A0A096MQZ8_PAPAN Loading...

Noggin

Inhibitor of bone morphogenetic proteins (BMP) signaling which is required for growth and patterning of the neural tube and somite.

AlphaFold DB (Q13253), UniProt , Accession A0A096MQZ8, Species PAPAN (Papio anubis, Olive baboon), Gene NOG, Length 232 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	45.3	Very low	67.8	Low	238 Å²	238	125.5 Å²	125.5	100%	1.172	68%	0.675	S	S	*	*				0	88.5	0	-68.5	-179.3	-165.9	0	0	107.6	R3	M1-R3 PolarHBondContact O-N 3.25Å
2	E	55.3	Low	69.2	Low	201 Å²	201	130.3 Å²	130.3	94%	0.939	68%	0.679	S	S	*	*			trans	-71.1	109.4	178.6	-73.8	172.8	106.5	0	0	109.2	C4	E2-C4 PolarHBondContact O-N 3.23Å
3	R	60.8	Low	70.3	Confident	242 Å²	242	124.3 Å²	124.3	91%	0.913	66%	0.66	S	S	*	*			trans	-73.6	109.5	172.9	-76.9	178.9	175.4	174.6	-1.2	107.8	M1 P5	M1-R3 PolarHBondContact O-N 3.25Å; R3-P5 VanDerWaalsContact O-CD 3.24Å; R3-P5 WeakPolarHBondContact O-CD 3.24Å
4	C	62.4	Low	71.4	Confident	83 Å²	83	122.9 Å²	122.9	56%	0.561	65%	0.653	S	S	*	*			trans	-66.4	113.5	-179.7	-146.6	0	0	0	0	110.2	E2 S6	E2-C4 PolarHBondContact O-N 3.23Å; C4-S6 PolarHBondContact O-N 3.3Å; C4-S6 PolarHBondContact SG-OG 2.81Å
5	P	66.1	Low	72.2	Confident	112 Å²	112	121.3 Å²	121.3	73%	0.727	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-8.7	179.9	28.3	-33.5	0	0	0	113.2	R3 L7	R3-P5 VanDerWaalsContact O-CD 3.24Å; R3-P5 WeakPolarHBondContact O-CD 3.24Å; P5-L7 PolarHBondContact O-N 2.83Å
6	S	68.8	Low	72.9	Confident	63 Å²	63	118.8 Å²	118.8	44%	0.441	64%	0.639	S	S	.	*	H	α-helix	trans	-69.4	-28.3	-177.2	57.5	0	0	0	0	114	C4 G8 V9 T10	C4-S6 PolarHBondContact O-N 3.3Å; C4-S6 PolarHBondContact SG-OG 2.81Å; S6-G8 VanDerWaalsContact C-N 3.35Å; S6-G8 PolarHBondContact O-N 3.21Å; S6-V9 PolarHBondContact O-N 2.91Å; S6-T10 PolarHBondContact O-N 3.43Å; S6-T10 VanDerWaalsContact O-N 3.17Å; S6-T10 PolarHBondContact O-OG1 3.19Å
7	L	71.5	Confident	73.6	Confident	114 Å²	114	115.8 Å²	115.8	60%	0.597	63%	0.626	S	S	*	*	H	α-helix	trans	-66.2	-34.4	179.9	-90.6	149.2	0	0	0	113	P5 T10 L11	P5-L7 PolarHBondContact O-N 2.83Å; L7-T10 PolarHBondContact O-OG1 3.06Å; L7-T10 VanDerWaalsContact O-OG1 3.06Å; L7-L11 WeakPolarHBondContact O-CB 3.5Å; L7-L11 WeakPolarHBondContact O-CD1 3.47Å; L7-L11 WeakPolarHBondContact O-CG 3.46Å; L7-L11 PolarHBondContact O-N 3.16Å
8	G	74.1	Confident	74	Confident	42 Å²	42	115.8 Å²	115.8	43%	0.433	62%	0.624	S	S	.	*	H	α-helix	trans	-68.6	-40.3	178	0	0	0	0	0	112.2	S6 Y12	S6-G8 VanDerWaalsContact C-N 3.35Å; S6-G8 PolarHBondContact O-N 3.21Å; G8-Y12 PolarHBondContact O-N 3.46Å
9	V	78.6	Confident	74.1	Confident	104 Å²	104	112.3 Å²	112.3	63%	0.63	62%	0.619	S	S	*	*	H	α-helix	trans	-70.1	-40.8	-178.8	-176.6	0	0	0	0	111.1	S6 Y12 A13	S6-V9 PolarHBondContact O-N 2.91Å; V9-Y12 PolarHBondContact O-N 3.15Å; V9-A13 WeakPolarHBondContact O-CB 3.37Å; V9-A13 PolarHBondContact O-N 3.26Å
10	T	79.9	Confident	74.2	Confident	76 Å²	76	113.9 Å²	113.9	47%	0.466	63%	0.625	S	S	.	*	H	α-helix	trans	-67.4	-39.2	177.7	50.4	0	0	0	0	112.4	S6 L7 A13 L14	S6-T10 PolarHBondContact O-N 3.43Å; S6-T10 VanDerWaalsContact O-N 3.17Å; S6-T10 PolarHBondContact O-OG1 3.19Å; L7-T10 PolarHBondContact O-OG1 3.06Å; L7-T10 VanDerWaalsContact O-OG1 3.06Å; T10-A13 PolarHBondContact O-N 3.45Å; T10-L14 WeakPolarHBondContact O-CB 3.26Å; T10-L14 PolarHBondContact O-N 3.49Å
11	L	82.5	Confident	74.1	Confident	105 Å²	105	117.9 Å²	117.9	55%	0.55	63%	0.631	S	S	.	*	H	α-helix	trans	-63.1	-45.1	173.4	-81.7	164.5	0	0	0	111.8	L7 A13 L14 V15	L7-L11 WeakPolarHBondContact O-CB 3.5Å; L7-L11 WeakPolarHBondContact O-CD1 3.47Å; L7-L11 WeakPolarHBondContact O-CG 3.46Å; L7-L11 PolarHBondContact O-N 3.16Å; L11-A13 PolarHBondContact O-N 3.41Å; L11-L14 PolarHBondContact O-N 3.46Å; L11-V15 WeakPolarHBondContact O-CG2 3.36Å; L11-V15 PolarHBondContact O-N 2.81Å
12	Y	84.7	Confident	74.8	Confident	183 Å²	183	109.9 Å²	109.9	72%	0.718	60%	0.603	S	S	*	*	H	α-helix	trans	-61.3	-44.3	176.2	-111.7	-85.5	0	0	0	112.1	G8 V9 L14 V15 V16	G8-Y12 PolarHBondContact O-N 3.46Å; V9-Y12 PolarHBondContact O-N 3.15Å; Y12-L14 PolarHBondContact O-N 3.2Å; Y12-V15 PolarHBondContact O-N 2.68Å; Y12-V16 WeakPolarHBondContact O-CG2 3.41Å; Y12-V16 PolarHBondContact O-N 2.68Å
13	A	84.5	Confident	75	Confident	53 Å²	53	105.8 Å²	105.8	44%	0.438	59%	0.592	S	S	.	*	H	α-helix	trans	-61.9	-42.3	177.2	0	0	0	0	0	111.9	V9 T10 L11 V16 V17	V9-A13 WeakPolarHBondContact O-CB 3.37Å; V9-A13 PolarHBondContact O-N 3.26Å; T10-A13 PolarHBondContact O-N 3.45Å; L11-A13 PolarHBondContact O-N 3.41Å; A13-V16 PolarHBondContact O-N 3Å; A13-V17 WeakPolarHBondContact O-CB 3.49Å; A13-V17 VanDerWaalsContact O-CG2 3.24Å; A13-V17 WeakPolarHBondContact O-CG2 3.44Å; A13-V17 PolarHBondContact O-N 3.29Å
14	L	85.6	Confident	74.9	Confident	105 Å²	105	100.2 Å²	100.2	55%	0.55	59%	0.587	S	S	.	*	H	α-helix	trans	-61.7	-43.2	175.3	-85.6	164.6	0	0	0	112.2	T10 L11 Y12 V17 L18	T10-L14 WeakPolarHBondContact O-CB 3.26Å; T10-L14 PolarHBondContact O-N 3.49Å; L11-L14 PolarHBondContact O-N 3.46Å; Y12-L14 PolarHBondContact O-N 3.2Å; L14-V17 PolarHBondContact O-N 2.76Å; L14-L18 WeakPolarHBondContact O-CB 3.32Å; L14-L18 VanDerWaalsContact O-CG 3.26Å; L14-L18 WeakPolarHBondContact O-CG 3.47Å; L14-L18 PolarHBondContact O-N 3.31Å
15	V	83.6	Confident	74.6	Confident	98 Å²	98	100.7 Å²	100.7	59%	0.594	60%	0.597	S	S	*	*	H	α-helix	trans	-64.4	-42.2	177.6	173.1	0	0	0	0	111.3	L11 Y12 L18 G19	L11-V15 WeakPolarHBondContact O-CG2 3.36Å; L11-V15 PolarHBondContact O-N 2.81Å; Y12-V15 PolarHBondContact O-N 2.68Å; V15-L18 PolarHBondContact O-N 3.36Å; V15-G19 PolarHBondContact O-N 3.05Å
16	V	83.3	Confident	74.3	Confident	81 Å²	81	98.8 Å²	98.8	49%	0.491	60%	0.597	S	S	.	*	H	α-helix	trans	-64.4	-43	176.2	173.3	0	0	0	0	111	Y12 A13 L18 G19 L20	Y12-V16 WeakPolarHBondContact O-CG2 3.41Å; Y12-V16 PolarHBondContact O-N 2.68Å; A13-V16 PolarHBondContact O-N 3Å; V16-L18 PolarHBondContact O-N 2.96Å; V16-G19 PolarHBondContact O-N 3.4Å; V16-L20 HydrophobicContact CG1-CD1 3.88Å; V16-L20 HydrophobicContact CG1-CG 4.41Å; V16-L20 WeakPolarHBondContact O-CB 3.29Å; V16-L20 VanDerWaalsContact O-CG 3.27Å; V16-L20 WeakPolarHBondContact O-CG 3.47Å; V16-L20 PolarHBondContact O-N 3.44Å
17	V	83.7	Confident	73.9	Confident	69 Å²	69	99.2 Å²	99.2	42%	0.418	61%	0.612	S	S	.	*	H	α-helix	trans	-65.1	-39.5	177.1	171.3	0	0	0	0	111.5	A13 L14 R21	A13-V17 WeakPolarHBondContact O-CB 3.49Å; A13-V17 VanDerWaalsContact O-CG2 3.24Å; A13-V17 WeakPolarHBondContact O-CG2 3.44Å; A13-V17 PolarHBondContact O-N 3.29Å; L14-V17 PolarHBondContact O-N 2.76Å; V17-R21 WeakPolarHBondContact O-CB 3.42Å; V17-R21 WeakPolarHBondContact O-CG 3.34Å; V17-R21 PolarHBondContact O-N 3.48Å
18	L	81.5	Confident	74.1	Confident	115 Å²	115	102.4 Å²	102.4	60%	0.602	62%	0.624	S	S	*	*	H	α-helix	trans	-67	-41	174.9	-73.7	168.9	0	0	0	111.7	L14 V15 V16 R21 A22	L14-L18 WeakPolarHBondContact O-CB 3.32Å; L14-L18 VanDerWaalsContact O-CG 3.26Å; L14-L18 WeakPolarHBondContact O-CG 3.47Å; L14-L18 PolarHBondContact O-N 3.31Å; V15-L18 PolarHBondContact O-N 3.36Å; V16-L18 PolarHBondContact O-N 2.96Å; L18-R21 CarbonylContact O-C 3.51Å; L18-R21 PolarHBondContact O-N 3.47Å; L18-A22 PolarHBondContact O-N 3.17Å
19	G	75.2	Confident	74.3	Confident	50 Å²	50	108 Å²	108	52%	0.515	64%	0.638	S	S	.	*	H	α-helix	trans	-64.6	-37.8	175.9	0	0	0	0	0	113	V15 V16 R21 A22	V15-G19 PolarHBondContact O-N 3.05Å; V16-G19 PolarHBondContact O-N 3.4Å; G19-R21 VanDerWaalsContact C-N 3.32Å; G19-A22 PolarHBondContact O-N 3.13Å
20	L	76.9	Confident	74.5	Confident	143 Å²	143	113.2 Å²	113.2	75%	0.749	65%	0.648	S	S	*	*	H	α-helix	trans	-72.8	-24	174.6	-70.3	169.5	0	0	0	113	V16	V16-L20 HydrophobicContact CG1-CD1 3.88Å; V16-L20 HydrophobicContact CG1-CG 4.41Å; V16-L20 WeakPolarHBondContact O-CB 3.29Å; V16-L20 VanDerWaalsContact O-CG 3.27Å; V16-L20 WeakPolarHBondContact O-CG 3.47Å; V16-L20 PolarHBondContact O-N 3.44Å
21	R	71	Confident	74.8	Confident	198 Å²	198	115.1 Å²	115.1	75%	0.747	66%	0.655	S	S	*	*	H	α-helix	trans	-90.9	-11.1	174.7	-74.1	-169.6	179.9	-172.9	2.2	113.9	V17 L18 G19 T23	V17-R21 WeakPolarHBondContact O-CB 3.42Å; V17-R21 WeakPolarHBondContact O-CG 3.34Å; V17-R21 PolarHBondContact O-N 3.48Å; L18-R21 CarbonylContact O-C 3.51Å; L18-R21 PolarHBondContact O-N 3.47Å; G19-R21 VanDerWaalsContact C-N 3.32Å; R21-T23 PolarHBondContact O-N 2.94Å
22	A	60.5	Low	74.9	Confident	70 Å²	70	117.2 Å²	117.2	58%	0.579	66%	0.661	S	S	*	*			trans	-68.3	85.5	168.6	0	0	0	0	0	107.5	L18 G19	L18-A22 PolarHBondContact O-N 3.17Å; G19-A22 PolarHBondContact O-N 3.13Å
23	T	60.6	Low	75.3	Confident	115 Å²	115	115.4 Å²	115.4	71%	0.706	66%	0.663	S	S	*	*			trans	-55	138.8	162.1	48.9	0	0	0	0	107	R21 A25	R21-T23 PolarHBondContact O-N 2.94Å; T23-A25 VanDerWaalsContact C-N 3.32Å; T23-A25 PolarHBondContact O-N 3.16Å
24	P	57.3	Low	75.6	Confident	125 Å²	125	123.1 Å²	123.1	81%	0.812	68%	0.681	S	S	*	*			trans	-58.9	104.1	172	23.4	-30.2	0	0	0	106.8	G26	P24-G26 PolarHBondContact O-N 2.9Å
25	A	56.6	Low	76	Confident	94 Å²	94	124.1 Å²	124.1	78%	0.777	69%	0.693	S	S	*	*			trans	-59.9	107.4	166.3	0	0	0	0	0	104.9	T23 G27	T23-A25 VanDerWaalsContact C-N 3.32Å; T23-A25 PolarHBondContact O-N 3.16Å; A25-G27 PolarHBondContact O-N 2.99Å
26	G	59.8	Low	76.3	Confident	71 Å²	71	123.5 Å²	123.5	73%	0.732	70%	0.698	S	S	*	*			trans	-56.7	103.8	176.1	0	0	0	0	0	107.9	P24 Q28	P24-G26 PolarHBondContact O-N 2.9Å; G26-Q28 PolarHBondContact O-N 3.06Å; G26-Q28 VanDerWaalsContact O-N 3.13Å
27	G	61	Low	76.7	Confident	72 Å²	72	125.4 Å²	125.4	74%	0.742	71%	0.712	S	S	*	*	P	Polyproline II helix	trans	-62	117	179.7	0	0	0	0	0	108.7	A25	A25-G27 PolarHBondContact O-N 2.99Å
28	Q	75.1	Confident	77.1	Confident	182 Å²	182	125.8 Å²	125.8	85%	0.85	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-61.7	143.1	169.7	-70.2	-178	-23.2	0	0	109	G26 Y30	G26-Q28 PolarHBondContact O-N 3.06Å; G26-Q28 VanDerWaalsContact O-N 3.13Å; Q28-Y30 PolarHBondContact O-N 3.15Å
29	H	77.8	Confident	77.5	Confident	160 Å²	160	127.8 Å²	127.8	74%	0.741	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-60.8	126	-179.3	-75	-85.6	0	0	0	110.5	H32	H29-H32 PolarHBondContact O-CE1 3.23Å
30	Y	83.8	Confident	78.2	Confident	213 Å²	213	131.5 Å²	131.5	84%	0.835	74%	0.738	S	S	*	*	S	Bend	trans	-64	-44.8	173.9	-179.9	-102.8	0	0	0	111.4	Q28 H32	Q28-Y30 PolarHBondContact O-N 3.15Å; Y30-H32 PolarHBondContact O-ND1 3.05Å
31	L	84.8	Confident	78.9	Confident	116 Å²	116	126.2 Å²	126.2	61%	0.607	71%	0.71	S	S	*	*	S	Bend	trans	-91.6	109.6	177.3	-63.2	176.7	0	0	0	110.6	I33	L31-I33 HydrophobicContact CB-CD1 4.14Å; L31-I33 HydrophobicContact CB-CG1 4.1Å; L31-I33 HydrophobicContact CD1-CD1 4.4Å; L31-I33 PolarHBondContact O-N 3.41Å
32	H	86.5	Confident	79.8	Confident	148 Å²	148	121.2 Å²	121.2	69%	0.685	70%	0.703	S	S	*	*			trans	-82.8	54.1	-179.8	-67.1	74.9	0	0	0	112.2	H29 Y30 R34	H29-H32 PolarHBondContact O-CE1 3.23Å; Y30-H32 PolarHBondContact O-ND1 3.05Å; H32-R34 VanDerWaalsContact C-N 3.27Å; H32-R34 PolarHBondContact O-N 3.36Å
33	I	92.1	Very high	81.1	Confident	145 Å²	145	121.8 Å²	121.8	74%	0.744	70%	0.696	S	S	*	*	S	Bend	trans	-75.1	-20.5	-179.6	-56.9	172.8	0	0	0	111.5	L31	L31-I33 HydrophobicContact CB-CD1 4.14Å; L31-I33 HydrophobicContact CB-CG1 4.1Å; L31-I33 HydrophobicContact CD1-CD1 4.4Å; L31-I33 PolarHBondContact O-N 3.41Å
34	R	91.8	Very high	82.4	Confident	216 Å²	216	122.7 Å²	122.7	82%	0.815	70%	0.701	S	S	*	*	S	Bend	trans	-123.3	148.6	175.5	-65.9	-178.1	-177.5	179.9	1.7	109.3	H32	H32-R34 VanDerWaalsContact C-N 3.27Å; H32-R34 PolarHBondContact O-N 3.36Å
35	P	92.6	Very high	83.7	Confident	125 Å²	125	121.1 Å²	121.1	81%	0.812	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-61.1	141.6	170.6	27.6	-34.2	0	0	0	110
36	A	90.2	Very high	85.3	Confident	85 Å²	85	122.1 Å²	122.1	70%	0.702	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-76.9	139.4	170.4	0	0	0	0	0	109.6
37	P	91.9	Very high	86.8	Confident	122 Å²	122	127 Å²	127	79%	0.792	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-67.6	155.1	172.1	30.6	-34.3	0	0	0	110.6
38	S	91.6	Very high	88.2	Confident	77 Å²	77	126.7 Å²	126.7	54%	0.538	66%	0.664	S	S	.	*			trans	-109.1	143.2	172.7	177.9	0	0	0	0	110	N40	S38-N40 VanDerWaalsContact C-N 3.27Å; S38-N40 WeakPolarHBondContact OG-CB 3.36Å; S38-N40 PolarHBondContact OG-N 2.89Å; S38-N40 PolarHBondContact OG-ND2 2.87Å; S38-N40 VanDerWaalsContact OG-ND2 3.14Å
39	D	90.2	Very high	88.9	Confident	156 Å²	156	123.2 Å²	123.2	83%	0.834	65%	0.648	S	S	*	*			trans	-89.8	9	174.5	-60.3	-40.9	0	0	0	112.6
40	N	90.8	Very high	89.6	Confident	129 Å²	129	121.2 Å²	121.2	69%	0.69	65%	0.649	S	S	*	*			trans	-66.1	134.2	179	-69.9	-23.2	0	0	0	111.4	S38	S38-N40 VanDerWaalsContact C-N 3.27Å; S38-N40 WeakPolarHBondContact OG-CB 3.36Å; S38-N40 PolarHBondContact OG-N 2.89Å; S38-N40 PolarHBondContact OG-ND2 2.87Å; S38-N40 VanDerWaalsContact OG-ND2 3.14Å
41	L	91.2	Very high	90	Very high	31 Å²	31	113.9 Å²	113.9	16%	0.162	62%	0.624	C	S	.	*	S	Bend	trans	-120.7	157.8	176.2	-70	175.4	0	0	0	110.3	L43 P194 S197 P223 I225	L41-L43 HydrophobicContact CD2-CD2 3.97Å; L41-L43 HydrophobicContact CD2-CG 3.72Å; L41-P194 HydrophobicContact CB-CB 4.16Å; L41-P194 HydrophobicContact CB-CG 4.18Å; L41-S197 VanDerWaalsContact CD1-CB 3.4Å; L41-P223 HydrophobicContact CD2-CB 4.19Å; L41-P223 HydrophobicContact CD2-CG 4.12Å; L41-I225 HydrophobicContact CB-CD1 4.31Å; L41-I225 HydrophobicContact CB-CG1 4.02Å; L41-I225 HydrophobicContact CD1-CG1 3.94Å
42	P	88.6	Confident	90.4	Very high	94 Å²	94	112.7 Å²	112.7	61%	0.61	62%	0.624	S	S	*	*	S	Bend	cis	-73.7	156.3	0.2	31.9	-36	0	0	0	113.2	I225	P42-I225 HydrophobicContact CB-CD1 4.17Å
43	L	88.2	Confident	90.7	Very high	82 Å²	82	109.5 Å²	109.5	43%	0.429	61%	0.611	S	S	.	*	P	Polyproline II helix	trans	-75.1	145.2	171	-64.9	-173.3	0	0	0	110.5	L41 P223	L41-L43 HydrophobicContact CD2-CD2 3.97Å; L41-L43 HydrophobicContact CD2-CG 3.72Å; L43-P223 HydrophobicContact CD1-CG 3.41Å; L43-P223 VanDerWaalsContact CD1-CG 3.41Å; L43-P223 HydrophobicContact CG-CG 4.03Å
44	V	88.3	Confident	90.8	Very high	134 Å²	134	105.1 Å²	105.1	81%	0.812	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-83.4	139.8	163.5	-176.7	0	0	0	0	107.8
45	D	84.5	Confident	91	Very high	92 Å²	92	97.1 Å²	97.1	49%	0.492	56%	0.56	S	S	.	*	P	Polyproline II helix	trans	-55.8	144.4	176	-64.9	-46	0	0	0	110.9	I47 N162	D45-I47 PolarHBondContact O-N 3.06Å; D45-N162 PolarHBondContact OD1-ND2 2.94Å; D45-N162 VanDerWaalsContact OD1-ND2 3.1Å
46	L	89.9	Confident	91.1	Very high	115 Å²	115	91.9 Å²	91.9	60%	0.602	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-64	131	-179.9	-67.7	174.4	0	0	0	110.2	E48 F168	L46-E48 PolarHBondContact O-N 3.08Å; L46-F168 HydrophobicContact CD1-CE2 4.23Å; L46-F168 HydrophobicContact CD1-CZ 3.75Å
47	I	90.9	Very high	91.3	Very high	174 Å²	174	94.6 Å²	94.6	89%	0.892	52%	0.522	S	S	*	.			trans	-75.1	96.7	169.1	-60.5	165	0	0	0	107.7	D45	D45-I47 PolarHBondContact O-N 3.06Å
48	E	90.7	Very high	91.5	Very high	65 Å²	65	97.3 Å²	97.3	30%	0.304	52%	0.524	S	S	.	.			trans	-80.7	143.4	179.3	-70.8	-62.6	155.7	0	0	112.1	L46 R167 R204	L46-E48 PolarHBondContact O-N 3.08Å; E48-R167 VanDerWaalsContact OE2-CD 3.27Å; E48-R167 WeakPolarHBondContact OE2-CD 3.27Å; E48-R167 IonicContact OE2-CZ 3.23Å; E48-R167 IonicContact OE2-NE 2.76Å; E48-R167 IonicContact OE2-NH1 2.68Å; E48-R167 PolarHBondContact OE2-NH1 2.97Å; E48-R204 IonicContact OE1-CZ 3.93Å; E48-R204 IonicContact OE1-NH1 2.99Å; E48-R204 PolarHBondContact OE1-NH1 2.91Å; E48-R204 IonicContact OE1-NH2 3.6Å; E48-R204 PolarHBondContact OE1-NH2 3.28Å; E48-R204 IonicContact OE2-CZ 2.76Å; E48-R204 IonicContact OE2-NH1 3.57Å; E48-R204 IonicContact OE2-NH2 2.81Å; E48-R204 PolarHBondContact OE2-NH2 3.11Å
49	H	90.3	Very high	91.6	Very high	108 Å²	108	101.3 Å²	101.3	50%	0.5	53%	0.532	S	S	.	.			trans	-64.3	129.7	170.5	-166.1	-70.6	0	0	0	109.6	D51 F54 R167	H49-D51 VanDerWaalsContact CE1-CB 3.46Å; H49-D51 WeakPolarHBondContact CE1-CB 3.45Å; H49-D51 WeakPolarHBondContact ND1-CB 3.24Å; H49-D51 PolarHBondContact ND1-N 2.77Å; H49-D51 PolarHBondContact O-N 3.13Å; H49-D51 VanDerWaalsContact O-N 3.09Å; H49-F54 HydrophobicContact CB-CD2 4.13Å; H49-F54 HydrophobicContact CB-CE2 4.21Å; H49-F54 AromaticContact CG-CE2 3.84Å; H49-F54 AromaticContact ND1-CD2 3.99Å; H49-F54 AromaticContact ND1-CE2 3.7Å; H49-R167 VanDerWaalsContact O-CZ 3.3Å; H49-R167 PolarHBondContact O-NH1 3.26Å; H49-R167 PolarHBondContact O-NH2 3.14Å
50	P	92.9	Very high	91.8	Very high	118 Å²	118	96.2 Å²	96.2	77%	0.766	50%	0.504	S	S	*	.			trans	-76.1	3.6	-172.2	31.7	-38.6	0	0	0	114.7	P52	P50-P52 WeakPolarHBondContact O-CD 3.4Å
51	D	93.1	Very high	92	Very high	59 Å²	59	93.7 Å²	93.7	32%	0.316	49%	0.49	S	S	.	.			trans	-82.6	121.2	-173	-175.2	-14.7	0	0	0	109.7	H49 I53 F54 R167	H49-D51 VanDerWaalsContact CE1-CB 3.46Å; H49-D51 WeakPolarHBondContact CE1-CB 3.45Å; H49-D51 WeakPolarHBondContact ND1-CB 3.24Å; H49-D51 PolarHBondContact ND1-N 2.77Å; H49-D51 PolarHBondContact O-N 3.13Å; H49-D51 VanDerWaalsContact O-N 3.09Å; D51-I53 HydrophobicContact CB-CG1 4.27Å; D51-I53 PolarHBondContact O-N 3.43Å; D51-I53 WeakPolarHBondContact OD1-CG1 3.45Å; D51-I53 WeakPolarHBondContact OD1-CG2 3.47Å; D51-I53 PolarHBondContact OD1-N 3.32Å; D51-I53 VanDerWaalsContact OD1-N 3.13Å; D51-I53 VanDerWaalsContact OD2-CD1 3.26Å; D51-I53 WeakPolarHBondContact OD2-CD1 3.33Å; D51-F54 HydrophobicContact CB-CD2 3.9Å; D51-F54 HydrophobicContact CB-CE2 3.96Å; D51-F54 WeakPolarHBondContact O-CD2 3.32Å; D51-F54 PolarHBondContact O-N 2.89Å; D51-F54 VanDerWaalsContact O-N 3.16Å; D51-R167 PolarHBondContact O-NH2 2.81Å
52	P	93	Very high	92.2	Very high	92 Å²	92	96 Å²	96	60%	0.597	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-61.2	-16.3	-177.1	-24.6	34.9	0	0	0	114.8	P50 F54 D55	P50-P52 WeakPolarHBondContact O-CD 3.4Å; P52-F54 PolarHBondContact O-N 2.84Å; P52-F54 VanDerWaalsContact O-N 3.12Å; P52-D55 WeakPolarHBondContact O-CB 3.43Å; P52-D55 PolarHBondContact O-N 2.86Å
53	I	92.5	Very high	92.5	Very high	81 Å²	81	95.4 Å²	95.4	42%	0.415	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-60.1	-22.6	175.6	69.8	-177.6	0	0	0	112.8	D51	D51-I53 HydrophobicContact CB-CG1 4.27Å; D51-I53 PolarHBondContact O-N 3.43Å; D51-I53 WeakPolarHBondContact OD1-CG1 3.45Å; D51-I53 WeakPolarHBondContact OD1-CG2 3.47Å; D51-I53 PolarHBondContact OD1-N 3.32Å; D51-I53 VanDerWaalsContact OD1-N 3.13Å; D51-I53 VanDerWaalsContact OD2-CD1 3.26Å; D51-I53 WeakPolarHBondContact OD2-CD1 3.33Å
54	F	93.6	Very high	92.9	Very high	53 Å²	53	96.7 Å²	96.7	23%	0.232	50%	0.503	C	S	.	.	G	3₁₀ helix	trans	-89.6	-2.1	178.6	-60.7	-67.2	0	0	0	112.9	H49 D51 P52 R167	H49-F54 HydrophobicContact CB-CD2 4.13Å; H49-F54 HydrophobicContact CB-CE2 4.21Å; H49-F54 AromaticContact CG-CE2 3.84Å; H49-F54 AromaticContact ND1-CD2 3.99Å; H49-F54 AromaticContact ND1-CE2 3.7Å; D51-F54 HydrophobicContact CB-CD2 3.9Å; D51-F54 HydrophobicContact CB-CE2 3.96Å; D51-F54 WeakPolarHBondContact O-CD2 3.32Å; D51-F54 PolarHBondContact O-N 2.89Å; D51-F54 VanDerWaalsContact O-N 3.16Å; P52-F54 PolarHBondContact O-N 2.84Å; P52-F54 VanDerWaalsContact O-N 3.12Å; F54-R167 PolarHBondContact O-NE 3.21Å
55	D	95.3	Very high	93.2	Very high	48 Å²	48	95.6 Å²	95.6	26%	0.257	49%	0.492	S	S	.	.	S	Bend	trans	-91.3	147.2	-179.8	-62.3	-20.9	0	0	0	111	P52 R167	P52-D55 WeakPolarHBondContact O-CB 3.43Å; P52-D55 PolarHBondContact O-N 2.86Å; D55-R167 IonicContact OD1-CZ 3.38Å; D55-R167 VanDerWaalsContact OD1-CZ 3.23Å; D55-R167 IonicContact OD1-NE 3.4Å; D55-R167 PolarHBondContact OD1-NE 3.2Å; D55-R167 IonicContact OD1-NH2 2.68Å; D55-R167 PolarHBondContact OD1-NH2 3.47Å
56	P	96.2	Very high	93.8	Very high	15 Å²	15	91.5 Å²	91.5	10%	0.097	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-65.8	144.7	173.1	27.4	-32.3	0	0	0	110.4	D60 L61 S166 W205 W217	P56-D60 HydrophobicContact CB-CB 4.19Å; P56-L61 HydrophobicContact CB-CD2 4.28Å; P56-L61 HydrophobicContact CB-CG 4.35Å; P56-L61 HydrophobicContact CG-CD2 4.06Å; P56-L61 HydrophobicContact CG-CG 4.46Å; P56-S166 VanDerWaalsContact CG-O 3.23Å; P56-S166 WeakPolarHBondContact CG-O 3.39Å; P56-W205 HydrophobicContact CB-CD2 3.84Å; P56-W205 HydrophobicContact CB-CE3 4.27Å; P56-W205 HydrophobicContact CB-CG 4.07Å; P56-W205 HydrophobicContact CB-CZ2 4.22Å; P56-W205 HydrophobicContact CG-CG 4.26Å; P56-W217 HydrophobicContact CB-CZ2 3.9Å; P56-W217 HydrophobicContact CG-CH2 4.14Å; P56-W217 HydrophobicContact CG-CZ2 3.85Å
57	K	94.7	Very high	94.2	Very high	141 Å²	141	90.1 Å²	90.1	61%	0.613	46%	0.457	S	S	*	.	P	Polyproline II helix	trans	-87.3	166.5	174.8	-61.7	177.7	-179.2	-176.9	0	109.7	K59 D60	K57-K59 HydrophobicContact CB-CG 4.17Å; K57-K59 PolarHBondContact O-N 2.98Å; K57-D60 PolarHBondContact N-OD2 3.38Å; K57-D60 WeakPolarHBondContact O-CA 3.48Å; K57-D60 WeakPolarHBondContact O-CB 3.08Å; K57-D60 PolarHBondContact O-N 3.5Å
58	E	94.4	Very high	94.4	Very high	179 Å²	179	85.8 Å²	85.8	84%	0.836	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-53	-40.6	179.6	-172.3	177.3	-176	0	0	113.3	D60 L61	E58-D60 PolarHBondContact O-N 3.37Å; E58-D60 VanDerWaalsContact O-N 3.16Å; E58-L61 PolarHBondContact O-N 3.05Å
59	K	94.4	Very high	94.7	Very high	162 Å²	162	87.1 Å²	87.1	70%	0.704	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-60.6	-24.2	175.7	66.4	176.2	-172.9	171.2	0	114.3	K57	K57-K59 HydrophobicContact CB-CG 4.17Å; K57-K59 PolarHBondContact O-N 2.98Å
60	D	94.4	Very high	95	Very high	49 Å²	49	82.1 Å²	82.1	26%	0.262	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-92.2	-0.9	-178.6	-53.9	-57.3	0	0	0	111.7	P56 K57 E58 W205 W217	P56-D60 HydrophobicContact CB-CB 4.19Å; K57-D60 PolarHBondContact N-OD2 3.38Å; K57-D60 WeakPolarHBondContact O-CA 3.48Å; K57-D60 WeakPolarHBondContact O-CB 3.08Å; K57-D60 PolarHBondContact O-N 3.5Å; E58-D60 PolarHBondContact O-N 3.37Å; E58-D60 VanDerWaalsContact O-N 3.16Å; D60-W205 HydrophobicContact CB-CH2 3.75Å; D60-W205 HydrophobicContact CB-CZ2 4.39Å; D60-W205 HydrophobicContact CB-CZ3 4.07Å; D60-W217 PolarHBondContact O-NE1 2.92Å
61	L	95.1	Very high	95.1	Very high	75 Å²	75	78.4 Å²	78.4	39%	0.393	41%	0.411	S	S	.	.			trans	-109.5	30.4	-174.6	-68.8	171	0	0	0	113.5	P56 E58 E63 W217	P56-L61 HydrophobicContact CB-CD2 4.28Å; P56-L61 HydrophobicContact CB-CG 4.35Å; P56-L61 HydrophobicContact CG-CD2 4.06Å; P56-L61 HydrophobicContact CG-CG 4.46Å; E58-L61 PolarHBondContact O-N 3.05Å; L61-E63 PolarHBondContact O-N 3.29Å; L61-E63 VanDerWaalsContact O-N 3.11Å; L61-W217 HydrophobicContact CD2-CH2 4.46Å; L61-W217 HydrophobicContact CD2-CZ2 3.76Å
62	N	95.5	Very high	95.2	Very high	79 Å²	79	79.8 Å²	79.8	42%	0.422	44%	0.439	S	S	.	.			trans	-71.3	105.3	176.3	-176	-36.5	0	0	0	111.1	T64 L65 L66	N62-T64 VanDerWaalsContact C-N 3.28Å; N62-T64 PolarHBondContact O-N 2.91Å; N62-T64 WeakPolarHBondContact OD1-CB 3.35Å; N62-T64 PolarHBondContact OD1-N 2.64Å; N62-T64 VanDerWaalsContact OD1-N 3.1Å; N62-L65 HydrophobicContact CB-CB 4.27Å; N62-L65 HydrophobicContact CB-CD1 4.05Å; N62-L65 HydrophobicContact CB-CG 4.24Å; N62-L65 PolarHBondContact O-N 3.31Å; N62-L65 VanDerWaalsContact O-N 3.12Å; N62-L65 PolarHBondContact OD1-N 2.97Å; N62-L66 WeakPolarHBondContact O-CG 3.37Å; N62-L66 PolarHBondContact O-N 3.22Å
63	E	94.9	Very high	95.4	Very high	83 Å²	83	80.8 Å²	80.8	39%	0.388	44%	0.435	S	S	.	.	H	α-helix	trans	-53.8	-39.8	-176.9	-76.2	-154.1	-167.5	0	0	113.9	L61 L65 L66 R67 T81	L61-E63 PolarHBondContact O-N 3.29Å; L61-E63 VanDerWaalsContact O-N 3.11Å; E63-L65 VanDerWaalsContact C-N 3.34Å; E63-L65 PolarHBondContact O-N 3.36Å; E63-L66 PolarHBondContact O-N 3.38Å; E63-R67 VanDerWaalsContact O-CB 3.29Å; E63-R67 WeakPolarHBondContact O-CB 2.99Å; E63-R67 VanDerWaalsContact O-CG 3.25Å; E63-R67 WeakPolarHBondContact O-CG 3.33Å; E63-R67 PolarHBondContact O-N 3.26Å; E63-R67 IonicContact OE2-CZ 3.62Å; E63-R67 IonicContact OE2-NE 3.36Å; E63-R67 PolarHBondContact OE2-NE 3.4Å; E63-R67 IonicContact OE2-NH2 2.96Å; E63-R67 PolarHBondContact OE2-NH2 2.73Å; E63-T81 PolarHBondContact OE1-OG1 2.96Å
64	T	95.6	Very high	95.6	Very high	109 Å²	109	79.6 Å²	79.6	67%	0.669	43%	0.426	S	S	*	.	H	α-helix	trans	-63	-44	-178.8	-54.9	0	0	0	0	110.9	N62 S68	N62-T64 VanDerWaalsContact C-N 3.28Å; N62-T64 PolarHBondContact O-N 2.91Å; N62-T64 WeakPolarHBondContact OD1-CB 3.35Å; N62-T64 PolarHBondContact OD1-N 2.64Å; N62-T64 VanDerWaalsContact OD1-N 3.1Å; T64-S68 WeakPolarHBondContact O-CB 3.23Å; T64-S68 PolarHBondContact O-N 2.92Å
65	L	96.1	Very high	95.7	Very high	110 Å²	110	80.1 Å²	80.1	58%	0.576	43%	0.431	S	S	*	.	H	α-helix	trans	-66.8	-43.1	176.9	-67.4	178.9	0	0	0	111.1	N62 E63 S68 L69	N62-L65 HydrophobicContact CB-CB 4.27Å; N62-L65 HydrophobicContact CB-CD1 4.05Å; N62-L65 HydrophobicContact CB-CG 4.24Å; N62-L65 PolarHBondContact O-N 3.31Å; N62-L65 VanDerWaalsContact O-N 3.12Å; N62-L65 PolarHBondContact OD1-N 2.97Å; E63-L65 VanDerWaalsContact C-N 3.34Å; E63-L65 PolarHBondContact O-N 3.36Å; L65-S68 PolarHBondContact O-N 2.85Å; L65-S68 PolarHBondContact O-OG 3.05Å; L65-L69 WeakPolarHBondContact O-CB 3.39Å; L65-L69 PolarHBondContact O-N 3.06Å
66	L	97.3	Very high	95.6	Very high	6 Å²	6	82.5 Å²	82.5	3%	0.031	45%	0.449	C	S	.	.	H	α-helix	trans	-68.6	-39.3	-179.2	-61.6	177.1	0	0	0	112.5	N62 E63 S68 L69 L70 W169 L203 W217	N62-L66 WeakPolarHBondContact O-CG 3.37Å; N62-L66 PolarHBondContact O-N 3.22Å; E63-L66 PolarHBondContact O-N 3.38Å; L66-S68 VanDerWaalsContact C-N 3.32Å; L66-S68 PolarHBondContact O-N 2.96Å; L66-L69 PolarHBondContact O-N 2.03Å; L66-L70 WeakPolarHBondContact O-CB 3.45Å; L66-L70 PolarHBondContact O-N 3.22Å; L66-W169 VanDerWaalsContact C-CH2 3.46Å; L66-W169 VanDerWaalsContact C-CZ3 3.42Å; L66-W169 HydrophobicContact CB-CD2 3.51Å; L66-W169 VanDerWaalsContact CB-CE2 3.45Å; L66-W169 HydrophobicContact CB-CE3 3.66Å; L66-W169 HydrophobicContact CB-CG 4.19Å; L66-W169 HydrophobicContact CB-CH2 3.81Å; L66-W169 HydrophobicContact CB-CZ2 3.62Å; L66-W169 HydrophobicContact CB-CZ3 3.8Å; L66-W169 HydrophobicContact CD1-CB 4.33Å; L66-W169 HydrophobicContact CD1-CD2 3.83Å; L66-W169 HydrophobicContact CD1-CG 3.59Å; L66-W169 HydrophobicContact CG-CD2 4.23Å; L66-W169 HydrophobicContact CG-CG 4.42Å; L66-W169 WeakPolarHBondContact O-CZ3 3.46Å; L66-L203 HydrophobicContact CB-CD1 4.13Å; L66-L203 HydrophobicContact CD2-CD1 3.93Å; L66-W217 HydrophobicContact CD2-CB 4.31Å; L66-W217 HydrophobicContact CD2-CD2 4.01Å; L66-W217 HydrophobicContact CD2-CG 3.62Å
67	R	96.3	Very high	95.6	Very high	87 Å²	87	83.3 Å²	83.3	33%	0.328	46%	0.46	S	S	.	.	H	α-helix	trans	-59	-45.2	170.1	-75.5	176.2	-169.8	-78.4	-3.6	110.7	E63 L69 L70 G71 Y74 W169	E63-R67 VanDerWaalsContact O-CB 3.29Å; E63-R67 WeakPolarHBondContact O-CB 2.99Å; E63-R67 VanDerWaalsContact O-CG 3.25Å; E63-R67 WeakPolarHBondContact O-CG 3.33Å; E63-R67 PolarHBondContact O-N 3.26Å; E63-R67 IonicContact OE2-CZ 3.62Å; E63-R67 IonicContact OE2-NE 3.36Å; E63-R67 PolarHBondContact OE2-NE 3.4Å; E63-R67 IonicContact OE2-NH2 2.96Å; E63-R67 PolarHBondContact OE2-NH2 2.73Å; R67-L69 VanDerWaalsContact C-N 3.34Å; R67-L69 PolarHBondContact O-N 3.02Å; R67-L70 PolarHBondContact O-N 3.43Å; R67-G71 PolarHBondContact O-N 2.89Å; R67-Y74 PolarHBondContact NH1-OH 2.94Å; R67-W169 HydrophobicContact CB-CH2 4.07Å; R67-W169 HydrophobicContact CG-CH2 3.42Å; R67-W169 VanDerWaalsContact CG-CH2 3.42Å; R67-W169 HydrophobicContact CG-CZ2 3.85Å
68	S	96.4	Very high	95.6	Very high	82 Å²	82	79.1 Å²	79.1	57%	0.573	44%	0.442	S	S	*	.	H	α-helix	trans	-65.7	-37	178.1	78	0	0	0	0	112.7	T64 L65 L66 G71	T64-S68 WeakPolarHBondContact O-CB 3.23Å; T64-S68 PolarHBondContact O-N 2.92Å; L65-S68 PolarHBondContact O-N 2.85Å; L65-S68 PolarHBondContact O-OG 3.05Å; L66-S68 VanDerWaalsContact C-N 3.32Å; L66-S68 PolarHBondContact O-N 2.96Å; S68-G71 PolarHBondContact O-N 3.49Å
69	L	96.5	Very high	95.7	Very high	93 Å²	93	70.7 Å²	70.7	49%	0.487	40%	0.403	S	S	.	.	H	α-helix	trans	-69.1	-38.4	178.3	179.9	59.8	0	0	0	111.9	L65 L66 R67 G71 L203 W217	L65-L69 WeakPolarHBondContact O-CB 3.39Å; L65-L69 PolarHBondContact O-N 3.06Å; L66-L69 PolarHBondContact O-N 2.03Å; R67-L69 VanDerWaalsContact C-N 3.34Å; R67-L69 PolarHBondContact O-N 3.02Å; L69-G71 VanDerWaalsContact C-N 3.33Å; L69-L203 HydrophobicContact CB-CD1 4.34Å; L69-L203 HydrophobicContact CD2-CD1 3.97Å; L69-L203 HydrophobicContact CD2-CD2 4.2Å; L69-L203 HydrophobicContact CG-CD1 4.24Å; L69-L203 HydrophobicContact CG-CD2 4.11Å; L69-W217 HydrophobicContact CD2-CB 3.67Å
70	L	96.3	Very high	95.7	Very high	4 Å²	4	63.7 Å²	63.7	2%	0.021	38%	0.375	C	S	.	.	H	α-helix	trans	-73.4	-29.4	175	-163.1	69.7	0	0	0	111.8	L66 R67 H73 Y74 M79 W169 T201 L203	L66-L70 WeakPolarHBondContact O-CB 3.45Å; L66-L70 PolarHBondContact O-N 3.22Å; R67-L70 PolarHBondContact O-N 3.43Å; L70-H73 HydrophobicContact CD1-CB 4.31Å; L70-H73 HydrophobicContact CG-CB 4.08Å; L70-H73 WeakPolarHBondContact O-CB 3.37Å; L70-H73 PolarHBondContact O-CD2 3.33Å; L70-H73 PolarHBondContact O-N 2.87Å; L70-Y74 HydrophobicContact CD2-CD2 3.93Å; L70-Y74 HydrophobicContact CD2-CG 4.42Å; L70-M79 HydrophobicContact CD2-SD 4.01Å; L70-W169 HydrophobicContact CB-CZ3 4Å; L70-W169 HydrophobicContact CD2-CZ3 3.93Å; L70-T201 HydrophobicContact CD1-CG2 4.27Å; L70-T201 VanDerWaalsContact CD1-O 3.3Å; L70-T201 WeakPolarHBondContact CD1-O 3.4Å; L70-L203 HydrophobicContact CB-CG 4.45Å; L70-L203 HydrophobicContact CD1-CD2 3.79Å; L70-L203 HydrophobicContact CD1-CG 3.87Å
71	G	95	Very high	95.7	Very high	39 Å²	39	63.1 Å²	63.1	40%	0.402	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	60.2	-135.6	175.1	0	0	0	0	0	112.3	R67 S68 L69 H73 Y74	R67-G71 PolarHBondContact O-N 2.89Å; S68-G71 PolarHBondContact O-N 3.49Å; L69-G71 VanDerWaalsContact C-N 3.33Å; G71-H73 PolarHBondContact O-N 2.99Å; G71-H73 VanDerWaalsContact O-N 3.1Å; G71-Y74 PolarHBondContact O-N 3.22Å
72	G	95.4	Very high	95.5	Very high	88 Å²	88	63 Å²	63	91%	0.907	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-69.7	-0.4	-179.1	0	0	0	0	0	115.3	Y74	G72-Y74 VanDerWaalsContact C-N 3.35Å
73	H	97.2	Very high	94.9	Very high	113 Å²	113	63 Å²	63	52%	0.523	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-84.2	-9.7	177	-66	-67.9	0	0	0	113.9	L70 G71 D75 M79 T201	L70-H73 HydrophobicContact CD1-CB 4.31Å; L70-H73 HydrophobicContact CG-CB 4.08Å; L70-H73 WeakPolarHBondContact O-CB 3.37Å; L70-H73 PolarHBondContact O-CD2 3.33Å; L70-H73 PolarHBondContact O-N 2.87Å; G71-H73 PolarHBondContact O-N 2.99Å; G71-H73 VanDerWaalsContact O-N 3.1Å; H73-D75 PolarHBondContact O-N 3.49Å; H73-M79 WeakPolarHBondContact O-CE 3.45Å; H73-T201 HydrophobicContact CB-CG2 4.17Å
74	Y	96.4	Very high	94.1	Very high	56 Å²	56	60.9 Å²	60.9	22%	0.22	38%	0.377	C	S	.	.			trans	-68.9	115.9	175.7	-172.3	-89.1	0	0	0	110.5	R67 L70 G71 G72 P76 M79 W169 P170	R67-Y74 PolarHBondContact NH1-OH 2.94Å; L70-Y74 HydrophobicContact CD2-CD2 3.93Å; L70-Y74 HydrophobicContact CD2-CG 4.42Å; G71-Y74 PolarHBondContact O-N 3.22Å; G72-Y74 VanDerWaalsContact C-N 3.35Å; Y74-P76 HydrophobicContact CE1-CB 4.06Å; Y74-M79 HydrophobicContact CD2-SD 4.5Å; Y74-M79 HydrophobicContact CE2-CB 4.43Å; Y74-W169 HydrophobicContact CD2-CH2 4.34Å; Y74-W169 HydrophobicContact CE2-CH2 4.45Å; Y74-P170 HydrophobicContact CD2-CG 3.89Å; Y74-P170 HydrophobicContact CE2-CG 3.56Å
75	D	95.8	Very high	92.6	Very high	65 Å²	65	64.8 Å²	64.8	35%	0.348	39%	0.388	S	S	.	.			trans	-112.9	107.4	175.4	-175.2	-16.5	0	0	0	110.3	H73 G77 F78 M79	H73-D75 PolarHBondContact O-N 3.49Å; D75-G77 PolarHBondContact O-N 3.36Å; D75-G77 WeakPolarHBondContact OD1-CA 3.29Å; D75-G77 PolarHBondContact OD1-N 3.36Å; D75-F78 HydrophobicContact CB-CB 4.42Å; D75-F78 CarbonylContact O-C 3.59Å; D75-F78 PolarHBondContact O-N 2.99Å; D75-F78 VanDerWaalsContact O-N 3.09Å; D75-F78 WeakPolarHBondContact OD2-CD2 3.39Å; D75-M79 VanDerWaalsContact O-CB 3.31Å; D75-M79 WeakPolarHBondContact O-CB 3.36Å; D75-M79 PolarHBondContact O-N 3.41Å
76	P	94.4	Very high	90.5	Very high	97 Å²	97	64.8 Å²	64.8	63%	0.63	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-18.8	179.8	27.3	-34.1	0	0	0	113.7	Y74 F78	Y74-P76 HydrophobicContact CE1-CB 4.06Å; P76-F78 VanDerWaalsContact C-N 3.31Å
77	G	94.7	Very high	87.9	Confident	32 Å²	32	73.3 Å²	73.3	33%	0.33	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-25.1	174.9	0	0	0	0	0	113.1	D75 K174	D75-G77 PolarHBondContact O-N 3.36Å; D75-G77 WeakPolarHBondContact OD1-CA 3.29Å; D75-G77 PolarHBondContact OD1-N 3.36Å; G77-K174 WeakPolarHBondContact O-CD 3.36Å; G77-K174 WeakPolarHBondContact O-CE 3.5Å; G77-K174 PolarHBondContact O-NZ 2.81Å
78	F	95.7	Very high	85.1	Confident	53 Å²	53	75.2 Å²	75.2	23%	0.232	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.2	-6.1	-173.9	-76	-91.7	0	0	0	114.8	D75 P76 Y159 V173 K174 L200 I224	D75-F78 HydrophobicContact CB-CB 4.42Å; D75-F78 CarbonylContact O-C 3.59Å; D75-F78 PolarHBondContact O-N 2.99Å; D75-F78 VanDerWaalsContact O-N 3.09Å; D75-F78 WeakPolarHBondContact OD2-CD2 3.39Å; P76-F78 VanDerWaalsContact C-N 3.31Å; F78-Y159 HydrophobicContact CE1-CD1 4.23Å; F78-Y159 AromaticContact CE1-CE1 3.69Å; F78-Y159 HydrophobicContact CE1-CE1 3.69Å; F78-Y159 HydrophobicContact CZ-CE1 4.26Å; F78-V173 CarbonylContact O-C 3.58Å; F78-V173 VanDerWaalsContact O-CA 3.26Å; F78-V173 WeakPolarHBondContact O-CA 3.36Å; F78-K174 HydrophobicContact CD1-CB 4.01Å; F78-K174 WeakPolarHBondContact CD1-O 3.26Å; F78-K174 PolarHBondContact O-N 2.79Å; F78-L200 HydrophobicContact CB-CD1 4.08Å; F78-L200 HydrophobicContact CB-CD2 3.98Å; F78-L200 HydrophobicContact CG-CD2 4.36Å; F78-I224 HydrophobicContact CD1-CD1 3.57Å; F78-I224 HydrophobicContact CE1-CD1 3.63Å
79	M	96.6	Very high	81.9	Confident	3 Å²	3	74.4 Å²	74.4	2%	0.015	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	139.3	-175.7	-54.6	178.9	-177.5	0	0	111.8	L70 H73 Y74 D75 P170 Y172 L200 T201 V202	L70-M79 HydrophobicContact CD2-SD 4.01Å; H73-M79 WeakPolarHBondContact O-CE 3.45Å; Y74-M79 HydrophobicContact CD2-SD 4.5Å; Y74-M79 HydrophobicContact CE2-CB 4.43Å; D75-M79 VanDerWaalsContact O-CB 3.31Å; D75-M79 WeakPolarHBondContact O-CB 3.36Å; D75-M79 PolarHBondContact O-N 3.41Å; M79-P170 HydrophobicContact CB-CB 4.28Å; M79-P170 HydrophobicContact CB-CG 4Å; M79-P170 HydrophobicContact SD-CG 4.37Å; M79-Y172 WeakPolarHBondContact CA-O 3.27Å; M79-L200 HydrophobicContact CE-CB 3.83Å; M79-L200 HydrophobicContact CE-CD1 4.47Å; M79-L200 HydrophobicContact CE-CD2 4.17Å; M79-L200 HydrophobicContact CE-CG 4.37Å; M79-T201 WeakPolarHBondContact CE-O 3.48Å; M79-V202 HydrophobicContact CE-CG1 4.05Å
80	A	95.2	Very high	78.7	Confident	15 Å²	15	73 Å²	73	12%	0.124	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	146.1	176.4	0	0	0	0	0	111.9	S82 W161 P170 Y172	A80-S82 WeakPolarHBondContact CB-O 3.33Å; A80-W161 HydrophobicContact CB-CH2 3.83Å; A80-W161 HydrophobicContact CB-CZ3 3.77Å; A80-P170 VanDerWaalsContact O-CB 3.25Å; A80-P170 WeakPolarHBondContact O-CB 3.49Å; A80-Y172 PolarHBondContact N-O 2.99Å; A80-Y172 PolarHBondContact O-N 3.09Å
81	T	93.4	Very high	75.3	Confident	36 Å²	36	75.5 Å²	75.5	22%	0.221	48%	0.483	C	S	.	.	S	Bend	trans	-84.1	-38.8	176	52.8	0	0	0	0	111.7	E63 W169 P170 Y172	E63-T81 PolarHBondContact OE1-OG1 2.96Å; T81-W169 HydrophobicContact CG2-CZ2 3.93Å; T81-P170 HydrophobicContact CG2-CB 4.2Å; T81-Y172 WeakPolarHBondContact O-CD2 3.19Å; T81-Y172 WeakPolarHBondContact O-CE2 3.33Å
82	S	90.4	Very high	72	Confident	73 Å²	73	77 Å²	77	51%	0.51	50%	0.498	S	S	.	.	S	Bend	trans	-97.8	157.8	171.8	55.6	0	0	0	0	111.5	A80 P84 Y172	A80-S82 WeakPolarHBondContact CB-O 3.33Å; S82-P84 WeakPolarHBondContact O-CD 3.48Å; S82-Y172 WeakPolarHBondContact O-CD2 3.47Å
83	P	84.3	Confident	68.8	Low	78 Å²	78	75.7 Å²	75.7	51%	0.506	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-55.1	124.5	168	-12.1	20.4	0	0	0	108.5	Y172	P83-Y172 HydrophobicContact CB-CE1 4.17Å; P83-Y172 HydrophobicContact CB-CE2 4.48Å; P83-Y172 HydrophobicContact CG-CE1 4.12Å; P83-Y172 HydrophobicContact CG-CE2 3.97Å; P83-Y172 WeakPolarHBondContact CG-OH 3.48Å; P83-Y172 VanDerWaalsContact N-CE2 3.32Å
84	P	77.9	Confident	65.9	Low	40 Å²	40	76 Å²	76	26%	0.26	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-69.4	135.3	178.4	18.3	-19.7	0	0	0	109.9	S82 D86 W161	S82-P84 WeakPolarHBondContact O-CD 3.48Å; P84-D86 PolarHBondContact O-N 3.24Å; P84-W161 HydrophobicContact CB-CD2 4.19Å; P84-W161 HydrophobicContact CB-CG 4.4Å; P84-W161 HydrophobicContact CB-CZ2 3.92Å; P84-W161 HydrophobicContact CG-CB 3.93Å; P84-W161 HydrophobicContact CG-CD2 3.14Å; P84-W161 HydrophobicContact CG-CE3 3.72Å; P84-W161 HydrophobicContact CG-CG 3.23Å; P84-W161 HydrophobicContact CG-CH2 4.24Å; P84-W161 HydrophobicContact CG-CZ2 3.73Å; P84-W161 HydrophobicContact CG-CZ3 4.23Å; P84-W161 VanDerWaalsContact CG-NE1 3.28Å
85	E	62.7	Low	62.9	Low	191 Å²	191	77.6 Å²	77.6	89%	0.893	53%	0.531	S	S	*	.			trans	-77.1	52.3	177.8	-65	-174.5	136.1	0	0	111.6	R87	E85-R87 VanDerWaalsContact C-N 3.31Å; E85-R87 PolarHBondContact O-N 2.9Å
86	D	53.6	Low	60.4	Low	110 Å²	110	76.2 Å²	76.2	59%	0.588	53%	0.533	S	S	*	.			trans	-93.7	68.9	169.3	-73.4	-38.4	0	0	0	109.2	P84 W161	P84-D86 PolarHBondContact O-N 3.24Å; D86-W161 PolarHBondContact OD2-NE1 2.63Å
87	R	41.8	Very low	59	Low	185 Å²	185	73.4 Å²	73.4	70%	0.698	52%	0.522	S	S	*	.			trans	-111.3	78.2	156.1	-80.5	-172.1	174.1	167.7	2.9	110.9	E85 G89	E85-R87 VanDerWaalsContact C-N 3.31Å; E85-R87 PolarHBondContact O-N 2.9Å; R87-G89 VanDerWaalsContact C-N 3.31Å; R87-G89 PolarHBondContact O-N 3.4Å
88	P	37	Very low	57.9	Low	126 Å²	126	75.4 Å²	75.4	82%	0.818	54%	0.535	S	S	*	.	S	Bend	trans	-87.7	77.6	145.9	10	9.1	0	0	0	107.9
89	G	30.3	Very low	57	Low	65 Å²	65	80.2 Å²	80.2	67%	0.67	56%	0.558	S	S	*	*	S	Bend	trans	121	123.1	174.8	0	0	0	0	0	114.5	R87	R87-G89 VanDerWaalsContact C-N 3.31Å; R87-G89 PolarHBondContact O-N 3.4Å
90	G	27.8	Very low	56.6	Low	63 Å²	63	84.8 Å²	84.8	65%	0.649	58%	0.583	S	S	*	*			trans	92.6	69.6	160.6	0	0	0	0	0	116.9
91	G	26.5	Very low	56.4	Low	58 Å²	58	88.1 Å²	88.1	60%	0.598	60%	0.598	S	S	*	*			trans	-66	128.8	151.5	0	0	0	0	0	110.3
92	G	26	Very low	56.3	Low	69 Å²	69	88.2 Å²	88.2	71%	0.711	60%	0.603	S	S	*	*	S	Bend	trans	80.5	117.4	156.5	0	0	0	0	0	116.6
93	G	26.9	Very low	56.5	Low	62 Å²	62	90.4 Å²	90.4	64%	0.639	61%	0.605	S	S	*	*			trans	104.3	120.5	157.3	0	0	0	0	0	114	A95	G93-A95 PolarHBondContact O-N 3.13Å
94	A	35.9	Very low	56.9	Low	120 Å²	120	90.4 Å²	90.4	99%	0.992	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	17.1	176.3	0	0	0	0	0	115.6
95	A	35.2	Very low	57.7	Low	88 Å²	88	88.5 Å²	88.5	73%	0.727	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.9	-30.4	-175.2	0	0	0	0	0	113.8	G93	G93-A95 PolarHBondContact O-N 3.13Å
96	G	42.7	Very low	59.2	Low	36 Å²	36	85.4 Å²	85.4	37%	0.371	57%	0.573	S	S	.	*	S	Bend	trans	-86.3	-20.5	-178.6	0	0	0	0	0	115.2	A98 D100	G96-A98 VanDerWaalsContact C-N 3.33Å; G96-A98 PolarHBondContact O-N 3.08Å; G96-D100 VanDerWaalsContact O-CG 3.3Å
97	G	64.2	Low	61.2	Low	39 Å²	39	85 Å²	85	40%	0.402	57%	0.571	S	S	.	*	H	α-helix	trans	-71.4	-19.7	-168.2	0	0	0	0	0	115.7	L101	G97-L101 WeakPolarHBondContact O-CB 3.44Å; G97-L101 WeakPolarHBondContact O-CD1 3.33Å; G97-L101 WeakPolarHBondContact O-CG 3.41Å; G97-L101 PolarHBondContact O-N 3.38Å
98	A	71.4	Confident	63.8	Low	74 Å²	74	79.5 Å²	79.5	61%	0.612	56%	0.555	S	S	*	*	H	α-helix	trans	-80.9	-41.1	-175.7	0	0	0	0	0	112.8	G96 A102	G96-A98 VanDerWaalsContact C-N 3.33Å; G96-A98 PolarHBondContact O-N 3.08Å; A98-A102 PolarHBondContact O-N 2.91Å; A98-A102 VanDerWaalsContact O-N 3.16Å
99	E	77.9	Confident	66.6	Low	154 Å²	154	73.8 Å²	73.8	72%	0.72	52%	0.517	S	S	*	.	H	α-helix	trans	-69.4	-43.5	178.3	-63.6	-170.5	120.1	0	0	110.4	L101 A102 E103	E99-L101 VanDerWaalsContact C-N 3.28Å; E99-L101 PolarHBondContact O-N 3.44Å; E99-A102 WeakPolarHBondContact O-CB 3Å; E99-A102 PolarHBondContact O-N 3.13Å; E99-E103 PolarHBondContact O-N 3.17Å
100	D	87.6	Confident	69.7	Low	99 Å²	99	76.6 Å²	76.6	53%	0.529	51%	0.512	S	S	.	.	H	α-helix	trans	-57.3	-40.7	175.6	-65.7	-16.3	0	0	0	112.1	G96 L104	G96-D100 VanDerWaalsContact O-CG 3.3Å; D100-L104 VanDerWaalsContact O-CB 3.29Å; D100-L104 WeakPolarHBondContact O-CB 3.45Å; D100-L104 PolarHBondContact O-N 2.94Å
101	L	89.9	Confident	72.8	Confident	84 Å²	84	84 Å²	84	44%	0.44	52%	0.521	S	S	.	.	H	α-helix	trans	-69.5	-35	176.8	-74.2	173.4	0	0	0	112.7	G97 E99 D105 L158 F179	G97-L101 WeakPolarHBondContact O-CB 3.44Å; G97-L101 WeakPolarHBondContact O-CD1 3.33Å; G97-L101 WeakPolarHBondContact O-CG 3.41Å; G97-L101 PolarHBondContact O-N 3.38Å; E99-L101 VanDerWaalsContact C-N 3.28Å; E99-L101 PolarHBondContact O-N 3.44Å; L101-D105 WeakPolarHBondContact O-CB 3.02Å; L101-D105 PolarHBondContact O-N 3.27Å; L101-L158 HydrophobicContact CD2-CD1 4.18Å; L101-F179 HydrophobicContact CB-CE2 4.48Å
102	A	92.8	Very high	76	Confident	39 Å²	39	82.2 Å²	82.2	32%	0.322	50%	0.499	S	S	.	.	H	α-helix	trans	-69.6	-41.3	176.7	0	0	0	0	0	111.4	A98 E99 D105 Q106 F179	A98-A102 PolarHBondContact O-N 2.91Å; A98-A102 VanDerWaalsContact O-N 3.16Å; E99-A102 WeakPolarHBondContact O-CB 3Å; E99-A102 PolarHBondContact O-N 3.13Å; A102-D105 PolarHBondContact O-N 2.9Å; A102-Q106 PolarHBondContact O-N 3.4Å; A102-F179 HydrophobicContact CB-CE2 4.34Å; A102-F179 HydrophobicContact CB-CZ 3.84Å
103	E	93.4	Very high	79.1	Confident	119 Å²	119	83.1 Å²	83.1	56%	0.556	49%	0.494	S	S	*	.	H	α-helix	trans	-62.8	-45.4	173.4	-174	177.3	170	0	0	110.9	E99 D105 Q106 L107	E99-E103 PolarHBondContact O-N 3.17Å; E103-D105 PolarHBondContact O-N 3.19Å; E103-Q106 PolarHBondContact O-N 3.37Å; E103-L107 HydrophobicContact CG-CD1 4.19Å; E103-L107 HydrophobicContact CG-CG 4.47Å; E103-L107 WeakPolarHBondContact O-CG 3.33Å; E103-L107 PolarHBondContact O-N 2.85Å
104	L	92.9	Very high	82.2	Confident	77 Å²	77	83.4 Å²	83.4	40%	0.403	50%	0.497	S	S	.	.	H	α-helix	trans	-60.6	-44.8	176.4	-178	61.5	0	0	0	112.3	D100 Q106 L107 L108 L158	D100-L104 VanDerWaalsContact O-CB 3.29Å; D100-L104 WeakPolarHBondContact O-CB 3.45Å; D100-L104 PolarHBondContact O-N 2.94Å; L104-Q106 VanDerWaalsContact C-N 3.32Å; L104-Q106 PolarHBondContact O-N 3.46Å; L104-L107 PolarHBondContact O-N 2.77Å; L104-L108 HydrophobicContact CD1-CD1 4.2Å; L104-L108 HydrophobicContact CD1-CG 4.25Å; L104-L108 HydrophobicContact CG-CD1 4.1Å; L104-L108 WeakPolarHBondContact O-CB 3.43Å; L104-L108 VanDerWaalsContact O-CG 3.3Å; L104-L108 WeakPolarHBondContact O-CG 3.4Å; L104-L108 PolarHBondContact O-N 2.03Å; L104-L158 HydrophobicContact CD2-CD2 4.22Å; L104-L158 HydrophobicContact CG-CD2 4.25Å
105	D	95	Very high	85	Confident	1 Å²	1	82 Å²	82	1%	0.005	49%	0.486	C	S	.	.	H	α-helix	trans	-56.9	-46.3	173.5	171.5	77.4	0	0	0	111	L101 A102 E103 L107 L108 R109 P156 F179 R182	L101-D105 WeakPolarHBondContact O-CB 3.02Å; L101-D105 PolarHBondContact O-N 3.27Å; A102-D105 PolarHBondContact O-N 2.9Å; E103-D105 PolarHBondContact O-N 3.19Å; D105-L107 PolarHBondContact O-N 3.14Å; D105-L108 PolarHBondContact O-N 2.86Å; D105-R109 WeakPolarHBondContact O-CB 3.02Å; D105-R109 WeakPolarHBondContact O-CG 3.25Å; D105-R109 PolarHBondContact O-N 2.84Å; D105-R109 IonicContact OD1-CZ 2.79Å; D105-R109 IonicContact OD1-NE 2.65Å; D105-R109 PolarHBondContact OD1-NE 2.94Å; D105-R109 IonicContact OD1-NH2 3.27Å; D105-R109 PolarHBondContact OD1-NH2 3.48Å; D105-R109 IonicContact OD2-CZ 3.54Å; D105-R109 IonicContact OD2-NE 3.27Å; D105-R109 PolarHBondContact OD2-NE 2.87Å; D105-R109 IonicContact OD2-NH2 3.69Å; D105-R109 PolarHBondContact OD2-NH2 2.88Å; D105-P156 WeakPolarHBondContact OD1-CG 3.31Å; D105-F179 HydrophobicContact CB-CB 4.16Å; D105-F179 HydrophobicContact CB-CD1 3.79Å; D105-F179 HydrophobicContact CB-CD2 4.18Å; D105-F179 HydrophobicContact CB-CE1 4.17Å; D105-F179 HydrophobicContact CB-CG 3.78Å; D105-F179 WeakPolarHBondContact OD1-CB 3.35Å; D105-F179 WeakPolarHBondContact OD2-CD1 3.45Å; D105-R182 WeakPolarHBondContact OD2-CD 3.2Å
106	Q	94.6	Very high	87.8	Confident	125 Å²	125	79.7 Å²	79.7	58%	0.584	46%	0.46	S	S	*	.	H	α-helix	trans	-62.2	-45.1	178.8	-178	170.9	-11.6	0	0	112.1	A102 E103 L104 R109 Q110	A102-Q106 PolarHBondContact O-N 3.4Å; E103-Q106 PolarHBondContact O-N 3.37Å; L104-Q106 VanDerWaalsContact C-N 3.32Å; L104-Q106 PolarHBondContact O-N 3.46Å; Q106-R109 PolarHBondContact O-N 3.47Å; Q106-Q110 WeakPolarHBondContact O-CG 3.45Å; Q106-Q110 PolarHBondContact O-N 2.92Å; Q106-Q110 VanDerWaalsContact O-N 3.15Å
107	L	95.6	Very high	90.4	Very high	103 Å²	103	80.2 Å²	80.2	54%	0.539	46%	0.457	S	S	.	.	H	α-helix	trans	-61.7	-43.9	178	-72.1	172.6	0	0	0	112	E103 L104 D105 Q110	E103-L107 HydrophobicContact CG-CD1 4.19Å; E103-L107 HydrophobicContact CG-CG 4.47Å; E103-L107 WeakPolarHBondContact O-CG 3.33Å; E103-L107 PolarHBondContact O-N 2.85Å; L104-L107 PolarHBondContact O-N 2.77Å; D105-L107 PolarHBondContact O-N 3.14Å; L107-Q110 PolarHBondContact O-N 3.44Å
108	L	96	Very high	91.9	Very high	69 Å²	69	82.3 Å²	82.3	36%	0.361	47%	0.466	S	S	.	.	H	α-helix	trans	-66.6	-36.5	177.7	-68.8	173.7	0	0	0	111.8	L104 D105 Q110 R111 P156 L158	L104-L108 HydrophobicContact CD1-CD1 4.2Å; L104-L108 HydrophobicContact CD1-CG 4.25Å; L104-L108 HydrophobicContact CG-CD1 4.1Å; L104-L108 WeakPolarHBondContact O-CB 3.43Å; L104-L108 VanDerWaalsContact O-CG 3.3Å; L104-L108 WeakPolarHBondContact O-CG 3.4Å; L104-L108 PolarHBondContact O-N 2.03Å; D105-L108 PolarHBondContact O-N 2.86Å; L108-Q110 VanDerWaalsContact C-N 3.3Å; L108-Q110 PolarHBondContact O-N 2.9Å; L108-R111 CarbonylContact O-C 3.56Å; L108-R111 PolarHBondContact O-N 3.29Å; L108-R111 VanDerWaalsContact O-N 3.12Å; L108-P156 HydrophobicContact CB-CB 3.79Å; L108-P156 HydrophobicContact CB-CG 4.03Å; L108-P156 HydrophobicContact CD1-CB 3.89Å; L108-P156 HydrophobicContact CD1-CG 4.4Å; L108-P156 HydrophobicContact CG-CB 4.49Å; L108-L158 HydrophobicContact CD1-CD2 3.59Å
109	R	96.1	Very high	93	Very high	6 Å²	6	85.4 Å²	85.4	2%	0.023	47%	0.467	C	S	.	.	H	α-helix	trans	-65.6	-27.9	173.6	-75.5	-179.6	-161.4	-110.4	-4.7	113.8	D105 Q106 R111 P112 S151 Q152 F154 P156 R182 C192	D105-R109 WeakPolarHBondContact O-CB 3.02Å; D105-R109 WeakPolarHBondContact O-CG 3.25Å; D105-R109 PolarHBondContact O-N 2.84Å; D105-R109 IonicContact OD1-CZ 2.79Å; D105-R109 IonicContact OD1-NE 2.65Å; D105-R109 PolarHBondContact OD1-NE 2.94Å; D105-R109 IonicContact OD1-NH2 3.27Å; D105-R109 PolarHBondContact OD1-NH2 3.48Å; D105-R109 IonicContact OD2-CZ 3.54Å; D105-R109 IonicContact OD2-NE 3.27Å; D105-R109 PolarHBondContact OD2-NE 2.87Å; D105-R109 IonicContact OD2-NH2 3.69Å; D105-R109 PolarHBondContact OD2-NH2 2.88Å; Q106-R109 PolarHBondContact O-N 3.47Å; R109-R111 PolarHBondContact O-N 3.13Å; R109-P112 VanDerWaalsContact O-CD 3.29Å; R109-P112 WeakPolarHBondContact O-CD 2.99Å; R109-P112 WeakPolarHBondContact O-CG 3.46Å; R109-S151 VanDerWaalsContact C-OG 3.3Å; R109-S151 WeakPolarHBondContact CB-O 3.3Å; R109-S151 WeakPolarHBondContact O-CA 3.35Å; R109-S151 VanDerWaalsContact O-CB 3.31Å; R109-S151 WeakPolarHBondContact O-CB 3.34Å; R109-S151 PolarHBondContact O-OG 2.85Å; R109-Q152 PolarHBondContact NH1-O 2.76Å; R109-Q152 VanDerWaalsContact NH1-O 3.13Å; R109-F154 HydrophobicContact CG-CD1 4.33Å; R109-F154 PolarHBondContact NH1-O 3.02Å; R109-P156 HydrophobicContact CG-CG 4.43Å; R109-R182 VanDerWaalsContact CZ-NH1 3.27Å; R109-C192 PolarHBondContact NH2-SG 3.29Å; R109-C192 VanDerWaalsContact NH2-SG 3.38Å
110	Q	94.8	Very high	93.8	Very high	123 Å²	123	78.8 Å²	78.8	58%	0.575	44%	0.437	S	S	*	.	H	α-helix	trans	-69.5	-18.5	174.1	-64.9	-50.2	-47.2	0	0	112.7	Q106 L107 L108	Q106-Q110 WeakPolarHBondContact O-CG 3.45Å; Q106-Q110 PolarHBondContact O-N 2.92Å; Q106-Q110 VanDerWaalsContact O-N 3.15Å; L107-Q110 PolarHBondContact O-N 3.44Å; L108-Q110 VanDerWaalsContact C-N 3.3Å; L108-Q110 PolarHBondContact O-N 2.9Å
111	R	93.7	Very high	94.1	Very high	219 Å²	219	80.8 Å²	80.8	83%	0.826	44%	0.441	S	S	*	.	S	Bend	trans	-129.4	68.1	176.8	-62	-175.9	179.5	-176.1	1.4	110.9	L108 R109 S113	L108-R111 CarbonylContact O-C 3.56Å; L108-R111 PolarHBondContact O-N 3.29Å; L108-R111 VanDerWaalsContact O-N 3.12Å; R109-R111 PolarHBondContact O-N 3.13Å; R111-S113 PolarHBondContact O-N 2.89Å
112	P	92.8	Very high	94.2	Very high	21 Å²	21	79.3 Å²	79.3	14%	0.136	45%	0.446	C	S	.	.			trans	-55.3	132.1	179.6	-24.3	35.8	0	0	0	111.2	R109 W150 F154	R109-P112 VanDerWaalsContact O-CD 3.29Å; R109-P112 WeakPolarHBondContact O-CD 2.99Å; R109-P112 WeakPolarHBondContact O-CG 3.46Å; P112-W150 HydrophobicContact CB-CD2 3.8Å; P112-W150 HydrophobicContact CB-CE3 4.37Å; P112-W150 HydrophobicContact CB-CG 4.21Å; P112-W150 HydrophobicContact CB-CH2 4.2Å; P112-W150 HydrophobicContact CB-CZ2 3.61Å; P112-W150 HydrophobicContact CG-CD2 3.99Å; P112-W150 HydrophobicContact CG-CE3 4.41Å; P112-W150 HydrophobicContact CG-CG 4.16Å; P112-F154 HydrophobicContact CB-CB 4.16Å; P112-F154 HydrophobicContact CB-CD1 4.02Å; P112-F154 HydrophobicContact CB-CD2 3.85Å; P112-F154 HydrophobicContact CB-CE1 4.36Å; P112-F154 HydrophobicContact CB-CE2 4.21Å; P112-F154 HydrophobicContact CB-CG 3.75Å; P112-F154 HydrophobicContact CB-CZ 4.45Å; P112-F154 HydrophobicContact CG-CB 4.25Å; P112-F154 HydrophobicContact CG-CD1 4.4Å; P112-F154 HydrophobicContact CG-CG 4.26Å
113	S	91.1	Very high	94.2	Very high	88 Å²	88	80.5 Å²	80.5	62%	0.615	45%	0.446	S	S	*	.			trans	-82.1	157.6	174.5	61.6	0	0	0	0	111.1	R111 F154	R111-S113 PolarHBondContact O-N 2.89Å; S113-F154 WeakPolarHBondContact OG-CZ 3.47Å
114	G	91.9	Very high	93.8	Very high	67 Å²	67	78.2 Å²	78.2	69%	0.691	44%	0.436	S	S	*	.	S	Bend	trans	79.5	-167.5	179.6	0	0	0	0	0	114.2	W150	G114-W150 WeakPolarHBondContact O-CH2 3.49Å; G114-W150 WeakPolarHBondContact O-CZ2 3.44Å
115	A	94.4	Very high	93.4	Very high	92 Å²	92	77.8 Å²	77.8	76%	0.76	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-86.1	147	177.8	0	0	0	0	0	110.9
116	M	95.2	Very high	92.2	Very high	38 Å²	38	81.1 Å²	81.1	19%	0.187	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-57.2	129.2	172.7	-179.2	179.5	-74.3	0	0	110.2	I120 K121 Q146 M147 W150	M116-I120 HydrophobicContact CG-CB 4.17Å; M116-I120 HydrophobicContact CG-CG2 4.14Å; M116-I120 HydrophobicContact SD-CB 4.48Å; M116-I120 HydrophobicContact SD-CG2 3.96Å; M116-K121 HydrophobicContact CG-CB 4.18Å; M116-K121 HydrophobicContact SD-CB 3.97Å; M116-K121 HydrophobicContact SD-CG 4.45Å; M116-Q146 HydrophobicContact CE-CB 4.04Å; M116-Q146 HydrophobicContact SD-CB 4.08Å; M116-M147 HydrophobicContact CE-CG 4.39Å; M116-M147 HydrophobicContact CE-SD 3.48Å; M116-M147 WeakPolarHBondContact CE-SD 3.46Å; M116-W150 HydrophobicContact CB-CD2 4.12Å; M116-W150 HydrophobicContact CB-CE3 3.91Å; M116-W150 HydrophobicContact CB-CH2 4.26Å; M116-W150 HydrophobicContact CB-CZ2 4.44Å; M116-W150 HydrophobicContact CB-CZ3 3.99Å; M116-W150 HydrophobicContact CE-CB 4.44Å; M116-W150 HydrophobicContact CE-CD2 4.33Å; M116-W150 HydrophobicContact CE-CE3 3.59Å; M116-W150 HydrophobicContact CE-CZ3 4.24Å; M116-W150 HydrophobicContact CG-CD2 4.21Å; M116-W150 HydrophobicContact CG-CE3 4.17Å; M116-W150 HydrophobicContact CG-CG 4.47Å
117	P	96	Very high	90.7	Very high	47 Å²	47	84.1 Å²	84.1	31%	0.305	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-53.9	140.3	177.1	-25.9	33.4	0	0	0	112	E119 I120 K121	P117-E119 WeakPolarHBondContact CB-OE2 3.36Å; P117-E119 PolarHBondContact O-N 3.32Å; P117-I120 HydrophobicContact CB-CG1 4.48Å; P117-I120 HydrophobicContact CG-CD1 4.3Å; P117-I120 PolarHBondContact O-N 2.94Å; P117-K121 WeakPolarHBondContact O-CB 3.34Å; P117-K121 PolarHBondContact O-N 3.24Å
118	S	96.1	Very high	89	Confident	84 Å²	84	82.9 Å²	82.9	59%	0.587	48%	0.48	S	S	*	.	H	α-helix	trans	-55.4	-36.6	-179.5	30.1	0	0	0	0	112.6	I120 K121 G122	S118-I120 VanDerWaalsContact C-N 3.26Å; S118-I120 PolarHBondContact O-N 3.38Å; S118-K121 PolarHBondContact O-N 2.85Å; S118-G122 PolarHBondContact O-N 3.43Å
119	E	94.5	Very high	87	Confident	138 Å²	138	84.5 Å²	84.5	65%	0.645	49%	0.489	S	S	*	.	H	α-helix	trans	-63.6	-33.5	-179.6	-57.5	70.4	-148.8	0	0	111.2	P117 L123	P117-E119 WeakPolarHBondContact CB-OE2 3.36Å; P117-E119 PolarHBondContact O-N 3.32Å; E119-L123 VanDerWaalsContact O-CG 3.32Å; E119-L123 WeakPolarHBondContact O-CG 3.44Å
120	I	95.7	Very high	85.1	Confident	15 Å²	15	88.4 Å²	88.4	8%	0.077	52%	0.522	C	S	.	.	H	α-helix	trans	-86.2	-44.7	177.5	-60.6	179.3	0	0	0	110.4	M116 P117 S118 G122 L123 Q146 L149 W150	M116-I120 HydrophobicContact CG-CB 4.17Å; M116-I120 HydrophobicContact CG-CG2 4.14Å; M116-I120 HydrophobicContact SD-CB 4.48Å; M116-I120 HydrophobicContact SD-CG2 3.96Å; P117-I120 HydrophobicContact CB-CG1 4.48Å; P117-I120 HydrophobicContact CG-CD1 4.3Å; P117-I120 PolarHBondContact O-N 2.94Å; S118-I120 VanDerWaalsContact C-N 3.26Å; S118-I120 PolarHBondContact O-N 3.38Å; I120-G122 PolarHBondContact O-N 3.38Å; I120-L123 WeakPolarHBondContact O-CB 3.36Å; I120-L123 PolarHBondContact O-N 2.96Å; I120-L123 VanDerWaalsContact O-N 3.13Å; I120-Q146 HydrophobicContact CG2-CB 3.99Å; I120-Q146 HydrophobicContact CG2-CG 4.33Å; I120-Q146 VanDerWaalsContact CG2-O 3.29Å; I120-Q146 WeakPolarHBondContact CG2-O 3.33Å; I120-Q146 PolarHBondContact O-NE2 3.5Å; I120-Q146 VanDerWaalsContact O-NE2 3.08Å; I120-L149 HydrophobicContact CD1-CB 4.32Å; I120-L149 HydrophobicContact CG2-CB 4.15Å; I120-W150 HydrophobicContact CD1-CB 4.14Å
121	K	94.5	Very high	83	Confident	141 Å²	141	92.6 Å²	92.6	61%	0.613	54%	0.542	S	S	*	.	H	α-helix	trans	-59.6	-34.2	179.9	-170.7	-179.6	179.1	-177	0	111.8	M116 P117 S118 Q146	M116-K121 HydrophobicContact CG-CB 4.18Å; M116-K121 HydrophobicContact SD-CB 3.97Å; M116-K121 HydrophobicContact SD-CG 4.45Å; P117-K121 WeakPolarHBondContact O-CB 3.34Å; P117-K121 PolarHBondContact O-N 3.24Å; S118-K121 PolarHBondContact O-N 2.85Å; K121-Q146 PolarHBondContact O-NE2 2.97Å
122	G	91.8	Very high	81.2	Confident	53 Å²	53	85.9 Å²	85.9	55%	0.546	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-12.5	178.7	0	0	0	0	0	115.6	S118 I120 E124	S118-G122 PolarHBondContact O-N 3.43Å; I120-G122 PolarHBondContact O-N 3.38Å; G122-E124 PolarHBondContact O-N 2.8Å
123	L	91.7	Very high	79.4	Confident	64 Å²	64	92.4 Å²	92.4	34%	0.335	57%	0.567	S	S	.	*			trans	-68	116.5	-177.2	-64.1	173.3	0	0	0	111.6	E119 I120 F125 R142 Q146 L149	E119-L123 VanDerWaalsContact O-CG 3.32Å; E119-L123 WeakPolarHBondContact O-CG 3.44Å; I120-L123 WeakPolarHBondContact O-CB 3.36Å; I120-L123 PolarHBondContact O-N 2.96Å; I120-L123 VanDerWaalsContact O-N 3.13Å; L123-F125 HydrophobicContact CB-CD2 4.26Å; L123-F125 HydrophobicContact CB-CE1 4.48Å; L123-F125 HydrophobicContact CB-CE2 3.81Å; L123-F125 HydrophobicContact CB-CZ 3.93Å; L123-F125 HydrophobicContact CD1-CE1 4.38Å; L123-F125 HydrophobicContact CD1-CZ 4Å; L123-R142 PolarHBondContact O-NE 2.94Å; L123-R142 PolarHBondContact O-NH2 3.18Å; L123-R142 VanDerWaalsContact O-NH2 3.14Å; L123-Q146 PolarHBondContact O-NE2 3.32Å; L123-L149 HydrophobicContact CD1-CD1 3.46Å; L123-L149 VanDerWaalsContact CD1-CD1 3.46Å
124	E	84.8	Confident	77.8	Confident	71 Å²	71	98.2 Å²	98.2	33%	0.332	58%	0.581	S	S	.	*			trans	-95	-12.4	176.8	-71.1	-76.6	154.6	0	0	113.2	G122 S126 R136 R142	G122-E124 PolarHBondContact O-N 2.8Å; E124-S126 PolarHBondContact O-N 3.24Å; E124-R136 IonicContact OE2-CZ 2.63Å; E124-R136 IonicContact OE2-NE 3.83Å; E124-R136 IonicContact OE2-NH2 2.82Å; E124-R136 PolarHBondContact OE2-NH2 3.31Å; E124-R142 IonicContact OE1-CZ 2.69Å; E124-R142 IonicContact OE1-NH1 3.59Å; E124-R142 PolarHBondContact OE1-NH1 2.03Å; E124-R142 IonicContact OE1-NH2 2.72Å; E124-R142 PolarHBondContact OE1-NH2 2.95Å; E124-R142 IonicContact OE2-CZ 2.8Å; E124-R142 VanDerWaalsContact OE2-CZ 3.27Å; E124-R142 IonicContact OE2-NE 3.05Å; E124-R142 IonicContact OE2-NH1 3.75Å; E124-R142 PolarHBondContact OE2-NH1 2.65Å; E124-R142 IonicContact OE2-NH2 2.74Å
125	F	84.4	Confident	76.2	Confident	68 Å²	68	102.6 Å²	102.6	30%	0.298	58%	0.584	S	S	.	*			trans	45.2	46.7	-177	-54	-86.6	0	0	0	112.9	L123 L137 R142 L145 Q146 L149	L123-F125 HydrophobicContact CB-CD2 4.26Å; L123-F125 HydrophobicContact CB-CE1 4.48Å; L123-F125 HydrophobicContact CB-CE2 3.81Å; L123-F125 HydrophobicContact CB-CZ 3.93Å; L123-F125 HydrophobicContact CD1-CE1 4.38Å; L123-F125 HydrophobicContact CD1-CZ 4Å; F125-L137 HydrophobicContact CB-CD1 3.39Å; F125-L137 HydrophobicContact CB-CG 3.96Å; F125-L137 HydrophobicContact CD2-CD1 4.33Å; F125-L137 HydrophobicContact CG-CD1 3.88Å; F125-R142 HydrophobicContact CD2-CB 4.49Å; F125-R142 HydrophobicContact CD2-CG 4.02Å; F125-R142 HydrophobicContact CE2-CG 4.27Å; F125-L145 HydrophobicContact CD1-CD1 4.31Å; F125-L145 HydrophobicContact CD2-CD1 4.39Å; F125-L145 HydrophobicContact CE1-CB 4.29Å; F125-L145 HydrophobicContact CE1-CD1 4.27Å; F125-L145 HydrophobicContact CE2-CB 3.84Å; F125-L145 HydrophobicContact CE2-CD1 4.34Å; F125-L145 HydrophobicContact CG-CD1 4.38Å; F125-L145 HydrophobicContact CZ-CB 3.64Å; F125-L145 HydrophobicContact CZ-CD1 4.28Å; F125-Q146 HydrophobicContact CE2-CG 4.03Å; F125-L149 HydrophobicContact CE1-CD1 4.26Å; F125-L149 HydrophobicContact CZ-CD1 3.87Å
126	S	71.1	Confident	75	Confident	71 Å²	71	105.9 Å²	105.9	50%	0.497	58%	0.576	S	S	.	*			trans	-101.3	-8.7	-171	45.7	0	0	0	0	114.7	E124	E124-S126 PolarHBondContact O-N 3.24Å
127	E	62.8	Low	74.3	Confident	189 Å²	189	106.9 Å²	106.9	88%	0.883	58%	0.582	S	S	*	*			trans	-115.5	119.5	-172.6	-71.4	167.7	-170.5	0	0	109.2
128	G	60	Low	73.9	Confident	77 Å²	77	108 Å²	108	79%	0.794	59%	0.591	S	S	*	*			trans	163.3	-13.7	-177.9	0	0	0	0	0	115.9
129	L	53.4	Low	73.6	Confident	103 Å²	103	112.9 Å²	112.9	54%	0.539	60%	0.602	S	S	.	*	S	Bend	trans	-104	140.3	163.4	-99	88.7	0	0	0	109.9	K133	L129-K133 HydrophobicContact CB-CB 4.37Å; L129-K133 HydrophobicContact CD2-CB 3.87Å; L129-K133 HydrophobicContact CD2-CD 4.14Å
130	A	56	Low	73.5	Confident	88 Å²	88	113.7 Å²	113.7	73%	0.727	60%	0.603	S	S	*	*			trans	-35.5	137.9	175.3	0	0	0	0	0	112.4	G132 K133	A130-G132 PolarHBondContact O-N 3.15Å; A130-K133 PolarHBondContact O-N 3.41Å
131	Q	51.3	Low	73.3	Confident	211 Å²	211	116.5 Å²	116.5	99%	0.986	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-38.4	101.5	176	-82.3	178.7	-42.6	0	0	110.3
132	G	56.3	Low	73.2	Confident	78 Å²	78	111.6 Å²	111.6	80%	0.804	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	142.3	-25.3	179.6	0	0	0	0	0	116.5	A130	A130-G132 PolarHBondContact O-N 3.15Å
133	K	55.5	Low	73.3	Confident	158 Å²	158	117.7 Å²	117.7	69%	0.687	60%	0.602	S	S	*	*			trans	-114.3	92.9	176.4	-75.4	-176.9	179.1	178.4	0	111.5	L129 A130 Q135	L129-K133 HydrophobicContact CB-CB 4.37Å; L129-K133 HydrophobicContact CD2-CB 3.87Å; L129-K133 HydrophobicContact CD2-CD 4.14Å; A130-K133 PolarHBondContact O-N 3.41Å; K133-Q135 PolarHBondContact O-N 3.36Å
134	K	56	Low	73.4	Confident	209 Å²	209	120.9 Å²	120.9	91%	0.909	61%	0.613	S	S	*	*			trans	-71.1	56.2	174.1	-64.4	-176.7	179.9	179.1	0	112.1	R136	K134-R136 VanDerWaalsContact C-N 3.25Å; K134-R136 PolarHBondContact O-N 3.25Å
135	Q	59.4	Low	73.9	Confident	159 Å²	159	120.1 Å²	120.1	74%	0.743	61%	0.611	S	S	*	*			trans	-77.8	85	173.5	-126.6	-166.2	-26.3	0	0	109.4	K133 L137	K133-Q135 PolarHBondContact O-N 3.36Å; Q135-L137 PolarHBondContact O-N 3.01Å
136	R	68.5	Low	74.4	Confident	161 Å²	161	117.8 Å²	117.8	61%	0.608	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-61.2	129.6	170.7	-167.6	177.5	-178.2	-176.5	3.1	108.2	E124 K134 S138	E124-R136 IonicContact OE2-CZ 2.63Å; E124-R136 IonicContact OE2-NE 3.83Å; E124-R136 IonicContact OE2-NH2 2.82Å; E124-R136 PolarHBondContact OE2-NH2 3.31Å; K134-R136 VanDerWaalsContact C-N 3.25Å; K134-R136 PolarHBondContact O-N 3.25Å; R136-S138 PolarHBondContact O-N 3.32Å
137	L	81	Confident	75.6	Confident	59 Å²	59	118 Å²	118	31%	0.309	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-53.6	145.1	171.9	-65.1	-171.2	0	0	0	109.9	F125 Q135 K139 L141 L145	F125-L137 HydrophobicContact CB-CD1 3.39Å; F125-L137 HydrophobicContact CB-CG 3.96Å; F125-L137 HydrophobicContact CD2-CD1 4.33Å; F125-L137 HydrophobicContact CG-CD1 3.88Å; Q135-L137 PolarHBondContact O-N 3.01Å; L137-K139 PolarHBondContact O-N 3.12Å; L137-L141 HydrophobicContact CB-CD2 4.46Å; L137-L141 HydrophobicContact CD1-CD2 4.27Å; L137-L141 HydrophobicContact CD1-CG 4.38Å; L137-L141 HydrophobicContact CD2-CD2 3.98Å; L137-L141 HydrophobicContact CG-CD2 4.48Å; L137-L145 HydrophobicContact CD1-CD1 3.49Å; L137-L145 VanDerWaalsContact CD1-CD1 3.49Å
138	S	86.8	Confident	77.2	Confident	71 Å²	71	115.5 Å²	115.5	50%	0.497	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-56	143.1	175.5	75.7	0	0	0	0	109.9	R136 K140 L141 R142	R136-S138 PolarHBondContact O-N 3.32Å; S138-K140 PolarHBondContact O-N 3.45Å; S138-L141 PolarHBondContact O-N 2.74Å; S138-L141 VanDerWaalsContact OG-CB 3.29Å; S138-L141 WeakPolarHBondContact OG-CB 3.33Å; S138-L141 PolarHBondContact OG-N 3.16Å; S138-L141 VanDerWaalsContact OG-N 3.15Å; S138-R142 PolarHBondContact O-N 3.06Å
139	K	90.1	Very high	78.9	Confident	187 Å²	187	113.5 Å²	113.5	81%	0.813	55%	0.549	S	S	*	.	H	α-helix	trans	-52.3	-35.4	179.3	-172.7	177.2	-177.9	177.9	0	112.2	L137 R143	L137-K139 PolarHBondContact O-N 3.12Å; K139-R143 PolarHBondContact O-N 3.01Å; K139-R143 VanDerWaalsContact O-N 3.17Å
140	K	92.5	Very high	81	Confident	154 Å²	154	110 Å²	110	67%	0.67	53%	0.528	S	S	*	.	H	α-helix	trans	-67	-48.2	176.6	-172.3	178.4	-175.9	178.1	0	111.9	S138 R143 K144	S138-K140 PolarHBondContact O-N 3.45Å; K140-R143 PolarHBondContact O-N 3.45Å; K140-K144 WeakPolarHBondContact O-CG 3.41Å; K140-K144 PolarHBondContact O-N 3.45Å; K140-K144 VanDerWaalsContact O-N 3.08Å
141	L	91.6	Very high	82.9	Confident	74 Å²	74	106.5 Å²	106.5	39%	0.387	50%	0.499	S	S	.	.	H	α-helix	trans	-64.9	-44.4	179	178.3	58.2	0	0	0	111.2	L137 S138 R143 K144 L145	L137-L141 HydrophobicContact CB-CD2 4.46Å; L137-L141 HydrophobicContact CD1-CD2 4.27Å; L137-L141 HydrophobicContact CD1-CG 4.38Å; L137-L141 HydrophobicContact CD2-CD2 3.98Å; L137-L141 HydrophobicContact CG-CD2 4.48Å; S138-L141 PolarHBondContact O-N 2.74Å; S138-L141 VanDerWaalsContact OG-CB 3.29Å; S138-L141 WeakPolarHBondContact OG-CB 3.33Å; S138-L141 PolarHBondContact OG-N 3.16Å; S138-L141 VanDerWaalsContact OG-N 3.15Å; L141-R143 PolarHBondContact O-N 3.48Å; L141-K144 WeakPolarHBondContact O-CB 3.06Å; L141-K144 PolarHBondContact O-N 2.89Å; L141-K144 VanDerWaalsContact O-N 3.13Å; L141-L145 HydrophobicContact CD1-CD1 4.28Å; L141-L145 HydrophobicContact CD1-CG 4.17Å; L141-L145 HydrophobicContact CG-CD1 4.1Å; L141-L145 HydrophobicContact CG-CG 4.44Å; L141-L145 WeakPolarHBondContact O-CG 3.05Å; L141-L145 PolarHBondContact O-N 2.78Å
142	R	92.4	Very high	85	Confident	39 Å²	39	98.1 Å²	98.1	15%	0.147	46%	0.46	C	S	.	.	H	α-helix	trans	-52.4	-52.1	174.4	172.4	175.7	176.6	-157.5	4.1	111.9	L123 E124 F125 S138 K144 L145 Q146	L123-R142 PolarHBondContact O-NE 2.94Å; L123-R142 PolarHBondContact O-NH2 3.18Å; L123-R142 VanDerWaalsContact O-NH2 3.14Å; E124-R142 IonicContact OE1-CZ 2.69Å; E124-R142 IonicContact OE1-NH1 3.59Å; E124-R142 PolarHBondContact OE1-NH1 2.03Å; E124-R142 IonicContact OE1-NH2 2.72Å; E124-R142 PolarHBondContact OE1-NH2 2.95Å; E124-R142 IonicContact OE2-CZ 2.8Å; E124-R142 VanDerWaalsContact OE2-CZ 3.27Å; E124-R142 IonicContact OE2-NE 3.05Å; E124-R142 IonicContact OE2-NH1 3.75Å; E124-R142 PolarHBondContact OE2-NH1 2.65Å; E124-R142 IonicContact OE2-NH2 2.74Å; F125-R142 HydrophobicContact CD2-CB 4.49Å; F125-R142 HydrophobicContact CD2-CG 4.02Å; F125-R142 HydrophobicContact CE2-CG 4.27Å; S138-R142 PolarHBondContact O-N 3.06Å; R142-K144 VanDerWaalsContact C-N 3.32Å; R142-K144 PolarHBondContact O-N 2.88Å; R142-L145 PolarHBondContact O-N 3.39Å; R142-Q146 WeakPolarHBondContact O-CG 3.44Å; R142-Q146 PolarHBondContact O-N 3.34Å
143	R	93.6	Very high	87	Confident	180 Å²	180	96.4 Å²	96.4	68%	0.679	43%	0.433	S	S	*	.	H	α-helix	trans	-61.8	-39.8	179.3	-174.5	178.4	177.3	-173.2	-0.4	112	K139 K140 L141 Q146 M147	K139-R143 PolarHBondContact O-N 3.01Å; K139-R143 VanDerWaalsContact O-N 3.17Å; K140-R143 PolarHBondContact O-N 3.45Å; L141-R143 PolarHBondContact O-N 3.48Å; R143-Q146 PolarHBondContact O-N 2.85Å; R143-M147 WeakPolarHBondContact O-CG 3.35Å; R143-M147 PolarHBondContact O-N 3.34Å
144	K	94.9	Very high	89	Confident	132 Å²	132	90.5 Å²	90.5	57%	0.574	41%	0.408	S	S	*	.	H	α-helix	trans	-62	-43.7	176	-76.2	-175.2	172	-165.1	0	111.9	K140 L141 R142 M147 W148	K140-K144 WeakPolarHBondContact O-CG 3.41Å; K140-K144 PolarHBondContact O-N 3.45Å; K140-K144 VanDerWaalsContact O-N 3.08Å; L141-K144 WeakPolarHBondContact O-CB 3.06Å; L141-K144 PolarHBondContact O-N 2.89Å; L141-K144 VanDerWaalsContact O-N 3.13Å; R142-K144 VanDerWaalsContact C-N 3.32Å; R142-K144 PolarHBondContact O-N 2.88Å; K144-M147 PolarHBondContact O-N 3.3Å; K144-W148 WeakPolarHBondContact O-CB 3.29Å; K144-W148 PolarHBondContact O-N 3.23Å
145	L	94.4	Very high	91	Very high	54 Å²	54	80.9 Å²	80.9	28%	0.283	37%	0.367	S	S	.	.	H	α-helix	trans	-64.2	-42.2	176.7	-70.7	171.5	0	0	0	111.9	F125 L137 L141 R142 M147 W148 L149	F125-L145 HydrophobicContact CD1-CD1 4.31Å; F125-L145 HydrophobicContact CD2-CD1 4.39Å; F125-L145 HydrophobicContact CE1-CB 4.29Å; F125-L145 HydrophobicContact CE1-CD1 4.27Å; F125-L145 HydrophobicContact CE2-CB 3.84Å; F125-L145 HydrophobicContact CE2-CD1 4.34Å; F125-L145 HydrophobicContact CG-CD1 4.38Å; F125-L145 HydrophobicContact CZ-CB 3.64Å; F125-L145 HydrophobicContact CZ-CD1 4.28Å; L137-L145 HydrophobicContact CD1-CD1 3.49Å; L137-L145 VanDerWaalsContact CD1-CD1 3.49Å; L141-L145 HydrophobicContact CD1-CD1 4.28Å; L141-L145 HydrophobicContact CD1-CG 4.17Å; L141-L145 HydrophobicContact CG-CD1 4.1Å; L141-L145 HydrophobicContact CG-CG 4.44Å; L141-L145 WeakPolarHBondContact O-CG 3.05Å; L141-L145 PolarHBondContact O-N 2.78Å; R142-L145 PolarHBondContact O-N 3.39Å; L145-M147 PolarHBondContact O-N 2.99Å; L145-W148 PolarHBondContact O-N 3.5Å; L145-L149 WeakPolarHBondContact O-CB 3.34Å; L145-L149 WeakPolarHBondContact O-CG 3.4Å; L145-L149 PolarHBondContact O-N 3.36Å
146	Q	95.8	Very high	92.8	Very high	19 Å²	19	73.7 Å²	73.7	9%	0.089	33%	0.334	C	S	.	.	H	α-helix	trans	-60.8	-44.2	174.8	-70.4	178.2	-35.5	0	0	112.2	M116 I120 K121 L123 F125 R142 R143 W150	M116-Q146 HydrophobicContact CE-CB 4.04Å; M116-Q146 HydrophobicContact SD-CB 4.08Å; I120-Q146 HydrophobicContact CG2-CB 3.99Å; I120-Q146 HydrophobicContact CG2-CG 4.33Å; I120-Q146 VanDerWaalsContact CG2-O 3.29Å; I120-Q146 WeakPolarHBondContact CG2-O 3.33Å; I120-Q146 PolarHBondContact O-NE2 3.5Å; I120-Q146 VanDerWaalsContact O-NE2 3.08Å; K121-Q146 PolarHBondContact O-NE2 2.97Å; L123-Q146 PolarHBondContact O-NE2 3.32Å; F125-Q146 HydrophobicContact CE2-CG 4.03Å; R142-Q146 WeakPolarHBondContact O-CG 3.44Å; R142-Q146 PolarHBondContact O-N 3.34Å; R143-Q146 PolarHBondContact O-N 2.85Å; Q146-W150 WeakPolarHBondContact O-CB 3.48Å; Q146-W150 PolarHBondContact O-N 2.99Å
147	M	95.5	Very high	94.1	Very high	75 Å²	75	67.3 Å²	67.3	37%	0.369	31%	0.313	S	S	.	.	H	α-helix	trans	-66	-40.5	176.6	-71.1	-57.8	-54.2	0	0	112.3	M116 R143 K144 L145 W150 S151	M116-M147 HydrophobicContact CE-CG 4.39Å; M116-M147 HydrophobicContact CE-SD 3.48Å; M116-M147 WeakPolarHBondContact CE-SD 3.46Å; R143-M147 WeakPolarHBondContact O-CG 3.35Å; R143-M147 PolarHBondContact O-N 3.34Å; K144-M147 PolarHBondContact O-N 3.3Å; L145-M147 PolarHBondContact O-N 2.99Å; M147-W150 HydrophobicContact CE-CE3 3.82Å; M147-W150 HydrophobicContact CE-CZ3 4.08Å; M147-W150 PolarHBondContact O-N 2.8Å; M147-W150 HydrophobicContact SD-CE3 3.88Å; M147-W150 HydrophobicContact SD-CZ3 4.22Å; M147-S151 WeakPolarHBondContact O-CB 3.41Å; M147-S151 PolarHBondContact O-N 3.06Å
148	W	95.9	Very high	94.7	Very high	138 Å²	138	65.2 Å²	65.2	52%	0.523	30%	0.302	S	S	.	.	H	α-helix	trans	-62.9	-47	176.1	176.3	82.7	0	0	0	111.5	K144 L145 W150 S151 Q152 V186	K144-W148 WeakPolarHBondContact O-CB 3.29Å; K144-W148 PolarHBondContact O-N 3.23Å; L145-W148 PolarHBondContact O-N 3.5Å; W148-W150 VanDerWaalsContact C-N 3.32Å; W148-W150 PolarHBondContact O-N 2.91Å; W148-S151 PolarHBondContact O-N 2.83Å; W148-Q152 WeakPolarHBondContact O-CB 3.49Å; W148-Q152 PolarHBondContact O-N 3.2Å; W148-V186 HydrophobicContact CH2-CG2 3.84Å; W148-V186 HydrophobicContact CZ3-CG2 4.36Å
149	L	96.6	Very high	95.1	Very high	35 Å²	35	67 Å²	67	18%	0.183	30%	0.299	C	S	.	.	H	α-helix	trans	-57.9	-46.8	174.4	-76.7	172	0	0	0	110.9	I120 L123 F125 L145 S151 Q152 T153	I120-L149 HydrophobicContact CD1-CB 4.32Å; I120-L149 HydrophobicContact CG2-CB 4.15Å; L123-L149 HydrophobicContact CD1-CD1 3.46Å; L123-L149 VanDerWaalsContact CD1-CD1 3.46Å; F125-L149 HydrophobicContact CE1-CD1 4.26Å; F125-L149 HydrophobicContact CZ-CD1 3.87Å; L145-L149 WeakPolarHBondContact O-CB 3.34Å; L145-L149 WeakPolarHBondContact O-CG 3.4Å; L145-L149 PolarHBondContact O-N 3.36Å; L149-S151 PolarHBondContact O-N 3.03Å; L149-Q152 PolarHBondContact O-N 2.94Å; L149-T153 WeakPolarHBondContact O-CG2 3.45Å; L149-T153 PolarHBondContact O-N 3.1Å; L149-T153 PolarHBondContact O-OG1 3.09Å
150	W	97.3	Very high	95.2	Very high	28 Å²	28	61.2 Å²	61.2	11%	0.106	29%	0.286	C	S	.	.	H	α-helix	trans	-60.3	-45.8	179.2	-172.4	17.3	0	0	0	111.6	P112 G114 M116 I120 Q146 M147 W148 Q152 T153 F154	P112-W150 HydrophobicContact CB-CD2 3.8Å; P112-W150 HydrophobicContact CB-CE3 4.37Å; P112-W150 HydrophobicContact CB-CG 4.21Å; P112-W150 HydrophobicContact CB-CH2 4.2Å; P112-W150 HydrophobicContact CB-CZ2 3.61Å; P112-W150 HydrophobicContact CG-CD2 3.99Å; P112-W150 HydrophobicContact CG-CE3 4.41Å; P112-W150 HydrophobicContact CG-CG 4.16Å; G114-W150 WeakPolarHBondContact O-CH2 3.49Å; G114-W150 WeakPolarHBondContact O-CZ2 3.44Å; M116-W150 HydrophobicContact CB-CD2 4.12Å; M116-W150 HydrophobicContact CB-CE3 3.91Å; M116-W150 HydrophobicContact CB-CH2 4.26Å; M116-W150 HydrophobicContact CB-CZ2 4.44Å; M116-W150 HydrophobicContact CB-CZ3 3.99Å; M116-W150 HydrophobicContact CE-CB 4.44Å; M116-W150 HydrophobicContact CE-CD2 4.33Å; M116-W150 HydrophobicContact CE-CE3 3.59Å; M116-W150 HydrophobicContact CE-CZ3 4.24Å; M116-W150 HydrophobicContact CG-CD2 4.21Å; M116-W150 HydrophobicContact CG-CE3 4.17Å; M116-W150 HydrophobicContact CG-CG 4.47Å; I120-W150 HydrophobicContact CD1-CB 4.14Å; Q146-W150 WeakPolarHBondContact O-CB 3.48Å; Q146-W150 PolarHBondContact O-N 2.99Å; M147-W150 HydrophobicContact CE-CE3 3.82Å; M147-W150 HydrophobicContact CE-CZ3 4.08Å; M147-W150 PolarHBondContact O-N 2.8Å; M147-W150 HydrophobicContact SD-CE3 3.88Å; M147-W150 HydrophobicContact SD-CZ3 4.22Å; W148-W150 VanDerWaalsContact C-N 3.32Å; W148-W150 PolarHBondContact O-N 2.91Å; W150-Q152 PolarHBondContact O-N 2.96Å; W150-T153 PolarHBondContact O-N 3.2Å; W150-F154 WeakPolarHBondContact O-CA 3.38Å; W150-F154 WeakPolarHBondContact O-CB 3.2Å; W150-F154 PolarHBondContact O-N 2.74Å
151	S	96.6	Very high	95.2	Very high	16 Å²	16	57.1 Å²	57.1	11%	0.112	27%	0.266	C	S	.	.	H	α-helix	trans	-61	-43.1	175.5	-173.2	0	0	0	0	112.6	R109 M147 W148 L149	R109-S151 VanDerWaalsContact C-OG 3.3Å; R109-S151 WeakPolarHBondContact CB-O 3.3Å; R109-S151 WeakPolarHBondContact O-CA 3.35Å; R109-S151 VanDerWaalsContact O-CB 3.31Å; R109-S151 WeakPolarHBondContact O-CB 3.34Å; R109-S151 PolarHBondContact O-OG 2.85Å; M147-S151 WeakPolarHBondContact O-CB 3.41Å; M147-S151 PolarHBondContact O-N 3.06Å; W148-S151 PolarHBondContact O-N 2.83Å; L149-S151 PolarHBondContact O-N 3.03Å
152	Q	95.2	Very high	95.3	Very high	34 Å²	34	55.6 Å²	55.6	16%	0.159	26%	0.258	C	S	.	.	H	α-helix	trans	-66.1	-41.6	-179.5	179.3	59.2	16.5	0	0	112.4	R109 W148 L149 W150 V186	R109-Q152 PolarHBondContact NH1-O 2.76Å; R109-Q152 VanDerWaalsContact NH1-O 3.13Å; W148-Q152 WeakPolarHBondContact O-CB 3.49Å; W148-Q152 PolarHBondContact O-N 3.2Å; L149-Q152 PolarHBondContact O-N 2.94Å; W150-Q152 PolarHBondContact O-N 2.96Å; Q152-V186 HydrophobicContact CG-CG2 3.92Å
153	T	97.1	Very high	95.4	Very high	42 Å²	42	56.8 Å²	56.8	26%	0.258	27%	0.268	S	S	.	.	H	α-helix	trans	-93.6	-11.7	-175.7	69.1	0	0	0	0	114.5	L149 W150 C184	L149-T153 WeakPolarHBondContact O-CG2 3.45Å; L149-T153 PolarHBondContact O-N 3.1Å; L149-T153 PolarHBondContact O-OG1 3.09Å; W150-T153 PolarHBondContact O-N 3.2Å; T153-C184 VanDerWaalsContact CA-O 3.23Å; T153-C184 WeakPolarHBondContact CA-O 3.39Å; T153-C184 WeakPolarHBondContact CG2-O 3.31Å
154	F	97.5	Very high	95.4	Very high	35 Å²	35	49.3 Å²	49.3	15%	0.154	24%	0.241	C	C	.	.			trans	-67.5	136.3	177.3	178.2	-106.3	0	0	0	110.7	R109 P112 S113 W150 P156	R109-F154 HydrophobicContact CG-CD1 4.33Å; R109-F154 PolarHBondContact NH1-O 3.02Å; P112-F154 HydrophobicContact CB-CB 4.16Å; P112-F154 HydrophobicContact CB-CD1 4.02Å; P112-F154 HydrophobicContact CB-CD2 3.85Å; P112-F154 HydrophobicContact CB-CE1 4.36Å; P112-F154 HydrophobicContact CB-CE2 4.21Å; P112-F154 HydrophobicContact CB-CG 3.75Å; P112-F154 HydrophobicContact CB-CZ 4.45Å; P112-F154 HydrophobicContact CG-CB 4.25Å; P112-F154 HydrophobicContact CG-CD1 4.4Å; P112-F154 HydrophobicContact CG-CG 4.26Å; S113-F154 WeakPolarHBondContact OG-CZ 3.47Å; W150-F154 WeakPolarHBondContact O-CA 3.38Å; W150-F154 WeakPolarHBondContact O-CB 3.2Å; W150-F154 PolarHBondContact O-N 2.74Å; F154-P156 HydrophobicContact CE1-CB 3.9Å
155	C	97.5	Very high	95.4	Very high	7 Å²	7	44 Å²	44	5%	0.047	22%	0.224	C	C	.	.			trans	-117.9	98.5	-178.8	-71.2	0	0	0	0	108.9	C192 C228 C230	C155-C192 VanDerWaalsContact CA-SG 3.56Å; C155-C192 HydrophobicContact CB-CB 3.62Å; C155-C192 WeakPolarHBondContact CB-SG 3.45Å; C155-C192 VanDerWaalsContact SG-CA 3.51Å; C155-C192 WeakPolarHBondContact SG-CB 3.26Å; C155-C192 CovalentContact SG-SG 2.03Å; C155-C192 PolarHBondContact SG-SG 3.45Å; C155-C228 HydrophobicContact CB-CB 3.66Å; C155-C230 PolarHBondContact SG-N 3.02Å
156	P	97.1	Very high	95.4	Very high	7 Å²	7	44 Å²	44	5%	0.045	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-67.6	152.4	176.3	28.2	-33.1	0	0	0	111.2	D105 L108 R109 F154	D105-P156 WeakPolarHBondContact OD1-CG 3.31Å; L108-P156 HydrophobicContact CB-CB 3.79Å; L108-P156 HydrophobicContact CB-CG 4.03Å; L108-P156 HydrophobicContact CD1-CB 3.89Å; L108-P156 HydrophobicContact CD1-CG 4.4Å; L108-P156 HydrophobicContact CG-CB 4.49Å; R109-P156 HydrophobicContact CG-CG 4.43Å; F154-P156 HydrophobicContact CE1-CB 3.9Å
157	V	96.3	Very high	95.4	Very high	27 Å²	27	44 Å²	44	16%	0.164	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	119.9	165.8	-177.6	0	0	0	0	107.5	Y159	V157-Y159 HydrophobicContact CB-CE2 4.25Å; V157-Y159 HydrophobicContact CG1-CD1 4.42Å; V157-Y159 HydrophobicContact CG1-CD2 4.4Å; V157-Y159 HydrophobicContact CG1-CE1 3.94Å; V157-Y159 HydrophobicContact CG1-CE2 3.94Å
158	L	95.1	Very high	95.5	Very high	16 Å²	16	41 Å²	41	8%	0.084	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	125.8	173.3	-56.7	-176.4	0	0	0	108.4	L101 L104 L108 G176 S177 F179	L101-L158 HydrophobicContact CD2-CD1 4.18Å; L104-L158 HydrophobicContact CD2-CD2 4.22Å; L104-L158 HydrophobicContact CG-CD2 4.25Å; L108-L158 HydrophobicContact CD1-CD2 3.59Å; L158-G176 CarbonylContact O-C 3.59Å; L158-G176 WeakPolarHBondContact O-CA 3.11Å; L158-S177 PolarHBondContact N-O 2.81Å; L158-S177 PolarHBondContact O-N 3.19Å; L158-F179 HydrophobicContact CD1-CB 3.99Å; L158-F179 HydrophobicContact CD1-CD2 4.07Å; L158-F179 HydrophobicContact CD1-CG 4.44Å
159	Y	93.3	Very high	95.6	Very high	109 Å²	109	35.1 Å²	35.1	43%	0.427	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	135.4	179.8	-72.5	-73.3	0	0	0	111	F78 V157 K174 V175	F78-Y159 HydrophobicContact CE1-CD1 4.23Å; F78-Y159 AromaticContact CE1-CE1 3.69Å; F78-Y159 HydrophobicContact CE1-CE1 3.69Å; F78-Y159 HydrophobicContact CZ-CE1 4.26Å; V157-Y159 HydrophobicContact CB-CE2 4.25Å; V157-Y159 HydrophobicContact CG1-CD1 4.42Å; V157-Y159 HydrophobicContact CG1-CD2 4.4Å; V157-Y159 HydrophobicContact CG1-CE1 3.94Å; V157-Y159 HydrophobicContact CG1-CE2 3.94Å; Y159-K174 HydrophobicContact CD1-CD 4.41Å; Y159-K174 HydrophobicContact CD1-CG 4.04Å; Y159-K174 HydrophobicContact CG-CD 4.33Å; Y159-K174 HydrophobicContact CG-CG 4.29Å; Y159-V175 WeakPolarHBondContact CA-O 3.24Å
160	A	92.7	Very high	95.6	Very high	65 Å²	65	33.4 Å²	33.4	54%	0.537	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	152.7	172.4	0	0	0	0	0	109.8	K174 V175	A160-K174 CarbonylContact O-C 3.57Å; A160-K174 WeakPolarHBondContact O-CA 3.45Å; A160-V175 PolarHBondContact N-O 3.09Å; A160-V175 PolarHBondContact O-N 2.82Å
161	W	93.2	Very high	95.6	Very high	67 Å²	67	36.7 Å²	36.7	25%	0.254	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	128	173.7	-71.1	104.4	0	0	0	110.1	A80 P84 D86 V173 K174	A80-W161 HydrophobicContact CB-CH2 3.83Å; A80-W161 HydrophobicContact CB-CZ3 3.77Å; P84-W161 HydrophobicContact CB-CD2 4.19Å; P84-W161 HydrophobicContact CB-CG 4.4Å; P84-W161 HydrophobicContact CB-CZ2 3.92Å; P84-W161 HydrophobicContact CG-CB 3.93Å; P84-W161 HydrophobicContact CG-CD2 3.14Å; P84-W161 HydrophobicContact CG-CE3 3.72Å; P84-W161 HydrophobicContact CG-CG 3.23Å; P84-W161 HydrophobicContact CG-CH2 4.24Å; P84-W161 HydrophobicContact CG-CZ2 3.73Å; P84-W161 HydrophobicContact CG-CZ3 4.23Å; P84-W161 VanDerWaalsContact CG-NE1 3.28Å; D86-W161 PolarHBondContact OD2-NE1 2.63Å; W161-V173 VanDerWaalsContact CE3-C 3.49Å; W161-K174 HydrophobicContact CD2-CB 4.1Å; W161-K174 HydrophobicContact CE3-CB 3.98Å; W161-K174 HydrophobicContact CH2-CB 4.37Å; W161-K174 HydrophobicContact CZ2-CB 4.49Å; W161-K174 VanDerWaalsContact CZ2-CE 3.42Å; W161-K174 HydrophobicContact CZ3-CB 4.12Å
162	N	93	Very high	95.5	Very high	43 Å²	43	37.4 Å²	37.4	23%	0.23	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	140.8	176.3	-164.1	37.9	0	0	0	110.4	D45 Y172 V173 V175	D45-N162 PolarHBondContact OD1-ND2 2.94Å; D45-N162 VanDerWaalsContact OD1-ND2 3.1Å; N162-Y172 WeakPolarHBondContact O-CA 3.33Å; N162-V173 HydrophobicContact CB-CG2 4.39Å; N162-V173 PolarHBondContact N-O 2.69Å; N162-V173 PolarHBondContact O-N 2.72Å; N162-V175 HydrophobicContact CB-CB 4.5Å; N162-V175 HydrophobicContact CB-CG2 3.69Å
163	D	94.5	Very high	95.5	Very high	64 Å²	64	35.8 Å²	35.8	34%	0.342	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	109.3	174	-177.7	-3.7	0	0	0	109.5	G165 R171 Y172	D163-G165 VanDerWaalsContact C-N 3.29Å; D163-G165 WeakPolarHBondContact OD1-CA 3.44Å; D163-G165 PolarHBondContact OD1-N 2.79Å; D163-R171 WeakPolarHBondContact OD1-CG 3.19Å; D163-R171 IonicContact OD1-CZ 2.96Å; D163-R171 IonicContact OD1-NE 3.49Å; D163-R171 PolarHBondContact OD1-NE 2.83Å; D163-R171 IonicContact OD1-NH2 2.94Å; D163-R171 IonicContact OD2-CZ 3.54Å; D163-R171 VanDerWaalsContact OD2-CZ 3.27Å; D163-R171 IonicContact OD2-NE 2.72Å; D163-R171 PolarHBondContact OD2-NE 3.02Å; D163-R171 IonicContact OD2-NH2 2.85Å; D163-R171 PolarHBondContact OD2-NH2 3.34Å; D163-Y172 HydrophobicContact CB-CD1 4Å; D163-Y172 HydrophobicContact CB-CE1 3.73Å
164	L	94.2	Very high	95.4	Very high	22 Å²	22	36 Å²	36	12%	0.115	18%	0.184	C	C	.	.			trans	-80.4	-10.8	179	-58.8	-179	0	0	0	113.2	F168 R171 V173 Y222	L164-F168 HydrophobicContact CB-CB 3.69Å; L164-F168 HydrophobicContact CB-CD1 4.48Å; L164-F168 HydrophobicContact CB-CD2 3.6Å; L164-F168 HydrophobicContact CB-CE2 4.22Å; L164-F168 HydrophobicContact CB-CG 3.7Å; L164-F168 HydrophobicContact CD1-CB 4.06Å; L164-F168 HydrophobicContact CD1-CD1 4.03Å; L164-F168 HydrophobicContact CD1-CG 4.01Å; L164-F168 WeakPolarHBondContact O-CD2 3.44Å; L164-R171 WeakPolarHBondContact CB-O 3.29Å; L164-R171 PolarHBondContact N-O 2.79Å; L164-V173 HydrophobicContact CD1-CB 4.41Å; L164-V173 HydrophobicContact CD1-CG1 3.76Å; L164-V173 HydrophobicContact CD1-CG2 3.72Å; L164-V173 HydrophobicContact CD2-CG2 3.92Å; L164-V173 HydrophobicContact CG-CG1 4.49Å; L164-V173 HydrophobicContact CG-CG2 3.77Å; L164-Y222 HydrophobicContact CD1-CD2 4.4Å; L164-Y222 HydrophobicContact CD1-CE2 4.32Å; L164-Y222 HydrophobicContact CD2-CE2 3.7Å
165	G	94	Very high	95.3	Very high	22 Å²	22	36 Å²	36	23%	0.227	19%	0.186	C	C	.	.			trans	88.6	176.2	-177.4	0	0	0	0	0	115	D163 R167 F168	D163-G165 VanDerWaalsContact C-N 3.29Å; D163-G165 WeakPolarHBondContact OD1-CA 3.44Å; D163-G165 PolarHBondContact OD1-N 2.79Å; G165-R167 PolarHBondContact O-N 3.46Å; G165-R167 VanDerWaalsContact O-N 3.16Å; G165-F168 PolarHBondContact O-N 3.25Å; G165-F168 VanDerWaalsContact O-N 3.17Å
166	S	94.9	Very high	95.1	Very high	53 Å²	53	35.7 Å²	35.7	37%	0.371	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-21.9	-172	55	0	0	0	0	114.7	P56 F168	P56-S166 VanDerWaalsContact CG-O 3.23Å; P56-S166 WeakPolarHBondContact CG-O 3.39Å; S166-F168 PolarHBondContact O-N 2.79Å
167	R	96.5	Very high	95	Very high	19 Å²	19	38.4 Å²	38.4	7%	0.072	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-0.4	-179.4	-62.4	-179.7	-173.5	161.3	12.7	113	E48 H49 D51 F54 D55 G165 R204 W205 W217	E48-R167 VanDerWaalsContact OE2-CD 3.27Å; E48-R167 WeakPolarHBondContact OE2-CD 3.27Å; E48-R167 IonicContact OE2-CZ 3.23Å; E48-R167 IonicContact OE2-NE 2.76Å; E48-R167 IonicContact OE2-NH1 2.68Å; E48-R167 PolarHBondContact OE2-NH1 2.97Å; H49-R167 VanDerWaalsContact O-CZ 3.3Å; H49-R167 PolarHBondContact O-NH1 3.26Å; H49-R167 PolarHBondContact O-NH2 3.14Å; D51-R167 PolarHBondContact O-NH2 2.81Å; F54-R167 PolarHBondContact O-NE 3.21Å; D55-R167 IonicContact OD1-CZ 3.38Å; D55-R167 VanDerWaalsContact OD1-CZ 3.23Å; D55-R167 IonicContact OD1-NE 3.4Å; D55-R167 PolarHBondContact OD1-NE 3.2Å; D55-R167 IonicContact OD1-NH2 2.68Å; D55-R167 PolarHBondContact OD1-NH2 3.47Å; G165-R167 PolarHBondContact O-N 3.46Å; G165-R167 VanDerWaalsContact O-N 3.16Å; R167-R204 CarbonylContact O-C 3.59Å; R167-R204 WeakPolarHBondContact O-CA 3.33Å; R167-R204 WeakPolarHBondContact O-CD 3.2Å; R167-W205 HydrophobicContact CB-CB 4.28Å; R167-W205 PolarHBondContact O-N 2.04Å; R167-W217 WeakPolarHBondContact O-CZ3 3.46Å
168	F	97.4	Very high	95	Very high	12 Å²	12	37.8 Å²	37.8	5%	0.053	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	149.5	174.1	-70.4	-91.8	0	0	0	110.9	L46 L164 G165 S166 V202 L203 R204 I220	L46-F168 HydrophobicContact CD1-CE2 4.23Å; L46-F168 HydrophobicContact CD1-CZ 3.75Å; L164-F168 HydrophobicContact CB-CB 3.69Å; L164-F168 HydrophobicContact CB-CD1 4.48Å; L164-F168 HydrophobicContact CB-CD2 3.6Å; L164-F168 HydrophobicContact CB-CE2 4.22Å; L164-F168 HydrophobicContact CB-CG 3.7Å; L164-F168 HydrophobicContact CD1-CB 4.06Å; L164-F168 HydrophobicContact CD1-CD1 4.03Å; L164-F168 HydrophobicContact CD1-CG 4.01Å; L164-F168 WeakPolarHBondContact O-CD2 3.44Å; G165-F168 PolarHBondContact O-N 3.25Å; G165-F168 VanDerWaalsContact O-N 3.17Å; S166-F168 PolarHBondContact O-N 2.79Å; F168-V202 HydrophobicContact CD1-CG2 4.07Å; F168-L203 CarbonylContact C-O 3.56Å; F168-L203 VanDerWaalsContact CA-O 3.28Å; F168-L203 WeakPolarHBondContact CA-O 3.36Å; F168-R204 HydrophobicContact CE1-CB 4.44Å; F168-I220 HydrophobicContact CD1-CD1 4.3Å; F168-I220 HydrophobicContact CE1-CD1 3.65Å
169	W	97.8	Very high	95	Very high	14 Å²	14	38 Å²	38	5%	0.053	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	129.9	172.9	-170.5	98.3	0	0	0	110.9	L66 R67 L70 Y74 T81 L203 W217	L66-W169 VanDerWaalsContact C-CH2 3.46Å; L66-W169 VanDerWaalsContact C-CZ3 3.42Å; L66-W169 HydrophobicContact CB-CD2 3.51Å; L66-W169 VanDerWaalsContact CB-CE2 3.45Å; L66-W169 HydrophobicContact CB-CE3 3.66Å; L66-W169 HydrophobicContact CB-CG 4.19Å; L66-W169 HydrophobicContact CB-CH2 3.81Å; L66-W169 HydrophobicContact CB-CZ2 3.62Å; L66-W169 HydrophobicContact CB-CZ3 3.8Å; L66-W169 HydrophobicContact CD1-CB 4.33Å; L66-W169 HydrophobicContact CD1-CD2 3.83Å; L66-W169 HydrophobicContact CD1-CG 3.59Å; L66-W169 HydrophobicContact CG-CD2 4.23Å; L66-W169 HydrophobicContact CG-CG 4.42Å; L66-W169 WeakPolarHBondContact O-CZ3 3.46Å; R67-W169 HydrophobicContact CB-CH2 4.07Å; R67-W169 HydrophobicContact CG-CH2 3.42Å; R67-W169 VanDerWaalsContact CG-CH2 3.42Å; R67-W169 HydrophobicContact CG-CZ2 3.85Å; L70-W169 HydrophobicContact CB-CZ3 4Å; L70-W169 HydrophobicContact CD2-CZ3 3.93Å; Y74-W169 HydrophobicContact CD2-CH2 4.34Å; Y74-W169 HydrophobicContact CE2-CH2 4.45Å; T81-W169 HydrophobicContact CG2-CZ2 3.93Å; W169-L203 HydrophobicContact CB-CB 4.23Å; W169-L203 HydrophobicContact CD2-CD1 4.39Å; W169-L203 HydrophobicContact CE3-CD1 3.59Å; W169-L203 HydrophobicContact CE3-CG 4.09Å; W169-L203 HydrophobicContact CZ3-CD1 4.19Å; W169-L203 PolarHBondContact N-O 2.83Å; W169-L203 WeakPolarHBondContact O-CA 3.44Å; W169-L203 WeakPolarHBondContact O-CB 3.41Å; W169-L203 PolarHBondContact O-N 2.72Å; W169-W217 HydrophobicContact CB-CE3 4.25Å; W169-W217 HydrophobicContact CB-CH2 3.78Å; W169-W217 HydrophobicContact CB-CZ2 4.35Å; W169-W217 HydrophobicContact CB-CZ3 3.72Å
170	P	96.7	Very high	95.1	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.203	C	C	.	.	S	Bend	cis	-61.7	148.2	-9.2	-22	36.6	0	0	0	111.6	Y74 M79 A80 T81 Y172	Y74-P170 HydrophobicContact CD2-CG 3.89Å; Y74-P170 HydrophobicContact CE2-CG 3.56Å; M79-P170 HydrophobicContact CB-CB 4.28Å; M79-P170 HydrophobicContact CB-CG 4Å; M79-P170 HydrophobicContact SD-CG 4.37Å; A80-P170 VanDerWaalsContact O-CB 3.25Å; A80-P170 WeakPolarHBondContact O-CB 3.49Å; T81-P170 HydrophobicContact CG2-CB 4.2Å; P170-Y172 PolarHBondContact O-N 2.83Å
171	R	96.1	Very high	95.2	Very high	97 Å²	97	41.6 Å²	41.6	37%	0.366	22%	0.215	S	C	.	.	S	Bend	trans	-67.5	-36.2	-172.1	174.8	172.6	176.4	-173.1	-3.3	112.6	D163 L164	D163-R171 WeakPolarHBondContact OD1-CG 3.19Å; D163-R171 IonicContact OD1-CZ 2.96Å; D163-R171 IonicContact OD1-NE 3.49Å; D163-R171 PolarHBondContact OD1-NE 2.83Å; D163-R171 IonicContact OD1-NH2 2.94Å; D163-R171 IonicContact OD2-CZ 3.54Å; D163-R171 VanDerWaalsContact OD2-CZ 3.27Å; D163-R171 IonicContact OD2-NE 2.72Å; D163-R171 PolarHBondContact OD2-NE 3.02Å; D163-R171 IonicContact OD2-NH2 2.85Å; D163-R171 PolarHBondContact OD2-NH2 3.34Å; L164-R171 WeakPolarHBondContact CB-O 3.29Å; L164-R171 PolarHBondContact N-O 2.79Å
172	Y	96.1	Very high	95.2	Very high	30 Å²	30	42.2 Å²	42.2	12%	0.118	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	131.6	-176.5	-57.8	-87.6	0	0	0	110.3	M79 A80 T81 S82 P83 N162 D163 P170	M79-Y172 WeakPolarHBondContact CA-O 3.27Å; A80-Y172 PolarHBondContact N-O 2.99Å; A80-Y172 PolarHBondContact O-N 3.09Å; T81-Y172 WeakPolarHBondContact O-CD2 3.19Å; T81-Y172 WeakPolarHBondContact O-CE2 3.33Å; S82-Y172 WeakPolarHBondContact O-CD2 3.47Å; P83-Y172 HydrophobicContact CB-CE1 4.17Å; P83-Y172 HydrophobicContact CB-CE2 4.48Å; P83-Y172 HydrophobicContact CG-CE1 4.12Å; P83-Y172 HydrophobicContact CG-CE2 3.97Å; P83-Y172 WeakPolarHBondContact CG-OH 3.48Å; P83-Y172 VanDerWaalsContact N-CE2 3.32Å; N162-Y172 WeakPolarHBondContact O-CA 3.33Å; D163-Y172 HydrophobicContact CB-CD1 4Å; D163-Y172 HydrophobicContact CB-CE1 3.73Å; P170-Y172 PolarHBondContact O-N 2.83Å
173	V	95.3	Very high	95.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	143.3	176.4	-63.1	0	0	0	0	110.5	F78 W161 N162 L164 V175 L200 V202 Y222	F78-V173 CarbonylContact O-C 3.58Å; F78-V173 VanDerWaalsContact O-CA 3.26Å; F78-V173 WeakPolarHBondContact O-CA 3.36Å; W161-V173 VanDerWaalsContact CE3-C 3.49Å; N162-V173 HydrophobicContact CB-CG2 4.39Å; N162-V173 PolarHBondContact N-O 2.69Å; N162-V173 PolarHBondContact O-N 2.72Å; L164-V173 HydrophobicContact CD1-CB 4.41Å; L164-V173 HydrophobicContact CD1-CG1 3.76Å; L164-V173 HydrophobicContact CD1-CG2 3.72Å; L164-V173 HydrophobicContact CD2-CG2 3.92Å; L164-V173 HydrophobicContact CG-CG1 4.49Å; L164-V173 HydrophobicContact CG-CG2 3.77Å; V173-V175 HydrophobicContact CG2-CG2 3.75Å; V173-L200 HydrophobicContact CB-CD1 4.27Å; V173-L200 HydrophobicContact CG1-CD1 4.45Å; V173-V202 HydrophobicContact CG1-CG1 4.11Å; V173-Y222 HydrophobicContact CG2-CE1 4.36Å
174	K	94.7	Very high	95.6	Very high	48 Å²	48	38 Å²	38	21%	0.209	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	114.6	175	-169	176	-73.9	162.3	0	108.9	G77 F78 Y159 A160 W161	G77-K174 WeakPolarHBondContact O-CD 3.36Å; G77-K174 WeakPolarHBondContact O-CE 3.5Å; G77-K174 PolarHBondContact O-NZ 2.81Å; F78-K174 HydrophobicContact CD1-CB 4.01Å; F78-K174 WeakPolarHBondContact CD1-O 3.26Å; F78-K174 PolarHBondContact O-N 2.79Å; Y159-K174 HydrophobicContact CD1-CD 4.41Å; Y159-K174 HydrophobicContact CD1-CG 4.04Å; Y159-K174 HydrophobicContact CG-CD 4.33Å; Y159-K174 HydrophobicContact CG-CG 4.29Å; A160-K174 CarbonylContact O-C 3.57Å; A160-K174 WeakPolarHBondContact O-CA 3.45Å; W161-K174 HydrophobicContact CD2-CB 4.1Å; W161-K174 HydrophobicContact CE3-CB 3.98Å; W161-K174 HydrophobicContact CH2-CB 4.37Å; W161-K174 HydrophobicContact CZ2-CB 4.49Å; W161-K174 VanDerWaalsContact CZ2-CE 3.42Å; W161-K174 HydrophobicContact CZ3-CB 4.12Å
175	V	94	Very high	95.7	Very high	33 Å²	33	37.5 Å²	37.5	20%	0.2	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	136.1	-176	-173.9	0	0	0	0	109.5	Y159 A160 N162 V173 Y222 I224	Y159-V175 WeakPolarHBondContact CA-O 3.24Å; A160-V175 PolarHBondContact N-O 3.09Å; A160-V175 PolarHBondContact O-N 2.82Å; N162-V175 HydrophobicContact CB-CB 4.5Å; N162-V175 HydrophobicContact CB-CG2 3.69Å; V173-V175 HydrophobicContact CG2-CG2 3.75Å; V175-Y222 HydrophobicContact CG2-CE1 4.39Å; V175-I224 HydrophobicContact CG1-CG2 4.37Å; V175-I224 HydrophobicContact CG2-CG2 4.31Å
176	G	94.1	Very high	95.8	Very high	2 Å²	2	40.9 Å²	40.9	2%	0.021	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	148.2	172.3	0	0	0	0	0	112.1	L158 I225	L158-G176 CarbonylContact O-C 3.59Å; L158-G176 WeakPolarHBondContact O-CA 3.11Å; G176-I225 WeakPolarHBondContact O-CD1 3.33Å
177	S	95.6	Very high	95.8	Very high	63 Å²	63	43.9 Å²	43.9	44%	0.441	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	152.9	174.2	-175.7	0	0	0	0	110.8	L158	L158-S177 PolarHBondContact N-O 2.81Å; L158-S177 PolarHBondContact O-N 3.19Å
178	C	96.2	Very high	95.8	Very high	14 Å²	14	51 Å²	51	10%	0.095	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	135.8	176.4	-54.8	0	0	0	0	110.6	S180 C192 P194 C228	C178-S180 PolarHBondContact O-N 3.43Å; C178-C192 HydrophobicContact CB-CB 4.22Å; C178-P194 VanDerWaalsContact SG-N 3.38Å; C178-C228 WeakPolarHBondContact CA-SG 3.47Å; C178-C228 HydrophobicContact CB-CB 3.9Å; C178-C228 WeakPolarHBondContact CB-SG 3.43Å; C178-C228 WeakPolarHBondContact SG-CB 3.37Å; C178-C228 CovalentContact SG-SG 2.03Å; C178-C228 PolarHBondContact SG-SG 3.12Å
179	F	95.7	Very high	95.8	Very high	22 Å²	22	53.3 Å²	53.3	10%	0.096	29%	0.29	C	S	.	.			trans	-77.9	111.9	176.1	-171.1	-102.5	0	0	0	111.8	L101 A102 D105 L158 K181 R182 C192	L101-F179 HydrophobicContact CB-CE2 4.48Å; A102-F179 HydrophobicContact CB-CE2 4.34Å; A102-F179 HydrophobicContact CB-CZ 3.84Å; D105-F179 HydrophobicContact CB-CB 4.16Å; D105-F179 HydrophobicContact CB-CD1 3.79Å; D105-F179 HydrophobicContact CB-CD2 4.18Å; D105-F179 HydrophobicContact CB-CE1 4.17Å; D105-F179 HydrophobicContact CB-CG 3.78Å; D105-F179 WeakPolarHBondContact OD1-CB 3.35Å; D105-F179 WeakPolarHBondContact OD2-CD1 3.45Å; L158-F179 HydrophobicContact CD1-CB 3.99Å; L158-F179 HydrophobicContact CD1-CD2 4.07Å; L158-F179 HydrophobicContact CD1-CG 4.44Å; F179-K181 HydrophobicContact CE1-CB 4Å; F179-K181 HydrophobicContact CE2-CB 4.12Å; F179-K181 HydrophobicContact CE2-CG 4.12Å; F179-K181 HydrophobicContact CZ-CB 3.66Å; F179-K181 HydrophobicContact CZ-CG 4.17Å; F179-R182 HydrophobicContact CD1-CG 3.97Å; F179-R182 HydrophobicContact CE1-CB 4.29Å; F179-R182 HydrophobicContact CE1-CG 3.79Å; F179-C192 WeakPolarHBondContact O-CB 3.48Å
180	S	94.5	Very high	95.8	Very high	67 Å²	67	55.6 Å²	55.6	47%	0.469	30%	0.302	S	S	.	.			trans	-113.4	8.1	-172.9	60	0	0	0	0	114.8	C178 R182	C178-S180 PolarHBondContact O-N 3.43Å; S180-R182 VanDerWaalsContact C-N 3.29Å; S180-R182 PolarHBondContact O-N 3.24Å
181	K	94.3	Very high	95.8	Very high	181 Å²	181	57.6 Å²	57.6	79%	0.787	32%	0.315	S	S	*	.	S	Bend	trans	-82.2	-1.2	-178.6	-55.6	-60.5	-174	-178.9	0	114.3	F179	F179-K181 HydrophobicContact CE1-CB 4Å; F179-K181 HydrophobicContact CE2-CB 4.12Å; F179-K181 HydrophobicContact CE2-CG 4.12Å; F179-K181 HydrophobicContact CZ-CB 3.66Å; F179-K181 HydrophobicContact CZ-CG 4.17Å
182	R	94.4	Very high	95.9	Very high	81 Å²	81	53.2 Å²	53.2	31%	0.306	30%	0.298	S	S	.	.	S	Bend	trans	-138.3	155.2	175.6	71.6	-178.4	-64.4	-85.9	1.3	111.5	D105 R109 F179 S180	D105-R182 WeakPolarHBondContact OD2-CD 3.2Å; R109-R182 VanDerWaalsContact CZ-NH1 3.27Å; F179-R182 HydrophobicContact CD1-CG 3.97Å; F179-R182 HydrophobicContact CE1-CB 4.29Å; F179-R182 HydrophobicContact CE1-CG 3.79Å; S180-R182 VanDerWaalsContact C-N 3.29Å; S180-R182 PolarHBondContact O-N 3.24Å
183	S	97.1	Very high	96	Very high	19 Å²	19	55.5 Å²	55.5	13%	0.133	31%	0.309	C	S	.	.			trans	-67.7	138.9	170.1	175.6	0	0	0	0	110.9	S185 E188 G189 M190	S183-S185 PolarHBondContact OG-N 3.27Å; S183-S185 PolarHBondContact OG-O 3.43Å; S183-S185 PolarHBondContact OG-OG 3.1Å; S183-S185 VanDerWaalsContact OG-OG 3.05Å; S183-E188 WeakPolarHBondContact OG-CA 3.3Å; S183-G189 PolarHBondContact OG-N 3.07Å; S183-M190 WeakPolarHBondContact CA-O 3.4Å; S183-M190 PolarHBondContact OG-O 2.79Å
184	C	97.3	Very high	96.1	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.323	C	S	.	.			trans	-99.7	8.4	170.6	58.3	0	0	0	0	112.6	T153 M190 V191 C230	T153-C184 VanDerWaalsContact CA-O 3.23Å; T153-C184 WeakPolarHBondContact CA-O 3.39Å; T153-C184 WeakPolarHBondContact CG2-O 3.31Å; C184-M190 PolarHBondContact N-O 2.65Å; C184-M190 VanDerWaalsContact SG-C 3.55Å; C184-M190 PolarHBondContact SG-O 3.24Å; C184-M190 VanDerWaalsContact SG-O 3.36Å; C184-V191 VanDerWaalsContact SG-CA 3.56Å; C184-C230 HydrophobicContact CB-CB 3.82Å; C184-C230 WeakPolarHBondContact CB-SG 3.29Å; C184-C230 PolarHBondContact O-SG 3.2Å; C184-C230 WeakPolarHBondContact SG-CA 3.36Å; C184-C230 WeakPolarHBondContact SG-CB 3.42Å; C184-C230 CovalentContact SG-SG 2.03Å; C184-C230 PolarHBondContact SG-SG 3.17Å
185	S	97.3	Very high	96.2	Very high	11 Å²	11	58 Å²	58	8%	0.077	33%	0.331	C	S	.	.	S	Bend	trans	-125.2	162.4	-173.1	52.1	0	0	0	0	112.6	S183 P187 G189 M190	S183-S185 PolarHBondContact OG-N 3.27Å; S183-S185 PolarHBondContact OG-O 3.43Å; S183-S185 PolarHBondContact OG-OG 3.1Å; S183-S185 VanDerWaalsContact OG-OG 3.05Å; S185-P187 CarbonylContact C-O 3.59Å; S185-P187 WeakPolarHBondContact CB-O 3.44Å; S185-P187 CarbonylContact O-C 3.58Å; S185-P187 PolarHBondContact OG-O 3.13Å; S185-P187 VanDerWaalsContact OG-O 3.13Å; S185-G189 PolarHBondContact OG-N 3.16Å; S185-M190 VanDerWaalsContact OG-CB 3.32Å; S185-M190 WeakPolarHBondContact OG-CB 3.42Å; S185-M190 PolarHBondContact OG-N 3.4Å
186	V	95.6	Very high	96.3	Very high	92 Å²	92	61.7 Å²	61.7	56%	0.558	35%	0.345	S	S	*	.	S	Bend	trans	-130.5	117	173.2	-177.5	0	0	0	0	107.4	W148 Q152	W148-V186 HydrophobicContact CH2-CG2 3.84Å; W148-V186 HydrophobicContact CZ3-CG2 4.36Å; Q152-V186 HydrophobicContact CG-CG2 3.92Å
187	P	96	Very high	96.4	Very high	116 Å²	116	64.2 Å²	64.2	75%	0.753	36%	0.362	S	S	*	.	S	Bend	cis	-64.1	171.1	-6.6	32	-36.9	0	0	0	112.1	S185	S185-P187 CarbonylContact C-O 3.59Å; S185-P187 WeakPolarHBondContact CB-O 3.44Å; S185-P187 CarbonylContact O-C 3.58Å; S185-P187 PolarHBondContact OG-O 3.13Å; S185-P187 VanDerWaalsContact OG-O 3.13Å
188	E	96.2	Very high	96.4	Very high	169 Å²	169	64.5 Å²	64.5	79%	0.79	36%	0.361	S	S	*	.	S	Bend	trans	-63.3	141.6	-179.5	-60.7	-171.7	153.6	0	0	112.5	S183	S183-E188 WeakPolarHBondContact OG-CA 3.3Å
189	G	96.4	Very high	96.4	Very high	61 Å²	61	69.1 Å²	69.1	63%	0.629	38%	0.381	S	S	*	.			trans	164.7	-34.2	175.5	0	0	0	0	0	115	S183 S185	S183-G189 PolarHBondContact OG-N 3.07Å; S185-G189 PolarHBondContact OG-N 3.16Å
190	M	97.9	Very high	96.5	Very high	61 Å²	61	68.8 Å²	68.8	30%	0.3	38%	0.38	S	S	.	.			trans	-90.8	149.6	177.3	-51.5	173.4	69.9	0	0	111.7	S183 C184 S185 C230 S231	S183-M190 WeakPolarHBondContact CA-O 3.4Å; S183-M190 PolarHBondContact OG-O 2.79Å; C184-M190 PolarHBondContact N-O 2.65Å; C184-M190 VanDerWaalsContact SG-C 3.55Å; C184-M190 PolarHBondContact SG-O 3.24Å; C184-M190 VanDerWaalsContact SG-O 3.36Å; S185-M190 VanDerWaalsContact OG-CB 3.32Å; S185-M190 WeakPolarHBondContact OG-CB 3.42Å; S185-M190 PolarHBondContact OG-N 3.4Å; M190-C230 VanDerWaalsContact CB-SG 3.57Å; M190-C230 WeakPolarHBondContact CE-O 3.25Å; M190-S231 WeakPolarHBondContact CA-O 3.4Å; M190-S231 WeakPolarHBondContact CB-O 3.44Å
191	V	97.9	Very high	96.7	Very high	43 Å²	43	66.1 Å²	66.1	26%	0.261	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	160.3	177.8	-64.2	0	0	0	0	111.4	C184 K193 S231	C184-V191 VanDerWaalsContact SG-CA 3.56Å; V191-K193 HydrophobicContact CG2-CG 4.15Å; V191-K193 PolarHBondContact O-N 3.32Å; V191-S231 PolarHBondContact N-O 2.85Å; V191-S231 PolarHBondContact O-N 3.06Å
192	C	97.7	Very high	96.8	Very high	4 Å²	4	57.5 Å²	57.5	3%	0.027	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	123	175	-64.9	0	0	0	0	110.2	R109 C155 C178 F179	R109-C192 PolarHBondContact NH2-SG 3.29Å; R109-C192 VanDerWaalsContact NH2-SG 3.38Å; C155-C192 VanDerWaalsContact CA-SG 3.56Å; C155-C192 HydrophobicContact CB-CB 3.62Å; C155-C192 WeakPolarHBondContact CB-SG 3.45Å; C155-C192 VanDerWaalsContact SG-CA 3.51Å; C155-C192 WeakPolarHBondContact SG-CB 3.26Å; C155-C192 CovalentContact SG-SG 2.03Å; C155-C192 PolarHBondContact SG-SG 3.45Å; C178-C192 HydrophobicContact CB-CB 4.22Å; F179-C192 WeakPolarHBondContact O-CB 3.48Å
193	K	97.6	Very high	97	Very high	79 Å²	79	53.6 Å²	53.6	34%	0.343	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	157.4	176.4	-62.6	-172.5	-175.8	175.9	0	110.7	V191 S195 C228 K229 C232	V191-K193 HydrophobicContact CG2-CG 4.15Å; V191-K193 PolarHBondContact O-N 3.32Å; K193-S195 PolarHBondContact O-N 3.2Å; K193-C228 CarbonylContact O-C 3.17Å; K193-C228 WeakPolarHBondContact O-CA 3.43Å; K193-K229 PolarHBondContact N-O 3.39Å; K193-K229 PolarHBondContact O-N 2.99Å; K193-C232 WeakPolarHBondContact CE-OXT 3.48Å; K193-C232 PolarHBondContact NZ-O 3.11Å; K193-C232 PolarHBondContact NZ-OXT 3.1Å
194	P	97.4	Very high	97	Very high	45 Å²	45	54.8 Å²	54.8	29%	0.292	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	132.4	173.9	-25.1	36.8	0	0	0	111.1	L41 C178 I225	L41-P194 HydrophobicContact CB-CB 4.16Å; L41-P194 HydrophobicContact CB-CG 4.18Å; C178-P194 VanDerWaalsContact SG-N 3.38Å; P194-I225 HydrophobicContact CB-CD1 4.13Å; P194-I225 HydrophobicContact CB-CG1 4.06Å; P194-I225 HydrophobicContact CB-CG2 4.18Å; P194-I225 HydrophobicContact CG-CD1 3.55Å; P194-I225 HydrophobicContact CG-CG1 4.05Å
195	S	96.4	Very high	97	Very high	55 Å²	55	55.6 Å²	55.6	39%	0.385	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	-25.2	177.6	59.7	0	0	0	0	113.6	K193 E227	K193-S195 PolarHBondContact O-N 3.2Å; S195-E227 PolarHBondContact N-O 3.42Å; S195-E227 PolarHBondContact OG-O 3.12Å
196	K	96.3	Very high	97	Very high	111 Å²	111	62.4 Å²	62.4	48%	0.483	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	153.3	171	-58.4	-167.7	-164.6	147.1	0	110.9	S226 E227	K196-S226 VanDerWaalsContact C-OG 3.3Å; K196-S226 PolarHBondContact O-N 3.16Å; K196-S226 PolarHBondContact O-OG 3.17Å; K196-E227 HydrophobicContact CB-CB 3.95Å; K196-E227 HydrophobicContact CB-CG 4.19Å; K196-E227 VanDerWaalsContact CD-CD 3.42Å; K196-E227 HydrophobicContact CD-CG 4.26Å; K196-E227 WeakPolarHBondContact CD-OE1 3.4Å; K196-E227 VanDerWaalsContact CD-OE2 3.25Å; K196-E227 WeakPolarHBondContact CD-OE2 3.45Å; K196-E227 WeakPolarHBondContact CE-OE2 3.4Å; K196-E227 HydrophobicContact CG-CB 4.2Å; K196-E227 HydrophobicContact CG-CG 4.38Å; K196-E227 PolarHBondContact N-O 2.76Å; K196-E227 IonicContact NZ-OE1 3.24Å; K196-E227 PolarHBondContact NZ-OE1 2.85Å; K196-E227 IonicContact NZ-OE2 3.79Å; K196-E227 PolarHBondContact NZ-OE2 3.46Å; K196-E227 PolarHBondContact O-N 2.85Å
197	S	96	Very high	96.9	Very high	54 Å²	54	59.5 Å²	59.5	38%	0.378	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	159.7	173.2	62.3	0	0	0	0	110.5	L41 I224 S226	L41-S197 VanDerWaalsContact CD1-CB 3.4Å; S197-I224 CarbonylContact C-O 3.53Å; S197-I224 WeakPolarHBondContact CA-O 3.39Å; S197-I224 WeakPolarHBondContact CB-O 3.35Å; S197-S226 PolarHBondContact N-OG 3.23Å
198	V	96.5	Very high	96.6	Very high	70 Å²	70	60.8 Å²	60.8	42%	0.424	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	160.8	164.6	-64.1	0	0	0	0	108.4	P223 I224	V198-P223 WeakPolarHBondContact O-CA 3.49Å; V198-I224 HydrophobicContact CG2-CD1 3.86Å; V198-I224 HydrophobicContact CG2-CG1 3.54Å; V198-I224 PolarHBondContact N-O 3.01Å; V198-I224 PolarHBondContact O-N 3.31Å
199	H	96.8	Very high	96.1	Very high	111 Å²	111	60 Å²	60	51%	0.514	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	132	178.2	-65.5	-76.3	0	0	0	111.2	Q221 Y222	H199-Q221 HydrophobicContact CB-CB 4.26Å; H199-Q221 VanDerWaalsContact CB-OE1 3.24Å; H199-Y222 WeakPolarHBondContact CA-O 3.45Å
200	L	96.6	Very high	95.6	Very high	14 Å²	14	68.8 Å²	68.8	7%	0.073	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	133.4	162.9	-62.6	-176.6	0	0	0	108.3	F78 M79 V173 V202 Y222 I224	F78-L200 HydrophobicContact CB-CD1 4.08Å; F78-L200 HydrophobicContact CB-CD2 3.98Å; F78-L200 HydrophobicContact CG-CD2 4.36Å; M79-L200 HydrophobicContact CE-CB 3.83Å; M79-L200 HydrophobicContact CE-CD1 4.47Å; M79-L200 HydrophobicContact CE-CD2 4.17Å; M79-L200 HydrophobicContact CE-CG 4.37Å; V173-L200 HydrophobicContact CB-CD1 4.27Å; V173-L200 HydrophobicContact CG1-CD1 4.45Å; L200-V202 HydrophobicContact CB-CG1 4.37Å; L200-Y222 PolarHBondContact N-O 2.8Å; L200-Y222 PolarHBondContact O-N 2.96Å; L200-I224 HydrophobicContact CD1-CD1 4.04Å; L200-I224 HydrophobicContact CD1-CG2 3.98Å; L200-I224 HydrophobicContact CD2-CD1 4.09Å; L200-I224 HydrophobicContact CG-CD1 3.92Å; L200-I224 HydrophobicContact CG-CG1 4.25Å; L200-I224 HydrophobicContact CG-CG2 4.27Å
201	T	98.1	Very high	94.9	Very high	11 Å²	11	67.8 Å²	67.8	7%	0.067	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	116.1	168	-59.9	0	0	0	0	108.1	L70 H73 M79 P219 I220 Q221	L70-T201 HydrophobicContact CD1-CG2 4.27Å; L70-T201 VanDerWaalsContact CD1-O 3.3Å; L70-T201 WeakPolarHBondContact CD1-O 3.4Å; H73-T201 HydrophobicContact CB-CG2 4.17Å; M79-T201 WeakPolarHBondContact CE-O 3.48Å; T201-P219 HydrophobicContact CG2-CB 4Å; T201-I220 WeakPolarHBondContact CA-O 3.23Å; T201-Q221 PolarHBondContact OG1-NE2 3.29Å; T201-Q221 PolarHBondContact OG1-OE1 3.36Å
202	V	97.5	Very high	94.2	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	165.6	177	-60.5	0	0	0	0	109.5	M79 F168 V173 L200 P219 I220	M79-V202 HydrophobicContact CE-CG1 4.05Å; F168-V202 HydrophobicContact CD1-CG2 4.07Å; V173-V202 HydrophobicContact CG1-CG1 4.11Å; L200-V202 HydrophobicContact CB-CG1 4.37Å; V202-P219 CarbonylContact O-C 3.48Å; V202-P219 WeakPolarHBondContact O-CA 3.44Å; V202-I220 HydrophobicContact CG2-CD1 3.71Å; V202-I220 HydrophobicContact CG2-CG1 3.64Å; V202-I220 PolarHBondContact N-O 2.87Å; V202-I220 WeakPolarHBondContact O-CG1 3.25Å; V202-I220 PolarHBondContact O-N 3.25Å
203	L	98.3	Very high	93.7	Very high	0 Å²	0	72 Å²	72	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	137.3	174.4	-54.5	-179.5	0	0	0	110.2	L66 L69 L70 F168 W169 W217 I218 P219	L66-L203 HydrophobicContact CB-CD1 4.13Å; L66-L203 HydrophobicContact CD2-CD1 3.93Å; L69-L203 HydrophobicContact CB-CD1 4.34Å; L69-L203 HydrophobicContact CD2-CD1 3.97Å; L69-L203 HydrophobicContact CD2-CD2 4.2Å; L69-L203 HydrophobicContact CG-CD1 4.24Å; L69-L203 HydrophobicContact CG-CD2 4.11Å; L70-L203 HydrophobicContact CB-CG 4.45Å; L70-L203 HydrophobicContact CD1-CD2 3.79Å; L70-L203 HydrophobicContact CD1-CG 3.87Å; F168-L203 CarbonylContact C-O 3.56Å; F168-L203 VanDerWaalsContact CA-O 3.28Å; F168-L203 WeakPolarHBondContact CA-O 3.36Å; W169-L203 HydrophobicContact CB-CB 4.23Å; W169-L203 HydrophobicContact CD2-CD1 4.39Å; W169-L203 HydrophobicContact CE3-CD1 3.59Å; W169-L203 HydrophobicContact CE3-CG 4.09Å; W169-L203 HydrophobicContact CZ3-CD1 4.19Å; W169-L203 PolarHBondContact N-O 2.83Å; W169-L203 WeakPolarHBondContact O-CA 3.44Å; W169-L203 WeakPolarHBondContact O-CB 3.41Å; W169-L203 PolarHBondContact O-N 2.72Å; L203-W217 HydrophobicContact CB-CB 4.46Å; L203-W217 HydrophobicContact CB-CD2 4.35Å; L203-W217 HydrophobicContact CB-CE3 3.63Å; L203-W217 HydrophobicContact CB-CZ3 4.26Å; L203-W217 HydrophobicContact CD1-CB 4.38Å; L203-I218 CarbonylContact C-O 3.18Å; L203-I218 WeakPolarHBondContact CA-O 3.48Å; L203-P219 HydrophobicContact CD2-CB 4.43Å
204	R	97.6	Very high	93.4	Very high	43 Å²	43	76.3 Å²	76.3	16%	0.162	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	131.8	172.3	174.8	64.1	-170	-163.2	-9.4	109.9	E48 R167 F168 R206 W217 I218 I220	E48-R204 IonicContact OE1-CZ 3.93Å; E48-R204 IonicContact OE1-NH1 2.99Å; E48-R204 PolarHBondContact OE1-NH1 2.91Å; E48-R204 IonicContact OE1-NH2 3.6Å; E48-R204 PolarHBondContact OE1-NH2 3.28Å; E48-R204 IonicContact OE2-CZ 2.76Å; E48-R204 IonicContact OE2-NH1 3.57Å; E48-R204 IonicContact OE2-NH2 2.81Å; E48-R204 PolarHBondContact OE2-NH2 3.11Å; R167-R204 CarbonylContact O-C 3.59Å; R167-R204 WeakPolarHBondContact O-CA 3.33Å; R167-R204 WeakPolarHBondContact O-CD 3.2Å; F168-R204 HydrophobicContact CE1-CB 4.44Å; R204-R206 PolarHBondContact O-N 2.89Å; R204-W217 VanDerWaalsContact C-CE3 3.48Å; R204-I218 HydrophobicContact CB-CG1 4.35Å; R204-I218 PolarHBondContact N-O 3.33Å; R204-I218 WeakPolarHBondContact O-CG1 3.28Å; R204-I218 PolarHBondContact O-N 3.49Å; R204-I220 HydrophobicContact CB-CD1 4.32Å; R204-I220 HydrophobicContact CB-CG1 3.97Å; R204-I220 HydrophobicContact CB-CG2 3.75Å
205	W	97.5	Very high	93.3	Very high	18 Å²	18	76 Å²	76	7%	0.068	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	118	170.2	-172.2	-115.9	0	0	0	109.4	P56 D60 R167 C215 W217	P56-W205 HydrophobicContact CB-CD2 3.84Å; P56-W205 HydrophobicContact CB-CE3 4.27Å; P56-W205 HydrophobicContact CB-CG 4.07Å; P56-W205 HydrophobicContact CB-CZ2 4.22Å; P56-W205 HydrophobicContact CG-CG 4.26Å; D60-W205 HydrophobicContact CB-CH2 3.75Å; D60-W205 HydrophobicContact CB-CZ2 4.39Å; D60-W205 HydrophobicContact CB-CZ3 4.07Å; R167-W205 HydrophobicContact CB-CB 4.28Å; R167-W205 PolarHBondContact O-N 2.04Å; W205-C215 HydrophobicContact CD2-CB 4.19Å; W205-C215 HydrophobicContact CH2-CB 3.85Å; W205-C215 HydrophobicContact CZ2-CB 3.19Å; W205-W217 HydrophobicContact CB-CD2 4.49Å; W205-W217 HydrophobicContact CB-CE3 4.08Å; W205-W217 HydrophobicContact CB-CH2 3.92Å; W205-W217 HydrophobicContact CB-CZ2 4.31Å; W205-W217 HydrophobicContact CB-CZ3 3.79Å; W205-W217 AromaticContact CE3-CD1 3.7Å; W205-W217 AromaticContact CE3-CD2 3.75Å; W205-W217 HydrophobicContact CE3-CD2 3.75Å; W205-W217 AromaticContact CE3-CE2 3.59Å; W205-W217 HydrophobicContact CE3-CE3 4.43Å; W205-W217 AromaticContact CE3-CG 3.84Å; W205-W217 HydrophobicContact CE3-CG 3.84Å; W205-W217 HydrophobicContact CE3-CZ2 4.17Å; W205-W217 AromaticContact CE3-NE1 3.56Å; W205-W217 AromaticContact CZ3-CD1 3.62Å; W205-W217 HydrophobicContact CZ3-CD2 4.44Å; W205-W217 HydrophobicContact CZ3-CG 4.15Å; W205-W217 AromaticContact CZ3-NE1 3.62Å
206	R	95.7	Very high	93.3	Very high	154 Å²	154	74.6 Å²	74.6	58%	0.581	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-129.5	126.1	-175.9	-178.5	-177.4	177.6	-173	0.8	110.9	R204 C215 G216 I218	R204-R206 PolarHBondContact O-N 2.89Å; R206-C215 VanDerWaalsContact O-CA 3.24Å; R206-C215 WeakPolarHBondContact O-CA 3.38Å; R206-G216 PolarHBondContact N-O 3.43Å; R206-G216 PolarHBondContact O-N 3.49Å; R206-G216 VanDerWaalsContact O-N 3.09Å; R206-I218 HydrophobicContact CB-CD1 4Å; R206-I218 HydrophobicContact CB-CG1 4.17Å; R206-I218 HydrophobicContact CG-CD1 4.41Å
207	C	94.2	Very high	93.4	Very high	31 Å²	31	70.9 Å²	70.9	21%	0.209	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	127.9	171.5	-56.8	0	0	0	0	110.9	C215	C207-C215 HydrophobicContact CB-CB 4.08Å; C207-C215 WeakPolarHBondContact CB-SG 3.06Å; C207-C215 WeakPolarHBondContact SG-CB 3.14Å; C207-C215 CovalentContact SG-SG 2.04Å; C207-C215 PolarHBondContact SG-SG 3.28Å
208	Q	89.7	Confident	93.4	Very high	142 Å²	142	71.1 Å²	71.1	66%	0.664	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	-26	-176.4	-64	179	10.1	0	0	113.5	Q213 R214	Q208-Q213 PolarHBondContact N-O 3.02Å; Q208-R214 HydrophobicContact CB-CB 4.41Å; Q208-R214 PolarHBondContact N-O 2.89Å
209	R	86.9	Confident	93.5	Very high	154 Å²	154	71.9 Å²	71.9	58%	0.581	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.5	155.6	-174.7	-66.8	-70	-176.6	165	-0.6	110.1	Q213	R209-Q213 HydrophobicContact CB-CB 3.92Å; R209-Q213 PolarHBondContact N-O 3.18Å
210	R	84.3	Confident	93.5	Very high	245 Å²	245	68.8 Å²	68.8	93%	0.925	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	147.2	172.2	-64.3	-176.9	-180	178.9	-0.5	109.8
211	G	83.6	Confident	93.5	Very high	39 Å²	39	73.5 Å²	73.5	40%	0.402	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.9	31	178.1	0	0	0	0	0	114.9	Q213	G211-Q213 VanDerWaalsContact C-N 3.33Å; G211-Q213 PolarHBondContact O-N 2.92Å; G211-Q213 PolarHBondContact O-NE2 3.43Å
212	G	83.3	Confident	93.3	Very high	14 Å²	14	74.2 Å²	74.2	14%	0.144	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.2	30.8	173.3	0	0	0	0	0	114.5	C215	G212-C215 PolarHBondContact O-SG 3.49Å
213	Q	87.5	Confident	93.3	Very high	122 Å²	122	75.5 Å²	75.5	57%	0.57	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.5	149.6	-179.6	-57.9	-59.8	-51.3	0	0	111.5	Q208 R209 G211	Q208-Q213 PolarHBondContact N-O 3.02Å; R209-Q213 HydrophobicContact CB-CB 3.92Å; R209-Q213 PolarHBondContact N-O 3.18Å; G211-Q213 VanDerWaalsContact C-N 3.33Å; G211-Q213 PolarHBondContact O-N 2.92Å; G211-Q213 PolarHBondContact O-NE2 3.43Å
214	R	91.1	Very high	93.1	Very high	169 Å²	169	75.6 Å²	75.6	64%	0.638	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	51.8	58.9	-177.4	-60	-175.9	-177.9	-170.7	-2	111.8	Q208	Q208-R214 HydrophobicContact CB-CB 4.41Å; Q208-R214 PolarHBondContact N-O 2.89Å
215	C	95.6	Very high	93.1	Very high	38 Å²	38	73.8 Å²	73.8	26%	0.257	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	153.8	176.3	-46.4	0	0	0	0	111.1	W205 R206 C207 G212	W205-C215 HydrophobicContact CD2-CB 4.19Å; W205-C215 HydrophobicContact CH2-CB 3.85Å; W205-C215 HydrophobicContact CZ2-CB 3.19Å; R206-C215 VanDerWaalsContact O-CA 3.24Å; R206-C215 WeakPolarHBondContact O-CA 3.38Å; C207-C215 HydrophobicContact CB-CB 4.08Å; C207-C215 WeakPolarHBondContact CB-SG 3.06Å; C207-C215 WeakPolarHBondContact SG-CB 3.14Å; C207-C215 CovalentContact SG-SG 2.04Å; C207-C215 PolarHBondContact SG-SG 3.28Å; G212-C215 PolarHBondContact O-SG 3.49Å
216	G	96.3	Very high	93	Very high	27 Å²	27	74.3 Å²	74.3	28%	0.278	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.6	163.4	177.8	0	0	0	0	0	111.5	R206	R206-G216 PolarHBondContact N-O 3.43Å; R206-G216 PolarHBondContact O-N 3.49Å; R206-G216 VanDerWaalsContact O-N 3.09Å
217	W	97.9	Very high	93.1	Very high	33 Å²	33	71 Å²	71	13%	0.125	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	130.5	173.2	-68.1	105.6	0	0	0	110.5	P56 D60 L61 L66 L69 R167 W169 L203 R204 W205	P56-W217 HydrophobicContact CB-CZ2 3.9Å; P56-W217 HydrophobicContact CG-CH2 4.14Å; P56-W217 HydrophobicContact CG-CZ2 3.85Å; D60-W217 PolarHBondContact O-NE1 2.92Å; L61-W217 HydrophobicContact CD2-CH2 4.46Å; L61-W217 HydrophobicContact CD2-CZ2 3.76Å; L66-W217 HydrophobicContact CD2-CB 4.31Å; L66-W217 HydrophobicContact CD2-CD2 4.01Å; L66-W217 HydrophobicContact CD2-CG 3.62Å; L69-W217 HydrophobicContact CD2-CB 3.67Å; R167-W217 WeakPolarHBondContact O-CZ3 3.46Å; W169-W217 HydrophobicContact CB-CE3 4.25Å; W169-W217 HydrophobicContact CB-CH2 3.78Å; W169-W217 HydrophobicContact CB-CZ2 4.35Å; W169-W217 HydrophobicContact CB-CZ3 3.72Å; L203-W217 HydrophobicContact CB-CB 4.46Å; L203-W217 HydrophobicContact CB-CD2 4.35Å; L203-W217 HydrophobicContact CB-CE3 3.63Å; L203-W217 HydrophobicContact CB-CZ3 4.26Å; L203-W217 HydrophobicContact CD1-CB 4.38Å; R204-W217 VanDerWaalsContact C-CE3 3.48Å; W205-W217 HydrophobicContact CB-CD2 4.49Å; W205-W217 HydrophobicContact CB-CE3 4.08Å; W205-W217 HydrophobicContact CB-CH2 3.92Å; W205-W217 HydrophobicContact CB-CZ2 4.31Å; W205-W217 HydrophobicContact CB-CZ3 3.79Å; W205-W217 AromaticContact CE3-CD1 3.7Å; W205-W217 AromaticContact CE3-CD2 3.75Å; W205-W217 HydrophobicContact CE3-CD2 3.75Å; W205-W217 AromaticContact CE3-CE2 3.59Å; W205-W217 HydrophobicContact CE3-CE3 4.43Å; W205-W217 AromaticContact CE3-CG 3.84Å; W205-W217 HydrophobicContact CE3-CG 3.84Å; W205-W217 HydrophobicContact CE3-CZ2 4.17Å; W205-W217 AromaticContact CE3-NE1 3.56Å; W205-W217 AromaticContact CZ3-CD1 3.62Å; W205-W217 HydrophobicContact CZ3-CD2 4.44Å; W205-W217 HydrophobicContact CZ3-CG 4.15Å; W205-W217 AromaticContact CZ3-NE1 3.62Å
218	I	97	Very high	93.2	Very high	58 Å²	58	70.2 Å²	70.2	30%	0.297	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	143	174.5	56.6	163.9	0	0	0	110.3	L203 R204 R206 I220	L203-I218 CarbonylContact C-O 3.18Å; L203-I218 WeakPolarHBondContact CA-O 3.48Å; R204-I218 HydrophobicContact CB-CG1 4.35Å; R204-I218 PolarHBondContact N-O 3.33Å; R204-I218 WeakPolarHBondContact O-CG1 3.28Å; R204-I218 PolarHBondContact O-N 3.49Å; R206-I218 HydrophobicContact CB-CD1 4Å; R206-I218 HydrophobicContact CB-CG1 4.17Å; R206-I218 HydrophobicContact CG-CD1 4.41Å; I218-I220 HydrophobicContact CD1-CG2 4.25Å; I218-I220 HydrophobicContact CG1-CG2 4.31Å
219	P	97.6	Very high	93.6	Very high	86 Å²	86	70.2 Å²	70.2	56%	0.558	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.4	137.5	171.7	29.2	-33.5	0	0	0	110.2	T201 V202 L203	T201-P219 HydrophobicContact CG2-CB 4Å; V202-P219 CarbonylContact O-C 3.48Å; V202-P219 WeakPolarHBondContact O-CA 3.44Å; L203-P219 HydrophobicContact CD2-CB 4.43Å
220	I	97	Very high	94.1	Very high	47 Å²	47	64 Å²	64	24%	0.241	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	157.6	174.5	63.5	135	0	0	0	110.1	F168 T201 V202 R204 I218	F168-I220 HydrophobicContact CD1-CD1 4.3Å; F168-I220 HydrophobicContact CE1-CD1 3.65Å; T201-I220 WeakPolarHBondContact CA-O 3.23Å; V202-I220 HydrophobicContact CG2-CD1 3.71Å; V202-I220 HydrophobicContact CG2-CG1 3.64Å; V202-I220 PolarHBondContact N-O 2.87Å; V202-I220 WeakPolarHBondContact O-CG1 3.25Å; V202-I220 PolarHBondContact O-N 3.25Å; R204-I220 HydrophobicContact CB-CD1 4.32Å; R204-I220 HydrophobicContact CB-CG1 3.97Å; R204-I220 HydrophobicContact CB-CG2 3.75Å; I218-I220 HydrophobicContact CD1-CG2 4.25Å; I218-I220 HydrophobicContact CG1-CG2 4.31Å
221	Q	96.2	Very high	94.7	Very high	113 Å²	113	54.8 Å²	54.8	53%	0.528	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	120.5	173.5	-62.2	-61.4	-25.6	0	0	109.5	H199 T201	H199-Q221 HydrophobicContact CB-CB 4.26Å; H199-Q221 VanDerWaalsContact CB-OE1 3.24Å; T201-Q221 PolarHBondContact OG1-NE2 3.29Å; T201-Q221 PolarHBondContact OG1-OE1 3.36Å
222	Y	95.2	Very high	95.2	Very high	26 Å²	26	58.9 Å²	58.9	10%	0.102	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	113.7	177.1	-171.9	-84.3	0	0	0	109.5	L164 V173 V175 H199 L200 I224	L164-Y222 HydrophobicContact CD1-CD2 4.4Å; L164-Y222 HydrophobicContact CD1-CE2 4.32Å; L164-Y222 HydrophobicContact CD2-CE2 3.7Å; V173-Y222 HydrophobicContact CG2-CE1 4.36Å; V175-Y222 HydrophobicContact CG2-CE1 4.39Å; H199-Y222 WeakPolarHBondContact CA-O 3.45Å; L200-Y222 PolarHBondContact N-O 2.8Å; L200-Y222 PolarHBondContact O-N 2.96Å; Y222-I224 HydrophobicContact CD1-CG2 3.91Å; Y222-I224 HydrophobicContact CE1-CG2 4Å
223	P	96.3	Very high	95.8	Very high	26 Å²	26	61.2 Å²	61.2	17%	0.169	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	137.4	-178	31.4	-33.7	0	0	0	111.8	L41 L43 V198	L41-P223 HydrophobicContact CD2-CB 4.19Å; L41-P223 HydrophobicContact CD2-CG 4.12Å; L43-P223 HydrophobicContact CD1-CG 3.41Å; L43-P223 VanDerWaalsContact CD1-CG 3.41Å; L43-P223 HydrophobicContact CG-CG 4.03Å; V198-P223 WeakPolarHBondContact O-CA 3.49Å
224	I	95.5	Very high	96.3	Very high	3 Å²	3	57.9 Å²	57.9	2%	0.015	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	151.2	169.8	62.2	167.4	0	0	0	110.2	F78 V175 S197 V198 L200 Y222 S226	F78-I224 HydrophobicContact CD1-CD1 3.57Å; F78-I224 HydrophobicContact CE1-CD1 3.63Å; V175-I224 HydrophobicContact CG1-CG2 4.37Å; V175-I224 HydrophobicContact CG2-CG2 4.31Å; S197-I224 CarbonylContact C-O 3.53Å; S197-I224 WeakPolarHBondContact CA-O 3.39Å; S197-I224 WeakPolarHBondContact CB-O 3.35Å; V198-I224 HydrophobicContact CG2-CD1 3.86Å; V198-I224 HydrophobicContact CG2-CG1 3.54Å; V198-I224 PolarHBondContact N-O 3.01Å; V198-I224 PolarHBondContact O-N 3.31Å; L200-I224 HydrophobicContact CD1-CD1 4.04Å; L200-I224 HydrophobicContact CD1-CG2 3.98Å; L200-I224 HydrophobicContact CD2-CD1 4.09Å; L200-I224 HydrophobicContact CG-CD1 3.92Å; L200-I224 HydrophobicContact CG-CG1 4.25Å; L200-I224 HydrophobicContact CG-CG2 4.27Å; Y222-I224 HydrophobicContact CD1-CG2 3.91Å; Y222-I224 HydrophobicContact CE1-CG2 4Å; I224-S226 PolarHBondContact O-N 2.68Å
225	I	97.1	Very high	96.6	Very high	4 Å²	4	51.8 Å²	51.8	2%	0.021	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	127.5	176.6	-61.7	165.9	0	0	0	109	L41 P42 G176 P194	L41-I225 HydrophobicContact CB-CD1 4.31Å; L41-I225 HydrophobicContact CB-CG1 4.02Å; L41-I225 HydrophobicContact CD1-CG1 3.94Å; P42-I225 HydrophobicContact CB-CD1 4.17Å; G176-I225 WeakPolarHBondContact O-CD1 3.33Å; P194-I225 HydrophobicContact CB-CD1 4.13Å; P194-I225 HydrophobicContact CB-CG1 4.06Å; P194-I225 HydrophobicContact CB-CG2 4.18Å; P194-I225 HydrophobicContact CG-CD1 3.55Å; P194-I225 HydrophobicContact CG-CG1 4.05Å
226	S	96	Very high	96.6	Very high	30 Å²	30	52.6 Å²	52.6	21%	0.21	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	-24.3	179	59.4	0	0	0	0	113.7	K196 S197 I224	K196-S226 VanDerWaalsContact C-OG 3.3Å; K196-S226 PolarHBondContact O-N 3.16Å; K196-S226 PolarHBondContact O-OG 3.17Å; S197-S226 PolarHBondContact N-OG 3.23Å; I224-S226 PolarHBondContact O-N 2.68Å
227	E	96.6	Very high	96.7	Very high	83 Å²	83	54.2 Å²	54.2	39%	0.388	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	145.3	174.2	-62.5	-179.9	-164.5	0	0	110.9	S195 K196	S195-E227 PolarHBondContact N-O 3.42Å; S195-E227 PolarHBondContact OG-O 3.12Å; K196-E227 HydrophobicContact CB-CB 3.95Å; K196-E227 HydrophobicContact CB-CG 4.19Å; K196-E227 VanDerWaalsContact CD-CD 3.42Å; K196-E227 HydrophobicContact CD-CG 4.26Å; K196-E227 WeakPolarHBondContact CD-OE1 3.4Å; K196-E227 VanDerWaalsContact CD-OE2 3.25Å; K196-E227 WeakPolarHBondContact CD-OE2 3.45Å; K196-E227 WeakPolarHBondContact CE-OE2 3.4Å; K196-E227 HydrophobicContact CG-CB 4.2Å; K196-E227 HydrophobicContact CG-CG 4.38Å; K196-E227 PolarHBondContact N-O 2.76Å; K196-E227 IonicContact NZ-OE1 3.24Å; K196-E227 PolarHBondContact NZ-OE1 2.85Å; K196-E227 IonicContact NZ-OE2 3.79Å; K196-E227 PolarHBondContact NZ-OE2 3.46Å; K196-E227 PolarHBondContact O-N 2.85Å
228	C	97.6	Very high	96.6	Very high	16 Å²	16	55.6 Å²	55.6	11%	0.108	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	146.3	171.5	-61.5	0	0	0	0	109.9	C155 C178 K193	C155-C228 HydrophobicContact CB-CB 3.66Å; C178-C228 WeakPolarHBondContact CA-SG 3.47Å; C178-C228 HydrophobicContact CB-CB 3.9Å; C178-C228 WeakPolarHBondContact CB-SG 3.43Å; C178-C228 WeakPolarHBondContact SG-CB 3.37Å; C178-C228 CovalentContact SG-SG 2.03Å; C178-C228 PolarHBondContact SG-SG 3.12Å; K193-C228 CarbonylContact O-C 3.17Å; K193-C228 WeakPolarHBondContact O-CA 3.43Å
229	K	97.1	Very high	96.5	Very high	142 Å²	142	55.4 Å²	55.4	62%	0.617	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.3	149.8	176.6	-168.3	173.8	179	179.5	0	110.9	K193 S231	K193-K229 PolarHBondContact N-O 3.39Å; K193-K229 PolarHBondContact O-N 2.99Å; K229-S231 PolarHBondContact O-N 3.16Å
230	C	97.5	Very high	96.5	Very high	23 Å²	23	53.1 Å²	53.1	16%	0.155	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	122.6	172.5	-166.5	0	0	0	0	110	C155 C184 M190	C155-C230 PolarHBondContact SG-N 3.02Å; C184-C230 HydrophobicContact CB-CB 3.82Å; C184-C230 WeakPolarHBondContact CB-SG 3.29Å; C184-C230 PolarHBondContact O-SG 3.2Å; C184-C230 WeakPolarHBondContact SG-CA 3.36Å; C184-C230 WeakPolarHBondContact SG-CB 3.42Å; C184-C230 CovalentContact SG-SG 2.03Å; C184-C230 PolarHBondContact SG-SG 3.17Å; M190-C230 VanDerWaalsContact CB-SG 3.57Å; M190-C230 WeakPolarHBondContact CE-O 3.25Å
231	S	96.8	Very high	96.4	Very high	51 Å²	51	53.6 Å²	53.6	36%	0.357	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	156.1	-175.1	-168.2	0	0	0	0	111.7	M190 V191 K229	M190-S231 WeakPolarHBondContact CA-O 3.4Å; M190-S231 WeakPolarHBondContact CB-O 3.44Å; V191-S231 PolarHBondContact N-O 2.85Å; V191-S231 PolarHBondContact O-N 3.06Å; K229-S231 PolarHBondContact O-N 3.16Å
232	C	95.1	Very high	96.4	Very high	126 Å²	126	48.2 Å²	48.2	85%	0.851	27%	0.272	S	S	*	.			trans	-74.4	0	173	-60.1	0	0	0	0	110.3	K193	K193-C232 WeakPolarHBondContact CE-OXT 3.48Å; K193-C232 PolarHBondContact NZ-O 3.11Å; K193-C232 PolarHBondContact NZ-OXT 3.1Å

Retrieved 232 of 232 residues in 728.3 ms (Link to these results)

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