F	93	Very high	91.5	Very high	7 Å²	7	68.3 Å²	68.3	3%	0.031	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-43.3	179.3	-65.9	-94.4	0	0	0	111.9	L115 M117 R118 I259 G260 K261 I273 T360	L115-F263 HydrophobicContact CB-CZ 4.32Å; L115-F263 HydrophobicContact CD2-CZ 3.91Å; L115-F263 VanDerWaalsContact O-CE1 3.27Å; L115-F263 WeakPolarHBondContact O-CE1 3.49Å; M117-F263 HydrophobicContact CE-CD1 4.34Å; M117-F263 HydrophobicContact CG-CD1 3.87Å; M117-F263 HydrophobicContact CG-CE1 3.95Å; M117-F263 HydrophobicContact SD-CD1 3.82Å; M117-F263 HydrophobicContact SD-CE1 4.39Å; R118-F263 HydrophobicContact CG-CD1 3.92Å; R118-F263 HydrophobicContact CG-CE1 4.45Å; R118-F263 PolarHBondContact NH1-O 2.96Å; I259-F263 HydrophobicContact CG2-CE2 4.37Å; I259-F263 VanDerWaalsContact O-CD2 3.28Å; I259-F263 WeakPolarHBondContact O-CD2 3.43Å; G260-F263 PolarHBondContact O-N 3.24Å; K261-F263 PolarHBondContact O-N 3.19Å; F263-I273 HydrophobicContact CB-CD1 3.88Å; F263-I273 HydrophobicContact CB-CG1 3.8Å; F263-I273 HydrophobicContact CD1-CD1 3.74Å; F263-I273 HydrophobicContact CD1-CG1 4.5Å; F263-I273 HydrophobicContact CD2-CD1 3.91Å; F263-I273 HydrophobicContact CD2-CG1 3.91Å; F263-I273 HydrophobicContact CD2-CG2 3.9Å; F263-I273 HydrophobicContact CE1-CD1 4.22Å; F263-I273 HydrophobicContact CE2-CD1 4.39Å; F263-I273 HydrophobicContact CE2-CG2 4Å; F263-I273 HydrophobicContact CG-CD1 3.56Å; F263-I273 HydrophobicContact CG-CG1 3.82Å; F263-T360 HydrophobicContact CD1-CG2 4.11Å; F263-T360 HydrophobicContact CE1-CG2 3.6Å; F263-T360 HydrophobicContact CE2-CG2 4.05Å; F263-T360 HydrophobicContact CZ-CG2 3.56Å
264	F	91.8	Very high	91.7	Very high	8 Å²	8	64 Å²	64	4%	0.035	31%	0.308	C	S	.	.			trans	-143	145.4	-170.5	-55.2	-74.2	0	0	0	113.1	L56 L63 M117 G260 K261 R269 Q270 I273	L56-F264 HydrophobicContact CD2-CE2 4.26Å; L56-F264 HydrophobicContact CD2-CZ 4.48Å; L63-F264 HydrophobicContact CD1-CE1 3.89Å; L63-F264 HydrophobicContact CD1-CZ 3.59Å; L63-F264 HydrophobicContact CD2-CE1 3.67Å; L63-F264 HydrophobicContact CD2-CZ 4.24Å; L63-F264 HydrophobicContact CG-CE1 3.72Å; L63-F264 HydrophobicContact CG-CZ 3.96Å; M117-F264 HydrophobicContact CE-CE1 4.25Å; M117-F264 HydrophobicContact CE-CZ 3.98Å; M117-F264 HydrophobicContact SD-CE2 4.49Å; M117-F264 HydrophobicContact SD-CZ 4.17Å; G260-F264 PolarHBondContact O-N 2.79Å; K261-F264 WeakPolarHBondContact CA-O 3.49Å; F264-R269 HydrophobicContact CB-CB 3.72Å; F264-R269 HydrophobicContact CD1-CB 3.67Å; F264-R269 HydrophobicContact CD1-CG 4.31Å; F264-R269 VanDerWaalsContact CD2-C 3.48Å; F264-R269 HydrophobicContact CD2-CB 3.58Å; F264-R269 VanDerWaalsContact CD2-O 3.29Å; F264-R269 WeakPolarHBondContact CD2-O 3.12Å; F264-R269 HydrophobicContact CE1-CB 4Å; F264-R269 HydrophobicContact CE1-CG 4.39Å; F264-R269 HydrophobicContact CE2-CB 3.93Å; F264-R269 WeakPolarHBondContact CE2-O 3.46Å; F264-R269 HydrophobicContact CG-CB 3.39Å; F264-R269 HydrophobicContact CG-CG 4.48Å; F264-R269 HydrophobicContact CZ-CB 4.09Å; F264-Q270 HydrophobicContact CB-CG 4.19Å; F264-Q270 VanDerWaalsContact O-CG 3.27Å; F264-Q270 WeakPolarHBondContact O-CG 3.41Å; F264-Q270 PolarHBondContact O-NE2 3.23Å; F264-I273 HydrophobicContact CD2-CD1 4.4Å; F264-I273 HydrophobicContact CD2-CG1 3.86Å; F264-I273 HydrophobicContact CE2-CD1 3.82Å; F264-I273 HydrophobicContact CE2-CG1 3.71Å
265	D	90.5	Very high	91.9	Very high	151 Å²	151	55.9 Å²	55.9	81%	0.807	28%	0.281	S	S	*	.	S	Bend	trans	-81.5	-31.2	178.2	-62.5	-45	0	0	0	113.1	Q270	D265-Q270 VanDerWaalsContact C-NE2 3.34Å; D265-Q270 PolarHBondContact O-NE2 3.09Å
266	D	91.7	Very high	92.3	Very high	50 Å²	50	50.7 Å²	50.7	27%	0.267	25%	0.254	S	S	.	.	S	Bend	trans	-89.4	145.9	-179.7	65.6	96.1	0	0	0	112.9	E268 R269 Q270	D266-E268 VanDerWaalsContact C-N 3.3Å; D266-E268 PolarHBondContact O-N 3.27Å; D266-E268 PolarHBondContact OD1-N 2.97Å; D266-R269 VanDerWaalsContact OD1-CB 3.32Å; D266-R269 WeakPolarHBondContact OD1-CB 3.39Å; D266-R269 WeakPolarHBondContact OD1-CG 3.42Å; D266-R269 PolarHBondContact OD1-N 3.26Å; D266-R269 IonicContact OD1-NE 3.78Å; D266-R269 IonicContact OD2-CZ 3.2Å; D266-R269 IonicContact OD2-NE 3.63Å; D266-R269 PolarHBondContact OD2-NE 2.82Å; D266-R269 IonicContact OD2-NH2 3.02Å; D266-R269 PolarHBondContact OD2-NH2 3.13Å; D266-Q270 WeakPolarHBondContact O-CB 3.45Å; D266-Q270 WeakPolarHBondContact O-CG 3.46Å; D266-Q270 PolarHBondContact O-N 3.13Å; D266-Q270 VanDerWaalsContact O-N 3.08Å
267	S	91.9	Very high	92.6	Very high	92 Å²	92	47.7 Å²	47.7	64%	0.643	24%	0.244	S	C	*	.	H	α-helix	trans	-66.9	-27.1	-175.1	53.9	0	0	0	0	114.4	Q271	S267-Q271 PolarHBondContact O-N 2.89Å; S267-Q271 VanDerWaalsContact O-N 3.15Å
268	E	91.1	Very high	92.8	Very high	147 Å²	147	44.9 Å²	44.9	69%	0.687	23%	0.225	S	C	*	.	H	α-helix	trans	-70.4	-48.2	-178.5	-175.4	176.9	-172.3	0	0	110.6	D266 Q271	D266-E268 VanDerWaalsContact C-N 3.3Å; D266-E268 PolarHBondContact O-N 3.27Å; D266-E268 PolarHBondContact OD1-N 2.97Å; E268-Q271 WeakPolarHBondContact O-CB 3.49Å; E268-Q271 PolarHBondContact O-N 2.92Å
269	R	91.1	Very high	92.9	Very high	65 Å²	65	43.9 Å²	43.9	25%	0.245	22%	0.219	C	C	.	.	H	α-helix	trans	-70.9	-32.6	174.8	-68.1	-171.3	-67.5	-172.8	-3.6	112.7	L62 F264 D266 Q271 L272	L62-R269 HydrophobicContact CB-CG 4.36Å; L62-R269 HydrophobicContact CD1-CG 3.56Å; L62-R269 PolarHBondContact O-NH1 3.28Å; F264-R269 HydrophobicContact CB-CB 3.72Å; F264-R269 HydrophobicContact CD1-CB 3.67Å; F264-R269 HydrophobicContact CD1-CG 4.31Å; F264-R269 VanDerWaalsContact CD2-C 3.48Å; F264-R269 HydrophobicContact CD2-CB 3.58Å; F264-R269 VanDerWaalsContact CD2-O 3.29Å; F264-R269 WeakPolarHBondContact CD2-O 3.12Å; F264-R269 HydrophobicContact CE1-CB 4Å; F264-R269 HydrophobicContact CE1-CG 4.39Å; F264-R269 HydrophobicContact CE2-CB 3.93Å; F264-R269 WeakPolarHBondContact CE2-O 3.46Å; F264-R269 HydrophobicContact CG-CB 3.39Å; F264-R269 HydrophobicContact CG-CG 4.48Å; F264-R269 HydrophobicContact CZ-CB 4.09Å; D266-R269 VanDerWaalsContact OD1-CB 3.32Å; D266-R269 WeakPolarHBondContact OD1-CB 3.39Å; D266-R269 WeakPolarHBondContact OD1-CG 3.42Å; D266-R269 PolarHBondContact OD1-N 3.26Å; D266-R269 IonicContact OD1-NE 3.78Å; D266-R269 IonicContact OD2-CZ 3.2Å; D266-R269 IonicContact OD2-NE 3.63Å; D266-R269 PolarHBondContact OD2-NE 2.82Å; D266-R269 IonicContact OD2-NH2 3.02Å; D266-R269 PolarHBondContact OD2-NH2 3.13Å; R269-Q271 PolarHBondContact O-N 2.91Å; R269-L272 HydrophobicContact CB-CD1 4.46Å; R269-L272 HydrophobicContact CG-CD1 4.38Å; R269-L272 WeakPolarHBondContact O-CB 3.4Å; R269-L272 PolarHBondContact O-N 3.18Å
270	Q	94.3	Very high	93	Very high	22 Å²	22	43.1 Å²	43.1	10%	0.103	22%	0.215	C	C	.	.	H	α-helix	trans	-56.4	-35.6	170.2	-72.3	171.1	21.3	0	0	112.1	F264 D265 D266 L272 I273 F274	F264-Q270 HydrophobicContact CB-CG 4.19Å; F264-Q270 VanDerWaalsContact O-CG 3.27Å; F264-Q270 WeakPolarHBondContact O-CG 3.41Å; F264-Q270 PolarHBondContact O-NE2 3.23Å; D265-Q270 VanDerWaalsContact C-NE2 3.34Å; D265-Q270 PolarHBondContact O-NE2 3.09Å; D266-Q270 WeakPolarHBondContact O-CB 3.45Å; D266-Q270 WeakPolarHBondContact O-CG 3.46Å; D266-Q270 PolarHBondContact O-N 3.13Å; D266-Q270 VanDerWaalsContact O-N 3.08Å; Q270-L272 VanDerWaalsContact C-N 3.27Å; Q270-L272 PolarHBondContact O-N 3.02Å; Q270-I273 PolarHBondContact O-N 3.44Å; Q270-F274 HydrophobicContact CB-CE2 4.12Å; Q270-F274 WeakPolarHBondContact O-CD2 3.29Å; Q270-F274 PolarHBondContact O-N 2.89Å
271	Q	93.7	Very high	92.9	Very high	51 Å²	51	43.3 Å²	43.3	24%	0.238	22%	0.216	C	C	.	.	H	α-helix	trans	-58.3	-39.4	175.4	-113.9	-69.8	-163.8	0	0	112.7	S267 E268 R269 I273 F274 D275	S267-Q271 PolarHBondContact O-N 2.89Å; S267-Q271 VanDerWaalsContact O-N 3.15Å; E268-Q271 WeakPolarHBondContact O-CB 3.49Å; E268-Q271 PolarHBondContact O-N 2.92Å; R269-Q271 PolarHBondContact O-N 2.91Å; Q271-I273 PolarHBondContact O-N 2.72Å; Q271-F274 PolarHBondContact O-N 3.26Å; Q271-F274 VanDerWaalsContact O-N 3.09Å; Q271-D275 PolarHBondContact NE2-OD1 3.36Å; Q271-D275 PolarHBondContact NE2-OD2 3.17Å; Q271-D275 VanDerWaalsContact O-CG 3.28Å; Q271-D275 PolarHBondContact O-N 2.78Å
272	L	93.4	Very high	92.7	Very high	30 Å²	30	37 Å²	37	16%	0.157	19%	0.189	C	C	.	.	H	α-helix	trans	-60	-38.5	-178.1	-53.1	177.1	0	0	0	111.1	K55 L56 R269 Q270 Y276	K55-L272 HydrophobicContact CB-CD2 4.19Å; K55-L272 HydrophobicContact CD-CD2 4.03Å; L56-L272 HydrophobicContact CD2-CB 3.58Å; L56-L272 HydrophobicContact CG-CB 4.46Å; R269-L272 HydrophobicContact CB-CD1 4.46Å; R269-L272 HydrophobicContact CG-CD1 4.38Å; R269-L272 WeakPolarHBondContact O-CB 3.4Å; R269-L272 PolarHBondContact O-N 3.18Å; Q270-L272 VanDerWaalsContact C-N 3.27Å; Q270-L272 PolarHBondContact O-N 3.02Å; L272-Y276 VanDerWaalsContact O-CB 3.3Å; L272-Y276 WeakPolarHBondContact O-CB 3.31Å; L272-Y276 PolarHBondContact O-N 3.08Å
273	I	94.5	Very high	92.5	Very high	1 Å²	1	36 Å²	36	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-66.1	-44.9	175.5	-58.7	-63	0	0	0	111.2	L56 M117 I259 F263 F264 Q270 Q271 Y276 I277	L56-I273 HydrophobicContact CD1-CD1 4.13Å; L56-I273 HydrophobicContact CD2-CD1 3.74Å; M117-I273 HydrophobicContact SD-CD1 4.28Å; I259-I273 HydrophobicContact CG2-CG2 3.71Å; F263-I273 HydrophobicContact CB-CD1 3.88Å; F263-I273 HydrophobicContact CB-CG1 3.8Å; F263-I273 HydrophobicContact CD1-CD1 3.74Å; F263-I273 HydrophobicContact CD1-CG1 4.5Å; F263-I273 HydrophobicContact CD2-CD1 3.91Å; F263-I273 HydrophobicContact CD2-CG1 3.91Å; F263-I273 HydrophobicContact CD2-CG2 3.9Å; F263-I273 HydrophobicContact CE1-CD1 4.22Å; F263-I273 HydrophobicContact CE2-CD1 4.39Å; F263-I273 HydrophobicContact CE2-CG2 4Å; F263-I273 HydrophobicContact CG-CD1 3.56Å; F263-I273 HydrophobicContact CG-CG1 3.82Å; F264-I273 HydrophobicContact CD2-CD1 4.4Å; F264-I273 HydrophobicContact CD2-CG1 3.86Å; F264-I273 HydrophobicContact CE2-CD1 3.82Å; F264-I273 HydrophobicContact CE2-CG1 3.71Å; Q270-I273 PolarHBondContact O-N 3.44Å; Q271-I273 PolarHBondContact O-N 2.72Å; I273-Y276 PolarHBondContact O-N 3.16Å; I273-I277 HydrophobicContact CG2-CD1 3.72Å; I273-I277 HydrophobicContact CG2-CG1 4.41Å; I273-I277 WeakPolarHBondContact O-CB 3.36Å; I273-I277 VanDerWaalsContact O-CG1 3.3Å; I273-I277 WeakPolarHBondContact O-CG1 3.33Å; I273-I277 PolarHBondContact O-N 2.85Å
274	F	94.9	Very high	92.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.1	-40	179.1	-61.9	-52.8	0	0	0	112.3	P249 I252 R253 R256 I259 Q270 Q271 Y278	P249-F274 HydrophobicContact CB-CB 4.4Å; I252-F274 HydrophobicContact CB-CD1 4.25Å; I252-F274 HydrophobicContact CG2-CD1 3.68Å; I252-F274 HydrophobicContact CG2-CE1 4.21Å; R253-F274 HydrophobicContact CB-CD1 4.4Å; R253-F274 HydrophobicContact CB-CD2 4Å; R253-F274 HydrophobicContact CB-CE1 4.28Å; R253-F274 HydrophobicContact CB-CE2 3.89Å; R253-F274 HydrophobicContact CB-CG 4.27Å; R253-F274 HydrophobicContact CB-CZ 4.03Å; R253-F274 HydrophobicContact CG-CD2 4.18Å; R253-F274 HydrophobicContact CG-CE2 3.65Å; R253-F274 HydrophobicContact CG-CZ 3.89Å; R256-F274 WeakPolarHBondContact O-CE1 3.19Å; I259-F274 HydrophobicContact CB-CE1 4.23Å; Q270-F274 HydrophobicContact CB-CE2 4.12Å; Q270-F274 WeakPolarHBondContact O-CD2 3.29Å; Q270-F274 PolarHBondContact O-N 2.89Å; Q271-F274 PolarHBondContact O-N 3.26Å; Q271-F274 VanDerWaalsContact O-N 3.09Å; F274-Y278 VanDerWaalsContact O-CB 3.27Å; F274-Y278 WeakPolarHBondContact O-CB 3.32Å; F274-Y278 PolarHBondContact O-N 3.5Å
275	D	92.9	Very high	92.2	Very high	44 Å²	44	43 Å²	43	24%	0.235	22%	0.224	C	C	.	.	H	α-helix	trans	-66	-45.6	177	-66.4	-24.4	0	0	0	110.8	P249 Q271 Y278 H279	P249-D275 VanDerWaalsContact CB-OD1 3.23Å; P249-D275 WeakPolarHBondContact CB-OD1 3.4Å; P249-D275 WeakPolarHBondContact CG-OD1 3.45Å; Q271-D275 PolarHBondContact NE2-OD1 3.36Å; Q271-D275 PolarHBondContact NE2-OD2 3.17Å; Q271-D275 VanDerWaalsContact O-CG 3.28Å; Q271-D275 PolarHBondContact O-N 2.78Å; D275-Y278 PolarHBondContact O-N 2.76Å; D275-H279 PolarHBondContact O-CD2 3.24Å; D275-H279 PolarHBondContact O-N 2.96Å
276	Y	94.5	Very high	92.3	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.2	-53.9	176.7	179.2	-111.2	0	0	0	111.8	L49 A52 E53 L56 G112 A114 L115 L272 I273 Y278 H279 C280	L49-Y276 HydrophobicContact CD1-CD2 3.78Å; L49-Y276 HydrophobicContact CD1-CE2 3.81Å; A52-Y276 HydrophobicContact CB-CD2 4.47Å; E53-Y276 HydrophobicContact CB-CD2 4.06Å; E53-Y276 HydrophobicContact CB-CE2 3.71Å; E53-Y276 HydrophobicContact CG-CE2 3.81Å; E53-Y276 WeakPolarHBondContact OE2-CE2 3.32Å; E53-Y276 PolarHBondContact OE2-OH 2.85Å; L56-Y276 HydrophobicContact CD1-CD1 3.83Å; L56-Y276 HydrophobicContact CD1-CD2 4.14Å; L56-Y276 HydrophobicContact CD1-CG 3.58Å; G112-Y276 WeakPolarHBondContact CA-OH 3.46Å; A114-Y276 HydrophobicContact CB-CE1 3.75Å; A114-Y276 HydrophobicContact CB-CE2 4.13Å; A114-Y276 VanDerWaalsContact CB-CZ 3.5Å; A114-Y276 WeakPolarHBondContact CB-OH 3.39Å; A114-Y276 PolarHBondContact N-OH 3.06Å; L115-Y276 HydrophobicContact CD2-CD1 4.02Å; L115-Y276 HydrophobicContact CD2-CE1 4.12Å; L115-Y276 HydrophobicContact CG-CE1 4.14Å; L272-Y276 VanDerWaalsContact O-CB 3.3Å; L272-Y276 WeakPolarHBondContact O-CB 3.31Å; L272-Y276 PolarHBondContact O-N 3.08Å; I273-Y276 PolarHBondContact O-N 3.16Å; Y276-Y278 VanDerWaalsContact C-N 3.28Å; Y276-Y278 PolarHBondContact O-N 2.92Å; Y276-H279 PolarHBondContact O-N 3.38Å; Y276-H279 VanDerWaalsContact O-N 3.15Å; Y276-C280 VanDerWaalsContact CZ-SG 3.59Å; Y276-C280 PolarHBondContact O-N 2.85Å; Y276-C280 PolarHBondContact O-SG 2.74Å
277	I	94.1	Very high	92.4	Very high	21 Å²	21	33.8 Å²	33.8	11%	0.108	18%	0.176	C	C	.	.	H	α-helix	trans	-60	-41.2	179.5	-66.5	171	0	0	0	110.6	L115 I252 I259 I273 C280 N281	L115-I277 HydrophobicContact CD2-CD1 4.23Å; L115-I277 HydrophobicContact CD2-CG1 4.07Å; I252-I277 HydrophobicContact CD1-CB 4.32Å; I252-I277 HydrophobicContact CD1-CG2 3.97Å; I259-I277 HydrophobicContact CG2-CD1 3.55Å; I273-I277 HydrophobicContact CG2-CD1 3.72Å; I273-I277 HydrophobicContact CG2-CG1 4.41Å; I273-I277 WeakPolarHBondContact O-CB 3.36Å; I273-I277 VanDerWaalsContact O-CG1 3.3Å; I273-I277 WeakPolarHBondContact O-CG1 3.33Å; I273-I277 PolarHBondContact O-N 2.85Å; I277-C280 PolarHBondContact O-N 3.45Å; I277-N281 PolarHBondContact O-N 3.05Å; I277-N281 PolarHBondContact O-ND2 2.96Å
278	Y	93.2	Very high	92.4	Very high	6 Å²	6	29.9 Å²	29.9	2%	0.024	15%	0.147	C	C	.	.	H	α-helix	trans	-59.2	-50.7	176.2	171	-108	0	0	0	111.3	G245 P249 F274 D275 Y276 C280 N281 A282	G245-Y278 VanDerWaalsContact CA-OH 3.31Å; G245-Y278 WeakPolarHBondContact CA-OH 3.25Å; G245-Y278 WeakPolarHBondContact O-CE2 3.32Å; G245-Y278 PolarHBondContact O-OH 3.33Å; P249-Y278 HydrophobicContact CG-CD1 3.67Å; P249-Y278 HydrophobicContact CG-CE1 4.47Å; P249-Y278 HydrophobicContact CG-CG 3.73Å; F274-Y278 VanDerWaalsContact O-CB 3.27Å; F274-Y278 WeakPolarHBondContact O-CB 3.32Å; F274-Y278 PolarHBondContact O-N 3.5Å; D275-Y278 PolarHBondContact O-N 2.76Å; Y276-Y278 VanDerWaalsContact C-N 3.28Å; Y276-Y278 PolarHBondContact O-N 2.92Å; Y278-C280 VanDerWaalsContact C-N 3.34Å; Y278-C280 PolarHBondContact O-N 2.77Å; Y278-N281 CarbonylContact O-C 3.5Å; Y278-N281 PolarHBondContact O-N 3.3Å; Y278-A282 HydrophobicContact CE1-CB 4.01Å; Y278-A282 HydrophobicContact CE2-CB 3.96Å; Y278-A282 WeakPolarHBondContact O-CB 3.25Å; Y278-A282 PolarHBondContact O-N 3.31Å
279	H	93.2	Very high	92.4	Very high	33 Å²	33	26.5 Å²	26.5	15%	0.153	13%	0.134	C	C	.	.	H	α-helix	trans	-71.2	-25.9	-177.5	-74.2	-62.3	0	0	0	113.8	V48 L49 D275 Y276 N281 Q283	V48-H279 WeakPolarHBondContact CG1-CE1 3.48Å; V48-H279 VanDerWaalsContact CG1-NE2 3.32Å; V48-H279 WeakPolarHBondContact CG1-NE2 3.34Å; L49-H279 HydrophobicContact CB-CB 4.01Å; L49-H279 HydrophobicContact CD1-CB 3.87Å; L49-H279 HydrophobicContact CG-CB 4.48Å; D275-H279 PolarHBondContact O-CD2 3.24Å; D275-H279 PolarHBondContact O-N 2.96Å; Y276-H279 PolarHBondContact O-N 3.38Å; Y276-H279 VanDerWaalsContact O-N 3.15Å; H279-N281 PolarHBondContact O-N 2.98Å; H279-Q283 PolarHBondContact O-NE2 3.42Å
280	C	93.4	Very high	92.5	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.007	12%	0.122	C	C	.	.	H	α-helix	trans	-59.5	-29.9	165.2	-69.5	0	0	0	0	111.8	R142 Y276 I277 Y278	R142-C280 PolarHBondContact NH2-O 2.66Å; Y276-C280 VanDerWaalsContact CZ-SG 3.59Å; Y276-C280 PolarHBondContact O-N 2.85Å; Y276-C280 PolarHBondContact O-SG 2.74Å; I277-C280 PolarHBondContact O-N 3.45Å; Y278-C280 VanDerWaalsContact C-N 3.34Å; Y278-C280 PolarHBondContact O-N 2.77Å
281	N	91.2	Very high	92.4	Very high	4 Å²	4	23.8 Å²	23.8	2%	0.021	12%	0.123	C	C	.	.	H	α-helix	trans	-113.5	-13	-171.6	-65.4	-71	0	0	0	114.6	G110 L238 R242 I277 Y278 H279 Q283	G110-N281 WeakPolarHBondContact CA-OD1 3.45Å; G110-N281 PolarHBondContact O-ND2 3.26Å; L238-N281 HydrophobicContact CB-CB 4.49Å; L238-N281 WeakPolarHBondContact CD1-OD1 3.2Å; L238-N281 HydrophobicContact CD2-CB 4Å; R242-N281 PolarHBondContact NE-O 3.31Å; R242-N281 PolarHBondContact NH2-O 3.4Å; I277-N281 PolarHBondContact O-N 3.05Å; I277-N281 PolarHBondContact O-ND2 2.96Å; Y278-N281 CarbonylContact O-C 3.5Å; Y278-N281 PolarHBondContact O-N 3.3Å; H279-N281 PolarHBondContact O-N 2.98Å; N281-Q283 PolarHBondContact O-N 3.37Å; N281-Q283 VanDerWaalsContact O-N 3.1Å
282	A	89.6	Confident	92.2	Very high	2 Å²	2	25 Å²	25	2%	0.017	13%	0.129	C	C	.	.	S	Bend	trans	-67.6	-10	176	0	0	0	0	0	113.5	P43 Y278	P43-A282 WeakPolarHBondContact O-CB 3.37Å; Y278-A282 HydrophobicContact CE1-CB 4.01Å; Y278-A282 HydrophobicContact CE2-CB 3.96Å; Y278-A282 WeakPolarHBondContact O-CB 3.25Å; Y278-A282 PolarHBondContact O-N 3.31Å
283	Q	89.6	Confident	92.1	Very high	22 Å²	22	26 Å²	26	10%	0.103	13%	0.134	C	C	.	.	S	Bend	trans	-79.8	179.2	-179.4	-69.9	-179.8	81.7	0	0	113.2	F44 G138 R142 R242 H279 N281	F44-Q283 HydrophobicContact CB-CG 3.91Å; F44-Q283 HydrophobicContact CD1-CG 3.55Å; F44-Q283 HydrophobicContact CD2-CB 4.49Å; F44-Q283 HydrophobicContact CD2-CG 3.09Å; F44-Q283 HydrophobicContact CE1-CG 3.7Å; F44-Q283 VanDerWaalsContact CE1-OE1 3.23Å; F44-Q283 HydrophobicContact CE2-CG 3.25Å; F44-Q283 VanDerWaalsContact CE2-NE2 3.3Å; F44-Q283 HydrophobicContact CG-CB 4.39Å; F44-Q283 HydrophobicContact CG-CG 3.22Å; F44-Q283 HydrophobicContact CZ-CG 3.54Å; G138-Q283 PolarHBondContact O-NE2 2.79Å; R142-Q283 VanDerWaalsContact CZ-NE2 3.35Å; R142-Q283 VanDerWaalsContact NH1-NE2 3.12Å; R142-Q283 VanDerWaalsContact NH2-NE2 3.11Å; R242-Q283 PolarHBondContact NE-O 2.87Å; R242-Q283 PolarHBondContact NH2-O 3.18Å; H279-Q283 PolarHBondContact O-NE2 3.42Å; N281-Q283 PolarHBondContact O-N 3.37Å; N281-Q283 VanDerWaalsContact O-N 3.1Å
284	L	87.8	Confident	92.1	Very high	126 Å²	126	26 Å²	26	66%	0.66	13%	0.134	S	C	*	.			trans	-53.6	138.9	173.8	-67.1	173.1	0	0	0	111.6	R142 S286	R142-L284 WeakPolarHBondContact CD-O 3.4Å; R142-L284 PolarHBondContact NE-O 2.88Å; R142-L284 VanDerWaalsContact NE-O 3.11Å; L284-S286 PolarHBondContact O-N 3.03Å
285	P	89.7	Confident	91.8	Very high	35 Å²	35	26.8 Å²	26.8	23%	0.227	14%	0.14	C	C	.	.			trans	-76.4	33.5	-175.8	32.7	-36.7	0	0	0	114.1	G287 E288 D289	P285-G287 PolarHBondContact O-N 2.93Å; P285-E288 HydrophobicContact CB-CB 4.05Å; P285-E288 HydrophobicContact CB-CG 4.33Å; P285-E288 CarbonylContact O-C 3.59Å; P285-E288 WeakPolarHBondContact O-CA 3.25Å; P285-E288 WeakPolarHBondContact O-CB 3.42Å; P285-E288 PolarHBondContact O-N 2.79Å; P285-D289 VanDerWaalsContact O-CG 3.23Å; P285-D289 PolarHBondContact O-N 3.1Å
286	S	93.5	Very high	91.4	Very high	8 Å²	8	27.1 Å²	27.1	6%	0.056	14%	0.141	C	C	.	.	H	α-helix	trans	-51	-57.7	-174.5	159.7	0	0	0	0	113.9	G136 R142 P143 F145 L284 E288 D289 A290	G136-S286 WeakPolarHBondContact CA-OG 3.15Å; R142-S286 VanDerWaalsContact C-OG 3.22Å; R142-S286 WeakPolarHBondContact CA-OG 3.42Å; P143-S286 WeakPolarHBondContact O-CB 3.22Å; P143-S286 PolarHBondContact O-OG 2.86Å; F145-S286 WeakPolarHBondContact CD2-O 3.34Å; F145-S286 WeakPolarHBondContact CE2-OG 3.49Å; L284-S286 PolarHBondContact O-N 3.03Å; S286-E288 VanDerWaalsContact C-N 3.27Å; S286-E288 PolarHBondContact O-N 2.9Å; S286-D289 PolarHBondContact O-N 2.91Å; S286-A290 PolarHBondContact O-N 3.48Å; S286-A290 VanDerWaalsContact O-N 3.17Å
287	G	93.8	Very high	90.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-70.5	-23.8	178.2	0	0	0	0	0	113.4	G136 F137 P285 F291	G136-G287 PolarHBondContact O-N 3.04Å; F137-G287 VanDerWaalsContact CZ-CA 3.49Å; F137-G287 VanDerWaalsContact CZ-O 3.28Å; F137-G287 WeakPolarHBondContact CZ-O 3.45Å; P285-G287 PolarHBondContact O-N 2.93Å; G287-F291 WeakPolarHBondContact O-CB 3.45Å; G287-F291 PolarHBondContact O-N 3.09Å
288	E	91.1	Very high	89.5	Confident	9 Å²	9	36.9 Å²	36.9	4%	0.042	19%	0.192	C	C	.	.	H	α-helix	trans	-72.4	-42.8	175.9	-57.5	177.3	-129.7	0	0	111.6	F137 S236 L238 R242 P285 S286 A290 F291 Q292	F137-E288 HydrophobicContact CE1-CG 4.35Å; S236-E288 WeakPolarHBondContact CB-OE2 3.29Å; S236-E288 PolarHBondContact OG-OE2 3.22Å; L238-E288 VanDerWaalsContact CB-OE2 3.25Å; L238-E288 WeakPolarHBondContact CB-OE2 3.38Å; L238-E288 VanDerWaalsContact CD1-CD 3.44Å; L238-E288 HydrophobicContact CD1-CG 3.67Å; R242-E288 IonicContact CZ-OE1 2.91Å; R242-E288 IonicContact NH1-OE1 3.91Å; R242-E288 IonicContact NH2-OE1 3.94Å; R242-E288 PolarHBondContact NH2-OE1 2.93Å; P285-E288 HydrophobicContact CB-CB 4.05Å; P285-E288 HydrophobicContact CB-CG 4.33Å; P285-E288 CarbonylContact O-C 3.59Å; P285-E288 WeakPolarHBondContact O-CA 3.25Å; P285-E288 WeakPolarHBondContact O-CB 3.42Å; P285-E288 PolarHBondContact O-N 2.79Å; S286-E288 VanDerWaalsContact C-N 3.27Å; S286-E288 PolarHBondContact O-N 2.9Å; E288-A290 VanDerWaalsContact C-N 3.29Å; E288-A290 PolarHBondContact O-N 3.46Å; E288-F291 WeakPolarHBondContact O-CB 3.24Å; E288-F291 PolarHBondContact O-N 2.84Å; E288-F291 VanDerWaalsContact O-N 3.15Å; E288-Q292 WeakPolarHBondContact O-CG 3.49Å; E288-Q292 PolarHBondContact O-N 2.97Å
289	D	90.6	Very high	88.7	Confident	77 Å²	77	38.7 Å²	38.7	41%	0.412	21%	0.208	S	C	.	.	H	α-helix	trans	-62.4	-42.6	175.8	-65	-18.9	0	0	0	109.4	P285 S286 F291 Q292 L293	P285-D289 VanDerWaalsContact O-CG 3.23Å; P285-D289 PolarHBondContact O-N 3.1Å; S286-D289 PolarHBondContact O-N 2.91Å; D289-F291 PolarHBondContact O-N 2.73Å; D289-Q292 WeakPolarHBondContact O-CB 3.28Å; D289-Q292 PolarHBondContact O-N 3.21Å; D289-L293 WeakPolarHBondContact O-CG 3.37Å; D289-L293 PolarHBondContact O-N 3.15Å
290	A	93.2	Very high	88.4	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.9	-43.1	172	0	0	0	0	0	112.6	F145 A152 W156 S286 E288 Q292 L293 I294	F145-A290 HydrophobicContact CB-CB 3.87Å; F145-A290 HydrophobicContact CD1-CB 3.59Å; F145-A290 HydrophobicContact CD2-CB 3.58Å; F145-A290 HydrophobicContact CE1-CB 3.92Å; F145-A290 HydrophobicContact CE2-CB 3.92Å; F145-A290 HydrophobicContact CG-CB 3.4Å; F145-A290 HydrophobicContact CZ-CB 4.08Å; A152-A290 HydrophobicContact CB-CB 4.45Å; W156-A290 HydrophobicContact CH2-CB 3.43Å; W156-A290 VanDerWaalsContact CH2-CB 3.43Å; W156-A290 HydrophobicContact CZ2-CB 3.59Å; W156-A290 HydrophobicContact CZ3-CB 4.2Å; S286-A290 PolarHBondContact O-N 3.48Å; S286-A290 VanDerWaalsContact O-N 3.17Å; E288-A290 VanDerWaalsContact C-N 3.29Å; E288-A290 PolarHBondContact O-N 3.46Å; A290-Q292 VanDerWaalsContact C-N 3.34Å; A290-Q292 PolarHBondContact O-N 3.35Å; A290-L293 WeakPolarHBondContact O-CB 3.5Å; A290-L293 PolarHBondContact O-N 3.07Å; A290-I294 PolarHBondContact O-N 3.5Å
291	F	93.1	Very high	88.3	Confident	29 Å²	29	39.4 Å²	39.4	13%	0.127	21%	0.21	C	C	.	.	H	α-helix	trans	-62.5	-40.9	176.1	179.7	-101	0	0	0	111.9	L109 L179 W204 G287 E288 D289 L293 I294 S295	L109-F291 HydrophobicContact CD1-CB 3.93Å; L109-F291 HydrophobicContact CD1-CD1 4.12Å; L109-F291 HydrophobicContact CD1-CD2 4.29Å; L109-F291 HydrophobicContact CD1-CG 3.85Å; L109-F291 HydrophobicContact CD2-CD1 3.85Å; L109-F291 HydrophobicContact CD2-CE1 3.81Å; L109-F291 HydrophobicContact CD2-CG 4.32Å; L109-F291 HydrophobicContact CD2-CZ 4.23Å; L179-F291 HydrophobicContact CD1-CD2 3.75Å; L179-F291 HydrophobicContact CD1-CE2 4.14Å; L179-F291 HydrophobicContact CD2-CD2 3.88Å; L179-F291 HydrophobicContact CG-CD2 4.29Å; W204-F291 AromaticContact CD2-CE2 3.6Å; W204-F291 HydrophobicContact CD2-CE2 3.6Å; W204-F291 AromaticContact CD2-CZ 3.98Å; W204-F291 HydrophobicContact CD2-CZ 3.98Å; W204-F291 AromaticContact CE2-CE2 3.54Å; W204-F291 AromaticContact CE2-CZ 3.53Å; W204-F291 HydrophobicContact CE3-CD2 4.47Å; W204-F291 AromaticContact CE3-CE2 3.62Å; W204-F291 HydrophobicContact CE3-CE2 3.62Å; W204-F291 HydrophobicContact CE3-CZ 4.43Å; W204-F291 HydrophobicContact CG-CE2 4.48Å; W204-F291 HydrophobicContact CH2-CD2 4.09Å; W204-F291 AromaticContact CH2-CE2 3.49Å; W204-F291 HydrophobicContact CH2-CE2 3.49Å; W204-F291 VanDerWaalsContact CH2-CE2 3.49Å; W204-F291 HydrophobicContact CH2-CZ 4.04Å; W204-F291 HydrophobicContact CZ2-CD2 4.43Å; W204-F291 AromaticContact CZ2-CE2 3.48Å; W204-F291 HydrophobicContact CZ2-CE2 3.48Å; W204-F291 VanDerWaalsContact CZ2-CE2 3.48Å; W204-F291 AromaticContact CZ2-CZ 3.55Å; W204-F291 HydrophobicContact CZ2-CZ 3.55Å; W204-F291 HydrophobicContact CZ3-CD2 4.12Å; W204-F291 AromaticContact CZ3-CE2 3.57Å; W204-F291 HydrophobicContact CZ3-CE2 3.57Å; W204-F291 HydrophobicContact CZ3-CZ 4.46Å; W204-F291 AromaticContact NE1-CZ 3.96Å; G287-F291 WeakPolarHBondContact O-CB 3.45Å; G287-F291 PolarHBondContact O-N 3.09Å; E288-F291 WeakPolarHBondContact O-CB 3.24Å; E288-F291 PolarHBondContact O-N 2.84Å; E288-F291 VanDerWaalsContact O-N 3.15Å; D289-F291 PolarHBondContact O-N 2.73Å; F291-L293 VanDerWaalsContact C-N 3.33Å; F291-I294 HydrophobicContact CD2-CD1 4.46Å; F291-I294 VanDerWaalsContact O-CG1 3.24Å; F291-I294 WeakPolarHBondContact O-CG1 3.44Å; F291-I294 PolarHBondContact O-N 2.9Å; F291-S295 VanDerWaalsContact O-CB 3.28Å; F291-S295 WeakPolarHBondContact O-CB 3.33Å; F291-S295 PolarHBondContact O-N 3.36Å; F291-S295 VanDerWaalsContact O-N 3.14Å; F291-S295 PolarHBondContact O-OG 3.46Å
292	Q	89.9	Confident	88.4	Confident	76 Å²	76	43.3 Å²	43.3	36%	0.355	23%	0.227	S	C	.	.	H	α-helix	trans	-63.4	-39.9	174.8	-71.2	179	27.9	0	0	111.6	E288 D289 A290 I294 S295	E288-Q292 WeakPolarHBondContact O-CG 3.49Å; E288-Q292 PolarHBondContact O-N 2.97Å; D289-Q292 WeakPolarHBondContact O-CB 3.28Å; D289-Q292 PolarHBondContact O-N 3.21Å; A290-Q292 VanDerWaalsContact C-N 3.34Å; A290-Q292 PolarHBondContact O-N 3.35Å; Q292-I294 VanDerWaalsContact C-N 3.31Å; Q292-I294 PolarHBondContact O-N 3.09Å; Q292-S295 PolarHBondContact O-N 2.83Å; Q292-S295 VanDerWaalsContact O-N 3.13Å
293	L	91.1	Very high	88.6	Confident	51 Å²	51	46.2 Å²	46.2	27%	0.267	24%	0.238	S	C	.	.	H	α-helix	trans	-60.6	-39.2	177.5	-73.7	170.7	0	0	0	112.3	G146 D149 A152 D289 A290 F291 S295 K302	G146-L293 WeakPolarHBondContact O-CD1 3.45Å; D149-L293 WeakPolarHBondContact CB-O 3.47Å; A152-L293 HydrophobicContact CB-CB 4.46Å; A152-L293 HydrophobicContact CB-CD1 4.4Å; D289-L293 WeakPolarHBondContact O-CG 3.37Å; D289-L293 PolarHBondContact O-N 3.15Å; A290-L293 WeakPolarHBondContact O-CB 3.5Å; A290-L293 PolarHBondContact O-N 3.07Å; F291-L293 VanDerWaalsContact C-N 3.33Å; L293-S295 VanDerWaalsContact C-N 3.32Å; L293-K302 VanDerWaalsContact O-CD 3.25Å; L293-K302 WeakPolarHBondContact O-CD 3.17Å; L293-K302 WeakPolarHBondContact O-CE 3.34Å; L293-K302 PolarHBondContact O-NZ 3.26Å
294	I	93.2	Very high	88.9	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-85.4	-3	178.2	65.5	161.3	0	0	0	113.9	D149 A152 W156 L179 Y182 W204 A290 F291 Q292 K302	D149-I294 HydrophobicContact CB-CB 4.35Å; D149-I294 HydrophobicContact CB-CG2 3.94Å; D149-I294 WeakPolarHBondContact O-CG2 3.45Å; A152-I294 HydrophobicContact CB-CG2 4.15Å; W156-I294 HydrophobicContact CH2-CD1 4.38Å; W156-I294 HydrophobicContact CZ3-CD1 3.81Å; W156-I294 HydrophobicContact CZ3-CG1 4.39Å; W156-I294 HydrophobicContact CZ3-CG2 4.41Å; L179-I294 HydrophobicContact CD1-CD1 4.14Å; Y182-I294 HydrophobicContact CD1-CD1 4.08Å; Y182-I294 HydrophobicContact CE1-CD1 3.82Å; W204-I294 HydrophobicContact CH2-CD1 3.7Å; W204-I294 HydrophobicContact CH2-CG1 3.92Å; W204-I294 HydrophobicContact CZ3-CD1 3.49Å; W204-I294 VanDerWaalsContact CZ3-CD1 3.49Å; W204-I294 HydrophobicContact CZ3-CG1 4.23Å; A290-I294 PolarHBondContact O-N 3.5Å; F291-I294 HydrophobicContact CD2-CD1 4.46Å; F291-I294 VanDerWaalsContact O-CG1 3.24Å; F291-I294 WeakPolarHBondContact O-CG1 3.44Å; F291-I294 PolarHBondContact O-N 2.9Å; Q292-I294 VanDerWaalsContact C-N 3.31Å; Q292-I294 PolarHBondContact O-N 3.09Å; I294-K302 PolarHBondContact O-N 3.37Å
295	S	90.1	Very high	89.4	Confident	18 Å²	18	39.8 Å²	39.8	13%	0.126	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	156	-178.2	-62.4	0	0	0	0	112.3	W204 F291 Q292 L293 W300 K302	W204-S295 WeakPolarHBondContact CH2-OG 3.49Å; W204-S295 VanDerWaalsContact CZ2-OG 3.27Å; W204-S295 WeakPolarHBondContact CZ2-OG 3.5Å; F291-S295 VanDerWaalsContact O-CB 3.28Å; F291-S295 WeakPolarHBondContact O-CB 3.33Å; F291-S295 PolarHBondContact O-N 3.36Å; F291-S295 VanDerWaalsContact O-N 3.14Å; F291-S295 PolarHBondContact O-OG 3.46Å; Q292-S295 PolarHBondContact O-N 2.83Å; Q292-S295 VanDerWaalsContact O-N 3.13Å; L293-S295 VanDerWaalsContact C-N 3.32Å; S295-W300 CarbonylContact C-O 3.59Å; S295-W300 VanDerWaalsContact CA-O 3.31Å; S295-W300 WeakPolarHBondContact CA-O 3.48Å; S295-K302 WeakPolarHBondContact O-CE 3.35Å
296	I	84.7	Confident	89.7	Confident	50 Å²	50	38.4 Å²	38.4	26%	0.256	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	168.6	162.5	66.9	-178.4	0	0	0	109	K209 A299 W300 K302	K209-I296 HydrophobicContact CB-CD1 3.99Å; K209-I296 HydrophobicContact CD-CD1 3.55Å; K209-I296 HydrophobicContact CG-CD1 4.35Å; I296-A299 PolarHBondContact O-N 3.09Å; I296-A299 VanDerWaalsContact O-N 3.15Å; I296-W300 HydrophobicContact CD1-CB 3.79Å; I296-W300 HydrophobicContact CG1-CB 3.48Å; I296-W300 VanDerWaalsContact CG1-CB 3.48Å; I296-W300 PolarHBondContact N-O 3.08Å; I296-W300 PolarHBondContact O-N 2.83Å; I296-K302 HydrophobicContact CG2-CB 4.38Å; I296-K302 HydrophobicContact CG2-CD 4.38Å; I296-K302 HydrophobicContact CG2-CG 3.33Å
297	P	76.9	Confident	89.8	Confident	84 Å²	84	43 Å²	43	55%	0.545	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-49.7	147	-178.6	-29.7	36.9	0	0	0	113.2	A299	P297-A299 VanDerWaalsContact C-N 3.27Å
298	F	70.4	Confident	90	Very high	142 Å²	142	44.4 Å²	44.4	62%	0.623	23%	0.225	S	C	*	.	G	3₁₀ helix	trans	66.9	21.8	-171.4	-49.5	-78.2	0	0	0	115	L217 W300	L217-F298 HydrophobicContact CD1-CZ 4.36Å; F298-W300 VanDerWaalsContact C-N 3.3Å; F298-W300 PolarHBondContact O-N 2.93Å
299	A	75.9	Confident	90.2	Very high	45 Å²	45	44 Å²	44	37%	0.372	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	60.3	36.1	175.2	0	0	0	0	0	113.5	W204 I296 P297	W204-A299 PolarHBondContact NE1-O 3.14Å; I296-A299 PolarHBondContact O-N 3.09Å; I296-A299 VanDerWaalsContact O-N 3.15Å; P297-A299 VanDerWaalsContact C-N 3.27Å
300	W	87	Confident	90.5	Very high	45 Å²	45	41.5 Å²	41.5	17%	0.17	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	148.2	164.6	-66.3	97.9	0	0	0	109.5	P207 A208 K209 P210 S295 I296 F298	P207-W300 HydrophobicContact CB-CH2 4.26Å; P207-W300 HydrophobicContact CB-CZ3 3.59Å; P207-W300 HydrophobicContact CG-CE3 4.28Å; P207-W300 HydrophobicContact CG-CH2 4.14Å; P207-W300 HydrophobicContact CG-CZ3 3.47Å; P207-W300 VanDerWaalsContact CG-CZ3 3.47Å; P207-W300 VanDerWaalsContact O-CE3 3.3Å; P207-W300 WeakPolarHBondContact O-CZ3 3.48Å; A208-W300 VanDerWaalsContact O-CZ3 3.25Å; A208-W300 WeakPolarHBondContact O-CZ3 3.27Å; K209-W300 HydrophobicContact CB-CB 4.09Å; K209-W300 HydrophobicContact CB-CD2 3.94Å; K209-W300 HydrophobicContact CB-CE3 4.28Å; K209-W300 HydrophobicContact CB-CG 3.81Å; K209-W300 HydrophobicContact CG-CD2 4.37Å; K209-W300 HydrophobicContact CG-CG 4.11Å; P210-W300 HydrophobicContact CG-CH2 4.23Å; P210-W300 HydrophobicContact CG-CZ2 4.29Å; S295-W300 CarbonylContact C-O 3.59Å; S295-W300 VanDerWaalsContact CA-O 3.31Å; S295-W300 WeakPolarHBondContact CA-O 3.48Å; I296-W300 HydrophobicContact CD1-CB 3.79Å; I296-W300 HydrophobicContact CG1-CB 3.48Å; I296-W300 VanDerWaalsContact CG1-CB 3.48Å; I296-W300 PolarHBondContact N-O 3.08Å; I296-W300 PolarHBondContact O-N 2.83Å; F298-W300 VanDerWaalsContact C-N 3.3Å; F298-W300 PolarHBondContact O-N 2.93Å
301	A	92.1	Very high	90.6	Very high	3 Å²	3	48.2 Å²	48.2	3%	0.025	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	140.9	172.3	0	0	0	0	0	110.3	Y182 W204 R303	Y182-A301 HydrophobicContact CE2-CB 3.96Å; W204-A301 HydrophobicContact CH2-CB 3.93Å; W204-A301 HydrophobicContact CZ2-CB 4.21Å; W204-A301 HydrophobicContact CZ3-CB 4.39Å; A301-R303 PolarHBondContact O-N 2.94Å
302	K	93	Very high	90.8	Very high	87 Å²	87	47 Å²	47	38%	0.378	24%	0.241	S	C	.	.	S	Bend	trans	-60.5	-34.2	169.1	-77.9	-179.8	179.3	175.2	0	112.1	D149 L293 I294 S295 I296 P304	D149-K302 HydrophobicContact CB-CB 4.48Å; D149-K302 HydrophobicContact CB-CD 3.76Å; D149-K302 IonicContact OD1-NZ 2.8Å; L293-K302 VanDerWaalsContact O-CD 3.25Å; L293-K302 WeakPolarHBondContact O-CD 3.17Å; L293-K302 WeakPolarHBondContact O-CE 3.34Å; L293-K302 PolarHBondContact O-NZ 3.26Å; I294-K302 PolarHBondContact O-N 3.37Å; S295-K302 WeakPolarHBondContact O-CE 3.35Å; I296-K302 HydrophobicContact CG2-CB 4.38Å; I296-K302 HydrophobicContact CG2-CD 4.38Å; I296-K302 HydrophobicContact CG2-CG 3.33Å; K302-P304 WeakPolarHBondContact O-CD 3.28Å
303	R	95.2	Very high	91.1	Very high	63 Å²	63	47.1 Å²	47.1	24%	0.238	24%	0.239	C	C	.	.	S	Bend	trans	-123.4	72.9	-175.7	-64.6	178.4	64.1	-142.1	-2.1	110.1	D149 E153 Y182 A301	D149-R303 WeakPolarHBondContact OD2-CD 3.48Å; D149-R303 WeakPolarHBondContact OD2-CG 3.23Å; E153-R303 VanDerWaalsContact CD-NH1 3.25Å; E153-R303 IonicContact OE1-CZ 3.47Å; E153-R303 IonicContact OE1-NH1 3.69Å; E153-R303 PolarHBondContact OE1-NH1 2.68Å; E153-R303 IonicContact OE1-NH2 3.31Å; E153-R303 IonicContact OE2-NH1 2.78Å; E153-R303 PolarHBondContact OE2-NH1 3.24Å; Y182-R303 PolarHBondContact OH-O 2.7Å; A301-R303 PolarHBondContact O-N 2.94Å
304	P	96	Very high	91.3	Very high	13 Å²	13	53.3 Å²	53.3	8%	0.084	26%	0.258	C	S	.	.			trans	-60.5	139.6	-172.6	27.3	-36.8	0	0	0	112.6	G205 A208 K302 V306 D307	G205-P304 WeakPolarHBondContact O-CA 3.45Å; A208-P304 HydrophobicContact CB-CB 4.16Å; A208-P304 HydrophobicContact CB-CG 3.84Å; K302-P304 WeakPolarHBondContact O-CD 3.28Å; P304-V306 VanDerWaalsContact C-N 3.3Å; P304-V306 HydrophobicContact CB-CG1 4.39Å; P304-V306 PolarHBondContact O-N 2.99Å; P304-D307 WeakPolarHBondContact CG-OD2 3.45Å; P304-D307 PolarHBondContact O-N 2.92Å
305	M	97.4	Very high	91.3	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-71	-22.6	-175	-73.9	-65.2	155.3	0	0	113.9	Y182 A186 L189 G205 F206 D307 R308 L309	Y182-M305 HydrophobicContact CD1-CE 4.2Å; Y182-M305 HydrophobicContact CD2-CE 3.71Å; Y182-M305 HydrophobicContact CD2-CG 3.85Å; Y182-M305 HydrophobicContact CE1-CE 3.89Å; Y182-M305 HydrophobicContact CE2-CE 3.39Å; Y182-M305 HydrophobicContact CE2-CG 4.05Å; Y182-M305 HydrophobicContact CG-CE 4.1Å; Y182-M305 VanDerWaalsContact CZ-CE 3.47Å; A186-M305 HydrophobicContact CB-CE 4.12Å; L189-M305 HydrophobicContact CD1-SD 4.13Å; G205-M305 PolarHBondContact O-N 3.23Å; F206-M305 HydrophobicContact CD1-CB 3.8Å; F206-M305 HydrophobicContact CD2-CB 3.94Å; F206-M305 HydrophobicContact CD2-CG 4.22Å; F206-M305 HydrophobicContact CE1-CB 3.81Å; F206-M305 HydrophobicContact CE2-CB 3.92Å; F206-M305 HydrophobicContact CE2-CG 3.93Å; F206-M305 HydrophobicContact CG-CB 3.89Å; F206-M305 HydrophobicContact CZ-CB 3.88Å; F206-M305 HydrophobicContact CZ-CG 4.14Å; F206-M305 PolarHBondContact O-N 3.13Å; M305-D307 PolarHBondContact O-N 3.3Å; M305-R308 PolarHBondContact O-N 2.88Å; M305-R308 VanDerWaalsContact O-N 3.08Å; M305-R308 HydrophobicContact SD-CB 4.4Å; M305-L309 HydrophobicContact CB-CD1 4.17Å; M305-L309 HydrophobicContact CB-CG 4.28Å; M305-L309 WeakPolarHBondContact O-CB 3.44Å; M305-L309 PolarHBondContact O-N 3.43Å
306	V	95.9	Very high	91.6	Very high	6 Å²	6	58 Å²	58	4%	0.036	28%	0.282	C	S	.	.	H	α-helix	trans	-60.7	-30.3	176.1	70.4	0	0	0	0	112.8	F206 A208 P304 P310 L335 V336 Q339	F206-V306 VanDerWaalsContact O-CB 3.32Å; F206-V306 WeakPolarHBondContact O-CB 3.38Å; F206-V306 VanDerWaalsContact O-CG1 3.23Å; F206-V306 WeakPolarHBondContact O-CG1 3.45Å; F206-V306 PolarHBondContact O-N 2.95Å; F206-V306 VanDerWaalsContact O-N 3.09Å; A208-V306 HydrophobicContact CB-CG1 4.32Å; P304-V306 VanDerWaalsContact C-N 3.3Å; P304-V306 HydrophobicContact CB-CG1 4.39Å; P304-V306 PolarHBondContact O-N 2.99Å; V306-P310 VanDerWaalsContact O-CD 3.25Å; V306-P310 WeakPolarHBondContact O-CD 3.25Å; V306-P310 WeakPolarHBondContact O-CG 3.26Å; V306-L335 HydrophobicContact CG2-CB 4.13Å; V306-L335 HydrophobicContact CG2-CD2 3.6Å; V306-L335 HydrophobicContact CG2-CG 3.81Å; V306-V336 HydrophobicContact CB-CG2 4.43Å; V306-V336 HydrophobicContact CG2-CG2 4.07Å; V306-Q339 PolarHBondContact O-OE1 3.47Å
307	D	95.6	Very high	92.2	Very high	104 Å²	104	56 Å²	56	56%	0.556	27%	0.272	S	S	*	.	H	α-helix	trans	-83.9	-18.8	178.6	-63.2	-25.9	0	0	0	112.4	P304 M305	P304-D307 WeakPolarHBondContact CG-OD2 3.45Å; P304-D307 PolarHBondContact O-N 2.92Å; M305-D307 PolarHBondContact O-N 3.3Å
308	R	97.6	Very high	93.2	Very high	30 Å²	30	52 Å²	52	11%	0.113	25%	0.246	C	C	.	.	H	α-helix	trans	-107.3	-41.2	-169.4	-63.1	172.3	56.8	-175.2	-0.7	113.3	E153 Y182 L189 M305 P310 L311	E153-R308 VanDerWaalsContact CD-NH1 3.35Å; E153-R308 IonicContact OE1-CZ 3.63Å; E153-R308 IonicContact OE1-NH1 2.81Å; E153-R308 PolarHBondContact OE1-NH1 3.02Å; E153-R308 IonicContact OE1-NH2 3.62Å; E153-R308 PolarHBondContact OE1-NH2 3.06Å; E153-R308 IonicContact OE2-CZ 3.83Å; E153-R308 IonicContact OE2-NH1 3.82Å; E153-R308 PolarHBondContact OE2-NH1 3.35Å; E153-R308 IonicContact OE2-NH2 2.58Å; Y182-R308 PolarHBondContact OH-NH1 3.3Å; L189-R308 HydrophobicContact CD1-CB 3.9Å; M305-R308 PolarHBondContact O-N 2.88Å; M305-R308 VanDerWaalsContact O-N 3.08Å; M305-R308 HydrophobicContact SD-CB 4.4Å; R308-P310 VanDerWaalsContact C-N 3.26Å; R308-L311 WeakPolarHBondContact O-CB 3.14Å; R308-L311 WeakPolarHBondContact O-CG 3.36Å; R308-L311 PolarHBondContact O-N 2.99Å
309	L	96.4	Very high	94.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-55.8	-30.8	179.2	-81.5	175.9	0	0	0	114.5	L189 L198 F206 M305 L311 I312 F320 V336	L189-L309 HydrophobicContact CG-CD2 4.49Å; L198-L309 HydrophobicContact CD2-CD2 4.26Å; F206-L309 HydrophobicContact CD1-CD1 4.15Å; F206-L309 HydrophobicContact CE1-CD1 3.3Å; F206-L309 HydrophobicContact CZ-CD1 3.96Å; M305-L309 HydrophobicContact CB-CD1 4.17Å; M305-L309 HydrophobicContact CB-CG 4.28Å; M305-L309 WeakPolarHBondContact O-CB 3.44Å; M305-L309 PolarHBondContact O-N 3.43Å; L309-L311 PolarHBondContact O-N 3.28Å; L309-I312 VanDerWaalsContact O-CB 3.26Å; L309-I312 WeakPolarHBondContact O-CB 3.25Å; L309-I312 WeakPolarHBondContact O-CG2 3.23Å; L309-I312 PolarHBondContact O-N 3.43Å; L309-F320 HydrophobicContact CD1-CZ 4.23Å; L309-V336 HydrophobicContact CB-CG1 4.25Å; L309-V336 HydrophobicContact CB-CG2 4.42Å; L309-V336 HydrophobicContact CD1-CG1 4.35Å; L309-V336 HydrophobicContact CD1-CG2 4.35Å
310	P	95.2	Very high	95.6	Very high	24 Å²	24	43.3 Å²	43.3	16%	0.156	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-58.9	-16.2	172.2	-29.3	38.9	0	0	0	115.1	V306 R308 I312 Q339 R343	V306-P310 VanDerWaalsContact O-CD 3.25Å; V306-P310 WeakPolarHBondContact O-CD 3.25Å; V306-P310 WeakPolarHBondContact O-CG 3.26Å; R308-P310 VanDerWaalsContact C-N 3.26Å; P310-I312 VanDerWaalsContact C-N 3.32Å; P310-Q339 HydrophobicContact CG-CB 4.14Å; P310-Q339 HydrophobicContact CG-CG 4.45Å; P310-R343 PolarHBondContact O-NH1 2.85Å; P310-R343 PolarHBondContact O-NH2 2.58Å
311	L	96.3	Very high	96.1	Very high	142 Å²	142	41.2 Å²	41.2	74%	0.743	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-81.2	-8.6	175.3	-55.6	176.1	0	0	0	113.3	L189 R308 L309	L189-L311 HydrophobicContact CD2-CB 4.41Å; R308-L311 WeakPolarHBondContact O-CB 3.14Å; R308-L311 WeakPolarHBondContact O-CG 3.36Å; R308-L311 PolarHBondContact O-N 2.99Å; L309-L311 PolarHBondContact O-N 3.28Å
312	I	97.1	Very high	96.4	Very high	3 Å²	3	41.2 Å²	41.2	2%	0.015	19%	0.191	C	C	.	.	S	Bend	trans	-58.8	151.1	179	-159.5	66	0	0	0	111.7	A188 L189 P192 L309 P310 F316 I318 L340 R343	A188-I312 HydrophobicContact CB-CD1 4.34Å; A188-I312 WeakPolarHBondContact O-CD1 3.39Å; L189-I312 HydrophobicContact CD2-CB 4.18Å; L189-I312 HydrophobicContact CD2-CD1 4.01Å; L189-I312 HydrophobicContact CG-CD1 4.4Å; P192-I312 HydrophobicContact CB-CD1 4.21Å; L309-I312 VanDerWaalsContact O-CB 3.26Å; L309-I312 WeakPolarHBondContact O-CB 3.25Å; L309-I312 WeakPolarHBondContact O-CG2 3.23Å; L309-I312 PolarHBondContact O-N 3.43Å; P310-I312 VanDerWaalsContact C-N 3.32Å; I312-F316 HydrophobicContact CD1-CD1 4.3Å; I312-F316 HydrophobicContact CD1-CD2 4.23Å; I312-F316 HydrophobicContact CD1-CE1 4.27Å; I312-F316 HydrophobicContact CD1-CE2 4.21Å; I312-F316 HydrophobicContact CD1-CG 4.28Å; I312-F316 HydrophobicContact CD1-CZ 4.24Å; I312-F316 HydrophobicContact CG1-CB 3.96Å; I312-F316 HydrophobicContact CG1-CD1 3.66Å; I312-F316 HydrophobicContact CG1-CD2 3.94Å; I312-F316 HydrophobicContact CG1-CE1 4.11Å; I312-F316 HydrophobicContact CG1-CE2 4.38Å; I312-F316 HydrophobicContact CG1-CG 3.56Å; I312-F316 HydrophobicContact CG1-CZ 4.45Å; I312-F316 HydrophobicContact CG2-CB 4.45Å; I312-I318 HydrophobicContact CG2-CD1 4.45Å; I312-L340 HydrophobicContact CG2-CD1 4.06Å; I312-L340 HydrophobicContact CG2-CD2 4.29Å; I312-R343 PolarHBondContact O-NH2 3.27Å
313	R	95.3	Very high	96.5	Very high	79 Å²	79	37.3 Å²	37.3	30%	0.298	18%	0.176	S	C	.	.	P	Polyproline II helix	trans	-57.7	156	177.2	74	171.9	174.4	80.3	0.9	111.6	P192 V195 N315 F316 C344	P192-R313 HydrophobicContact CB-CB 4.3Å; P192-R313 HydrophobicContact CB-CG 3.79Å; P192-R313 PolarHBondContact O-NE 2.79Å; P192-R313 PolarHBondContact O-NH2 3.29Å; V195-R313 PolarHBondContact O-NH2 3Å; R313-N315 PolarHBondContact NH1-O 3.47Å; R313-F316 HydrophobicContact CG-CB 4.15Å; R313-F316 HydrophobicContact CG-CD2 3.86Å; R313-F316 HydrophobicContact CG-CG 4.43Å; R313-F316 VanDerWaalsContact O-CB 3.28Å; R313-F316 WeakPolarHBondContact O-CB 3.44Å; R313-C344 PolarHBondContact O-SG 2.72Å
314	R	95.5	Very high	96.5	Very high	180 Å²	180	37.1 Å²	37.1	68%	0.679	19%	0.185	S	C	*	.	S	Bend	trans	-64.1	156.8	174.4	-69.2	-174.8	171.8	114.9	-2	111.4	F316	R314-F316 VanDerWaalsContact C-N 3.28Å; R314-F316 PolarHBondContact O-N 3.47Å
315	N	94.4	Very high	96.3	Very high	119 Å²	119	45 Å²	45	64%	0.636	21%	0.213	S	C	*	.	S	Bend	trans	54.5	44.7	179.7	-56.7	-23.6	0	0	0	111.9	R313 R343	R313-N315 PolarHBondContact NH1-O 3.47Å; N315-R343 PolarHBondContact N-O 3.4Å
316	F	96.1	Very high	95.9	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.22	C	C	.	.			trans	-110.8	105.9	-180	-167.7	-81.2	0	0	0	110.2	A188 P192 V195 L198 I312 R313 R314 I318 C344	A188-F316 HydrophobicContact CB-CE1 4.29Å; A188-F316 HydrophobicContact CB-CZ 3.74Å; P192-F316 HydrophobicContact CB-CD2 4.43Å; P192-F316 HydrophobicContact CB-CE2 4.25Å; V195-F316 HydrophobicContact CB-CE2 3.89Å; V195-F316 HydrophobicContact CB-CZ 3.75Å; V195-F316 HydrophobicContact CG1-CE2 4.18Å; V195-F316 HydrophobicContact CG1-CZ 3.58Å; V195-F316 WeakPolarHBondContact O-CE2 3.35Å; L198-F316 HydrophobicContact CB-CE1 3.63Å; L198-F316 HydrophobicContact CB-CZ 4.24Å; L198-F316 HydrophobicContact CD2-CE1 4.39Å; I312-F316 HydrophobicContact CD1-CD1 4.3Å; I312-F316 HydrophobicContact CD1-CD2 4.23Å; I312-F316 HydrophobicContact CD1-CE1 4.27Å; I312-F316 HydrophobicContact CD1-CE2 4.21Å; I312-F316 HydrophobicContact CD1-CG 4.28Å; I312-F316 HydrophobicContact CD1-CZ 4.24Å; I312-F316 HydrophobicContact CG1-CB 3.96Å; I312-F316 HydrophobicContact CG1-CD1 3.66Å; I312-F316 HydrophobicContact CG1-CD2 3.94Å; I312-F316 HydrophobicContact CG1-CE1 4.11Å; I312-F316 HydrophobicContact CG1-CE2 4.38Å; I312-F316 HydrophobicContact CG1-CG 3.56Å; I312-F316 HydrophobicContact CG1-CZ 4.45Å; I312-F316 HydrophobicContact CG2-CB 4.45Å; R313-F316 HydrophobicContact CG-CB 4.15Å; R313-F316 HydrophobicContact CG-CD2 3.86Å; R313-F316 HydrophobicContact CG-CG 4.43Å; R313-F316 VanDerWaalsContact O-CB 3.28Å; R313-F316 WeakPolarHBondContact O-CB 3.44Å; R314-F316 VanDerWaalsContact C-N 3.28Å; R314-F316 PolarHBondContact O-N 3.47Å; F316-I318 HydrophobicContact CD1-CD1 4.32Å; F316-I318 HydrophobicContact CD1-CG1 3.83Å; F316-I318 HydrophobicContact CE1-CG1 4.21Å; F316-I318 PolarHBondContact O-N 2.9Å; F316-C344 VanDerWaalsContact O-CB 3.29Å; F316-C344 WeakPolarHBondContact O-CB 3.48Å
317	P	96.8	Very high	95.5	Very high	6 Å²	6	53.3 Å²	53.3	4%	0.039	25%	0.247	C	C	.	.			trans	-67.4	130.6	-177.7	-19.8	32	0	0	0	113.4	N196 H197 L198 P345 T377 P378	N196-P317 WeakPolarHBondContact O-CD 3.31Å; H197-P317 HydrophobicContact CB-CB 4.39Å; H197-P317 PolarHBondContact CD2-O 3.13Å; H197-P317 VanDerWaalsContact CD2-O 3.29Å; L198-P317 PolarHBondContact N-O 3.18Å; P317-P345 WeakPolarHBondContact CA-O 3.5Å; P317-P345 HydrophobicContact CB-CG 4.09Å; P317-P345 HydrophobicContact CG-CG 4.04Å; P317-T377 HydrophobicContact CG-CG2 4.24Å; P317-P378 HydrophobicContact CG-CG 4.22Å
318	I	97.7	Very high	95	Very high	1 Å²	1	49 Å²	49	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	129.9	176.6	-54.9	165.6	0	0	0	109.3	L198 L200 I312 F316 F320 L340 P345 V346 R347	L198-I318 HydrophobicContact CB-CG1 4.47Å; L198-I318 CarbonylContact O-C 3.45Å; L198-I318 VanDerWaalsContact O-CA 3.28Å; L198-I318 WeakPolarHBondContact O-CA 3.27Å; L200-I318 HydrophobicContact CD1-CG2 3.82Å; I312-I318 HydrophobicContact CG2-CD1 4.45Å; F316-I318 HydrophobicContact CD1-CD1 4.32Å; F316-I318 HydrophobicContact CD1-CG1 3.83Å; F316-I318 HydrophobicContact CE1-CG1 4.21Å; F316-I318 PolarHBondContact O-N 2.9Å; I318-F320 HydrophobicContact CG2-CD2 3.91Å; I318-F320 HydrophobicContact CG2-CE2 3.49Å; I318-F320 VanDerWaalsContact CG2-CE2 3.49Å; I318-F320 HydrophobicContact CG2-CZ 4.12Å; I318-L340 HydrophobicContact CD1-CD1 3.78Å; I318-P345 PolarHBondContact N-O 3.18Å; I318-V346 HydrophobicContact CB-CG1 4.33Å; I318-V346 HydrophobicContact CB-CG2 4.27Å; I318-V346 HydrophobicContact CD1-CG2 4.33Å; I318-V346 CarbonylContact O-C 3.59Å; I318-V346 VanDerWaalsContact O-CA 3.29Å; I318-V346 WeakPolarHBondContact O-CA 3.35Å; I318-R347 PolarHBondContact O-N 3.13Å
319	T	97.8	Very high	94.3	Very high	5 Å²	5	50.9 Å²	50.9	3%	0.031	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	117.1	174.3	-60.3	0	0	0	0	109.9	H197 L198 I199 L200 I321 R347 L369 A373	H197-T319 PolarHBondContact NE2-OG1 3.4Å; L198-T319 PolarHBondContact O-N 3.44Å; I199-T319 CarbonylContact C-O 3.5Å; I199-T319 WeakPolarHBondContact CA-O 3.5Å; I199-T319 HydrophobicContact CG2-CG2 4.39Å; L200-T319 PolarHBondContact N-O 3.3Å; T319-I321 HydrophobicContact CG2-CG1 4.2Å; T319-R347 CarbonylContact C-O 3.59Å; T319-R347 WeakPolarHBondContact CA-O 3.43Å; T319-R347 HydrophobicContact CG2-CB 4.34Å; T319-L369 HydrophobicContact CG2-CD2 4.48Å; T319-A373 HydrophobicContact CG2-CB 4.27Å
320	F	98.3	Very high	94.2	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	138.9	171.1	-68.6	-94.9	0	0	0	110.5	L200 P203 F206 L309 I318 Y322 V336 V346 R347 V348 E349	L200-F320 HydrophobicContact CB-CD1 4.08Å; L200-F320 HydrophobicContact CB-CE1 4.44Å; L200-F320 HydrophobicContact CD1-CD1 3.81Å; L200-F320 HydrophobicContact CD1-CE1 3.4Å; L200-F320 VanDerWaalsContact CD1-CE1 3.4Å; L200-F320 HydrophobicContact CD1-CE2 4.18Å; L200-F320 HydrophobicContact CD1-CG 4.38Å; L200-F320 HydrophobicContact CD1-CZ 3.6Å; P203-F320 HydrophobicContact CG-CD1 4.12Å; P203-F320 HydrophobicContact CG-CE1 4.38Å; F206-F320 AromaticContact CD1-CE1 3.54Å; F206-F320 HydrophobicContact CD1-CE1 3.54Å; F206-F320 HydrophobicContact CD1-CZ 4.07Å; F206-F320 HydrophobicContact CE1-CD1 4.44Å; F206-F320 AromaticContact CE1-CE1 3.29Å; F206-F320 HydrophobicContact CE1-CE1 3.29Å; F206-F320 AromaticContact CE1-CZ 3.67Å; F206-F320 HydrophobicContact CE1-CZ 3.67Å; F206-F320 HydrophobicContact CZ-CE1 4.21Å; L309-F320 HydrophobicContact CD1-CZ 4.23Å; I318-F320 HydrophobicContact CG2-CD2 3.91Å; I318-F320 HydrophobicContact CG2-CE2 3.49Å; I318-F320 VanDerWaalsContact CG2-CE2 3.49Å; I318-F320 HydrophobicContact CG2-CZ 4.12Å; F320-Y322 HydrophobicContact CB-CD2 4.15Å; F320-Y322 HydrophobicContact CB-CE2 3.6Å; F320-Y322 AromaticContact CD1-CE2 3.82Å; F320-Y322 HydrophobicContact CD1-CE2 3.82Å; F320-Y322 AromaticContact CD1-CZ 3.84Å; F320-Y322 WeakPolarHBondContact CD1-OH 3.28Å; F320-Y322 HydrophobicContact CG-CE2 4.07Å; F320-V336 HydrophobicContact CE2-CB 4.26Å; F320-V336 HydrophobicContact CE2-CG1 4.05Å; F320-V336 HydrophobicContact CZ-CB 4.12Å; F320-V336 HydrophobicContact CZ-CG1 4.08Å; F320-V336 HydrophobicContact CZ-CG2 4.35Å; F320-V346 HydrophobicContact CD2-CG1 3.98Å; F320-V346 HydrophobicContact CE2-CG1 3.86Å; F320-R347 PolarHBondContact N-O 3.36Å; F320-V348 HydrophobicContact CB-CB 4.4Å; F320-V348 HydrophobicContact CB-CG1 4.21Å; F320-V348 HydrophobicContact CB-CG2 4.21Å; F320-V348 HydrophobicContact CD2-CG2 4.09Å; F320-V348 HydrophobicContact CG-CG2 4.42Å; F320-E349 PolarHBondContact O-N 3.47Å
321	I	98.1	Very high	94.1	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	111.1	176.4	-52.9	167.5	0	0	0	107.5	I199 L200 D202 T319 E349 M351 V358 F366 L369 I370	I199-I321 HydrophobicContact CG2-CD1 3.71Å; I199-I321 HydrophobicContact CG2-CG1 4.42Å; L200-I321 PolarHBondContact O-N 2.85Å; D202-I321 WeakPolarHBondContact CA-O 3.15Å; D202-I321 PolarHBondContact N-O 3.1Å; T319-I321 HydrophobicContact CG2-CG1 4.2Å; I321-E349 CarbonylContact C-O 3.58Å; I321-E349 WeakPolarHBondContact CA-O 3.34Å; I321-M351 HydrophobicContact CG2-CG 3.8Å; I321-M351 HydrophobicContact CG2-SD 3.72Å; I321-V358 HydrophobicContact CG2-CG2 4.47Å; I321-F366 HydrophobicContact CD1-CD2 4.39Å; I321-F366 HydrophobicContact CD1-CE2 3.87Å; I321-F366 HydrophobicContact CG2-CD2 4.27Å; I321-F366 HydrophobicContact CG2-CE2 4.29Å; I321-L369 HydrophobicContact CD1-CD2 3.28Å; I321-L369 HydrophobicContact CG1-CD2 3.47Å; I321-L369 VanDerWaalsContact CG1-CD2 3.47Å; I321-L369 HydrophobicContact CG2-CD2 4.49Å; I321-I370 HydrophobicContact CD1-CD1 3.41Å; I321-I370 VanDerWaalsContact CD1-CD1 3.41Å; I321-I370 HydrophobicContact CD1-CG1 4.47Å
322	Y	97.7	Very high	94	Very high	3 Å²	3	49.9 Å²	49.9	1%	0.012	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	147.6	179.2	-65.9	-87.6	0	0	0	111.5	P203 F320 P330 G333 V348 E349 I350 M351	P203-Y322 HydrophobicContact CG-CE1 3.85Å; F320-Y322 HydrophobicContact CB-CD2 4.15Å; F320-Y322 HydrophobicContact CB-CE2 3.6Å; F320-Y322 AromaticContact CD1-CE2 3.82Å; F320-Y322 HydrophobicContact CD1-CE2 3.82Å; F320-Y322 AromaticContact CD1-CZ 3.84Å; F320-Y322 WeakPolarHBondContact CD1-OH 3.28Å; F320-Y322 HydrophobicContact CG-CE2 4.07Å; Y322-P330 HydrophobicContact CD1-CB 4.23Å; Y322-P330 HydrophobicContact CD2-CB 3.77Å; Y322-P330 HydrophobicContact CE2-CB 4.08Å; Y322-P330 HydrophobicContact CG-CB 3.84Å; Y322-G333 PolarHBondContact OH-N 3.12Å; Y322-V348 HydrophobicContact CD2-CG1 4.13Å; Y322-V348 HydrophobicContact CE2-CG1 4.13Å; Y322-E349 PolarHBondContact N-O 2.72Å; Y322-I350 HydrophobicContact CD2-CD1 4Å; Y322-I350 HydrophobicContact CG-CD1 4.26Å; Y322-I350 CarbonylContact O-C 3.14Å; Y322-I350 WeakPolarHBondContact O-CA 3.26Å; Y322-M351 PolarHBondContact O-N 3.19Å
323	G	96.1	Very high	94	Very high	5 Å²	5	49.8 Å²	49.8	5%	0.052	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	126.4	166.4	0	0	0	0	0	110.7	D202 R325 S326 S354	D202-G323 PolarHBondContact OD1-N 3.4Å; G323-R325 PolarHBondContact O-N 3.03Å; G323-S326 VanDerWaalsContact O-CB 3.24Å; G323-S326 WeakPolarHBondContact O-CB 3.24Å; G323-S326 PolarHBondContact O-N 2.78Å; G323-S354 CarbonylContact C-O 3.5Å; G323-S354 WeakPolarHBondContact CA-O 3.42Å
324	S	94.8	Very high	94.1	Very high	60 Å²	60	50.7 Å²	50.7	42%	0.42	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-18.8	176.3	56.8	0	0	0	0	115.3	M351 R352 N353 S354	S324-M351 WeakPolarHBondContact CB-O 2.97Å; S324-M351 PolarHBondContact N-O 2.78Å; S324-M351 PolarHBondContact OG-O 3.4Å; S324-R352 WeakPolarHBondContact OG-CA 3.44Å; S324-N353 PolarHBondContact OG-N 3.46Å; S324-S354 PolarHBondContact N-O 2.66Å; S324-S354 VanDerWaalsContact N-O 3.11Å
325	R	92	Very high	94.1	Very high	178 Å²	178	45.9 Å²	45.9	67%	0.672	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.9	13.9	176.1	-55.8	-177.7	-175.9	-175.5	3	112	G323 N353 S354	G323-R325 PolarHBondContact O-N 3.03Å; R325-N353 PolarHBondContact NH2-OD1 3.39Å; R325-S354 PolarHBondContact N-O 3.29Å
326	S	89.8	Confident	94.3	Very high	23 Å²	23	40.2 Å²	40.2	16%	0.161	19%	0.194	C	C	.	.			trans	-74.9	158.4	176.1	-162.5	0	0	0	0	110.9	D202 G323 T328 H356	D202-S326 VanDerWaalsContact CG-OG 3.27Å; D202-S326 WeakPolarHBondContact OD1-CB 3.3Å; D202-S326 PolarHBondContact OD1-OG 2.87Å; D202-S326 WeakPolarHBondContact OD2-CB 3.34Å; D202-S326 PolarHBondContact OD2-OG 2.58Å; G323-S326 VanDerWaalsContact O-CB 3.24Å; G323-S326 WeakPolarHBondContact O-CB 3.24Å; G323-S326 PolarHBondContact O-N 2.78Å; S326-T328 VanDerWaalsContact C-N 3.29Å; S326-T328 WeakPolarHBondContact CB-OG1 3.41Å; S326-T328 PolarHBondContact OG-N 3.48Å; S326-T328 PolarHBondContact OG-OG1 3.15Å; S326-H356 WeakPolarHBondContact OG-CA 3.2Å
327	W	86.2	Confident	94.3	Very high	157 Å²	157	43.3 Å²	43.3	60%	0.595	21%	0.208	S	C	*	.	S	Bend	trans	-82.2	-12.9	170.5	59.4	-88.9	0	0	0	111.9	W204 H356	W204-W327 AromaticContact CD1-CH2 3.56Å; W204-W327 HydrophobicContact CG-CH2 4.39Å; W327-H356 AromaticContact CE2-CE1 3.99Å; W327-H356 AromaticContact CE2-ND1 3.84Å; W327-H356 AromaticContact CZ2-CE1 3.68Å; W327-H356 AromaticContact CZ2-ND1 3.99Å; W327-H356 AromaticContact NE1-CD2 3.86Å; W327-H356 AromaticContact NE1-CE1 3.9Å; W327-H356 AromaticContact NE1-CG 3.38Å; W327-H356 AromaticContact NE1-ND1 3.4Å; W327-H356 PolarHBondContact NE1-ND1 3.49Å
328	T	85.1	Confident	94.3	Very high	13 Å²	13	50.7 Å²	50.7	8%	0.08	24%	0.24	C	C	.	.	S	Bend	trans	-74.8	138.4	175.8	58.6	0	0	0	0	109.9	D202 S326 P330	D202-T328 PolarHBondContact OD1-OG1 3.15Å; D202-T328 VanDerWaalsContact OD1-OG1 3.09Å; D202-T328 WeakPolarHBondContact OD2-CG2 3.44Å; D202-T328 PolarHBondContact OD2-OG1 2.88Å; S326-T328 VanDerWaalsContact C-N 3.29Å; S326-T328 WeakPolarHBondContact CB-OG1 3.41Å; S326-T328 PolarHBondContact OG-N 3.48Å; S326-T328 PolarHBondContact OG-OG1 3.15Å; T328-P330 WeakPolarHBondContact O-CD 3.38Å
329	D	84.4	Confident	94.3	Very high	70 Å²	70	54.5 Å²	54.5	37%	0.374	26%	0.258	S	S	.	.			trans	-86.4	118.5	-178.6	-174.9	-3.2	0	0	0	110.8	D331	D329-D331 PolarHBondContact O-N 3.11Å; D329-D331 VanDerWaalsContact OD1-CB 3.25Å; D329-D331 WeakPolarHBondContact OD1-CB 3.48Å; D329-D331 PolarHBondContact OD1-N 3.21Å
330	P	93.2	Very high	94.3	Very high	39 Å²	39	54.3 Å²	54.3	25%	0.253	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-16.1	176.3	30.4	-36	0	0	0	113.9	Y322 T328 A332 G333 Y334 I350	Y322-P330 HydrophobicContact CD1-CB 4.23Å; Y322-P330 HydrophobicContact CD2-CB 3.77Å; Y322-P330 HydrophobicContact CE2-CB 4.08Å; Y322-P330 HydrophobicContact CG-CB 3.84Å; T328-P330 WeakPolarHBondContact O-CD 3.38Å; P330-A332 PolarHBondContact O-N 3.23Å; P330-G333 WeakPolarHBondContact O-CA 3.38Å; P330-G333 PolarHBondContact O-N 2.7Å; P330-Y334 HydrophobicContact CB-CD2 4.49Å; P330-Y334 HydrophobicContact CB-CE2 4.2Å; P330-Y334 WeakPolarHBondContact O-CD2 3.35Å; P330-Y334 PolarHBondContact O-N 3Å; P330-I350 HydrophobicContact CB-CD1 3.7Å; P330-I350 HydrophobicContact CG-CD1 4.38Å
331	D	94.1	Very high	94	Very high	103 Å²	103	63.3 Å²	63.3	55%	0.551	29%	0.291	S	S	*	.	H	α-helix	trans	-59.3	-31.6	-178	-76.3	-8.2	0	0	0	112.1	D329 G333 Y334 L335	D329-D331 PolarHBondContact O-N 3.11Å; D329-D331 VanDerWaalsContact OD1-CB 3.25Å; D329-D331 WeakPolarHBondContact OD1-CB 3.48Å; D329-D331 PolarHBondContact OD1-N 3.21Å; D331-G333 VanDerWaalsContact C-N 3.33Å; D331-G333 PolarHBondContact O-N 2.68Å; D331-Y334 PolarHBondContact O-N 3.43Å; D331-L335 WeakPolarHBondContact O-CB 3.4Å; D331-L335 PolarHBondContact O-N 3.38Å
332	A	93.6	Very high	93.7	Very high	4 Å²	4	71.5 Å²	71.5	3%	0.033	33%	0.328	C	S	.	.	H	α-helix	trans	-61.4	-41.2	173.6	0	0	0	0	0	112.3	F206 P207 P330 L335 V336	F206-A332 HydrophobicContact CB-CB 3.93Å; P207-A332 HydrophobicContact CB-CB 3.98Å; P330-A332 PolarHBondContact O-N 3.23Å; A332-L335 PolarHBondContact O-N 2.92Å; A332-V336 WeakPolarHBondContact O-CG2 3.45Å; A332-V336 PolarHBondContact O-N 3.13Å
333	G	96.5	Very high	93.6	Very high	0 Å²	0	75.5 Å²	75.5	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-64.4	-43	176.4	0	0	0	0	0	111.9	Y322 P330 D331 V336 Q337	Y322-G333 PolarHBondContact OH-N 3.12Å; P330-G333 WeakPolarHBondContact O-CA 3.38Å; P330-G333 PolarHBondContact O-N 2.7Å; D331-G333 VanDerWaalsContact C-N 3.33Å; D331-G333 PolarHBondContact O-N 2.68Å; G333-V336 PolarHBondContact O-N 2.93Å; G333-Q337 WeakPolarHBondContact O-CB 3.42Å; G333-Q337 PolarHBondContact O-N 3.15Å
334	Y	97.5	Very high	93.6	Very high	99 Å²	99	75.6 Å²	75.6	39%	0.388	34%	0.343	S	S	.	.	H	α-helix	trans	-66.1	-36.5	174.8	-69.9	-62.8	0	0	0	112.7	P330 D331 Q337 K338 V348 I350	P330-Y334 HydrophobicContact CB-CD2 4.49Å; P330-Y334 HydrophobicContact CB-CE2 4.2Å; P330-Y334 WeakPolarHBondContact O-CD2 3.35Å; P330-Y334 PolarHBondContact O-N 3Å; D331-Y334 PolarHBondContact O-N 3.43Å; Y334-Q337 PolarHBondContact O-N 2.97Å; Y334-K338 WeakPolarHBondContact O-CB 3.26Å; Y334-K338 PolarHBondContact O-N 3.41Å; Y334-V348 HydrophobicContact CD1-CB 4.02Å; Y334-V348 HydrophobicContact CD1-CG1 4.06Å; Y334-V348 HydrophobicContact CD1-CG2 4.09Å; Y334-V348 HydrophobicContact CD2-CG1 4.36Å; Y334-V348 HydrophobicContact CE1-CB 3.69Å; Y334-V348 HydrophobicContact CE1-CG1 3.66Å; Y334-V348 HydrophobicContact CE1-CG2 4.29Å; Y334-V348 HydrophobicContact CE2-CG1 4Å; Y334-V348 HydrophobicContact CG-CG1 4.39Å; Y334-I350 HydrophobicContact CE2-CD1 4.5Å
335	L	96.7	Very high	93.6	Very high	79 Å²	79	76 Å²	76	41%	0.414	34%	0.344	S	S	.	.	H	α-helix	trans	-65	-45	175.4	-177.6	53.4	0	0	0	111.2	V306 D331 A332 Q337 K338 Q339	V306-L335 HydrophobicContact CG2-CB 4.13Å; V306-L335 HydrophobicContact CG2-CD2 3.6Å; V306-L335 HydrophobicContact CG2-CG 3.81Å; D331-L335 WeakPolarHBondContact O-CB 3.4Å; D331-L335 PolarHBondContact O-N 3.38Å; A332-L335 PolarHBondContact O-N 2.92Å; L335-Q337 PolarHBondContact O-N 2.93Å; L335-K338 WeakPolarHBondContact O-CB 3.38Å; L335-K338 PolarHBondContact O-N 3Å; L335-Q339 HydrophobicContact CD1-CG 4.33Å; L335-Q339 VanDerWaalsContact O-CG 3.29Å; L335-Q339 WeakPolarHBondContact O-CG 3.5Å; L335-Q339 PolarHBondContact O-N 3.43Å
336	V	97.1	Very high	93.8	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-60.4	-45.4	173.1	171.8	0	0	0	0	110.9	V306 L309 F320 A332 G333 K338 Q339 L340	V306-V336 HydrophobicContact CB-CG2 4.43Å; V306-V336 HydrophobicContact CG2-CG2 4.07Å; L309-V336 HydrophobicContact CB-CG1 4.25Å; L309-V336 HydrophobicContact CB-CG2 4.42Å; L309-V336 HydrophobicContact CD1-CG1 4.35Å; L309-V336 HydrophobicContact CD1-CG2 4.35Å; F320-V336 HydrophobicContact CE2-CB 4.26Å; F320-V336 HydrophobicContact CE2-CG1 4.05Å; F320-V336 HydrophobicContact CZ-CB 4.12Å; F320-V336 HydrophobicContact CZ-CG1 4.08Å; F320-V336 HydrophobicContact CZ-CG2 4.35Å; A332-V336 WeakPolarHBondContact O-CG2 3.45Å; A332-V336 PolarHBondContact O-N 3.13Å; G333-V336 PolarHBondContact O-N 2.93Å; V336-K338 VanDerWaalsContact C-N 3.28Å; V336-K338 PolarHBondContact O-N 3.25Å; V336-Q339 PolarHBondContact O-N 3.38Å; V336-L340 HydrophobicContact CG1-CD1 3.76Å; V336-L340 HydrophobicContact CG1-CG 4.42Å; V336-L340 WeakPolarHBondContact O-CB 3.31Å; V336-L340 PolarHBondContact O-N 3.37Å
337	Q	97	Very high	94.1	Very high	64 Å²	64	70.7 Å²	70.7	30%	0.299	32%	0.323	S	S	.	.	H	α-helix	trans	-56.7	-42.9	175.8	-178.7	-177.7	63.8	0	0	111.6	G333 Y334 L335 L340 R341 V346 V348	G333-Q337 WeakPolarHBondContact O-CB 3.42Å; G333-Q337 PolarHBondContact O-N 3.15Å; Y334-Q337 PolarHBondContact O-N 2.97Å; L335-Q337 PolarHBondContact O-N 2.93Å; Q337-L340 PolarHBondContact O-N 2.81Å; Q337-R341 WeakPolarHBondContact O-CA 3.45Å; Q337-R341 PolarHBondContact O-N 2.91Å; Q337-V346 HydrophobicContact CB-CB 4.07Å; Q337-V346 HydrophobicContact CB-CG1 3.72Å; Q337-V346 HydrophobicContact CG-CB 4.05Å; Q337-V346 HydrophobicContact CG-CG1 4.15Å; Q337-V346 PolarHBondContact NE2-O 3.14Å; Q337-V348 HydrophobicContact CB-CG2 4.16Å
338	K	97.5	Very high	94.7	Very high	162 Å²	162	63.9 Å²	63.9	70%	0.704	30%	0.299	S	S	*	.	H	α-helix	trans	-65.5	-45.6	176.6	-177.3	-179.7	177.3	-177.9	0	112.1	Y334 L335 V336 L340 R341	Y334-K338 WeakPolarHBondContact O-CB 3.26Å; Y334-K338 PolarHBondContact O-N 3.41Å; L335-K338 WeakPolarHBondContact O-CB 3.38Å; L335-K338 PolarHBondContact O-N 3Å; V336-K338 VanDerWaalsContact C-N 3.28Å; V336-K338 PolarHBondContact O-N 3.25Å; K338-L340 PolarHBondContact O-N 3.15Å; K338-R341 PolarHBondContact O-N 2.8Å
339	Q	97	Very high	95.2	Very high	81 Å²	81	65.8 Å²	65.8	38%	0.379	31%	0.307	S	S	.	.	H	α-helix	trans	-63.8	-30.6	179	-71.7	167.3	-29.8	0	0	112.4	V306 P310 L335 V336	V306-Q339 PolarHBondContact O-OE1 3.47Å; P310-Q339 HydrophobicContact CG-CB 4.14Å; P310-Q339 HydrophobicContact CG-CG 4.45Å; L335-Q339 HydrophobicContact CD1-CG 4.33Å; L335-Q339 VanDerWaalsContact O-CG 3.29Å; L335-Q339 WeakPolarHBondContact O-CG 3.5Å; L335-Q339 PolarHBondContact O-N 3.43Å; V336-Q339 PolarHBondContact O-N 3.38Å
340	L	96.7	Very high	95.9	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-103.2	0.8	-176.9	-69.3	179.8	0	0	0	114.9	I312 I318 V336 Q337 K338 H342 R343 C344 V346	I312-L340 HydrophobicContact CG2-CD1 4.06Å; I312-L340 HydrophobicContact CG2-CD2 4.29Å; I318-L340 HydrophobicContact CD1-CD1 3.78Å; V336-L340 HydrophobicContact CG1-CD1 3.76Å; V336-L340 HydrophobicContact CG1-CG 4.42Å; V336-L340 WeakPolarHBondContact O-CB 3.31Å; V336-L340 PolarHBondContact O-N 3.37Å; Q337-L340 PolarHBondContact O-N 2.81Å; K338-L340 PolarHBondContact O-N 3.15Å; L340-H342 PolarHBondContact O-N 3.46Å; L340-R343 HydrophobicContact CD2-CB 4.41Å; L340-R343 PolarHBondContact O-N 3.32Å; L340-C344 HydrophobicContact CB-CB 4.16Å; L340-C344 HydrophobicContact CD1-CB 4.28Å; L340-C344 PolarHBondContact O-N 3.37Å; L340-V346 HydrophobicContact CB-CG2 3.81Å; L340-V346 HydrophobicContact CD1-CG2 3.92Å
341	R	92.3	Very high	96.1	Very high	190 Å²	190	63.9 Å²	63.9	72%	0.717	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-44.6	-33	-170.6	-173.2	-179.8	-178.7	-175.3	0.7	116.2	Q337 K338	Q337-R341 WeakPolarHBondContact O-CA 3.45Å; Q337-R341 PolarHBondContact O-N 2.91Å; K338-R341 PolarHBondContact O-N 2.8Å
342	H	92.5	Very high	96.1	Very high	172 Å²	172	68.7 Å²	68.7	80%	0.796	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	10.8	-178.3	-58.7	-60.3	0	0	0	113.8	L340	L340-H342 PolarHBondContact O-N 3.46Å
343	R	95.1	Very high	96.1	Very high	86 Å²	86	73.3 Å²	73.3	33%	0.325	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	-36.7	-176.8	-72.7	179	57.8	-162	-8.2	112.7	P310 I312 N315 L340	P310-R343 PolarHBondContact O-NH1 2.85Å; P310-R343 PolarHBondContact O-NH2 2.58Å; I312-R343 PolarHBondContact O-NH2 3.27Å; N315-R343 PolarHBondContact N-O 3.4Å; L340-R343 HydrophobicContact CD2-CB 4.41Å; L340-R343 PolarHBondContact O-N 3.32Å
344	C	96.1	Very high	96.1	Very high	7 Å²	7	73.3 Å²	73.3	5%	0.047	33%	0.328	C	S	.	.	S	Bend	trans	-141.6	142.7	-174.5	-62.3	0	0	0	0	110.3	R313 F316 L340 V346	R313-C344 PolarHBondContact O-SG 2.72Å; F316-C344 VanDerWaalsContact O-CB 3.29Å; F316-C344 WeakPolarHBondContact O-CB 3.48Å; L340-C344 HydrophobicContact CB-CB 4.16Å; L340-C344 HydrophobicContact CD1-CB 4.28Å; L340-C344 PolarHBondContact O-N 3.37Å; C344-V346 HydrophobicContact CB-CG2 4.21Å; C344-V346 PolarHBondContact O-N 2.69Å
345	P	95.3	Very high	95.9	Very high	68 Å²	68	69.2 Å²	69.2	44%	0.442	32%	0.316	S	S	.	.			trans	-72.1	110.8	169.3	26	-24.9	0	0	0	109	P317 I318	P317-P345 WeakPolarHBondContact CA-O 3.5Å; P317-P345 HydrophobicContact CB-CG 4.09Å; P317-P345 HydrophobicContact CG-CG 4.04Å; I318-P345 PolarHBondContact N-O 3.18Å
346	V	96.6	Very high	95.7	Very high	19 Å²	19	67 Å²	67	12%	0.115	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	123.2	178.1	-175.5	0	0	0	0	109.5	I318 F320 Q337 L340 C344	I318-V346 HydrophobicContact CB-CG1 4.33Å; I318-V346 HydrophobicContact CB-CG2 4.27Å; I318-V346 HydrophobicContact CD1-CG2 4.33Å; I318-V346 CarbonylContact O-C 3.59Å; I318-V346 VanDerWaalsContact O-CA 3.29Å; I318-V346 WeakPolarHBondContact O-CA 3.35Å; F320-V346 HydrophobicContact CD2-CG1 3.98Å; F320-V346 HydrophobicContact CE2-CG1 3.86Å; Q337-V346 HydrophobicContact CB-CB 4.07Å; Q337-V346 HydrophobicContact CB-CG1 3.72Å; Q337-V346 HydrophobicContact CG-CB 4.05Å; Q337-V346 HydrophobicContact CG-CG1 4.15Å; Q337-V346 PolarHBondContact NE2-O 3.14Å; L340-V346 HydrophobicContact CB-CG2 3.81Å; L340-V346 HydrophobicContact CD1-CG2 3.92Å; C344-V346 HydrophobicContact CB-CG2 4.21Å; C344-V346 PolarHBondContact O-N 2.69Å
347	R	96	Very high	95.7	Very high	71 Å²	71	68.4 Å²	68.4	27%	0.268	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	139.6	176.2	-171	176.6	177.7	-172.7	-7.7	109.4	I318 T319 F320 E349 E372	I318-R347 PolarHBondContact O-N 3.13Å; T319-R347 CarbonylContact C-O 3.59Å; T319-R347 WeakPolarHBondContact CA-O 3.43Å; T319-R347 HydrophobicContact CG2-CB 4.34Å; F320-R347 PolarHBondContact N-O 3.36Å; R347-E349 HydrophobicContact CG-CG 4.05Å; R347-E349 IonicContact CZ-OE1 3.11Å; R347-E349 IonicContact NE-OE1 2.66Å; R347-E349 PolarHBondContact NE-OE1 3.39Å; R347-E349 IonicContact NH2-OE1 2.71Å; R347-E349 PolarHBondContact NH2-OE1 3.18Å; R347-E372 IonicContact CZ-OE1 3.95Å; R347-E372 IonicContact CZ-OE2 3.21Å; R347-E372 IonicContact NH1-OE1 2.65Å; R347-E372 PolarHBondContact NH1-OE1 3.49Å; R347-E372 IonicContact NH1-OE2 2.9Å; R347-E372 PolarHBondContact NH1-OE2 2.95Å; R347-E372 IonicContact NH2-OE1 3.54Å; R347-E372 PolarHBondContact NH2-OE1 2.73Å; R347-E372 IonicContact NH2-OE2 2.77Å; R347-E372 PolarHBondContact NH2-OE2 3.24Å
348	V	97.5	Very high	95.6	Very high	14 Å²	14	65.4 Å²	65.4	9%	0.085	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	118.6	175.7	-177.1	0	0	0	0	108.1	F320 Y322 Y334 Q337 I350	F320-V348 HydrophobicContact CB-CB 4.4Å; F320-V348 HydrophobicContact CB-CG1 4.21Å; F320-V348 HydrophobicContact CB-CG2 4.21Å; F320-V348 HydrophobicContact CD2-CG2 4.09Å; F320-V348 HydrophobicContact CG-CG2 4.42Å; Y322-V348 HydrophobicContact CD2-CG1 4.13Å; Y322-V348 HydrophobicContact CE2-CG1 4.13Å; Y334-V348 HydrophobicContact CD1-CB 4.02Å; Y334-V348 HydrophobicContact CD1-CG1 4.06Å; Y334-V348 HydrophobicContact CD1-CG2 4.09Å; Y334-V348 HydrophobicContact CD2-CG1 4.36Å; Y334-V348 HydrophobicContact CE1-CB 3.69Å; Y334-V348 HydrophobicContact CE1-CG1 3.66Å; Y334-V348 HydrophobicContact CE1-CG2 4.29Å; Y334-V348 HydrophobicContact CE2-CG1 4Å; Y334-V348 HydrophobicContact CG-CG1 4.39Å; Q337-V348 HydrophobicContact CB-CG2 4.16Å; V348-I350 HydrophobicContact CG1-CD1 4.36Å
349	E	97.2	Very high	95.6	Very high	53 Å²	53	58 Å²	58	25%	0.248	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	136.8	-176.1	-70.9	-65.2	160.7	0	0	110.6	F320 I321 Y322 R347 L369	F320-E349 PolarHBondContact O-N 3.47Å; I321-E349 CarbonylContact C-O 3.58Å; I321-E349 WeakPolarHBondContact CA-O 3.34Å; Y322-E349 PolarHBondContact N-O 2.72Å; R347-E349 HydrophobicContact CG-CG 4.05Å; R347-E349 IonicContact CZ-OE1 3.11Å; R347-E349 IonicContact NE-OE1 2.66Å; R347-E349 PolarHBondContact NE-OE1 3.39Å; R347-E349 IonicContact NH2-OE1 2.71Å; R347-E349 PolarHBondContact NH2-OE1 3.18Å; E349-L369 HydrophobicContact CB-CD1 3.81Å; E349-L369 HydrophobicContact CB-CD2 4.45Å; E349-L369 HydrophobicContact CG-CD1 3.83Å; E349-L369 HydrophobicContact CG-CD2 4.42Å; E349-L369 HydrophobicContact CG-CG 4.46Å
350	I	97.7	Very high	95.5	Very high	59 Å²	59	54.3 Å²	54.3	30%	0.303	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	110.2	179.6	-49.9	-60.4	0	0	0	108.7	Y322 P330 Y334 V348 R352	Y322-I350 HydrophobicContact CD2-CD1 4Å; Y322-I350 HydrophobicContact CG-CD1 4.26Å; Y322-I350 CarbonylContact O-C 3.14Å; Y322-I350 WeakPolarHBondContact O-CA 3.26Å; P330-I350 HydrophobicContact CB-CD1 3.7Å; P330-I350 HydrophobicContact CG-CD1 4.38Å; Y334-I350 HydrophobicContact CE2-CD1 4.5Å; V348-I350 HydrophobicContact CG1-CD1 4.36Å; I350-R352 PolarHBondContact O-N 3.18Å
351	M	97.1	Very high	95.4	Very high	11 Å²	11	56.4 Å²	56.4	5%	0.054	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	112.9	175.6	-66	-170.9	77.5	0	0	110.6	I321 Y322 S324 S354 V358 Q362 F366	I321-M351 HydrophobicContact CG2-CG 3.8Å; I321-M351 HydrophobicContact CG2-SD 3.72Å; Y322-M351 PolarHBondContact O-N 3.19Å; S324-M351 WeakPolarHBondContact CB-O 2.97Å; S324-M351 PolarHBondContact N-O 2.78Å; S324-M351 PolarHBondContact OG-O 3.4Å; M351-S354 PolarHBondContact O-N 2.8Å; M351-V358 HydrophobicContact SD-CB 3.99Å; M351-Q362 HydrophobicContact CE-CB 3.71Å; M351-F366 HydrophobicContact CE-CB 3.84Å; M351-F366 HydrophobicContact SD-CB 4.07Å; M351-F366 HydrophobicContact SD-CD2 3.84Å; M351-F366 HydrophobicContact SD-CG 4.47Å
352	R	95.7	Very high	95.4	Very high	203 Å²	203	50.2 Å²	50.2	77%	0.766	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	139.5	178.4	-67.4	-173.8	179.1	-165.8	0.5	110.7	S324 I350 S354 Q362	S324-R352 WeakPolarHBondContact OG-CA 3.44Å; I350-R352 PolarHBondContact O-N 3.18Å; R352-S354 PolarHBondContact O-N 3.48Å; R352-Q362 PolarHBondContact O-NE2 3.25Å; R352-Q362 PolarHBondContact O-OE1 2.85Å
353	N	93.5	Very high	95.6	Very high	101 Å²	101	42.2 Å²	42.2	54%	0.54	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.2	8.6	-178.6	-57.6	-39.1	0	0	0	115.7	S324 R325	S324-N353 PolarHBondContact OG-N 3.46Å; R325-N353 PolarHBondContact NH2-OD1 3.39Å
354	S	95	Very high	95.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.214	C	C	.	.			trans	-96.1	142	171.4	-55.7	0	0	0	0	111.1	G323 S324 R325 M351 R352	G323-S354 CarbonylContact C-O 3.5Å; G323-S354 WeakPolarHBondContact CA-O 3.42Å; S324-S354 PolarHBondContact N-O 2.66Å; S324-S354 VanDerWaalsContact N-O 3.11Å; R325-S354 PolarHBondContact N-O 3.29Å; M351-S354 PolarHBondContact O-N 2.8Å; R352-S354 PolarHBondContact O-N 3.48Å
355	G	93.1	Very high	95.7	Very high	14 Å²	14	45.8 Å²	45.8	14%	0.144	23%	0.23	C	C	.	.			trans	-97	-151.2	168.4	0	0	0	0	0	111.4	H357 V358 D361	G355-H357 VanDerWaalsContact C-N 3.28Å; G355-H357 PolarHBondContact O-N 3.15Å; G355-V358 WeakPolarHBondContact O-CG1 3.25Å; G355-D361 WeakPolarHBondContact CA-OD2 3.03Å; G355-D361 PolarHBondContact N-OD2 3.35Å
356	H	94.3	Very high	95.9	Very high	31 Å²	31	42.5 Å²	42.5	14%	0.144	21%	0.209	C	C	.	.	S	Bend	trans	-62.2	-29.3	-175.5	-172.7	58.7	0	0	0	114.4	H177 S178 D202 S326 W327 V358	H177-H356 AromaticContact CE1-CD2 3.8Å; H177-H356 AromaticContact CE1-NE2 3.57Å; H177-H356 AromaticContact NE2-CD2 3.8Å; H177-H356 AromaticContact NE2-CE1 3.84Å; H177-H356 AromaticContact NE2-NE2 3.64Å; H177-H356 PolarHBondContact NE2-O 3.23Å; S178-H356 VanDerWaalsContact CB-CE1 3.43Å; S178-H356 WeakPolarHBondContact CB-CE1 3.49Å; S178-H356 VanDerWaalsContact CB-NE2 3.33Å; S178-H356 WeakPolarHBondContact CB-NE2 3.11Å; S178-H356 PolarHBondContact OG-CE1 3.17Å; S178-H356 VanDerWaalsContact OG-CE1 3.23Å; S178-H356 PolarHBondContact OG-NE2 3.37Å; D202-H356 WeakPolarHBondContact CB-O 3.42Å; D202-H356 PolarHBondContact O-CE1 2.94Å; D202-H356 IonicContact OD2-CE1 2.72Å; D202-H356 IonicContact OD2-CG 3.62Å; D202-H356 IonicContact OD2-ND1 3.18Å; D202-H356 PolarHBondContact OD2-ND1 3.25Å; S326-H356 WeakPolarHBondContact OG-CA 3.2Å; W327-H356 AromaticContact CE2-CE1 3.99Å; W327-H356 AromaticContact CE2-ND1 3.84Å; W327-H356 AromaticContact CZ2-CE1 3.68Å; W327-H356 AromaticContact CZ2-ND1 3.99Å; W327-H356 AromaticContact NE1-CD2 3.86Å; W327-H356 AromaticContact NE1-CE1 3.9Å; W327-H356 AromaticContact NE1-CG 3.38Å; W327-H356 AromaticContact NE1-ND1 3.4Å; W327-H356 PolarHBondContact NE1-ND1 3.49Å; H356-V358 VanDerWaalsContact C-N 3.3Å; H356-V358 PolarHBondContact O-N 3Å
357	H	95.3	Very high	95.9	Very high	31 Å²	31	41.9 Å²	41.9	14%	0.144	21%	0.205	C	C	.	.			trans	-94.3	56.4	179.6	-60.7	-87.2	0	0	0	110.7	R256 K262 G355 Y359 T360 D361	R256-H357 PolarHBondContact NH2-CD2 3.36Å; R256-H357 PolarHBondContact NH2-NE2 3.48Å; K262-H357 HydrophobicContact CD-CB 4.04Å; G355-H357 VanDerWaalsContact C-N 3.28Å; G355-H357 PolarHBondContact O-N 3.15Å; H357-Y359 HydrophobicContact CB-CE1 4.13Å; H357-Y359 AromaticContact ND1-CE1 3.89Å; H357-Y359 AromaticContact ND1-CZ 3.8Å; H357-Y359 PolarHBondContact ND1-OH 2.89Å; H357-Y359 PolarHBondContact O-N 2.98Å; H357-T360 PolarHBondContact O-N 3.42Å; H357-T360 PolarHBondContact O-OG1 2.89Å; H357-D361 PolarHBondContact O-N 2.92Å
358	V	96.3	Very high	96	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-51.1	-32.8	-176.6	-66.9	0	0	0	0	113.6	A201 D202 I321 M351 G355 H356 T360 F366	A201-V358 HydrophobicContact CB-CG2 3.88Å; D202-V358 HydrophobicContact CB-CG1 4.25Å; D202-V358 HydrophobicContact CB-CG2 4.3Å; I321-V358 HydrophobicContact CG2-CG2 4.47Å; M351-V358 HydrophobicContact SD-CB 3.99Å; G355-V358 WeakPolarHBondContact O-CG1 3.25Å; H356-V358 VanDerWaalsContact C-N 3.3Å; H356-V358 PolarHBondContact O-N 3Å; V358-T360 VanDerWaalsContact C-N 3.26Å; V358-T360 PolarHBondContact O-N 2.95Å; V358-F366 HydrophobicContact CB-CD2 4.27Å; V358-F366 HydrophobicContact CB-CE2 4.49Å; V358-F366 HydrophobicContact CG2-CD2 3.97Å; V358-F366 HydrophobicContact CG2-CE2 3.71Å
359	Y	97.2	Very high	96	Very high	6 Å²	6	45.3 Å²	45.3	2%	0.024	22%	0.224	C	C	.	.	H	α-helix	trans	-69.9	-17.4	-178.8	62.7	-88	0	0	0	114.3	L115 W116 N119 H177 H357 A363	L115-Y359 HydrophobicContact CB-CE2 4.36Å; L115-Y359 WeakPolarHBondContact O-CE2 3.48Å; W116-Y359 AromaticContact CE3-CD2 3.96Å; W116-Y359 HydrophobicContact CE3-CD2 3.96Å; W116-Y359 AromaticContact CE3-CG 3.97Å; W116-Y359 HydrophobicContact CE3-CG 3.97Å; W116-Y359 HydrophobicContact CH2-CD1 4.22Å; W116-Y359 HydrophobicContact CH2-CG 4.17Å; W116-Y359 HydrophobicContact CZ3-CD1 4.15Å; W116-Y359 HydrophobicContact CZ3-CD2 4.12Å; W116-Y359 AromaticContact CZ3-CG 3.64Å; W116-Y359 HydrophobicContact CZ3-CG 3.64Å; N119-Y359 PolarHBondContact ND2-O 2.81Å; N119-Y359 PolarHBondContact OD1-O 3.45Å; H177-Y359 HydrophobicContact CB-CD1 4.44Å; H177-Y359 HydrophobicContact CB-CE1 4.32Å; H177-Y359 AromaticContact CD2-CD1 3.91Å; H177-Y359 AromaticContact CD2-CE1 3.73Å; H177-Y359 AromaticContact CE1-CE1 3.73Å; H177-Y359 AromaticContact CG-CD1 3.98Å; H177-Y359 AromaticContact CG-CE1 3.59Å; H177-Y359 AromaticContact ND1-CE1 3.59Å; H177-Y359 AromaticContact NE2-CE1 3.8Å; H357-Y359 HydrophobicContact CB-CE1 4.13Å; H357-Y359 AromaticContact ND1-CE1 3.89Å; H357-Y359 AromaticContact ND1-CZ 3.8Å; H357-Y359 PolarHBondContact ND1-OH 2.89Å; H357-Y359 PolarHBondContact O-N 2.98Å; Y359-A363 WeakPolarHBondContact O-CA 3.19Å
360	T	95.9	Very high	96	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.031	21%	0.212	C	C	.	.	H	α-helix	trans	-115	-31.3	174.2	48.9	0	0	0	0	114	R118 F263 H357 V358 Q362	R118-T360 HydrophobicContact CB-CG2 4.34Å; R118-T360 HydrophobicContact CG-CG2 4.18Å; F263-T360 HydrophobicContact CD1-CG2 4.11Å; F263-T360 HydrophobicContact CE1-CG2 3.6Å; F263-T360 HydrophobicContact CE2-CG2 4.05Å; F263-T360 HydrophobicContact CZ-CG2 3.56Å; H357-T360 PolarHBondContact O-N 3.42Å; H357-T360 PolarHBondContact O-OG1 2.89Å; V358-T360 VanDerWaalsContact C-N 3.26Å; V358-T360 PolarHBondContact O-N 2.95Å; T360-Q362 PolarHBondContact O-N 3.4Å
361	D	94.2	Very high	95.9	Very high	43 Å²	43	41.8 Å²	41.8	23%	0.23	21%	0.208	C	C	.	.	H	α-helix	trans	-56.3	-39.6	-179.5	-76.9	-17.8	0	0	0	112.8	K262 G355 H357	K262-D361 WeakPolarHBondContact CD-OD1 3.36Å; K262-D361 WeakPolarHBondContact CE-OD1 3.38Å; K262-D361 IonicContact NZ-OD1 3.17Å; K262-D361 PolarHBondContact NZ-OD1 2.91Å; K262-D361 IonicContact NZ-OD2 3.6Å; G355-D361 WeakPolarHBondContact CA-OD2 3.03Å; G355-D361 PolarHBondContact N-OD2 3.35Å; H357-D361 PolarHBondContact O-N 2.92Å
362	Q	92.4	Very high	95.8	Very high	61 Å²	61	45 Å²	45	29%	0.285	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-141.3	64.4	174.9	-69.8	179.5	-10.7	0	0	108.9	M351 R352 T360 D364 S365 F366	M351-Q362 HydrophobicContact CE-CB 3.71Å; R352-Q362 PolarHBondContact O-NE2 3.25Å; R352-Q362 PolarHBondContact O-OE1 2.85Å; T360-Q362 PolarHBondContact O-N 3.4Å; Q362-D364 VanDerWaalsContact C-N 3.28Å; Q362-D364 PolarHBondContact O-N 3.03Å; Q362-S365 PolarHBondContact O-N 3.26Å; Q362-F366 WeakPolarHBondContact O-CB 3.3Å; Q362-F366 PolarHBondContact O-N 2.9Å
363	A	95.9	Very high	95.7	Very high	3 Å²	3	35.4 Å²	35.4	3%	0.025	19%	0.186	C	C	.	.	H	α-helix	trans	-51.9	-43.8	-172.5	0	0	0	0	0	113.1	R118 Y359 F366 N367	R118-A363 HydrophobicContact CB-CB 3.94Å; Y359-A363 WeakPolarHBondContact O-CA 3.19Å; A363-F366 PolarHBondContact O-N 2.76Å; A363-N367 WeakPolarHBondContact O-CB 3.42Å; A363-N367 PolarHBondContact O-N 3.25Å; A363-N367 PolarHBondContact O-ND2 2.73Å; A363-N367 PolarHBondContact O-OD1 3.47Å
364	D	96.5	Very high	95.6	Very high	111 Å²	111	31 Å²	31	59%	0.594	16%	0.163	S	C	*	.	H	α-helix	trans	-65	-50.9	-178.1	-60.7	-30.8	0	0	0	111.8	Q362 F366 N367 E368	Q362-D364 VanDerWaalsContact C-N 3.28Å; Q362-D364 PolarHBondContact O-N 3.03Å; D364-F366 VanDerWaalsContact C-N 3.3Å; D364-F366 PolarHBondContact O-N 3.41Å; D364-N367 WeakPolarHBondContact O-CB 3.39Å; D364-N367 PolarHBondContact O-N 3.02Å; D364-N367 VanDerWaalsContact O-N 3.15Å; D364-E368 WeakPolarHBondContact O-CG 3.38Å; D364-E368 PolarHBondContact O-N 3.48Å
365	S	97.4	Very high	95.1	Very high	57 Å²	57	34.9 Å²	34.9	40%	0.399	20%	0.195	S	C	.	.	H	α-helix	trans	-63.8	-35.7	176.5	-54.2	0	0	0	0	112.5	Q362 L369	Q362-S365 PolarHBondContact O-N 3.26Å; S365-L369 WeakPolarHBondContact O-CB 3.04Å; S365-L369 PolarHBondContact O-N 2.9Å; S365-L369 VanDerWaalsContact O-N 3.1Å
366	F	98.4	Very high	94	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.1	-49.2	172.6	179.4	-95	0	0	0	110.3	W116 N119 L175 A201 I321 M351 V358 Q362 A363 D364 E368 L369 I370	W116-F366 HydrophobicContact CH2-CZ 4.46Å; W116-F366 AromaticContact CZ3-CE1 3.89Å; W116-F366 HydrophobicContact CZ3-CE1 3.89Å; W116-F366 AromaticContact CZ3-CZ 4Å; W116-F366 HydrophobicContact CZ3-CZ 4Å; N119-F366 WeakPolarHBondContact ND2-CD1 3.16Å; L175-F366 HydrophobicContact CD1-CZ 4.17Å; L175-F366 HydrophobicContact CD2-CE1 4.03Å; L175-F366 HydrophobicContact CD2-CZ 3.98Å; A201-F366 HydrophobicContact CB-CE2 3.88Å; A201-F366 HydrophobicContact CB-CZ 4Å; I321-F366 HydrophobicContact CD1-CD2 4.39Å; I321-F366 HydrophobicContact CD1-CE2 3.87Å; I321-F366 HydrophobicContact CG2-CD2 4.27Å; I321-F366 HydrophobicContact CG2-CE2 4.29Å; M351-F366 HydrophobicContact CE-CB 3.84Å; M351-F366 HydrophobicContact SD-CB 4.07Å; M351-F366 HydrophobicContact SD-CD2 3.84Å; M351-F366 HydrophobicContact SD-CG 4.47Å; V358-F366 HydrophobicContact CB-CD2 4.27Å; V358-F366 HydrophobicContact CB-CE2 4.49Å; V358-F366 HydrophobicContact CG2-CD2 3.97Å; V358-F366 HydrophobicContact CG2-CE2 3.71Å; Q362-F366 WeakPolarHBondContact O-CB 3.3Å; Q362-F366 PolarHBondContact O-N 2.9Å; A363-F366 PolarHBondContact O-N 2.76Å; D364-F366 VanDerWaalsContact C-N 3.3Å; D364-F366 PolarHBondContact O-N 3.41Å; F366-E368 PolarHBondContact O-N 3.37Å; F366-L369 PolarHBondContact O-N 2.88Å; F366-I370 HydrophobicContact CD1-CG1 3.98Å; F366-I370 HydrophobicContact CE1-CD1 4.14Å; F366-I370 HydrophobicContact CE1-CG1 3.65Å; F366-I370 HydrophobicContact CE2-CD1 4.24Å; F366-I370 HydrophobicContact CE2-CG1 4.41Å; F366-I370 HydrophobicContact CZ-CD1 3.86Å; F366-I370 HydrophobicContact CZ-CG1 3.9Å; F366-I370 VanDerWaalsContact O-CG1 3.3Å; F366-I370 WeakPolarHBondContact O-CG1 3.36Å; F366-I370 PolarHBondContact O-N 2.93Å
367	N	98.2	Very high	92.4	Very high	5 Å²	5	41 Å²	41	3%	0.027	22%	0.22	C	C	.	.	H	α-helix	trans	-61.5	-41.7	-179.7	-65.9	-25.7	0	0	0	112.2	R118 N119 A122 A363 D364 I370 N371	R118-N367 PolarHBondContact O-ND2 3.39Å; N119-N367 WeakPolarHBondContact CA-OD1 3.23Å; N119-N367 VanDerWaalsContact CB-OD1 3.26Å; N119-N367 WeakPolarHBondContact CB-OD1 3.26Å; N119-N367 PolarHBondContact ND2-OD1 2.82Å; A122-N367 HydrophobicContact CB-CB 3.68Å; A363-N367 WeakPolarHBondContact O-CB 3.42Å; A363-N367 PolarHBondContact O-N 3.25Å; A363-N367 PolarHBondContact O-ND2 2.73Å; A363-N367 PolarHBondContact O-OD1 3.47Å; D364-N367 WeakPolarHBondContact O-CB 3.39Å; D364-N367 PolarHBondContact O-N 3.02Å; D364-N367 VanDerWaalsContact O-N 3.15Å; N367-I370 PolarHBondContact O-N 2.81Å; N367-N371 WeakPolarHBondContact O-CB 3.27Å; N367-N371 PolarHBondContact O-N 2.79Å; N367-N371 PolarHBondContact O-ND2 2.66Å
368	E	97.1	Very high	90.3	Very high	136 Å²	136	46.8 Å²	46.8	64%	0.636	26%	0.261	S	S	*	.	H	α-helix	trans	-58.6	-47.2	174	-74.7	173.4	-179.3	0	0	111.4	D364 F366 I370 N371 E372	D364-E368 WeakPolarHBondContact O-CG 3.38Å; D364-E368 PolarHBondContact O-N 3.48Å; F366-E368 PolarHBondContact O-N 3.37Å; E368-I370 PolarHBondContact O-N 2.89Å; E368-N371 PolarHBondContact O-N 3.06Å; E368-E372 WeakPolarHBondContact O-CB 3.41Å; E368-E372 PolarHBondContact O-N 2.65Å
369	L	96.7	Very high	90	Very high	22 Å²	22	49.2 Å²	49.2	12%	0.115	27%	0.274	C	S	.	.	H	α-helix	trans	-65.6	-38.4	-179.8	-170.3	145.7	0	0	0	112.5	T319 I321 E349 S365 F366 E372 A373	T319-L369 HydrophobicContact CG2-CD2 4.48Å; I321-L369 HydrophobicContact CD1-CD2 3.28Å; I321-L369 HydrophobicContact CG1-CD2 3.47Å; I321-L369 VanDerWaalsContact CG1-CD2 3.47Å; I321-L369 HydrophobicContact CG2-CD2 4.49Å; E349-L369 HydrophobicContact CB-CD1 3.81Å; E349-L369 HydrophobicContact CB-CD2 4.45Å; E349-L369 HydrophobicContact CG-CD1 3.83Å; E349-L369 HydrophobicContact CG-CD2 4.42Å; E349-L369 HydrophobicContact CG-CG 4.46Å; S365-L369 WeakPolarHBondContact O-CB 3.04Å; S365-L369 PolarHBondContact O-N 2.9Å; S365-L369 VanDerWaalsContact O-N 3.1Å; F366-L369 PolarHBondContact O-N 2.88Å; L369-E372 PolarHBondContact O-N 2.73Å; L369-A373 WeakPolarHBondContact O-CB 3.44Å; L369-A373 PolarHBondContact O-N 3.36Å
370	I	97.7	Very high	89.6	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-63	-48.6	172	-62.4	-58.2	0	0	0	110.3	L103 L123 L175 I199 I321 F366 N367 E368 E372 A373 L374	L103-I370 HydrophobicContact CD2-CG2 4.25Å; L123-I370 HydrophobicContact CD2-CB 3.75Å; L123-I370 HydrophobicContact CD2-CG1 4.44Å; L123-I370 HydrophobicContact CD2-CG2 3.44Å; L123-I370 VanDerWaalsContact CD2-CG2 3.44Å; L175-I370 HydrophobicContact CD1-CD1 3.75Å; L175-I370 HydrophobicContact CD2-CD1 3.76Å; L175-I370 HydrophobicContact CD2-CG1 4.02Å; L175-I370 HydrophobicContact CD2-CG2 4.34Å; L175-I370 HydrophobicContact CG-CD1 4.43Å; I199-I370 HydrophobicContact CD1-CD1 4.23Å; I199-I370 HydrophobicContact CD1-CG2 4.25Å; I199-I370 HydrophobicContact CG2-CD1 3.59Å; I321-I370 HydrophobicContact CD1-CD1 3.41Å; I321-I370 VanDerWaalsContact CD1-CD1 3.41Å; I321-I370 HydrophobicContact CD1-CG1 4.47Å; F366-I370 HydrophobicContact CD1-CG1 3.98Å; F366-I370 HydrophobicContact CE1-CD1 4.14Å; F366-I370 HydrophobicContact CE1-CG1 3.65Å; F366-I370 HydrophobicContact CE2-CD1 4.24Å; F366-I370 HydrophobicContact CE2-CG1 4.41Å; F366-I370 HydrophobicContact CZ-CD1 3.86Å; F366-I370 HydrophobicContact CZ-CG1 3.9Å; F366-I370 VanDerWaalsContact O-CG1 3.3Å; F366-I370 WeakPolarHBondContact O-CG1 3.36Å; F366-I370 PolarHBondContact O-N 2.93Å; N367-I370 PolarHBondContact O-N 2.81Å; E368-I370 PolarHBondContact O-N 2.89Å; I370-E372 VanDerWaalsContact C-N 3.29Å; I370-E372 PolarHBondContact O-N 3.29Å; I370-A373 PolarHBondContact O-N 3.21Å; I370-L374 HydrophobicContact CG2-CD1 3.58Å; I370-L374 HydrophobicContact CG2-CG 4.12Å; I370-L374 WeakPolarHBondContact O-CB 3.32Å; I370-L374 WeakPolarHBondContact O-CG 3.43Å; I370-L374 PolarHBondContact O-N 3.47Å
371	N	95.8	Very high	89.3	Confident	38 Å²	38	54 Å²	54	20%	0.203	30%	0.301	C	S	.	.	H	α-helix	trans	-62.1	-36.7	179.5	-80.5	-33.1	0	0	0	112.5	A122 N367 E368 A375	A122-N371 PolarHBondContact O-ND2 3.5Å; N367-N371 WeakPolarHBondContact O-CB 3.27Å; N367-N371 PolarHBondContact O-N 2.79Å; N367-N371 PolarHBondContact O-ND2 2.66Å; E368-N371 PolarHBondContact O-N 3.06Å; N371-A375 PolarHBondContact O-N 2.92Å; N371-A375 VanDerWaalsContact O-N 3.16Å
372	E	94.4	Very high	89	Confident	77 Å²	77	54.6 Å²	54.6	36%	0.36	31%	0.305	S	S	.	.	H	α-helix	trans	-62.4	-53.2	171.8	-167.8	-159.7	162.1	0	0	110.8	R347 E368 L369 I370 L374 A375 F376	R347-E372 IonicContact CZ-OE1 3.95Å; R347-E372 IonicContact CZ-OE2 3.21Å; R347-E372 IonicContact NH1-OE1 2.65Å; R347-E372 PolarHBondContact NH1-OE1 3.49Å; R347-E372 IonicContact NH1-OE2 2.9Å; R347-E372 PolarHBondContact NH1-OE2 2.95Å; R347-E372 IonicContact NH2-OE1 3.54Å; R347-E372 PolarHBondContact NH2-OE1 2.73Å; R347-E372 IonicContact NH2-OE2 2.77Å; R347-E372 PolarHBondContact NH2-OE2 3.24Å; E368-E372 WeakPolarHBondContact O-CB 3.41Å; E368-E372 PolarHBondContact O-N 2.65Å; L369-E372 PolarHBondContact O-N 2.73Å; I370-E372 VanDerWaalsContact C-N 3.29Å; I370-E372 PolarHBondContact O-N 3.29Å; E372-L374 PolarHBondContact O-N 3.1Å; E372-A375 WeakPolarHBondContact O-CB 3.28Å; E372-A375 PolarHBondContact O-N 3.19Å; E372-F376 HydrophobicContact CG-CD2 4.01Å; E372-F376 HydrophobicContact CG-CE2 3.74Å; E372-F376 VanDerWaalsContact O-CD2 3.24Å; E372-F376 WeakPolarHBondContact O-CD2 3.38Å; E372-F376 PolarHBondContact O-N 2.82Å
373	A	93.6	Very high	88.8	Confident	2 Å²	2	54.3 Å²	54.3	2%	0.017	31%	0.306	C	S	.	.	H	α-helix	trans	-55.7	-40.6	179.1	0	0	0	0	0	111.8	H197 I199 T319 L369 I370 A375 F376	H197-A373 PolarHBondContact CE1-O 3.4Å; H197-A373 PolarHBondContact ND1-O 2.85Å; I199-A373 HydrophobicContact CD1-CB 4.25Å; T319-A373 HydrophobicContact CG2-CB 4.27Å; L369-A373 WeakPolarHBondContact O-CB 3.44Å; L369-A373 PolarHBondContact O-N 3.36Å; I370-A373 PolarHBondContact O-N 3.21Å; A373-A375 VanDerWaalsContact C-N 3.29Å; A373-A375 PolarHBondContact O-N 3.43Å; A373-F376 PolarHBondContact O-N 3.22Å
374	L	92.5	Very high	88.3	Confident	10 Å²	10	57.7 Å²	57.7	5%	0.052	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-14.9	178.7	-69.4	174.1	0	0	0	114.8	L103 R127 T173 I199 I370 E372	L103-L374 HydrophobicContact CD1-CD2 4.39Å; L103-L374 HydrophobicContact CD2-CD1 4.21Å; R127-L374 VanDerWaalsContact NH2-CB 3.35Å; T173-L374 HydrophobicContact CG2-CD2 3.36Å; I199-L374 HydrophobicContact CD1-CD2 3.97Å; I199-L374 HydrophobicContact CD1-CG 4.18Å; I370-L374 HydrophobicContact CG2-CD1 3.58Å; I370-L374 HydrophobicContact CG2-CG 4.12Å; I370-L374 WeakPolarHBondContact O-CB 3.32Å; I370-L374 WeakPolarHBondContact O-CG 3.43Å; I370-L374 PolarHBondContact O-N 3.47Å; E372-L374 PolarHBondContact O-N 3.1Å
375	A	85.2	Confident	87.7	Confident	80 Å²	80	53.9 Å²	53.9	66%	0.661	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-20.9	172.3	0	0	0	0	0	112.1	N371 E372 A373	N371-A375 PolarHBondContact O-N 2.92Å; N371-A375 VanDerWaalsContact O-N 3.16Å; E372-A375 WeakPolarHBondContact O-CB 3.28Å; E372-A375 PolarHBondContact O-N 3.19Å; A373-A375 VanDerWaalsContact C-N 3.29Å; A373-A375 PolarHBondContact O-N 3.43Å
376	F	68.1	Low	86.9	Confident	141 Å²	141	53.6 Å²	53.6	62%	0.618	30%	0.299	S	S	*	.			trans	-92.9	13.9	-177.8	-81	-70.3	0	0	0	114.5	E372 A373 P378	E372-F376 HydrophobicContact CG-CD2 4.01Å; E372-F376 HydrophobicContact CG-CE2 3.74Å; E372-F376 VanDerWaalsContact O-CD2 3.24Å; E372-F376 WeakPolarHBondContact O-CD2 3.38Å; E372-F376 PolarHBondContact O-N 2.82Å; A373-F376 PolarHBondContact O-N 3.22Å; F376-P378 VanDerWaalsContact O-CD 3.31Å; F376-P378 WeakPolarHBondContact O-CD 3.45Å
377	T	62.7	Low	86	Confident	33 Å²	33	58.1 Å²	58.1	20%	0.202	32%	0.324	C	S	.	.			trans	-73.6	117.8	176	-42.2	0	0	0	0	109.9	N196 H197 P317	N196-T377 HydrophobicContact CB-CG2 4.46Å; N196-T377 VanDerWaalsContact CG-CG2 3.41Å; N196-T377 WeakPolarHBondContact ND2-CG2 3.43Å; H197-T377 PolarHBondContact ND1-OG1 3.01Å; P317-T377 HydrophobicContact CG-CG2 4.24Å
378	P	49.9	Very low	84.9	Confident	153 Å²	153	62.9 Å²	62.9	99%	0.994	35%	0.351	S	S	*	.			trans	-68.5	0	-173.4	27.6	-35.4	0	0	0	114.8	P317 F376	P317-P378 HydrophobicContact CG-CG 4.22Å; F376-P378 VanDerWaalsContact O-CD 3.31Å; F376-P378 WeakPolarHBondContact O-CD 3.45Å

Retrieved 378 of 378 residues in 900.4 ms (Link to these results)

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