A0A077JIU5_HUMAN Loading...

Carcinoembryonic antigen-related cell adhesion molecule 4-sv1

AlphaFold DB , UniProt , Accession A0A077JIU5, Species HUMAN (Homo sapiens, Human), Gene CEACAM4, Length 256 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	54.7	Low	52.3	Low	256 Å²	256	126.7 Å²	126.7	100%	1.261	83%	0.831	S	S	*	*				0	126.5	0	-82.9	-178.8	167.5	0	0	108.4
2	G	41.8	Very low	52.8	Low	73 Å²	73	131 Å²	131	75%	0.753	83%	0.83	S	S	*	*			trans	178.7	108.9	170.8	0	0	0	0	0	109.9
3	P	67.1	Low	53.5	Low	125 Å²	125	135.8 Å²	135.8	81%	0.812	82%	0.822	S	S	*	*			trans	-101.1	-174.2	163.8	38.8	-28.5	0	0	0	109.5
4	P	63.4	Low	54	Low	121 Å²	121	133.6 Å²	133.6	79%	0.786	81%	0.812	S	S	*	*			cis	-127.6	169.4	-26.2	27.3	-6.1	0	0	0	112.5
5	S	44.3	Very low	54.4	Low	123 Å²	123	136.7 Å²	136.7	86%	0.86	80%	0.803	S	S	*	*			trans	-156.6	100.4	157.5	-122.4	0	0	0	0	108.9
6	A	46.4	Very low	54.9	Low	89 Å²	89	135.4 Å²	135.4	74%	0.736	79%	0.787	S	S	*	*				99.7	103.4	91.5	0	0	0	0	0	111.2
7	A	56	Low	55.8	Low	97 Å²	97	129.9 Å²	129.9	80%	0.802	77%	0.766	S	S	*	*			trans	-75.1	141.2	144.3	0	0	0	0	0	106.5
8	P	48.3	Very low	56.6	Low	118 Å²	118	128.8 Å²	128.8	77%	0.766	76%	0.756	S	S	*	*				-146	143.1	68.3	35.9	-17	0	0	0	113.5
9	R	50	Low	57.5	Low	257 Å²	257	127.8 Å²	127.8	97%	0.97	75%	0.746	S	S	*	*			trans	-130.7	121.7	161.8	-77.2	-167.2	-176.5	-167.2	2.8	110.7
10	G	51.3	Low	58	Low	56 Å²	56	126.7 Å²	126.7	58%	0.577	74%	0.735	S	S	*	*			trans	99	65.9	148	0	0	0	0	0	115.3	H12	G10-H12 PolarHBondContact O-N 3.48Å
11	G	52.3	Low	58.4	Low	79 Å²	79	124.7 Å²	124.7	81%	0.814	73%	0.726	S	S	*	*			trans	-62.6	92.9	152.2	0	0	0	0	0	108.6	R13	G11-R13 PolarHBondContact O-N 3.39Å; G11-R13 VanDerWaalsContact O-N 3.16Å
12	H	58	Low	58.9	Low	178 Å²	178	115 Å²	115	82%	0.824	69%	0.686	S	S	*	*			trans	-62.1	114.3	170.9	-80.2	-77.1	0	0	0	108.2	G10 P14	G10-H12 PolarHBondContact O-N 3.48Å; H12-P14 VanDerWaalsContact O-CD 3.24Å; H12-P14 WeakPolarHBondContact O-CD 3.33Å
13	R	61.4	Low	60.2	Low	194 Å²	194	115.1 Å²	115.1	73%	0.732	68%	0.675	S	S	*	*			trans	-66.2	113.4	-178.7	-68	-169.1	179.8	-172.5	1.2	108.9	G11 W15 Q16	G11-R13 PolarHBondContact O-N 3.39Å; G11-R13 VanDerWaalsContact O-N 3.16Å; R13-W15 PolarHBondContact O-N 3.47Å; R13-Q16 PolarHBondContact O-N 2.75Å; R13-Q16 VanDerWaalsContact O-N 3.08Å
14	P	60.4	Low	60.2	Low	104 Å²	104	114.4 Å²	114.4	68%	0.675	66%	0.664	S	S	*	*	H	α-helix	trans	-60.6	-17.3	-177.2	22.1	-31.8	0	0	0	113.2	H12 L18	H12-P14 VanDerWaalsContact O-CD 3.24Å; H12-P14 WeakPolarHBondContact O-CD 3.33Å; P14-L18 PolarHBondContact O-N 3.1Å
15	W	60.9	Low	60.2	Low	180 Å²	180	114.2 Å²	114.2	68%	0.682	66%	0.656	S	S	*	*	H	α-helix	trans	-69.1	-30.8	176.6	-70.3	85.9	0	0	0	114.1	R13 G17 L18 L19	R13-W15 PolarHBondContact O-N 3.47Å; W15-G17 PolarHBondContact O-N 3.17Å; W15-L18 PolarHBondContact O-N 3.09Å; W15-L19 WeakPolarHBondContact O-CB 3.43Å; W15-L19 VanDerWaalsContact O-CG 3.23Å; W15-L19 WeakPolarHBondContact O-CG 3.42Å; W15-L19 PolarHBondContact O-N 3.02Å
16	Q	62.3	Low	61	Low	117 Å²	117	113.2 Å²	113.2	55%	0.547	65%	0.645	S	S	.	*	H	α-helix	trans	-65.3	-41.3	178.1	-117.3	80.4	4.7	0	0	111.5	R13 L18 L19 I20	R13-Q16 PolarHBondContact O-N 2.75Å; R13-Q16 VanDerWaalsContact O-N 3.08Å; Q16-L18 VanDerWaalsContact C-N 3.34Å; Q16-L19 PolarHBondContact O-N 3.37Å; Q16-I20 WeakPolarHBondContact O-CD1 3.26Å; Q16-I20 VanDerWaalsContact O-CG1 3.26Å; Q16-I20 WeakPolarHBondContact O-CG1 3.41Å; Q16-I20 PolarHBondContact O-N 3Å; Q16-I20 VanDerWaalsContact O-N 3.1Å
17	G	69.1	Low	61.7	Low	41 Å²	41	117.5 Å²	117.5	42%	0.423	65%	0.647	S	S	.	*	H	α-helix	trans	-65.2	-39.5	175.8	0	0	0	0	0	112.1	W15 I20 T21	W15-G17 PolarHBondContact O-N 3.17Å; G17-I20 PolarHBondContact O-N 2.8Å; G17-T21 PolarHBondContact O-N 3.32Å; G17-T21 PolarHBondContact O-OG1 2.87Å; G17-T21 VanDerWaalsContact O-OG1 3.05Å
18	L	71.6	Confident	62.2	Low	111 Å²	111	123 Å²	123	58%	0.581	65%	0.647	S	S	*	*	H	α-helix	trans	-67.6	-34.8	178.1	-147.2	113.3	0	0	0	112.8	P14 W15 Q16 T21 A22	P14-L18 PolarHBondContact O-N 3.1Å; W15-L18 PolarHBondContact O-N 3.09Å; Q16-L18 VanDerWaalsContact C-N 3.34Å; L18-T21 WeakPolarHBondContact CA-OG1 3.3Å; L18-T21 PolarHBondContact O-OG1 3.33Å; L18-A22 VanDerWaalsContact O-CB 3.26Å; L18-A22 WeakPolarHBondContact O-CB 3.33Å; L18-A22 PolarHBondContact O-N 3.47Å
19	L	73.3	Confident	62.6	Low	110 Å²	110	123.9 Å²	123.9	58%	0.576	64%	0.641	S	S	*	*	H	α-helix	trans	-71.9	-36.5	175.4	-70.7	170.5	0	0	0	112	W15 Q16 S23	W15-L19 WeakPolarHBondContact O-CB 3.43Å; W15-L19 VanDerWaalsContact O-CG 3.23Å; W15-L19 WeakPolarHBondContact O-CG 3.42Å; W15-L19 PolarHBondContact O-N 3.02Å; Q16-L19 PolarHBondContact O-N 3.37Å; L19-S23 VanDerWaalsContact O-CB 3.25Å; L19-S23 WeakPolarHBondContact O-CB 3.23Å; L19-S23 PolarHBondContact O-N 2.91Å
20	I	67.4	Low	63.3	Low	104 Å²	104	116.5 Å²	116.5	53%	0.533	63%	0.626	S	S	.	*	H	α-helix	trans	-67.6	-43.8	175.4	-67.2	162.5	0	0	0	110.5	Q16 G17 S23 L24	Q16-I20 WeakPolarHBondContact O-CD1 3.26Å; Q16-I20 VanDerWaalsContact O-CG1 3.26Å; Q16-I20 WeakPolarHBondContact O-CG1 3.41Å; Q16-I20 PolarHBondContact O-N 3Å; Q16-I20 VanDerWaalsContact O-N 3.1Å; G17-I20 PolarHBondContact O-N 2.8Å; I20-S23 PolarHBondContact O-N 3.24Å; I20-L24 HydrophobicContact CG2-CD1 4.03Å; I20-L24 WeakPolarHBondContact O-CG 3.16Å; I20-L24 PolarHBondContact O-N 3.13Å
21	T	65.6	Low	63.8	Low	86 Å²	86	119.4 Å²	119.4	53%	0.528	64%	0.635	S	S	.	*	H	α-helix	trans	-67	-38.7	176.8	48.9	0	0	0	0	112.3	G17 L18 L25	G17-T21 PolarHBondContact O-N 3.32Å; G17-T21 PolarHBondContact O-OG1 2.87Å; G17-T21 VanDerWaalsContact O-OG1 3.05Å; L18-T21 WeakPolarHBondContact CA-OG1 3.3Å; L18-T21 PolarHBondContact O-OG1 3.33Å; T21-L25 PolarHBondContact O-N 2.73Å
22	A	66.6	Low	64.4	Low	52 Å²	52	122 Å²	122	43%	0.43	64%	0.635	S	S	.	*	H	α-helix	trans	-64.5	-37.5	173.2	0	0	0	0	0	112.8	L18 L25 T26	L18-A22 VanDerWaalsContact O-CB 3.26Å; L18-A22 WeakPolarHBondContact O-CB 3.33Å; L18-A22 PolarHBondContact O-N 3.47Å; A22-L25 PolarHBondContact O-N 3.4Å; A22-T26 PolarHBondContact O-N 2.87Å
23	S	69.1	Low	64.6	Low	75 Å²	75	118.6 Å²	118.6	52%	0.524	63%	0.627	S	S	.	*	H	α-helix	trans	-70.8	-38.9	178.5	-173.4	0	0	0	0	113.2	L19 I20 L25 T26 F27	L19-S23 VanDerWaalsContact O-CB 3.25Å; L19-S23 WeakPolarHBondContact O-CB 3.23Å; L19-S23 PolarHBondContact O-N 2.91Å; I20-S23 PolarHBondContact O-N 3.24Å; S23-L25 VanDerWaalsContact C-N 3.27Å; S23-L25 PolarHBondContact O-N 3.26Å; S23-T26 PolarHBondContact O-N 3.03Å; S23-T26 PolarHBondContact O-OG1 3.45Å; S23-F27 PolarHBondContact O-N 2.9Å
24	L	66.7	Low	65.3	Low	110 Å²	110	114.2 Å²	114.2	58%	0.576	62%	0.622	S	S	*	*	H	α-helix	trans	-66.6	-31.3	174	-73.5	165.8	0	0	0	111.8	I20 F27 W28	I20-L24 HydrophobicContact CG2-CD1 4.03Å; I20-L24 WeakPolarHBondContact O-CG 3.16Å; I20-L24 PolarHBondContact O-N 3.13Å; L24-F27 PolarHBondContact O-N 2.88Å; L24-W28 WeakPolarHBondContact O-CB 3.47Å; L24-W28 PolarHBondContact O-N 3.5Å; L24-W28 VanDerWaalsContact O-N 3.1Å
25	L	63.2	Low	66.4	Low	117 Å²	117	116 Å²	116	61%	0.613	62%	0.621	S	S	*	*	H	α-helix	trans	-69.4	-36	178.4	-148.5	73.4	0	0	0	112.2	T21 A22 S23 H29	T21-L25 PolarHBondContact O-N 2.73Å; A22-L25 PolarHBondContact O-N 3.4Å; S23-L25 VanDerWaalsContact C-N 3.27Å; S23-L25 PolarHBondContact O-N 3.26Å; L25-H29 PolarHBondContact O-CD2 3.35Å; L25-H29 PolarHBondContact O-NE2 2.92Å
26	T	60.5	Low	68	Low	103 Å²	103	108.6 Å²	108.6	63%	0.632	59%	0.593	S	S	*	*	H	α-helix	trans	-75.1	-29	175.8	56.4	0	0	0	0	112.9	A22 S23	A22-T26 PolarHBondContact O-N 2.87Å; S23-T26 PolarHBondContact O-N 3.03Å; S23-T26 PolarHBondContact O-OG1 3.45Å
27	F	61.3	Low	69.5	Low	179 Å²	179	105.4 Å²	105.4	79%	0.785	58%	0.582	S	S	*	*	H	α-helix	trans	-76.7	-22.8	174.5	-168.7	-101.4	0	0	0	113.3	S23 L24	S23-F27 PolarHBondContact O-N 2.9Å; L24-F27 PolarHBondContact O-N 2.88Å
28	W	67.7	Low	70.9	Confident	213 Å²	213	104.4 Å²	104.4	81%	0.807	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-3.4	-177.9	-160.4	-86.3	0	0	0	114.1	L24 P30	L24-W28 WeakPolarHBondContact O-CB 3.47Å; L24-W28 PolarHBondContact O-N 3.5Å; L24-W28 VanDerWaalsContact O-N 3.1Å; W28-P30 WeakPolarHBondContact O-CD 3.34Å; W28-P30 VanDerWaalsContact O-N 3.12Å
29	H	57	Low	72	Confident	136 Å²	136	104.4 Å²	104.4	63%	0.63	56%	0.564	S	S	*	*	S	Bend	trans	-71.4	107.9	170.9	-69.1	-53.6	0	0	0	108.6	L25	L25-H29 PolarHBondContact O-CD2 3.35Å; L25-H29 PolarHBondContact O-NE2 2.92Å
30	P	64.2	Low	73.2	Confident	102 Å²	102	100 Å²	100	66%	0.662	54%	0.544	S	S	*	.			trans	-58.4	141.3	175.9	25.6	-32.3	0	0	0	108.1	W28 T32	W28-P30 WeakPolarHBondContact O-CD 3.34Å; W28-P30 VanDerWaalsContact O-N 3.12Å; P30-T32 PolarHBondContact O-N 3.46Å; P30-T32 VanDerWaalsContact O-N 3.07Å
31	P	61	Low	74.6	Confident	116 Å²	116	100.4 Å²	100.4	75%	0.753	55%	0.546	S	S	*	.			trans	-52.3	123.1	173.1	-20.8	29.8	0	0	0	108.4	T33	P31-T33 PolarHBondContact O-N 3.39Å
32	T	64.3	Low	76.1	Confident	133 Å²	133	99.3 Å²	99.3	82%	0.816	54%	0.541	S	S	*	.			trans	-60.8	96.2	170	-53.2	0	0	0	0	106.2	P30 V34	P30-T32 PolarHBondContact O-N 3.46Å; P30-T32 VanDerWaalsContact O-N 3.07Å; T32-V34 PolarHBondContact O-N 3.46Å
33	T	63.9	Low	77.3	Confident	108 Å²	108	101.1 Å²	101.1	66%	0.663	55%	0.55	S	S	*	*			trans	-62	114.2	178.5	-62.7	0	0	0	0	105.9	P31 Q35	P31-T33 PolarHBondContact O-N 3.39Å; T33-Q35 HydrophobicContact CG2-CG 4.45Å; T33-Q35 PolarHBondContact O-N 2.9Å
34	V	75.1	Confident	78.6	Confident	102 Å²	102	100.2 Å²	100.2	62%	0.618	54%	0.544	S	S	*	.			trans	-69.7	104.8	177.7	-177.3	0	0	0	0	106.5	T32 N57	T32-V34 PolarHBondContact O-N 3.46Å; V34-N57 HydrophobicContact CG1-CB 3.62Å; V34-N57 VanDerWaalsContact CG1-ND2 3.27Å; V34-N57 WeakPolarHBondContact CG1-ND2 3.42Å; V34-N57 VanDerWaalsContact CG1-OD1 3.27Å; V34-N57 WeakPolarHBondContact CG1-OD1 3.37Å
35	Q	84.6	Confident	79.9	Confident	140 Å²	140	95.1 Å²	95.1	65%	0.654	52%	0.518	S	S	*	.			trans	-86.4	147.2	-176.7	-70.1	178	-22	0	0	110.5	T33 T37 N57	T33-Q35 HydrophobicContact CG2-CG 4.45Å; T33-Q35 PolarHBondContact O-N 2.9Å; Q35-T37 PolarHBondContact O-N 3.3Å; Q35-N57 WeakPolarHBondContact O-CB 3.22Å; Q35-N57 PolarHBondContact O-ND2 3.49Å
36	F	92.8	Very high	81.5	Confident	25 Å²	25	90.2 Å²	90.2	11%	0.11	49%	0.494	C	S	.	.			trans	-59.5	122.8	169.1	167.6	-146.1	0	0	0	109.5	A55 C56 I58 L122 T124 A134	F36-A55 HydrophobicContact CE2-CB 4.28Å; F36-C56 WeakPolarHBondContact CD2-O 3.49Å; F36-I58 HydrophobicContact CD2-CG1 3.73Å; F36-I58 HydrophobicContact CE2-CD1 4.26Å; F36-I58 HydrophobicContact CE2-CG1 3.67Å; F36-L122 HydrophobicContact CE2-CD2 4.06Å; F36-L122 HydrophobicContact CZ-CB 3.98Å; F36-L122 HydrophobicContact CZ-CD2 3.71Å; F36-L122 HydrophobicContact CZ-CG 3.78Å; F36-T124 HydrophobicContact CE1-CG2 3.93Å; F36-T124 HydrophobicContact CZ-CG2 3.94Å; F36-A134 HydrophobicContact CD1-CB 3.63Å; F36-A134 HydrophobicContact CD2-CB 3.94Å; F36-A134 HydrophobicContact CE1-CB 3.48Å; F36-A134 VanDerWaalsContact CE1-CB 3.48Å; F36-A134 HydrophobicContact CE2-CB 3.76Å; F36-A134 HydrophobicContact CG-CB 3.86Å; F36-A134 HydrophobicContact CZ-CB 3.52Å
37	T	95.1	Very high	83.2	Confident	50 Å²	50	88.4 Å²	88.4	31%	0.307	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	160.5	-175.9	53.2	0	0	0	0	111.9	Q35 C56	Q35-T37 PolarHBondContact O-N 3.3Å; T37-C56 PolarHBondContact N-O 3.46Å; T37-C56 VanDerWaalsContact N-O 3.13Å; T37-C56 PolarHBondContact O-N 3.41Å
38	I	97.2	Very high	84.9	Confident	20 Å²	20	81.6 Å²	81.6	10%	0.103	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	130.1	173.2	-63.6	165.1	0	0	0	108.7	L53 L54 W67 L122 A134	I38-L53 HydrophobicContact CG2-CB 4.12Å; I38-L54 CarbonylContact C-O 3.2Å; I38-L54 VanDerWaalsContact CA-O 3.29Å; I38-L54 WeakPolarHBondContact CA-O 3.38Å; I38-W67 HydrophobicContact CD1-CH2 3.64Å; I38-W67 HydrophobicContact CD1-CZ3 3.79Å; I38-W67 HydrophobicContact CG1-CH2 3.99Å; I38-W67 HydrophobicContact CG2-CH2 3.79Å; I38-W67 HydrophobicContact CG2-CZ3 4.41Å; I38-L122 HydrophobicContact CD1-CB 3.73Å; I38-L122 HydrophobicContact CG1-CB 4.43Å; I38-A134 VanDerWaalsContact CD1-C 3.44Å; I38-A134 HydrophobicContact CD1-CB 3.92Å; I38-A134 WeakPolarHBondContact CD1-O 3.39Å; I38-A134 HydrophobicContact CG1-CB 3.88Å
39	E	96.4	Very high	86.3	Confident	111 Å²	111	77 Å²	77	52%	0.519	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	126.4	177.1	-64.6	-175.7	-178.6	0	0	110	L54	E39-L54 PolarHBondContact N-O 2.93Å; E39-L54 WeakPolarHBondContact O-CB 3.46Å; E39-L54 PolarHBondContact O-N 3.28Å
40	A	97.3	Very high	88.2	Confident	19 Å²	19	74.5 Å²	74.5	16%	0.157	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	129.5	173.7	0	0	0	0	0	110.2	P42 S43 V51 L53	A40-P42 CarbonylContact C-O 3.59Å; A40-P42 CarbonylContact O-C 3.58Å; A40-S43 VanDerWaalsContact O-CA 3.28Å; A40-S43 WeakPolarHBondContact O-CA 3.41Å; A40-S43 PolarHBondContact O-N 2.89Å; A40-S43 VanDerWaalsContact O-N 3.12Å; A40-V51 HydrophobicContact CB-CG1 4.43Å; A40-L53 HydrophobicContact CB-CD2 3.79Å
41	L	97.1	Very high	89.8	Confident	111 Å²	111	69.7 Å²	69.7	58%	0.581	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.6	112.9	179.9	-169.6	66.7	0	0	0	111	L52	L41-L52 HydrophobicContact CB-CB 4.47Å; L41-L52 PolarHBondContact N-O 2.92Å; L41-L52 PolarHBondContact O-N 3.34Å
42	P	96.2	Very high	91.6	Very high	64 Å²	64	66.2 Å²	66.2	42%	0.416	38%	0.379	S	S	.	.	S	Bend	cis	-66.2	160.3	-9.4	31	-36.3	0	0	0	112.3	A40 S44 A45	A40-P42 CarbonylContact C-O 3.59Å; A40-P42 CarbonylContact O-C 3.58Å; P42-S44 PolarHBondContact O-N 3.05Å; P42-A45 HydrophobicContact CG-CB 3.98Å
43	S	93.4	Very high	93.2	Very high	90 Å²	90	59.9 Å²	59.9	63%	0.629	34%	0.34	S	S	*	.	S	Bend	trans	-65	-23.5	-178.3	56.5	0	0	0	0	113.9	A40	A40-S43 VanDerWaalsContact O-CA 3.28Å; A40-S43 WeakPolarHBondContact O-CA 3.41Å; A40-S43 PolarHBondContact O-N 2.89Å; A40-S43 VanDerWaalsContact O-N 3.12Å
44	S	95.3	Very high	94.8	Very high	56 Å²	56	57.1 Å²	57.1	39%	0.392	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	128.7	168	178.8	0	0	0	0	108.7	P42 H139 H141	P42-S44 PolarHBondContact O-N 3.05Å; S44-H139 WeakPolarHBondContact CA-O 3.29Å; S44-H141 PolarHBondContact OG-ND1 3.24Å; S44-H141 VanDerWaalsContact OG-ND1 3.1Å
45	A	95.4	Very high	95.8	Very high	3 Å²	3	52.9 Å²	52.9	3%	0.025	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	147.5	-176.7	0	0	0	0	0	111.5	P42 V51 I112 H139 V140 H141	P42-A45 HydrophobicContact CG-CB 3.98Å; A45-V51 HydrophobicContact CB-CG2 3.2Å; A45-I112 HydrophobicContact CB-CD1 3.38Å; A45-H139 PolarHBondContact N-O 2.85Å; A45-V140 CarbonylContact O-C 3.58Å; A45-V140 VanDerWaalsContact O-CA 3.28Å; A45-V140 WeakPolarHBondContact O-CA 3.42Å; A45-H141 PolarHBondContact O-N 3.03Å; A45-H141 PolarHBondContact O-ND1 3.48Å; A45-H141 VanDerWaalsContact O-ND1 3.14Å
46	A	95.9	Very high	96.2	Very high	14 Å²	14	47.4 Å²	47.4	12%	0.116	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	149.2	173.1	0	0	0	0	0	109.8	G48 K49 H141 N143	A46-G48 PolarHBondContact O-N 3.4Å; A46-K49 HydrophobicContact CB-CG 4.01Å; A46-K49 VanDerWaalsContact O-CB 3.24Å; A46-K49 WeakPolarHBondContact O-CB 3.46Å; A46-K49 WeakPolarHBondContact O-CG 3.25Å; A46-K49 PolarHBondContact O-N 2.95Å; A46-K49 VanDerWaalsContact O-N 3.13Å; A46-H141 CarbonylContact C-O 3.22Å; A46-H141 WeakPolarHBondContact CA-O 3.35Å; A46-H141 PolarHBondContact N-CE1 3.29Å; A46-H141 VanDerWaalsContact N-CE1 3.27Å; A46-N143 HydrophobicContact CB-CB 4.06Å
47	E	96.6	Very high	96.2	Very high	65 Å²	65	50.6 Å²	50.6	30%	0.304	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	138.2	169.3	177.2	168.5	-124.5	0	0	111.5	K49 L114 V140 H141 N143	E47-K49 VanDerWaalsContact C-N 3.32Å; E47-L114 PolarHBondContact OE1-N 2.9Å; E47-V140 HydrophobicContact CB-CG1 4.38Å; E47-H141 PolarHBondContact N-O 3.44Å; E47-N143 HydrophobicContact CB-CB 4.28Å; E47-N143 WeakPolarHBondContact O-CB 3.28Å
48	G	96	Very high	95.9	Very high	35 Å²	35	50 Å²	50	36%	0.361	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	6.5	-176.2	0	0	0	0	0	115.1	A46 N111 I112	A46-G48 PolarHBondContact O-N 3.4Å; G48-N111 VanDerWaalsContact CA-OD1 3.28Å; G48-N111 WeakPolarHBondContact CA-OD1 3.41Å; G48-I112 PolarHBondContact N-O 2.94Å
49	K	96.6	Very high	95.2	Very high	117 Å²	117	52.6 Å²	52.6	51%	0.509	31%	0.306	S	S	.	.			trans	-97	166.6	173.1	-60	-60	-177.1	-176.4	0	111.8	A46 E47 N111 I112	A46-K49 HydrophobicContact CB-CG 4.01Å; A46-K49 VanDerWaalsContact O-CB 3.24Å; A46-K49 WeakPolarHBondContact O-CB 3.46Å; A46-K49 WeakPolarHBondContact O-CG 3.25Å; A46-K49 PolarHBondContact O-N 2.95Å; A46-K49 VanDerWaalsContact O-N 3.13Å; E47-K49 VanDerWaalsContact C-N 3.32Å; K49-N111 PolarHBondContact O-N 3.47Å; K49-I112 WeakPolarHBondContact O-CG1 3.47Å; K49-I112 PolarHBondContact O-N 3.02Å
50	D	97.6	Very high	94.3	Very high	83 Å²	83	56.7 Å²	56.7	44%	0.444	33%	0.325	S	S	.	.			trans	-95.5	142.5	174.1	-59.1	-10.5	0	0	0	109.3	L108 F109 Q110 N111	D50-L108 HydrophobicContact CB-CD1 4.39Å; D50-F109 CarbonylContact C-O 3.5Å; D50-F109 WeakPolarHBondContact CA-O 3.14Å; D50-Q110 WeakPolarHBondContact OD1-CA 3.28Å; D50-N111 PolarHBondContact OD1-N 3.49Å
51	V	97.9	Very high	93.8	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.006	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	141.4	174.4	171.5	0	0	0	0	109.6	A40 A45 L53 F109 I112 L138	A40-V51 HydrophobicContact CB-CG1 4.43Å; A45-V51 HydrophobicContact CB-CG2 3.2Å; V51-L53 HydrophobicContact CG1-CD2 4.31Å; V51-F109 PolarHBondContact N-O 3.1Å; V51-F109 PolarHBondContact O-N 3.5Å; V51-I112 HydrophobicContact CG2-CD1 3.64Å; V51-L138 HydrophobicContact CB-CD1 4.05Å; V51-L138 HydrophobicContact CG1-CD1 3.67Å; V51-L138 HydrophobicContact CG2-CD1 3.97Å
52	L	98.3	Very high	93.8	Very high	43 Å²	43	54.9 Å²	54.9	23%	0.225	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	120.8	168.7	-171.2	71.4	0	0	0	109.1	L41 L54 Y102 L107 L108	L41-L52 HydrophobicContact CB-CB 4.47Å; L41-L52 PolarHBondContact N-O 2.92Å; L41-L52 PolarHBondContact O-N 3.34Å; L52-L54 HydrophobicContact CD2-CD1 4.12Å; L52-L54 PolarHBondContact O-N 3.05Å; L52-Y102 HydrophobicContact CD1-CD2 3.98Å; L52-Y102 HydrophobicContact CD1-CE2 3.84Å; L52-L107 WeakPolarHBondContact CA-O 3.33Å; L52-L108 HydrophobicContact CD1-CB 4.33Å
53	L	98.3	Very high	93.8	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	94.4	163.3	-57.8	178.9	0	0	0	107.3	I38 A40 V51 W67 S106 L107 Y120	I38-L53 HydrophobicContact CG2-CB 4.12Å; A40-L53 HydrophobicContact CB-CD2 3.79Å; V51-L53 HydrophobicContact CG1-CD2 4.31Å; L53-W67 HydrophobicContact CB-CH2 3.57Å; L53-W67 HydrophobicContact CB-CZ2 4.1Å; L53-W67 HydrophobicContact CB-CZ3 4.14Å; L53-W67 HydrophobicContact CD1-CE3 4.35Å; L53-W67 HydrophobicContact CD1-CH2 4.06Å; L53-W67 HydrophobicContact CD1-CZ3 3.74Å; L53-W67 HydrophobicContact CG-CH2 4.48Å; L53-S106 VanDerWaalsContact O-CA 3.3Å; L53-S106 WeakPolarHBondContact O-CA 3.47Å; L53-S106 WeakPolarHBondContact O-CB 3.45Å; L53-L107 HydrophobicContact CB-CB 4.22Å; L53-L107 HydrophobicContact CD1-CD2 4.16Å; L53-L107 PolarHBondContact N-O 2.87Å; L53-L107 PolarHBondContact O-N 2.79Å; L53-Y120 HydrophobicContact CD1-CD1 4.04Å; L53-Y120 HydrophobicContact CD1-CD2 4.14Å; L53-Y120 HydrophobicContact CD1-CG 3.66Å
54	L	97.8	Very high	93.9	Very high	51 Å²	51	51.2 Å²	51.2	27%	0.267	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	127.7	-177.9	-173.8	69.8	0	0	0	109.5	I38 E39 L52	I38-L54 CarbonylContact C-O 3.2Å; I38-L54 VanDerWaalsContact CA-O 3.29Å; I38-L54 WeakPolarHBondContact CA-O 3.38Å; E39-L54 PolarHBondContact N-O 2.93Å; E39-L54 WeakPolarHBondContact O-CB 3.46Å; E39-L54 PolarHBondContact O-N 3.28Å; L52-L54 HydrophobicContact CD2-CD1 4.12Å; L52-L54 PolarHBondContact O-N 3.05Å
55	A	96.2	Very high	94.1	Very high	13 Å²	13	49.5 Å²	49.5	11%	0.107	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	117.8	174.5	0	0	0	0	0	109.5	F36 I58 S106 L122	F36-A55 HydrophobicContact CE2-CB 4.28Å; A55-I58 HydrophobicContact CB-CD1 3.3Å; A55-I58 HydrophobicContact CB-CG1 4.14Å; A55-S106 PolarHBondContact N-OG 3.36Å; A55-S106 VanDerWaalsContact N-OG 3.14Å; A55-L122 HydrophobicContact CB-CD2 3.53Å
56	C	93.8	Very high	94.2	Very high	25 Å²	25	52.7 Å²	52.7	17%	0.169	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	149.5	-173.5	-66.5	0	0	0	0	110.8	F36 T37 I58	F36-C56 WeakPolarHBondContact CD2-O 3.49Å; T37-C56 PolarHBondContact N-O 3.46Å; T37-C56 VanDerWaalsContact N-O 3.13Å; T37-C56 PolarHBondContact O-N 3.41Å; C56-I58 VanDerWaalsContact C-N 3.25Å; C56-I58 PolarHBondContact O-N 3.01Å
57	N	91.7	Very high	94.3	Very high	92 Å²	92	52 Å²	52	49%	0.492	28%	0.276	S	S	.	.	S	Bend	trans	57.9	35.2	173.5	-47.4	-41.6	0	0	0	114.1	V34 Q35	V34-N57 HydrophobicContact CG1-CB 3.62Å; V34-N57 VanDerWaalsContact CG1-ND2 3.27Å; V34-N57 WeakPolarHBondContact CG1-ND2 3.42Å; V34-N57 VanDerWaalsContact CG1-OD1 3.27Å; V34-N57 WeakPolarHBondContact CG1-OD1 3.37Å; Q35-N57 WeakPolarHBondContact O-CB 3.22Å; Q35-N57 PolarHBondContact O-ND2 3.49Å
58	I	89.3	Confident	94.4	Very high	36 Å²	36	50 Å²	50	19%	0.185	27%	0.267	C	S	.	.			trans	-76.9	142.5	174	-57.4	166.5	0	0	0	109.3	F36 A55 C56 I62 Y65 N104 L122 T124	F36-I58 HydrophobicContact CD2-CG1 3.73Å; F36-I58 HydrophobicContact CE2-CD1 4.26Å; F36-I58 HydrophobicContact CE2-CG1 3.67Å; A55-I58 HydrophobicContact CB-CD1 3.3Å; A55-I58 HydrophobicContact CB-CG1 4.14Å; C56-I58 VanDerWaalsContact C-N 3.25Å; C56-I58 PolarHBondContact O-N 3.01Å; I58-I62 HydrophobicContact CG2-CD1 4.03Å; I58-I62 HydrophobicContact CG2-CG1 3.42Å; I58-I62 VanDerWaalsContact CG2-CG1 3.42Å; I58-Y65 HydrophobicContact CD1-CE1 3.95Å; I58-Y65 HydrophobicContact CG2-CE1 4.24Å; I58-N104 WeakPolarHBondContact CD1-O 3.48Å; I58-L122 HydrophobicContact CD1-CD2 4.45Å; I58-T124 HydrophobicContact CG2-CG2 4.34Å
59	S	81.4	Confident	94.5	Very high	76 Å²	76	51.9 Å²	51.9	53%	0.531	27%	0.265	S	S	.	.			trans	-59	147.6	171.8	-171.5	0	0	0	0	112	T61 I62	S59-T61 PolarHBondContact O-N 2.88Å; S59-T61 VanDerWaalsContact O-N 3.17Å; S59-I62 WeakPolarHBondContact O-CG1 3.28Å
60	E	77.9	Confident	94.5	Very high	196 Å²	196	47.1 Å²	47.1	92%	0.916	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-6.5	-173.4	-63.5	-173.9	167.2	0	0	114.5
61	T	87.9	Confident	94.5	Very high	82 Å²	82	50.4 Å²	50.4	50%	0.503	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.2	46	-171.9	56.2	0	0	0	0	113.9	S59 N126 A127	S59-T61 PolarHBondContact O-N 2.88Å; S59-T61 VanDerWaalsContact O-N 3.17Å; T61-N126 CarbonylContact O-C 3.51Å; T61-N126 WeakPolarHBondContact O-CA 3.39Å; T61-A127 PolarHBondContact O-N 3.48Å
62	I	95.7	Very high	94.4	Very high	11 Å²	11	53.1 Å²	53.1	6%	0.056	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	125.8	177.6	-56.5	-48.4	0	0	0	112.1	I58 S59 A64 Y65 T84 I125 N126	I58-I62 HydrophobicContact CG2-CD1 4.03Å; I58-I62 HydrophobicContact CG2-CG1 3.42Å; I58-I62 VanDerWaalsContact CG2-CG1 3.42Å; S59-I62 WeakPolarHBondContact O-CG1 3.28Å; I62-A64 WeakPolarHBondContact CG2-O 3.36Å; I62-Y65 HydrophobicContact CB-CE1 4Å; I62-Y65 HydrophobicContact CB-CE2 4.45Å; I62-Y65 HydrophobicContact CG1-CE1 4.11Å; I62-Y65 HydrophobicContact CG2-CD1 3.9Å; I62-Y65 HydrophobicContact CG2-CD2 4.33Å; I62-Y65 HydrophobicContact CG2-CE1 3.54Å; I62-Y65 HydrophobicContact CG2-CE2 4Å; I62-Y65 HydrophobicContact CG2-CG 4.27Å; I62-T84 PolarHBondContact O-OG1 2.89Å; I62-I125 WeakPolarHBondContact CG2-O 3.39Å; I62-N126 HydrophobicContact CD1-CB 4.26Å
63	Q	96.2	Very high	94.2	Very high	72 Å²	72	51.4 Å²	51.4	34%	0.336	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	-31.5	173.3	-70.1	-173	-11.4	0	0	112.8	T84 I125 A127	Q63-T84 WeakPolarHBondContact O-CB 3.41Å; Q63-T84 PolarHBondContact O-N 3.26Å; Q63-T84 PolarHBondContact O-OG1 3.13Å; Q63-I125 PolarHBondContact N-O 2.71Å; Q63-A127 HydrophobicContact CG-CB 4.46Å
64	A	97.2	Very high	94	Very high	5 Å²	5	56.8 Å²	56.8	4%	0.041	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	146.6	-179.5	0	0	0	0	0	113.7	I62 Y66 Y82 I83 T124 I125	I62-A64 WeakPolarHBondContact CG2-O 3.36Å; A64-Y66 HydrophobicContact CB-CD2 4.36Å; A64-Y66 HydrophobicContact CB-CE2 3.52Å; A64-Y82 CarbonylContact C-O 3.52Å; A64-Y82 WeakPolarHBondContact CA-O 3.28Å; A64-I83 HydrophobicContact CB-CD1 3.75Å; A64-T124 WeakPolarHBondContact O-CA 3.47Å; A64-I125 HydrophobicContact CB-CB 4.34Å; A64-I125 PolarHBondContact N-O 2.96Å; A64-I125 PolarHBondContact O-N 3.46Å
65	Y	97.9	Very high	93.8	Very high	19 Å²	19	58.6 Å²	58.6	8%	0.075	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	138.1	171.7	-59	-77.4	0	0	0	109.3	I58 I62 G81 Y82 P103 G105 L122 T124	I58-Y65 HydrophobicContact CD1-CE1 3.95Å; I58-Y65 HydrophobicContact CG2-CE1 4.24Å; I62-Y65 HydrophobicContact CB-CE1 4Å; I62-Y65 HydrophobicContact CB-CE2 4.45Å; I62-Y65 HydrophobicContact CG1-CE1 4.11Å; I62-Y65 HydrophobicContact CG2-CD1 3.9Å; I62-Y65 HydrophobicContact CG2-CD2 4.33Å; I62-Y65 HydrophobicContact CG2-CE1 3.54Å; I62-Y65 HydrophobicContact CG2-CE2 4Å; I62-Y65 HydrophobicContact CG2-CG 4.27Å; Y65-G81 CarbonylContact O-C 3.56Å; Y65-G81 WeakPolarHBondContact O-CA 3.11Å; Y65-Y82 AromaticContact CD2-CD1 3.83Å; Y65-Y82 HydrophobicContact CD2-CD1 3.83Å; Y65-Y82 HydrophobicContact CD2-CG 4.34Å; Y65-Y82 HydrophobicContact CE2-CD1 4.28Å; Y65-Y82 PolarHBondContact N-O 3.14Å; Y65-Y82 PolarHBondContact O-N 2.89Å; Y65-P103 WeakPolarHBondContact CE2-O 3.24Å; Y65-G105 VanDerWaalsContact CD1-CA 3.44Å; Y65-L122 HydrophobicContact CD1-CD1 4.25Å; Y65-L122 HydrophobicContact CD1-CD2 4.41Å; Y65-T124 HydrophobicContact CD1-CG2 3.9Å; Y65-T124 HydrophobicContact CE1-CG2 4.13Å
66	Y	98.2	Very high	93.9	Very high	70 Å²	70	59.2 Å²	59.2	28%	0.275	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	115.2	175.8	-61.4	-78	0	0	0	110.2	A64 H68 L78 R123 I125	A64-Y66 HydrophobicContact CB-CD2 4.36Å; A64-Y66 HydrophobicContact CB-CE2 3.52Å; Y66-H68 PolarHBondContact O-CD2 2.98Å; Y66-L78 HydrophobicContact CD1-CD1 4.01Å; Y66-L78 HydrophobicContact CG-CD1 4.42Å; Y66-R123 PolarHBondContact N-O 3.44Å; Y66-R123 PolarHBondContact O-N 3.39Å; Y66-I125 HydrophobicContact CD2-CG1 4.15Å; Y66-I125 HydrophobicContact CE2-CG1 3.76Å
67	W	98.6	Very high	94	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	129.9	176.3	-82.9	97.2	0	0	0	111	I38 L53 L78 I79 A80 G105 L107 T121 L122	I38-W67 HydrophobicContact CD1-CH2 3.64Å; I38-W67 HydrophobicContact CD1-CZ3 3.79Å; I38-W67 HydrophobicContact CG1-CH2 3.99Å; I38-W67 HydrophobicContact CG2-CH2 3.79Å; I38-W67 HydrophobicContact CG2-CZ3 4.41Å; L53-W67 HydrophobicContact CB-CH2 3.57Å; L53-W67 HydrophobicContact CB-CZ2 4.1Å; L53-W67 HydrophobicContact CB-CZ3 4.14Å; L53-W67 HydrophobicContact CD1-CE3 4.35Å; L53-W67 HydrophobicContact CD1-CH2 4.06Å; L53-W67 HydrophobicContact CD1-CZ3 3.74Å; L53-W67 HydrophobicContact CG-CH2 4.48Å; W67-L78 WeakPolarHBondContact O-CD1 3.45Å; W67-I79 HydrophobicContact CB-CB 4.3Å; W67-I79 WeakPolarHBondContact O-CB 3.46Å; W67-I79 PolarHBondContact O-N 2.84Å; W67-A80 PolarHBondContact N-O 2.9Å; W67-A80 PolarHBondContact O-N 3.37Å; W67-G105 PolarHBondContact NE1-O 3.16Å; W67-L107 HydrophobicContact CB-CD1 4.39Å; W67-L107 HydrophobicContact CB-CD2 4.39Å; W67-L107 HydrophobicContact CD2-CB 3.89Å; W67-L107 HydrophobicContact CD2-CD2 4.08Å; W67-L107 HydrophobicContact CD2-CG 4.43Å; W67-L107 HydrophobicContact CE3-CD2 4.28Å; W67-L107 HydrophobicContact CG-CB 4.17Å; W67-L107 HydrophobicContact CG-CD1 4.05Å; W67-L107 HydrophobicContact CG-CD2 4.14Å; W67-L107 HydrophobicContact CG-CG 4.38Å; W67-L107 HydrophobicContact CZ2-CB 3.9Å; W67-T121 WeakPolarHBondContact CA-O 3.32Å; W67-L122 HydrophobicContact CD2-CB 4.03Å; W67-L122 HydrophobicContact CD2-CD1 4.13Å; W67-L122 HydrophobicContact CE3-CB 4.07Å; W67-L122 HydrophobicContact CG-CD1 4.14Å; W67-L122 HydrophobicContact CH2-CB 3.89Å; W67-L122 HydrophobicContact CH2-CD2 4.49Å; W67-L122 HydrophobicContact CZ2-CB 3.83Å; W67-L122 HydrophobicContact CZ2-CD1 4.43Å; W67-L122 HydrophobicContact CZ2-CD2 3.78Å; W67-L122 HydrophobicContact CZ2-CG 4.22Å; W67-L122 HydrophobicContact CZ3-CB 4Å
68	H	98.6	Very high	94.4	Very high	23 Å²	23	58.9 Å²	58.9	11%	0.106	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	142.6	179.3	-65.7	-104.7	0	0	0	110.8	Y66 G70 A73 S76 P77 Y120 T121	Y66-H68 PolarHBondContact O-CD2 2.98Å; H68-G70 PolarHBondContact O-N 3.41Å; H68-A73 PolarHBondContact CE1-O 3.37Å; H68-A73 PolarHBondContact ND1-O 2.85Å; H68-S76 PolarHBondContact ND1-O 3.21Å; H68-P77 WeakPolarHBondContact CA-O 3.28Å; H68-Y120 WeakPolarHBondContact O-CA 3.3Å; H68-T121 PolarHBondContact N-O 2.88Å; H68-T121 PolarHBondContact O-N 3.01Å
69	K	97.7	Very high	94.8	Very high	74 Å²	74	57.2 Å²	57.2	32%	0.322	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	92.9	172.3	-168	171.3	-177.3	173.1	0	108.9	P77 I79 E115 D116 Y120	K69-P77 HydrophobicContact CB-CG 4.35Å; K69-P77 PolarHBondContact N-O 3.38Å; K69-P77 WeakPolarHBondContact O-CD 3.22Å; K69-I79 HydrophobicContact CB-CD1 3.92Å; K69-I79 HydrophobicContact CB-CG1 3.98Å; K69-E115 PolarHBondContact NZ-O 3.14Å; K69-E115 VanDerWaalsContact NZ-O 3.1Å; K69-D116 IonicContact NZ-OD1 3.89Å; K69-Y120 HydrophobicContact CB-CE1 4.43Å; K69-Y120 HydrophobicContact CG-CE1 4.06Å
70	G	97.1	Very high	95.6	Very high	17 Å²	17	53.7 Å²	53.7	18%	0.175	30%	0.295	C	S	.	.	S	Bend	trans	162.6	-172.3	-179.7	0	0	0	0	0	113.7	H68 S76 S119 Y120 T121	H68-G70 PolarHBondContact O-N 3.41Å; G70-S76 WeakPolarHBondContact CA-OG 3.41Å; G70-S119 CarbonylContact C-O 3.4Å; G70-S119 WeakPolarHBondContact CA-O 3.49Å; G70-S119 PolarHBondContact N-O 2.96Å; G70-S119 CarbonylContact O-C 3.51Å; G70-S119 WeakPolarHBondContact O-CB 3.24Å; G70-S119 VanDerWaalsContact O-O 3.1Å; G70-Y120 CarbonylContact O-C 3.5Å; G70-Y120 PolarHBondContact O-N 3.43Å; G70-T121 PolarHBondContact O-N 3.45Å; G70-T121 PolarHBondContact O-OG1 3.14Å; G70-T121 VanDerWaalsContact O-OG1 3.06Å
71	K	96.3	Very high	96.6	Very high	153 Å²	153	44.4 Å²	44.4	67%	0.665	25%	0.251	S	S	*	.	S	Bend	trans	-87	-16.8	-177.7	-72.1	-179.9	178.1	178.6	0	114.2	S119 T121 T135	K71-S119 WeakPolarHBondContact CG-OG 3.39Å; K71-T121 PolarHBondContact O-OG1 3.3Å; K71-T135 PolarHBondContact O-OG1 2.58Å
72	T	96.1	Very high	97.1	Very high	58 Å²	58	41 Å²	41	36%	0.356	23%	0.23	S	C	.	.	S	Bend	trans	-148.1	145.7	-173.2	-55.6	0	0	0	0	108.3	E74 S76 T121	T72-E74 VanDerWaalsContact C-N 3.34Å; T72-E74 HydrophobicContact CG2-CB 4.24Å; T72-E74 WeakPolarHBondContact CG2-OE2 3.46Å; T72-S76 WeakPolarHBondContact O-CB 3.38Å; T72-S76 PolarHBondContact O-OG 2.71Å; T72-T121 PolarHBondContact N-OG1 3.14Å
73	A	95.1	Very high	97.2	Very high	6 Å²	6	42.2 Å²	42.2	5%	0.05	24%	0.235	C	C	.	.	S	Bend	trans	-66.5	-38.6	-179.8	0	0	0	0	0	111.8	H68 G75 S76 T121 R123	H68-A73 PolarHBondContact CE1-O 3.37Å; H68-A73 PolarHBondContact ND1-O 2.85Å; A73-G75 PolarHBondContact O-N 2.96Å; A73-S76 PolarHBondContact O-N 3.49Å; A73-T121 HydrophobicContact CB-CG2 4.23Å; A73-R123 HydrophobicContact CB-CB 3.97Å; A73-R123 HydrophobicContact CB-CG 4.41Å
74	E	94.3	Very high	97.2	Very high	113 Å²	113	41.3 Å²	41.3	53%	0.528	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	124.3	175.3	-67.5	70.2	-152.2	0	0	111.4	T72 S76	T72-E74 VanDerWaalsContact C-N 3.34Å; T72-E74 HydrophobicContact CG2-CB 4.24Å; T72-E74 WeakPolarHBondContact CG2-OE2 3.46Å; E74-S76 PolarHBondContact O-N 3.21Å
75	G	92.9	Very high	97.1	Very high	90 Å²	90	48.2 Å²	48.2	93%	0.928	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	-11.8	177.3	0	0	0	0	0	115.2	A73	A73-G75 PolarHBondContact O-N 2.96Å
76	S	97.3	Very high	97	Very high	26 Å²	26	52.7 Å²	52.7	18%	0.182	30%	0.295	C	S	.	.	S	Bend	trans	-88.2	138	174.7	-59.9	0	0	0	0	111	H68 G70 T72 A73 E74 L78	H68-S76 PolarHBondContact ND1-O 3.21Å; G70-S76 WeakPolarHBondContact CA-OG 3.41Å; T72-S76 WeakPolarHBondContact O-CB 3.38Å; T72-S76 PolarHBondContact O-OG 2.71Å; A73-S76 PolarHBondContact O-N 3.49Å; E74-S76 PolarHBondContact O-N 3.21Å; S76-L78 PolarHBondContact O-N 3.15Å
77	P	97.8	Very high	96.9	Very high	64 Å²	64	56.7 Å²	56.7	42%	0.416	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-65	137.3	-179.3	29.1	-36.4	0	0	0	111.2	H68 K69 A94	H68-P77 WeakPolarHBondContact CA-O 3.28Å; K69-P77 HydrophobicContact CB-CG 4.35Å; K69-P77 PolarHBondContact N-O 3.38Å; K69-P77 WeakPolarHBondContact O-CD 3.22Å; P77-A94 HydrophobicContact CB-CB 3.91Å; P77-A94 HydrophobicContact CG-CB 4.09Å
78	L	98.4	Very high	96.8	Very high	45 Å²	45	58.1 Å²	58.1	24%	0.236	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	130.1	176.6	-176.4	74.4	0	0	0	109.7	Y66 W67 S76 G92 A93 A94	Y66-L78 HydrophobicContact CD1-CD1 4.01Å; Y66-L78 HydrophobicContact CG-CD1 4.42Å; W67-L78 WeakPolarHBondContact O-CD1 3.45Å; S76-L78 PolarHBondContact O-N 3.15Å; L78-G92 CarbonylContact O-C 3.56Å; L78-G92 VanDerWaalsContact O-CA 3.27Å; L78-G92 WeakPolarHBondContact O-CA 3.39Å; L78-A93 PolarHBondContact O-N 3.11Å; L78-A94 PolarHBondContact O-N 2.86Å
79	I	98.5	Very high	96.8	Very high	2 Å²	2	60.3 Å²	60.3	1%	0.01	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-60	171.1	-60.2	167.5	0	0	0	108.8	W67 K69 G92 A94 Y95 E99 L107 Y120	W67-I79 HydrophobicContact CB-CB 4.3Å; W67-I79 WeakPolarHBondContact O-CB 3.46Å; W67-I79 PolarHBondContact O-N 2.84Å; K69-I79 HydrophobicContact CB-CD1 3.92Å; K69-I79 HydrophobicContact CB-CG1 3.98Å; I79-G92 WeakPolarHBondContact O-CA 3.48Å; I79-G92 PolarHBondContact O-N 3.3Å; I79-A94 HydrophobicContact CG1-CB 4.17Å; I79-Y95 WeakPolarHBondContact O-CB 3.33Å; I79-E99 HydrophobicContact CG2-CB 3.77Å; I79-E99 HydrophobicContact CG2-CG 3.6Å; I79-L107 HydrophobicContact CD1-CD2 4.44Å; I79-Y120 HydrophobicContact CD1-CD1 3.45Å; I79-Y120 VanDerWaalsContact CD1-CD1 3.45Å; I79-Y120 HydrophobicContact CD1-CE1 3.53Å
80	A	98.4	Very high	96.8	Very high	2 Å²	2	60.5 Å²	60.5	2%	0.017	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	146.2	-179.9	0	0	0	0	0	110.9	W67 I90 V101	W67-A80 PolarHBondContact N-O 2.9Å; W67-A80 PolarHBondContact O-N 3.37Å; A80-I90 CarbonylContact C-O 3.52Å; A80-I90 VanDerWaalsContact CA-O 3.29Å; A80-I90 WeakPolarHBondContact CA-O 3.43Å; A80-V101 HydrophobicContact CB-CG2 3.61Å
81	G	98.2	Very high	96.8	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	155.5	165.8	0	0	0	0	0	111.6	Y65 N89 I90	Y65-G81 CarbonylContact O-C 3.56Å; Y65-G81 WeakPolarHBondContact O-CA 3.11Å; G81-N89 CarbonylContact O-C 3.58Å; G81-N89 VanDerWaalsContact O-CA 3.27Å; G81-N89 WeakPolarHBondContact O-CA 3.5Å; G81-I90 PolarHBondContact N-O 3.26Å; G81-I90 PolarHBondContact O-N 2.72Å
82	Y	98.4	Very high	96.9	Very high	12 Å²	12	57.2 Å²	57.2	5%	0.047	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	124.6	167.1	-176.1	-90.2	0	0	0	108.8	A64 Y65 Q87 A88 N89 V101 P103	A64-Y82 CarbonylContact C-O 3.52Å; A64-Y82 WeakPolarHBondContact CA-O 3.28Å; Y65-Y82 AromaticContact CD2-CD1 3.83Å; Y65-Y82 HydrophobicContact CD2-CD1 3.83Å; Y65-Y82 HydrophobicContact CD2-CG 4.34Å; Y65-Y82 HydrophobicContact CE2-CD1 4.28Å; Y65-Y82 PolarHBondContact N-O 3.14Å; Y65-Y82 PolarHBondContact O-N 2.89Å; Y82-Q87 WeakPolarHBondContact OH-CA 3.13Å; Y82-Q87 WeakPolarHBondContact OH-CB 3.27Å; Y82-A88 WeakPolarHBondContact CA-O 3.44Å; Y82-N89 WeakPolarHBondContact CD2-OD1 3.44Å; Y82-V101 HydrophobicContact CG-CG1 4.35Å; Y82-P103 HydrophobicContact CE1-CB 4.21Å; Y82-P103 HydrophobicContact CE2-CG 4.46Å; Y82-P103 WeakPolarHBondContact OH-CG 3.48Å
83	I	97.7	Very high	97	Very high	35 Å²	35	59.2 Å²	59.2	18%	0.179	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	117.4	175.8	-52.4	-57.3	0	0	0	108.5	A64 D85 I86 Q87 A88 I90	A64-I83 HydrophobicContact CB-CD1 3.75Å; I83-D85 PolarHBondContact O-N 3.25Å; I83-I86 HydrophobicContact CB-CD1 4.24Å; I83-I86 HydrophobicContact CB-CG1 3.78Å; I83-I86 HydrophobicContact CG2-CD1 4.4Å; I83-I86 HydrophobicContact CG2-CG1 3.81Å; I83-Q87 WeakPolarHBondContact O-CA 3.34Å; I83-Q87 PolarHBondContact O-N 3.47Å; I83-A88 PolarHBondContact N-O 3Å; I83-A88 PolarHBondContact O-N 2.95Å; I83-I90 HydrophobicContact CD1-CD1 4.03Å; I83-I90 HydrophobicContact CG1-CD1 3.51Å; I83-I90 HydrophobicContact CG1-CG1 4.33Å
84	T	96.1	Very high	97.1	Very high	53 Å²	53	60.3 Å²	60.3	33%	0.325	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-40.2	-172.6	-53.2	0	0	0	0	112.6	I62 Q63 I86 Q87	I62-T84 PolarHBondContact O-OG1 2.89Å; Q63-T84 WeakPolarHBondContact O-CB 3.41Å; Q63-T84 PolarHBondContact O-N 3.26Å; Q63-T84 PolarHBondContact O-OG1 3.13Å; T84-I86 PolarHBondContact O-N 3.45Å; T84-Q87 WeakPolarHBondContact O-CG 3.3Å; T84-Q87 PolarHBondContact O-N 3.29Å
85	D	94.8	Very high	97.3	Very high	150 Å²	150	59.7 Å²	59.7	80%	0.802	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-46	-176.6	-174.8	21.7	0	0	0	112.5	I83	I83-D85 PolarHBondContact O-N 3.25Å
86	I	96.3	Very high	97.5	Very high	114 Å²	114	58.2 Å²	58.2	59%	0.585	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	1.7	-179.1	61.7	167.1	0	0	0	113.4	I83 T84 A88	I83-I86 HydrophobicContact CB-CD1 4.24Å; I83-I86 HydrophobicContact CB-CG1 3.78Å; I83-I86 HydrophobicContact CG2-CD1 4.4Å; I83-I86 HydrophobicContact CG2-CG1 3.81Å; T84-I86 PolarHBondContact O-N 3.45Å; I86-A88 VanDerWaalsContact C-N 3.29Å; I86-A88 HydrophobicContact CD1-CB 3.72Å; I86-A88 HydrophobicContact CG1-CB 3.79Å; I86-A88 PolarHBondContact O-N 3.33Å
87	Q	96.1	Very high	97.5	Very high	153 Å²	153	59.2 Å²	59.2	72%	0.715	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.5	46.8	-178.3	-60.6	-176.2	-2.2	0	0	113.8	Y82 I83 T84	Y82-Q87 WeakPolarHBondContact OH-CA 3.13Å; Y82-Q87 WeakPolarHBondContact OH-CB 3.27Å; I83-Q87 WeakPolarHBondContact O-CA 3.34Å; I83-Q87 PolarHBondContact O-N 3.47Å; T84-Q87 WeakPolarHBondContact O-CG 3.3Å; T84-Q87 PolarHBondContact O-N 3.29Å
88	A	97	Very high	97.5	Very high	31 Å²	31	58.6 Å²	58.6	26%	0.256	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	138.4	-171.7	0	0	0	0	0	112.7	Y82 I83 I86	Y82-A88 WeakPolarHBondContact CA-O 3.44Å; I83-A88 PolarHBondContact N-O 3Å; I83-A88 PolarHBondContact O-N 2.95Å; I86-A88 VanDerWaalsContact C-N 3.29Å; I86-A88 HydrophobicContact CD1-CB 3.72Å; I86-A88 HydrophobicContact CG1-CB 3.79Å; I86-A88 PolarHBondContact O-N 3.33Å
89	N	97.7	Very high	97.5	Very high	69 Å²	69	56.7 Å²	56.7	37%	0.369	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	132.4	168.9	-68.9	32.9	0	0	0	109.9	G81 Y82 V101	G81-N89 CarbonylContact O-C 3.58Å; G81-N89 VanDerWaalsContact O-CA 3.27Å; G81-N89 WeakPolarHBondContact O-CA 3.5Å; Y82-N89 WeakPolarHBondContact CD2-OD1 3.44Å; N89-V101 PolarHBondContact ND2-N 2.92Å; N89-V101 VanDerWaalsContact ND2-N 3.11Å; N89-V101 PolarHBondContact ND2-O 2.57Å; N89-V101 PolarHBondContact OD1-O 3.46Å
90	I	97.7	Very high	97.4	Very high	78 Å²	78	59 Å²	59	40%	0.4	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	111.5	175.8	-55.4	177.8	0	0	0	107.6	A80 G81 I83	A80-I90 CarbonylContact C-O 3.52Å; A80-I90 VanDerWaalsContact CA-O 3.29Å; A80-I90 WeakPolarHBondContact CA-O 3.43Å; G81-I90 PolarHBondContact N-O 3.26Å; G81-I90 PolarHBondContact O-N 2.72Å; I83-I90 HydrophobicContact CD1-CD1 4.03Å; I83-I90 HydrophobicContact CG1-CD1 3.51Å; I83-I90 HydrophobicContact CG1-CG1 4.33Å
91	P	98.1	Very high	97.4	Very high	83 Å²	83	59 Å²	59	54%	0.539	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	139.8	179.1	28.1	-33.9	0	0	0	111.2	Y95	P91-Y95 HydrophobicContact CB-CD1 3.53Å; P91-Y95 HydrophobicContact CB-CD2 4.31Å; P91-Y95 HydrophobicContact CB-CE1 4.06Å; P91-Y95 HydrophobicContact CB-CG 3.67Å
92	G	97.9	Very high	97.4	Very high	18 Å²	18	63.7 Å²	63.7	19%	0.186	37%	0.365	C	S	.	.			trans	-101.8	-176.3	175.4	0	0	0	0	0	113.5	L78 I79 A94 Y95	L78-G92 CarbonylContact O-C 3.56Å; L78-G92 VanDerWaalsContact O-CA 3.27Å; L78-G92 WeakPolarHBondContact O-CA 3.39Å; I79-G92 WeakPolarHBondContact O-CA 3.48Å; I79-G92 PolarHBondContact O-N 3.3Å; G92-A94 VanDerWaalsContact C-N 3.28Å; G92-A94 PolarHBondContact O-N 3.39Å; G92-Y95 WeakPolarHBondContact O-CB 3.34Å; G92-Y95 PolarHBondContact O-N 3.22Å; G92-Y95 VanDerWaalsContact O-N 3.15Å
93	A	97.8	Very high	97.2	Very high	100 Å²	100	66.9 Å²	66.9	83%	0.826	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-25.4	-178.3	0	0	0	0	0	114.1	L78	L78-A93 PolarHBondContact O-N 3.11Å
94	A	97.4	Very high	97.1	Very high	28 Å²	28	69.1 Å²	69.1	23%	0.231	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	9	175	0	0	0	0	0	113	P77 L78 I79 G92 S96	P77-A94 HydrophobicContact CB-CB 3.91Å; P77-A94 HydrophobicContact CG-CB 4.09Å; L78-A94 PolarHBondContact O-N 2.86Å; I79-A94 HydrophobicContact CG1-CB 4.17Å; G92-A94 VanDerWaalsContact C-N 3.28Å; G92-A94 PolarHBondContact O-N 3.39Å; A94-S96 PolarHBondContact O-N 3.3Å
95	Y	98.1	Very high	97.1	Very high	101 Å²	101	66.6 Å²	66.6	40%	0.396	39%	0.385	S	S	.	.			trans	-65.3	122.9	176.5	-171.4	-117.7	0	0	0	110.7	I79 P91 G92 E99	I79-Y95 WeakPolarHBondContact O-CB 3.33Å; P91-Y95 HydrophobicContact CB-CD1 3.53Å; P91-Y95 HydrophobicContact CB-CD2 4.31Å; P91-Y95 HydrophobicContact CB-CE1 4.06Å; P91-Y95 HydrophobicContact CB-CG 3.67Å; G92-Y95 WeakPolarHBondContact O-CB 3.34Å; G92-Y95 PolarHBondContact O-N 3.22Å; G92-Y95 VanDerWaalsContact O-N 3.15Å; Y95-E99 HydrophobicContact CD2-CB 4.4Å; Y95-E99 WeakPolarHBondContact CD2-OE2 3.24Å; Y95-E99 HydrophobicContact CE2-CB 4.22Å; Y95-E99 VanDerWaalsContact CE2-O 3.28Å; Y95-E99 WeakPolarHBondContact CE2-O 3.33Å; Y95-E99 PolarHBondContact OH-O 2.94Å
96	S	97.1	Very high	97.2	Very high	58 Å²	58	59.5 Å²	59.5	41%	0.406	35%	0.347	S	S	.	.			trans	-103.3	-0.6	178.7	72.7	0	0	0	0	113.3	A94 R98 E99	A94-S96 PolarHBondContact O-N 3.3Å; S96-R98 PolarHBondContact OG-NE 2.78Å; S96-R98 PolarHBondContact OG-NH2 3.36Å; S96-E99 WeakPolarHBondContact CB-OE1 3.38Å; S96-E99 PolarHBondContact N-OE1 2.76Å; S96-E99 PolarHBondContact N-OE2 3.3Å; S96-E99 PolarHBondContact OG-OE1 2.89Å; S96-E99 PolarHBondContact OG-OE2 2.88Å; S96-E99 VanDerWaalsContact OG-OE2 3.13Å
97	G	97.6	Very high	97.3	Very high	47 Å²	47	54 Å²	54	49%	0.485	32%	0.319	S	S	.	.	S	Bend	trans	83.6	-0.5	-175	0	0	0	0	0	113.7	E99	G97-E99 PolarHBondContact N-OE2 3.13Å
98	R	97.9	Very high	97.4	Very high	51 Å²	51	48.1 Å²	48.1	19%	0.192	29%	0.292	C	S	.	.			trans	-103.3	-9.3	-178.6	-62.6	179	-66.1	156.4	4.2	112.7	S96 F109 Q110 N111 D116	S96-R98 PolarHBondContact OG-NE 2.78Å; S96-R98 PolarHBondContact OG-NH2 3.36Å; R98-F109 HydrophobicContact CB-CD2 4.2Å; R98-F109 HydrophobicContact CB-CE2 4.02Å; R98-Q110 WeakPolarHBondContact CB-O 3.4Å; R98-Q110 PolarHBondContact O-N 2.78Å; R98-N111 PolarHBondContact NH1-O 2.96Å; R98-D116 IonicContact CZ-OD1 3.97Å; R98-D116 IonicContact CZ-OD2 3.3Å; R98-D116 VanDerWaalsContact CZ-OD2 3.3Å; R98-D116 IonicContact NH1-OD2 2.76Å; R98-D116 PolarHBondContact NH1-OD2 3.47Å; R98-D116 VanDerWaalsContact NH2-CG 3.32Å; R98-D116 IonicContact NH2-OD1 2.95Å; R98-D116 PolarHBondContact NH2-OD1 2.83Å; R98-D116 IonicContact NH2-OD2 3Å; R98-D116 PolarHBondContact NH2-OD2 2.82Å
99	E	98.3	Very high	97.5	Very high	5 Å²	5	46.7 Å²	46.7	2%	0.023	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	140.9	-174.8	-51.4	87.8	170.3	0	0	111.2	I79 Y95 S96 G97 L107 L108 F109	I79-E99 HydrophobicContact CG2-CB 3.77Å; I79-E99 HydrophobicContact CG2-CG 3.6Å; Y95-E99 HydrophobicContact CD2-CB 4.4Å; Y95-E99 WeakPolarHBondContact CD2-OE2 3.24Å; Y95-E99 HydrophobicContact CE2-CB 4.22Å; Y95-E99 VanDerWaalsContact CE2-O 3.28Å; Y95-E99 WeakPolarHBondContact CE2-O 3.33Å; Y95-E99 PolarHBondContact OH-O 2.94Å; S96-E99 WeakPolarHBondContact CB-OE1 3.38Å; S96-E99 PolarHBondContact N-OE1 2.76Å; S96-E99 PolarHBondContact N-OE2 3.3Å; S96-E99 PolarHBondContact OG-OE1 2.89Å; S96-E99 PolarHBondContact OG-OE2 2.88Å; S96-E99 VanDerWaalsContact OG-OE2 3.13Å; G97-E99 PolarHBondContact N-OE2 3.13Å; E99-L107 HydrophobicContact CB-CD1 4.08Å; E99-L108 CarbonylContact C-O 3.44Å; E99-L108 VanDerWaalsContact CA-O 3.3Å; E99-L108 WeakPolarHBondContact CA-O 3.36Å; E99-F109 HydrophobicContact CG-CD1 4.39Å; E99-F109 HydrophobicContact CG-CD2 4.04Å; E99-F109 HydrophobicContact CG-CE1 4.34Å; E99-F109 HydrophobicContact CG-CE2 3.99Å; E99-F109 HydrophobicContact CG-CG 4.23Å; E99-F109 HydrophobicContact CG-CZ 4.14Å; E99-F109 WeakPolarHBondContact OE1-CZ 3.17Å
100	T	97.9	Very high	97.5	Very high	51 Å²	51	47.3 Å²	47.3	31%	0.313	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	120.4	174.6	-63.5	0	0	0	0	109.2	L108	T100-L108 PolarHBondContact N-O 3.46Å; T100-L108 PolarHBondContact O-N 2.85Å
101	V	98.3	Very high	97.5	Very high	3 Å²	3	48.2 Å²	48.2	2%	0.018	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	131.3	173	-168.8	0	0	0	0	108.6	A80 Y82 N89 S106 L107	A80-V101 HydrophobicContact CB-CG2 3.61Å; Y82-V101 HydrophobicContact CG-CG1 4.35Å; N89-V101 PolarHBondContact ND2-N 2.92Å; N89-V101 VanDerWaalsContact ND2-N 3.11Å; N89-V101 PolarHBondContact ND2-O 2.57Å; N89-V101 PolarHBondContact OD1-O 3.46Å; V101-S106 WeakPolarHBondContact CA-O 3.39Å; V101-L107 HydrophobicContact CB-CD1 4.5Å; V101-L107 HydrophobicContact CG2-CD1 3.65Å
102	Y	97.1	Very high	97.4	Very high	97 Å²	97	44.3 Å²	44.3	38%	0.38	26%	0.261	S	S	.	.			trans	-91.3	159.9	174.6	-74.7	-56.6	0	0	0	111.9	L52 N104 G105 S106 L108	L52-Y102 HydrophobicContact CD1-CD2 3.98Å; L52-Y102 HydrophobicContact CD1-CE2 3.84Å; Y102-N104 VanDerWaalsContact CB-OD1 3.23Å; Y102-N104 WeakPolarHBondContact CB-OD1 3.27Å; Y102-N104 PolarHBondContact O-N 2.98Å; Y102-G105 WeakPolarHBondContact O-CA 3.29Å; Y102-G105 PolarHBondContact O-N 3.37Å; Y102-S106 PolarHBondContact N-O 3.15Å; Y102-L108 HydrophobicContact CD2-CB 4.5Å; Y102-L108 HydrophobicContact CE2-CB 3.73Å
103	P	94.9	Very high	97.3	Very high	80 Å²	80	45.4 Å²	45.4	52%	0.519	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-21.2	178.8	-22.9	31.9	0	0	0	114.8	Y65 Y82 G105	Y65-P103 WeakPolarHBondContact CE2-O 3.24Å; Y82-P103 HydrophobicContact CE1-CB 4.21Å; Y82-P103 HydrophobicContact CE2-CG 4.46Å; Y82-P103 WeakPolarHBondContact OH-CG 3.48Å; P103-G105 PolarHBondContact O-N 3.27Å
104	N	94.6	Very high	97.3	Very high	82 Å²	82	44.3 Å²	44.3	44%	0.439	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	7.1	174.6	70.3	-9.4	0	0	0	113.2	I58 Y102 S106	I58-N104 WeakPolarHBondContact CD1-O 3.48Å; Y102-N104 VanDerWaalsContact CB-OD1 3.23Å; Y102-N104 WeakPolarHBondContact CB-OD1 3.27Å; Y102-N104 PolarHBondContact O-N 2.98Å; N104-S106 VanDerWaalsContact C-N 3.28Å; N104-S106 PolarHBondContact ND2-OG 2.84Å; N104-S106 PolarHBondContact O-N 3.16Å; N104-S106 VanDerWaalsContact OD1-CB 3.22Å; N104-S106 WeakPolarHBondContact OD1-CB 3.42Å; N104-S106 PolarHBondContact OD1-N 3.01Å; N104-S106 PolarHBondContact OD1-OG 2.79Å
105	G	96	Very high	97.2	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.27	C	S	.	.	S	Bend	trans	81.1	-5	-177.6	0	0	0	0	0	115.1	Y65 W67 Y102 P103 L122	Y65-G105 VanDerWaalsContact CD1-CA 3.44Å; W67-G105 PolarHBondContact NE1-O 3.16Å; Y102-G105 WeakPolarHBondContact O-CA 3.29Å; Y102-G105 PolarHBondContact O-N 3.37Å; P103-G105 PolarHBondContact O-N 3.27Å; G105-L122 WeakPolarHBondContact O-CD2 3.49Å
106	S	97.8	Very high	97.2	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.253	C	S	.	.			trans	-73.9	149.4	179.4	-56.5	0	0	0	0	111.7	L53 A55 V101 Y102 N104	L53-S106 VanDerWaalsContact O-CA 3.3Å; L53-S106 WeakPolarHBondContact O-CA 3.47Å; L53-S106 WeakPolarHBondContact O-CB 3.45Å; A55-S106 PolarHBondContact N-OG 3.36Å; A55-S106 VanDerWaalsContact N-OG 3.14Å; V101-S106 WeakPolarHBondContact CA-O 3.39Å; Y102-S106 PolarHBondContact N-O 3.15Å; N104-S106 VanDerWaalsContact C-N 3.28Å; N104-S106 PolarHBondContact ND2-OG 2.84Å; N104-S106 PolarHBondContact O-N 3.16Å; N104-S106 VanDerWaalsContact OD1-CB 3.22Å; N104-S106 WeakPolarHBondContact OD1-CB 3.42Å; N104-S106 PolarHBondContact OD1-N 3.01Å; N104-S106 PolarHBondContact OD1-OG 2.79Å
107	L	98.4	Very high	97.2	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	117.8	178	-170.6	74.2	0	0	0	110.4	L52 L53 W67 I79 E99 V101	L52-L107 WeakPolarHBondContact CA-O 3.33Å; L53-L107 HydrophobicContact CB-CB 4.22Å; L53-L107 HydrophobicContact CD1-CD2 4.16Å; L53-L107 PolarHBondContact N-O 2.87Å; L53-L107 PolarHBondContact O-N 2.79Å; W67-L107 HydrophobicContact CB-CD1 4.39Å; W67-L107 HydrophobicContact CB-CD2 4.39Å; W67-L107 HydrophobicContact CD2-CB 3.89Å; W67-L107 HydrophobicContact CD2-CD2 4.08Å; W67-L107 HydrophobicContact CD2-CG 4.43Å; W67-L107 HydrophobicContact CE3-CD2 4.28Å; W67-L107 HydrophobicContact CG-CB 4.17Å; W67-L107 HydrophobicContact CG-CD1 4.05Å; W67-L107 HydrophobicContact CG-CD2 4.14Å; W67-L107 HydrophobicContact CG-CG 4.38Å; W67-L107 HydrophobicContact CZ2-CB 3.9Å; I79-L107 HydrophobicContact CD1-CD2 4.44Å; E99-L107 HydrophobicContact CB-CD1 4.08Å; V101-L107 HydrophobicContact CB-CD1 4.5Å; V101-L107 HydrophobicContact CG2-CD1 3.65Å
108	L	98.4	Very high	97.1	Very high	28 Å²	28	45 Å²	45	15%	0.147	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	126.9	161.9	-179.6	66	0	0	0	108.8	D50 L52 E99 T100 Y102 Q110	D50-L108 HydrophobicContact CB-CD1 4.39Å; L52-L108 HydrophobicContact CD1-CB 4.33Å; E99-L108 CarbonylContact C-O 3.44Å; E99-L108 VanDerWaalsContact CA-O 3.3Å; E99-L108 WeakPolarHBondContact CA-O 3.36Å; T100-L108 PolarHBondContact N-O 3.46Å; T100-L108 PolarHBondContact O-N 2.85Å; Y102-L108 HydrophobicContact CD2-CB 4.5Å; Y102-L108 HydrophobicContact CE2-CB 3.73Å; L108-Q110 HydrophobicContact CD2-CG 3.86Å; L108-Q110 HydrophobicContact CG-CG 3.92Å
109	F	97.9	Very high	97.1	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.009	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	108.4	172.8	-157.9	155.1	0	0	0	108.6	D50 V51 R98 E99 I112 D116 Y120 L138	D50-F109 CarbonylContact C-O 3.5Å; D50-F109 WeakPolarHBondContact CA-O 3.14Å; V51-F109 PolarHBondContact N-O 3.1Å; V51-F109 PolarHBondContact O-N 3.5Å; R98-F109 HydrophobicContact CB-CD2 4.2Å; R98-F109 HydrophobicContact CB-CE2 4.02Å; E99-F109 HydrophobicContact CG-CD1 4.39Å; E99-F109 HydrophobicContact CG-CD2 4.04Å; E99-F109 HydrophobicContact CG-CE1 4.34Å; E99-F109 HydrophobicContact CG-CE2 3.99Å; E99-F109 HydrophobicContact CG-CG 4.23Å; E99-F109 HydrophobicContact CG-CZ 4.14Å; E99-F109 WeakPolarHBondContact OE1-CZ 3.17Å; F109-I112 HydrophobicContact CB-CG2 4.16Å; F109-I112 HydrophobicContact CD1-CG2 4.5Å; F109-I112 HydrophobicContact CD2-CG2 3.94Å; F109-I112 HydrophobicContact CG-CG2 3.93Å; F109-D116 HydrophobicContact CE1-CB 4Å; F109-D116 HydrophobicContact CZ-CB 3.9Å; F109-D116 VanDerWaalsContact CZ-CG 3.49Å; F109-D116 WeakPolarHBondContact CZ-OD1 3.4Å; F109-Y120 HydrophobicContact CD1-CE1 4.35Å; F109-Y120 AromaticContact CE1-CE1 3.98Å; F109-Y120 HydrophobicContact CE1-CE1 3.98Å; F109-Y120 AromaticContact CE1-CZ 3.93Å; F109-Y120 WeakPolarHBondContact CE1-OH 3.42Å; F109-L138 HydrophobicContact CD1-CD2 4.12Å; F109-L138 HydrophobicContact CE1-CD2 4.49Å
110	Q	98.1	Very high	97.1	Very high	82 Å²	82	43.1 Å²	43.1	38%	0.383	24%	0.237	S	C	.	.			trans	-88.5	149.8	-177.8	-60.6	-176.9	-46.7	0	0	112.4	D50 R98 L108 I112	D50-Q110 WeakPolarHBondContact OD1-CA 3.28Å; R98-Q110 WeakPolarHBondContact CB-O 3.4Å; R98-Q110 PolarHBondContact O-N 2.78Å; L108-Q110 HydrophobicContact CD2-CG 3.86Å; L108-Q110 HydrophobicContact CG-CG 3.92Å; Q110-I112 PolarHBondContact O-N 3.25Å
111	N	97.1	Very high	97.1	Very high	97 Å²	97	40.7 Å²	40.7	52%	0.519	22%	0.223	S	C	.	.	S	Bend	trans	46.5	57.6	171.6	-170.9	25.4	0	0	0	112.6	G48 K49 D50 R98	G48-N111 VanDerWaalsContact CA-OD1 3.28Å; G48-N111 WeakPolarHBondContact CA-OD1 3.41Å; K49-N111 PolarHBondContact O-N 3.47Å; D50-N111 PolarHBondContact OD1-N 3.49Å; R98-N111 PolarHBondContact NH1-O 2.96Å
112	I	97.1	Very high	97.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.222	C	C	.	.			trans	-67.7	149.1	-175.7	70.3	-169	0	0	0	111.5	A45 G48 K49 V51 F109 Q110 V140	A45-I112 HydrophobicContact CB-CD1 3.38Å; G48-I112 PolarHBondContact N-O 2.94Å; K49-I112 WeakPolarHBondContact O-CG1 3.47Å; K49-I112 PolarHBondContact O-N 3.02Å; V51-I112 HydrophobicContact CG2-CD1 3.64Å; F109-I112 HydrophobicContact CB-CG2 4.16Å; F109-I112 HydrophobicContact CD1-CG2 4.5Å; F109-I112 HydrophobicContact CD2-CG2 3.94Å; F109-I112 HydrophobicContact CG-CG2 3.93Å; Q110-I112 PolarHBondContact O-N 3.25Å; I112-V140 HydrophobicContact CD1-CB 4.5Å; I112-V140 HydrophobicContact CD1-CG1 4.01Å; I112-V140 HydrophobicContact CD1-CG2 3.82Å; I112-V140 HydrophobicContact CG1-CG1 3.96Å; I112-V140 HydrophobicContact CG1-CG2 4.18Å
113	T	96.4	Very high	97.2	Very high	42 Å²	42	39.8 Å²	39.8	26%	0.258	22%	0.218	S	C	.	.			trans	-114.3	168.6	175.2	65.7	0	0	0	0	111.1	E115 D116	T113-E115 PolarHBondContact O-N 3.32Å; T113-E115 PolarHBondContact OG1-N 2.78Å; T113-D116 WeakPolarHBondContact CB-OD2 3.48Å; T113-D116 PolarHBondContact N-OD2 3.47Å; T113-D116 WeakPolarHBondContact O-CB 3.47Å; T113-D116 PolarHBondContact O-N 2.91Å; T113-D116 VanDerWaalsContact OG1-CG 3.31Å; T113-D116 PolarHBondContact OG1-OD2 3.05Å
114	L	96.5	Very high	97.3	Very high	76 Å²	76	36.2 Å²	36.2	40%	0.398	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-58.9	-29.3	173.2	-72.4	169.9	0	0	0	113.1	E47 D116 A117 V140	E47-L114 PolarHBondContact OE1-N 2.9Å; L114-D116 PolarHBondContact O-N 2.86Å; L114-A117 WeakPolarHBondContact O-CB 3.49Å; L114-A117 PolarHBondContact O-N 3.39Å; L114-V140 HydrophobicContact CD2-CG1 4.3Å
115	E	96.2	Very high	97.4	Very high	168 Å²	168	33.5 Å²	33.5	79%	0.785	18%	0.18	S	C	*	.	G	3₁₀ helix	trans	-74.7	-12.7	177.4	-58.2	-175.4	-177.7	0	0	113.5	K69 T113 A117	K69-E115 PolarHBondContact NZ-O 3.14Å; K69-E115 VanDerWaalsContact NZ-O 3.1Å; T113-E115 PolarHBondContact O-N 3.32Å; T113-E115 PolarHBondContact OG1-N 2.78Å; E115-A117 VanDerWaalsContact C-N 3.34Å
116	D	96.8	Very high	97.3	Very high	8 Å²	8	35.1 Å²	35.1	4%	0.043	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-85.1	-11.4	175.4	-60	-48.6	0	0	0	111.9	K69 R98 F109 T113 L114 Y120	K69-D116 IonicContact NZ-OD1 3.89Å; R98-D116 IonicContact CZ-OD1 3.97Å; R98-D116 IonicContact CZ-OD2 3.3Å; R98-D116 VanDerWaalsContact CZ-OD2 3.3Å; R98-D116 IonicContact NH1-OD2 2.76Å; R98-D116 PolarHBondContact NH1-OD2 3.47Å; R98-D116 VanDerWaalsContact NH2-CG 3.32Å; R98-D116 IonicContact NH2-OD1 2.95Å; R98-D116 PolarHBondContact NH2-OD1 2.83Å; R98-D116 IonicContact NH2-OD2 3Å; R98-D116 PolarHBondContact NH2-OD2 2.82Å; F109-D116 HydrophobicContact CE1-CB 4Å; F109-D116 HydrophobicContact CZ-CB 3.9Å; F109-D116 VanDerWaalsContact CZ-CG 3.49Å; F109-D116 WeakPolarHBondContact CZ-OD1 3.4Å; T113-D116 WeakPolarHBondContact CB-OD2 3.48Å; T113-D116 PolarHBondContact N-OD2 3.47Å; T113-D116 WeakPolarHBondContact O-CB 3.47Å; T113-D116 PolarHBondContact O-N 2.91Å; T113-D116 VanDerWaalsContact OG1-CG 3.31Å; T113-D116 PolarHBondContact OG1-OD2 3.05Å; L114-D116 PolarHBondContact O-N 2.86Å; D116-Y120 VanDerWaalsContact O-CE2 3.31Å; D116-Y120 WeakPolarHBondContact O-CE2 3.23Å; D116-Y120 PolarHBondContact O-OH 3.14Å
117	A	97.1	Very high	97	Very high	45 Å²	45	37.5 Å²	37.5	37%	0.372	21%	0.209	S	C	.	.			trans	-61.5	139	174.6	0	0	0	0	0	111.5	L114 E115 L138 V140	L114-A117 WeakPolarHBondContact O-CB 3.49Å; L114-A117 PolarHBondContact O-N 3.39Å; E115-A117 VanDerWaalsContact C-N 3.34Å; A117-L138 WeakPolarHBondContact CA-O 3.28Å; A117-V140 HydrophobicContact CB-CB 4.21Å; A117-V140 HydrophobicContact CB-CG2 4.1Å
118	G	96.9	Very high	96.7	Very high	28 Å²	28	41.7 Å²	41.7	29%	0.289	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	145.3	-164.5	178.1	0	0	0	0	0	114.3	Y120 Q137 L138	G118-Y120 WeakPolarHBondContact O-CD2 3.3Å; G118-Q137 VanDerWaalsContact C-OE1 3.25Å; G118-Q137 PolarHBondContact O-OE1 2.97Å; G118-L138 PolarHBondContact N-O 3.06Å; G118-L138 PolarHBondContact O-N 2.82Å
119	S	97.8	Very high	96.4	Very high	16 Å²	16	48.9 Å²	48.9	11%	0.112	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	140.2	-178.8	-53.1	0	0	0	0	111.5	G70 K71 G136 Q137	G70-S119 CarbonylContact C-O 3.4Å; G70-S119 WeakPolarHBondContact CA-O 3.49Å; G70-S119 PolarHBondContact N-O 2.96Å; G70-S119 CarbonylContact O-C 3.51Å; G70-S119 WeakPolarHBondContact O-CB 3.24Å; G70-S119 VanDerWaalsContact O-O 3.1Å; K71-S119 WeakPolarHBondContact CG-OG 3.39Å; S119-G136 WeakPolarHBondContact CA-O 3.22Å; S119-Q137 VanDerWaalsContact CB-OE1 3.29Å; S119-Q137 VanDerWaalsContact N-OE1 3.14Å; S119-Q137 VanDerWaalsContact OG-CD 3.32Å; S119-Q137 PolarHBondContact OG-NE2 2.84Å; S119-Q137 PolarHBondContact OG-OE1 3.03Å
120	Y	98.3	Very high	96.1	Very high	1 Å²	1	53.4 Å²	53.4	0%	0.004	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	131	175.8	-69.5	-96.7	0	0	0	108.6	L53 H68 K69 G70 I79 F109 D116 G118 T135 G136 L138	L53-Y120 HydrophobicContact CD1-CD1 4.04Å; L53-Y120 HydrophobicContact CD1-CD2 4.14Å; L53-Y120 HydrophobicContact CD1-CG 3.66Å; H68-Y120 WeakPolarHBondContact O-CA 3.3Å; K69-Y120 HydrophobicContact CB-CE1 4.43Å; K69-Y120 HydrophobicContact CG-CE1 4.06Å; G70-Y120 CarbonylContact O-C 3.5Å; G70-Y120 PolarHBondContact O-N 3.43Å; I79-Y120 HydrophobicContact CD1-CD1 3.45Å; I79-Y120 VanDerWaalsContact CD1-CD1 3.45Å; I79-Y120 HydrophobicContact CD1-CE1 3.53Å; F109-Y120 HydrophobicContact CD1-CE1 4.35Å; F109-Y120 AromaticContact CE1-CE1 3.98Å; F109-Y120 HydrophobicContact CE1-CE1 3.98Å; F109-Y120 AromaticContact CE1-CZ 3.93Å; F109-Y120 WeakPolarHBondContact CE1-OH 3.42Å; D116-Y120 VanDerWaalsContact O-CE2 3.31Å; D116-Y120 WeakPolarHBondContact O-CE2 3.23Å; D116-Y120 PolarHBondContact O-OH 3.14Å; G118-Y120 WeakPolarHBondContact O-CD2 3.3Å; Y120-T135 CarbonylContact O-C 3.57Å; Y120-T135 WeakPolarHBondContact O-CA 3.37Å; Y120-G136 PolarHBondContact N-O 2.93Å; Y120-G136 PolarHBondContact O-N 3.22Å; Y120-L138 HydrophobicContact CD2-CB 3.84Å; Y120-L138 HydrophobicContact CE2-CB 3.62Å; Y120-L138 HydrophobicContact CE2-CD2 3.83Å; Y120-L138 HydrophobicContact CE2-CG 4.35Å
121	T	98.4	Very high	95.9	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	130.1	179.6	-63.2	0	0	0	0	109.6	W67 H68 G70 K71 T72 A73 Q133 A134 T135	W67-T121 WeakPolarHBondContact CA-O 3.32Å; H68-T121 PolarHBondContact N-O 2.88Å; H68-T121 PolarHBondContact O-N 3.01Å; G70-T121 PolarHBondContact O-N 3.45Å; G70-T121 PolarHBondContact O-OG1 3.14Å; G70-T121 VanDerWaalsContact O-OG1 3.06Å; K71-T121 PolarHBondContact O-OG1 3.3Å; T72-T121 PolarHBondContact N-OG1 3.14Å; A73-T121 HydrophobicContact CB-CG2 4.23Å; T121-Q133 HydrophobicContact CG2-CB 4.05Å; T121-A134 CarbonylContact C-O 3.14Å; T121-A134 VanDerWaalsContact CA-O 3.29Å; T121-A134 WeakPolarHBondContact CA-O 3.39Å; T121-A134 WeakPolarHBondContact CG2-O 3.4Å; T121-T135 PolarHBondContact OG1-OG1 2.98Å
122	L	98.3	Very high	95.8	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	119.9	167.7	175.1	55.1	0	0	0	108.6	F36 I38 A55 I58 Y65 W67 G105 T124 Q133 A134	F36-L122 HydrophobicContact CE2-CD2 4.06Å; F36-L122 HydrophobicContact CZ-CB 3.98Å; F36-L122 HydrophobicContact CZ-CD2 3.71Å; F36-L122 HydrophobicContact CZ-CG 3.78Å; I38-L122 HydrophobicContact CD1-CB 3.73Å; I38-L122 HydrophobicContact CG1-CB 4.43Å; A55-L122 HydrophobicContact CB-CD2 3.53Å; I58-L122 HydrophobicContact CD1-CD2 4.45Å; Y65-L122 HydrophobicContact CD1-CD1 4.25Å; Y65-L122 HydrophobicContact CD1-CD2 4.41Å; W67-L122 HydrophobicContact CD2-CB 4.03Å; W67-L122 HydrophobicContact CD2-CD1 4.13Å; W67-L122 HydrophobicContact CE3-CB 4.07Å; W67-L122 HydrophobicContact CG-CD1 4.14Å; W67-L122 HydrophobicContact CH2-CB 3.89Å; W67-L122 HydrophobicContact CH2-CD2 4.49Å; W67-L122 HydrophobicContact CZ2-CB 3.83Å; W67-L122 HydrophobicContact CZ2-CD1 4.43Å; W67-L122 HydrophobicContact CZ2-CD2 3.78Å; W67-L122 HydrophobicContact CZ2-CG 4.22Å; W67-L122 HydrophobicContact CZ3-CB 4Å; G105-L122 WeakPolarHBondContact O-CD2 3.49Å; L122-T124 HydrophobicContact CD2-CG2 4.45Å; L122-T124 HydrophobicContact CG-CG2 4.18Å; L122-Q133 WeakPolarHBondContact O-CA 3.21Å; L122-A134 PolarHBondContact N-O 3.37Å; L122-A134 PolarHBondContact O-N 3.35Å
123	R	97.6	Very high	95.7	Very high	80 Å²	80	55.5 Å²	55.5	30%	0.302	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	130.8	167.9	-173.9	-179.6	-173.4	-160.5	0.4	109.6	Y66 A73 S131 D132	Y66-R123 PolarHBondContact N-O 3.44Å; Y66-R123 PolarHBondContact O-N 3.39Å; A73-R123 HydrophobicContact CB-CB 3.97Å; A73-R123 HydrophobicContact CB-CG 4.41Å; R123-S131 PolarHBondContact NE-OG 2.98Å; R123-S131 PolarHBondContact NH2-OG 2.8Å; R123-S131 VanDerWaalsContact NH2-OG 3.08Å; R123-D132 CarbonylContact C-O 3.5Å; R123-D132 WeakPolarHBondContact CA-O 3.43Å
124	T	97.3	Very high	95.7	Very high	6 Å²	6	53.9 Å²	53.9	4%	0.037	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	146.7	176.3	64	0	0	0	0	109.6	F36 I58 A64 Y65 L122 S131 D132	F36-T124 HydrophobicContact CE1-CG2 3.93Å; F36-T124 HydrophobicContact CZ-CG2 3.94Å; I58-T124 HydrophobicContact CG2-CG2 4.34Å; A64-T124 WeakPolarHBondContact O-CA 3.47Å; Y65-T124 HydrophobicContact CD1-CG2 3.9Å; Y65-T124 HydrophobicContact CE1-CG2 4.13Å; L122-T124 HydrophobicContact CD2-CG2 4.45Å; L122-T124 HydrophobicContact CG-CG2 4.18Å; T124-S131 WeakPolarHBondContact O-CA 3.46Å; T124-D132 PolarHBondContact N-O 2.93Å; T124-D132 PolarHBondContact O-N 3.24Å; T124-D132 PolarHBondContact OG1-O 3.1Å
125	I	96.3	Very high	95.8	Very high	25 Å²	25	53.3 Å²	53.3	13%	0.128	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	120.6	171.8	-54.8	-62.1	0	0	0	108.2	I62 Q63 A64 Y66 D130	I62-I125 WeakPolarHBondContact CG2-O 3.39Å; Q63-I125 PolarHBondContact N-O 2.71Å; A64-I125 HydrophobicContact CB-CB 4.34Å; A64-I125 PolarHBondContact N-O 2.96Å; A64-I125 PolarHBondContact O-N 3.46Å; Y66-I125 HydrophobicContact CD2-CG1 4.15Å; Y66-I125 HydrophobicContact CE2-CG1 3.76Å; I125-D130 WeakPolarHBondContact CA-O 3.31Å
126	N	94.4	Very high	95.8	Very high	33 Å²	33	45.5 Å²	45.5	18%	0.176	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	177	179.2	77.2	6.7	0	0	0	112.2	T61 I62 S128 Y129 D130	T61-N126 CarbonylContact O-C 3.51Å; T61-N126 WeakPolarHBondContact O-CA 3.39Å; I62-N126 HydrophobicContact CD1-CB 4.26Å; N126-S128 PolarHBondContact O-N 3.23Å; N126-S128 VanDerWaalsContact OD1-C 3.27Å; N126-S128 VanDerWaalsContact OD1-CA 3.27Å; N126-S128 WeakPolarHBondContact OD1-CA 3.41Å; N126-S128 WeakPolarHBondContact OD1-CB 3.45Å; N126-S128 PolarHBondContact OD1-N 3.01Å; N126-Y129 PolarHBondContact O-N 2.81Å; N126-Y129 PolarHBondContact OD1-N 2.88Å; N126-D130 PolarHBondContact N-O 3.32Å; N126-D130 WeakPolarHBondContact ND2-CB 3.37Å; N126-D130 PolarHBondContact ND2-OD2 2.76Å; N126-D130 PolarHBondContact OD1-N 2.81Å; N126-D130 PolarHBondContact OD1-O 2.85Å
127	A	92.2	Very high	95.8	Very high	51 Å²	51	49.6 Å²	49.6	42%	0.421	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-21.4	177.2	0	0	0	0	0	115.3	T61 Q63 Y129	T61-A127 PolarHBondContact O-N 3.48Å; Q63-A127 HydrophobicContact CG-CB 4.46Å; A127-Y129 VanDerWaalsContact C-N 3.31Å
128	S	92.8	Very high	95.8	Very high	87 Å²	87	47.5 Å²	47.5	61%	0.608	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	3.4	175.3	-56.6	0	0	0	0	113.1	N126 D130	N126-S128 PolarHBondContact O-N 3.23Å; N126-S128 VanDerWaalsContact OD1-C 3.27Å; N126-S128 VanDerWaalsContact OD1-CA 3.27Å; N126-S128 WeakPolarHBondContact OD1-CA 3.41Å; N126-S128 WeakPolarHBondContact OD1-CB 3.45Å; N126-S128 PolarHBondContact OD1-N 3.01Å; S128-D130 WeakPolarHBondContact CB-OD2 3.14Å; S128-D130 PolarHBondContact O-N 2.9Å
129	Y	90.7	Very high	95.9	Very high	180 Å²	180	51.3 Å²	51.3	71%	0.706	27%	0.272	S	S	*	.	S	Bend	trans	64.5	17.1	-172.7	-56.3	-87	0	0	0	115.2	N126 A127	N126-Y129 PolarHBondContact O-N 2.81Å; N126-Y129 PolarHBondContact OD1-N 2.88Å; A127-Y129 VanDerWaalsContact C-N 3.31Å
130	D	93.1	Very high	95.9	Very high	96 Å²	96	51.4 Å²	51.4	51%	0.513	27%	0.272	S	S	.	.			trans	-75.7	147.5	168.1	-50.7	-53.8	0	0	0	109.7	I125 N126 S128	I125-D130 WeakPolarHBondContact CA-O 3.31Å; N126-D130 PolarHBondContact N-O 3.32Å; N126-D130 WeakPolarHBondContact ND2-CB 3.37Å; N126-D130 PolarHBondContact ND2-OD2 2.76Å; N126-D130 PolarHBondContact OD1-N 2.81Å; N126-D130 PolarHBondContact OD1-O 2.85Å; S128-D130 WeakPolarHBondContact CB-OD2 3.14Å; S128-D130 PolarHBondContact O-N 2.9Å
131	S	93.4	Very high	95.7	Very high	60 Å²	60	55.6 Å²	55.6	42%	0.42	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	134.7	176.1	70.2	0	0	0	0	112.4	R123 T124	R123-S131 PolarHBondContact NE-OG 2.98Å; R123-S131 PolarHBondContact NH2-OG 2.8Å; R123-S131 VanDerWaalsContact NH2-OG 3.08Å; T124-S131 WeakPolarHBondContact O-CA 3.46Å
132	D	94.1	Very high	95.6	Very high	91 Å²	91	61.5 Å²	61.5	49%	0.487	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	160.3	168.2	-164.5	11.5	0	0	0	109.6	R123 T124	R123-D132 CarbonylContact C-O 3.5Å; R123-D132 WeakPolarHBondContact CA-O 3.43Å; T124-D132 PolarHBondContact N-O 2.93Å; T124-D132 PolarHBondContact O-N 3.24Å; T124-D132 PolarHBondContact OG1-O 3.1Å
133	Q	95.7	Very high	95.2	Very high	72 Å²	72	65 Å²	65	34%	0.336	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	147.8	177.6	69.3	174.3	18.2	0	0	113.1	T121 L122	T121-Q133 HydrophobicContact CG2-CB 4.05Å; L122-Q133 WeakPolarHBondContact O-CA 3.21Å
134	A	96.8	Very high	94.4	Very high	9 Å²	9	67 Å²	67	7%	0.074	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	154.5	169.1	0	0	0	0	0	109.6	F36 I38 T121 L122	F36-A134 HydrophobicContact CD1-CB 3.63Å; F36-A134 HydrophobicContact CD2-CB 3.94Å; F36-A134 HydrophobicContact CE1-CB 3.48Å; F36-A134 VanDerWaalsContact CE1-CB 3.48Å; F36-A134 HydrophobicContact CE2-CB 3.76Å; F36-A134 HydrophobicContact CG-CB 3.86Å; F36-A134 HydrophobicContact CZ-CB 3.52Å; I38-A134 VanDerWaalsContact CD1-C 3.44Å; I38-A134 HydrophobicContact CD1-CB 3.92Å; I38-A134 WeakPolarHBondContact CD1-O 3.39Å; I38-A134 HydrophobicContact CG1-CB 3.88Å; T121-A134 CarbonylContact C-O 3.14Å; T121-A134 VanDerWaalsContact CA-O 3.29Å; T121-A134 WeakPolarHBondContact CA-O 3.39Å; T121-A134 WeakPolarHBondContact CG2-O 3.4Å; L122-A134 PolarHBondContact N-O 3.37Å; L122-A134 PolarHBondContact O-N 3.35Å
135	T	97.6	Very high	93.3	Very high	63 Å²	63	71.7 Å²	71.7	39%	0.387	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	128.6	178.8	-61.3	0	0	0	0	109.8	K71 Y120 T121	K71-T135 PolarHBondContact O-OG1 2.58Å; Y120-T135 CarbonylContact O-C 3.57Å; Y120-T135 WeakPolarHBondContact O-CA 3.37Å; T121-T135 PolarHBondContact OG1-OG1 2.98Å
136	G	96.3	Very high	92.1	Very high	5 Å²	5	76.1 Å²	76.1	5%	0.052	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	162	173.7	0	0	0	0	0	111.4	S119 Y120	S119-G136 WeakPolarHBondContact CA-O 3.22Å; Y120-G136 PolarHBondContact N-O 2.93Å; Y120-G136 PolarHBondContact O-N 3.22Å
137	Q	97.3	Very high	90.9	Very high	93 Å²	93	77.4 Å²	77.4	44%	0.435	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	130	176	-67.2	-75.2	47.1	0	0	110.1	G118 S119	G118-Q137 VanDerWaalsContact C-OE1 3.25Å; G118-Q137 PolarHBondContact O-OE1 2.97Å; S119-Q137 VanDerWaalsContact CB-OE1 3.29Å; S119-Q137 VanDerWaalsContact N-OE1 3.14Å; S119-Q137 VanDerWaalsContact OG-CD 3.32Å; S119-Q137 PolarHBondContact OG-NE2 2.84Å; S119-Q137 PolarHBondContact OG-OE1 3.03Å
138	L	97.5	Very high	89.9	Confident	2 Å²	2	80.7 Å²	80.7	1%	0.01	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	116.2	172	178.8	57.1	0	0	0	109.3	V51 F109 A117 G118 Y120 V140	V51-L138 HydrophobicContact CB-CD1 4.05Å; V51-L138 HydrophobicContact CG1-CD1 3.67Å; V51-L138 HydrophobicContact CG2-CD1 3.97Å; F109-L138 HydrophobicContact CD1-CD2 4.12Å; F109-L138 HydrophobicContact CE1-CD2 4.49Å; A117-L138 WeakPolarHBondContact CA-O 3.28Å; G118-L138 PolarHBondContact N-O 3.06Å; G118-L138 PolarHBondContact O-N 2.82Å; Y120-L138 HydrophobicContact CD2-CB 3.84Å; Y120-L138 HydrophobicContact CE2-CB 3.62Å; Y120-L138 HydrophobicContact CE2-CD2 3.83Å; Y120-L138 HydrophobicContact CE2-CG 4.35Å; L138-V140 HydrophobicContact CD1-CG2 4.4Å; L138-V140 HydrophobicContact CD2-CG2 4.35Å; L138-V140 HydrophobicContact CG-CG2 3.98Å
139	H	97.6	Very high	89.2	Confident	107 Å²	107	80.7 Å²	80.7	50%	0.495	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	124.3	173	-64.2	-65.7	0	0	0	110.1	S44 A45	S44-H139 WeakPolarHBondContact CA-O 3.29Å; A45-H139 PolarHBondContact N-O 2.85Å
140	V	97.4	Very high	88.4	Confident	19 Å²	19	78.4 Å²	78.4	12%	0.115	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	134.1	176.6	-169.4	0	0	0	0	108.8	A45 E47 I112 L114 A117 L138	A45-V140 CarbonylContact O-C 3.58Å; A45-V140 VanDerWaalsContact O-CA 3.28Å; A45-V140 WeakPolarHBondContact O-CA 3.42Å; E47-V140 HydrophobicContact CB-CG1 4.38Å; I112-V140 HydrophobicContact CD1-CB 4.5Å; I112-V140 HydrophobicContact CD1-CG1 4.01Å; I112-V140 HydrophobicContact CD1-CG2 3.82Å; I112-V140 HydrophobicContact CG1-CG1 3.96Å; I112-V140 HydrophobicContact CG1-CG2 4.18Å; L114-V140 HydrophobicContact CD2-CG1 4.3Å; A117-V140 HydrophobicContact CB-CB 4.21Å; A117-V140 HydrophobicContact CB-CG2 4.1Å; L138-V140 HydrophobicContact CD1-CG2 4.4Å; L138-V140 HydrophobicContact CD2-CG2 4.35Å; L138-V140 HydrophobicContact CG-CG2 3.98Å
141	H	96.1	Very high	87.6	Confident	89 Å²	89	76.5 Å²	76.5	41%	0.412	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	155	173.9	62.3	-90.2	0	0	0	110.9	S44 A45 A46 E47 N143	S44-H141 PolarHBondContact OG-ND1 3.24Å; S44-H141 VanDerWaalsContact OG-ND1 3.1Å; A45-H141 PolarHBondContact O-N 3.03Å; A45-H141 PolarHBondContact O-ND1 3.48Å; A45-H141 VanDerWaalsContact O-ND1 3.14Å; A46-H141 CarbonylContact C-O 3.22Å; A46-H141 WeakPolarHBondContact CA-O 3.35Å; A46-H141 PolarHBondContact N-CE1 3.29Å; A46-H141 VanDerWaalsContact N-CE1 3.27Å; E47-H141 PolarHBondContact N-O 3.44Å; H141-N143 PolarHBondContact O-N 2.96Å
142	Q	94.7	Very high	87.2	Confident	123 Å²	123	75.2 Å²	75.2	58%	0.575	44%	0.442	S	S	*	.			trans	-63.8	131.3	-178.9	-166.5	166.6	12.1	0	0	110.5	N144	Q142-N144 VanDerWaalsContact C-N 3.31Å; Q142-N144 PolarHBondContact O-N 3.35Å
143	N	89.6	Confident	86.7	Confident	73 Å²	73	74.3 Å²	74.3	39%	0.39	44%	0.44	S	S	.	.			trans	-78.8	84.7	175.7	-173.3	17.7	0	0	0	109.4	A46 E47 H141 V145	A46-N143 HydrophobicContact CB-CB 4.06Å; E47-N143 HydrophobicContact CB-CB 4.28Å; E47-N143 WeakPolarHBondContact O-CB 3.28Å; H141-N143 PolarHBondContact O-N 2.96Å; N143-V145 WeakPolarHBondContact ND2-CG2 3.48Å; N143-V145 PolarHBondContact O-N 2.8Å; N143-V145 WeakPolarHBondContact OD1-CG2 3.5Å
144	N	81.6	Confident	86.1	Confident	122 Å²	122	73.3 Å²	73.3	65%	0.652	44%	0.444	S	S	*	.			trans	-74.5	79.4	172.3	-74.5	-4.1	0	0	0	108.8	Q142 P146	Q142-N144 VanDerWaalsContact C-N 3.31Å; Q142-N144 PolarHBondContact O-N 3.35Å; N144-P146 WeakPolarHBondContact O-CD 3.09Å
145	V	74.5	Confident	85.7	Confident	105 Å²	105	74.8 Å²	74.8	64%	0.636	46%	0.46	S	S	*	.			trans	-72.9	110.4	165.1	-161	0	0	0	0	106	N143 G147	N143-V145 WeakPolarHBondContact ND2-CG2 3.48Å; N143-V145 PolarHBondContact O-N 2.8Å; N143-V145 WeakPolarHBondContact OD1-CG2 3.5Å; V145-G147 VanDerWaalsContact C-N 3.28Å; V145-G147 PolarHBondContact O-N 2.9Å
146	P	69.8	Low	85.4	Confident	119 Å²	119	77 Å²	77	77%	0.773	47%	0.469	S	S	*	.			trans	-69.1	98.8	171.2	-7.9	27	0	0	0	105.1	N144 L148	N144-P146 WeakPolarHBondContact O-CD 3.09Å; P146-L148 PolarHBondContact O-N 2.77Å
147	G	69.6	Low	85.2	Confident	59 Å²	59	81 Å²	81	61%	0.608	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-51.9	137.6	164.6	0	0	0	0	0	107.3	V145 P149	V145-G147 VanDerWaalsContact C-N 3.28Å; V145-G147 PolarHBondContact O-N 2.9Å; G147-P149 VanDerWaalsContact O-N 3.15Å
148	L	72.6	Confident	85	Confident	120 Å²	120	80.6 Å²	80.6	63%	0.628	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-46.5	130.1	170	-79.2	168.5	0	0	0	107.1	P146 V150 V153	P146-L148 PolarHBondContact O-N 2.77Å; L148-V150 PolarHBondContact O-N 3.12Å; L148-V153 HydrophobicContact CB-CG2 3.61Å; L148-V153 HydrophobicContact CD1-CG2 4.21Å
149	P	77.1	Confident	84.8	Confident	88 Å²	88	82.5 Å²	82.5	57%	0.571	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-50.3	136.2	-177.9	-1.2	-4.5	0	0	0	107.9	G147 G151 A152 V153	G147-P149 VanDerWaalsContact O-N 3.15Å; P149-G151 CarbonylContact O-C 3.57Å; P149-G151 PolarHBondContact O-N 3.16Å; P149-A152 HydrophobicContact CB-CB 4.35Å; P149-A152 HydrophobicContact CG-CB 3.85Å; P149-A152 WeakPolarHBondContact O-CA 3.37Å; P149-A152 WeakPolarHBondContact O-CB 3.42Å; P149-A152 PolarHBondContact O-N 2.87Å; P149-V153 PolarHBondContact O-N 2.77Å
150	V	73.2	Confident	84.7	Confident	131 Å²	131	81.5 Å²	81.5	79%	0.794	52%	0.517	S	S	*	.	H	α-helix	trans	-51.2	-32.3	-179.3	175.9	0	0	0	0	110.5	L148 A154	L148-V150 PolarHBondContact O-N 3.12Å; V150-A154 VanDerWaalsContact O-CB 3.3Å; V150-A154 WeakPolarHBondContact O-CB 3.36Å; V150-A154 PolarHBondContact O-N 2.96Å
151	G	76.5	Confident	84.7	Confident	56 Å²	56	86.7 Å²	86.7	58%	0.577	54%	0.544	S	S	*	.	H	α-helix	trans	-67.1	-32.7	171.9	0	0	0	0	0	115.8	P149 G155	P149-G151 CarbonylContact O-C 3.57Å; P149-G151 PolarHBondContact O-N 3.16Å; G151-G155 WeakPolarHBondContact O-CA 3.29Å; G151-G155 PolarHBondContact O-N 3.26Å
152	A	85.3	Confident	84.7	Confident	34 Å²	34	86.2 Å²	86.2	28%	0.281	55%	0.547	S	S	.	.	H	α-helix	trans	-70.4	-43.4	174.6	0	0	0	0	0	111.5	P149 G155 I156	P149-A152 HydrophobicContact CB-CB 4.35Å; P149-A152 HydrophobicContact CG-CB 3.85Å; P149-A152 WeakPolarHBondContact O-CA 3.37Å; P149-A152 WeakPolarHBondContact O-CB 3.42Å; P149-A152 PolarHBondContact O-N 2.87Å; A152-G155 PolarHBondContact O-N 3.47Å; A152-I156 WeakPolarHBondContact O-CD1 3.44Å; A152-I156 VanDerWaalsContact O-CG1 3.24Å; A152-I156 WeakPolarHBondContact O-CG1 3.4Å; A152-I156 PolarHBondContact O-N 3.47Å
153	V	84.9	Confident	84.8	Confident	71 Å²	71	81.9 Å²	81.9	43%	0.43	54%	0.535	S	S	.	.	H	α-helix	trans	-64.8	-47.5	176.7	-176.8	0	0	0	0	110.5	L148 P149 G155 I156 V157	L148-V153 HydrophobicContact CB-CG2 3.61Å; L148-V153 HydrophobicContact CD1-CG2 4.21Å; P149-V153 PolarHBondContact O-N 2.77Å; V153-G155 VanDerWaalsContact C-N 3.32Å; V153-G155 PolarHBondContact O-N 3.36Å; V153-I156 PolarHBondContact O-N 2.6Å; V153-V157 WeakPolarHBondContact O-CG2 3.32Å; V153-V157 PolarHBondContact O-N 3.31Å; V153-V157 VanDerWaalsContact O-N 3.14Å
154	A	83	Confident	85.1	Confident	51 Å²	51	82.9 Å²	82.9	42%	0.421	54%	0.544	S	S	.	.	H	α-helix	trans	-62.5	-38.8	176.1	0	0	0	0	0	112.3	V150 T158	V150-A154 VanDerWaalsContact O-CB 3.3Å; V150-A154 WeakPolarHBondContact O-CB 3.36Å; V150-A154 PolarHBondContact O-N 2.96Å; A154-T158 VanDerWaalsContact O-CB 3.32Å; A154-T158 WeakPolarHBondContact O-CB 3.43Å; A154-T158 PolarHBondContact O-N 3.48Å; A154-T158 PolarHBondContact O-OG1 3.06Å
155	G	86.9	Confident	85.9	Confident	41 Å²	41	80 Å²	80	42%	0.423	54%	0.537	S	S	.	.	H	α-helix	trans	-64.6	-43.7	178	0	0	0	0	0	112.9	G151 A152 V153 G159	G151-G155 WeakPolarHBondContact O-CA 3.29Å; G151-G155 PolarHBondContact O-N 3.26Å; A152-G155 PolarHBondContact O-N 3.47Å; V153-G155 VanDerWaalsContact C-N 3.32Å; V153-G155 PolarHBondContact O-N 3.36Å; G155-G159 PolarHBondContact O-N 2.86Å
156	I	91.6	Very high	87	Confident	109 Å²	109	80.5 Å²	80.5	56%	0.559	54%	0.536	S	S	*	.	H	α-helix	trans	-64.6	-48	177.6	-67	164	0	0	0	110.4	A152 V153 T158 G159 V160	A152-I156 WeakPolarHBondContact O-CD1 3.44Å; A152-I156 VanDerWaalsContact O-CG1 3.24Å; A152-I156 WeakPolarHBondContact O-CG1 3.4Å; A152-I156 PolarHBondContact O-N 3.47Å; V153-I156 PolarHBondContact O-N 2.6Å; I156-T158 PolarHBondContact O-N 2.85Å; I156-G159 PolarHBondContact O-N 3.22Å; I156-V160 HydrophobicContact CG2-CG2 4.41Å; I156-V160 WeakPolarHBondContact O-CB 3.22Å; I156-V160 VanDerWaalsContact O-CG2 3.24Å; I156-V160 WeakPolarHBondContact O-CG2 3.33Å; I156-V160 PolarHBondContact O-N 3.2Å
157	V	92.8	Very high	88.3	Confident	88 Å²	88	79.2 Å²	79.2	53%	0.533	53%	0.525	S	S	.	.	H	α-helix	trans	-62.4	-44	-179.4	175.3	0	0	0	0	111.2	V153 L161	V153-V157 WeakPolarHBondContact O-CG2 3.32Å; V153-V157 PolarHBondContact O-N 3.31Å; V153-V157 VanDerWaalsContact O-N 3.14Å; V157-L161 PolarHBondContact O-N 2.61Å
158	T	92.9	Very high	89.5	Confident	85 Å²	85	79.1 Å²	79.1	52%	0.521	52%	0.518	S	S	.	.	H	α-helix	trans	-66.9	-44.4	179.4	-51.9	0	0	0	0	111.4	A154 I156 V160 L161 V162	A154-T158 VanDerWaalsContact O-CB 3.32Å; A154-T158 WeakPolarHBondContact O-CB 3.43Å; A154-T158 PolarHBondContact O-N 3.48Å; A154-T158 PolarHBondContact O-OG1 3.06Å; I156-T158 PolarHBondContact O-N 2.85Å; T158-V160 PolarHBondContact O-N 3.2Å; T158-L161 PolarHBondContact O-N 3.42Å; T158-V162 HydrophobicContact CG2-CG2 4.45Å; T158-V162 WeakPolarHBondContact O-CG2 3.42Å; T158-V162 PolarHBondContact O-N 2.99Å
159	G	92.3	Very high	90.6	Very high	43 Å²	43	76.1 Å²	76.1	44%	0.443	51%	0.511	S	S	.	.	H	α-helix	trans	-60.9	-42.7	178	0	0	0	0	0	112.4	G155 I156 G163	G155-G159 PolarHBondContact O-N 2.86Å; I156-G159 PolarHBondContact O-N 3.22Å; G159-G163 PolarHBondContact O-N 3.22Å
160	V	96.5	Very high	91.5	Very high	86 Å²	86	77 Å²	77	52%	0.521	51%	0.511	S	S	.	.	H	α-helix	trans	-64.2	-44.6	176	172.6	0	0	0	0	111	I156 T158 V162 G163 V164	I156-V160 HydrophobicContact CG2-CG2 4.41Å; I156-V160 WeakPolarHBondContact O-CB 3.22Å; I156-V160 VanDerWaalsContact O-CG2 3.24Å; I156-V160 WeakPolarHBondContact O-CG2 3.33Å; I156-V160 PolarHBondContact O-N 3.2Å; T158-V160 PolarHBondContact O-N 3.2Å; V160-V162 PolarHBondContact O-N 3.43Å; V160-G163 PolarHBondContact O-N 3.33Å; V160-V164 HydrophobicContact CG1-CG2 4.28Å; V160-V164 WeakPolarHBondContact O-CB 3.35Å; V160-V164 VanDerWaalsContact O-CG2 3.22Å; V160-V164 WeakPolarHBondContact O-CG2 3.09Å; V160-V164 PolarHBondContact O-N 2.92Å
161	L	96.9	Very high	92.6	Very high	127 Å²	127	74.4 Å²	74.4	67%	0.665	50%	0.495	S	S	*	.	H	α-helix	trans	-60.3	-47.4	179.7	-135.2	83.8	0	0	0	112	V157 T158 A165	V157-L161 PolarHBondContact O-N 2.61Å; T158-L161 PolarHBondContact O-N 3.42Å; L161-A165 WeakPolarHBondContact O-CB 3.27Å; L161-A165 PolarHBondContact O-N 3.5Å
162	V	97.1	Very high	93.4	Very high	79 Å²	79	74.7 Å²	74.7	48%	0.479	49%	0.487	S	S	.	.	H	α-helix	trans	-68.6	-42.7	-179.8	175.3	0	0	0	0	110.9	T158 V160 V164 A165 L166	T158-V162 HydrophobicContact CG2-CG2 4.45Å; T158-V162 WeakPolarHBondContact O-CG2 3.42Å; T158-V162 PolarHBondContact O-N 2.99Å; V160-V162 PolarHBondContact O-N 3.43Å; V162-V164 PolarHBondContact O-N 2.98Å; V162-A165 PolarHBondContact O-N 3.19Å; V162-L166 HydrophobicContact CG1-CD1 3.95Å; V162-L166 HydrophobicContact CG1-CG 4.35Å; V162-L166 WeakPolarHBondContact O-CB 3.36Å; V162-L166 WeakPolarHBondContact O-CG 3.44Å; V162-L166 PolarHBondContact O-N 3.02Å
163	G	96.1	Very high	93.8	Very high	32 Å²	32	79.7 Å²	79.7	33%	0.33	50%	0.503	S	S	.	.	H	α-helix	trans	-59.5	-46.5	176.7	0	0	0	0	0	112.2	G159 V160 A165 L166 V167	G159-G163 PolarHBondContact O-N 3.22Å; V160-G163 PolarHBondContact O-N 3.33Å; G163-A165 PolarHBondContact O-N 2.86Å; G163-L166 PolarHBondContact O-N 2.91Å; G163-V167 VanDerWaalsContact O-CG2 3.28Å; G163-V167 WeakPolarHBondContact O-CG2 3.27Å; G163-V167 PolarHBondContact O-N 3.17Å
164	V	97	Very high	94.1	Very high	94 Å²	94	81 Å²	81	57%	0.57	51%	0.507	S	S	*	.	H	α-helix	trans	-61.8	-43.8	176.5	171.6	0	0	0	0	111.2	V160 V162 L166 V167 A168	V160-V164 HydrophobicContact CG1-CG2 4.28Å; V160-V164 WeakPolarHBondContact O-CB 3.35Å; V160-V164 VanDerWaalsContact O-CG2 3.22Å; V160-V164 WeakPolarHBondContact O-CG2 3.09Å; V160-V164 PolarHBondContact O-N 2.92Å; V162-V164 PolarHBondContact O-N 2.98Å; V164-L166 PolarHBondContact O-N 2.82Å; V164-V167 PolarHBondContact O-N 3.13Å; V164-A168 WeakPolarHBondContact O-CB 3.21Å; V164-A168 PolarHBondContact O-N 3.26Å
165	A	96.9	Very high	94.3	Very high	61 Å²	61	83.8 Å²	83.8	50%	0.504	51%	0.514	S	S	.	.	H	α-helix	trans	-62.3	-42.8	177.6	0	0	0	0	0	112.4	L161 V162 G163 A168 A169	L161-A165 WeakPolarHBondContact O-CB 3.27Å; L161-A165 PolarHBondContact O-N 3.5Å; V162-A165 PolarHBondContact O-N 3.19Å; G163-A165 PolarHBondContact O-N 2.86Å; A165-A168 PolarHBondContact O-N 2.87Å; A165-A169 WeakPolarHBondContact O-CB 3.46Å; A165-A169 PolarHBondContact O-N 3.04Å
166	L	97.4	Very high	94.2	Very high	117 Å²	117	86.9 Å²	86.9	61%	0.613	52%	0.521	S	S	*	.	H	α-helix	trans	-65.5	-43.1	177.4	-74.3	172.7	0	0	0	112	V162 G163 V164 A169 L170	V162-L166 HydrophobicContact CG1-CD1 3.95Å; V162-L166 HydrophobicContact CG1-CG 4.35Å; V162-L166 WeakPolarHBondContact O-CB 3.36Å; V162-L166 WeakPolarHBondContact O-CG 3.44Å; V162-L166 PolarHBondContact O-N 3.02Å; G163-L166 PolarHBondContact O-N 2.91Å; V164-L166 PolarHBondContact O-N 2.82Å; L166-A169 PolarHBondContact O-N 3.46Å; L166-L170 WeakPolarHBondContact O-CB 3.17Å; L166-L170 PolarHBondContact O-N 3.08Å
167	V	97	Very high	93.7	Very high	91 Å²	91	84.1 Å²	84.1	55%	0.552	51%	0.511	S	S	*	.	H	α-helix	trans	-63.7	-44.9	176.4	172.6	0	0	0	0	110.5	G163 V164 A169 L170 V171	G163-V167 VanDerWaalsContact O-CG2 3.28Å; G163-V167 WeakPolarHBondContact O-CG2 3.27Å; G163-V167 PolarHBondContact O-N 3.17Å; V164-V167 PolarHBondContact O-N 3.13Å; V167-A169 PolarHBondContact O-N 3.37Å; V167-L170 PolarHBondContact O-N 3.03Å; V167-V171 HydrophobicContact CG1-CG2 4.35Å; V167-V171 WeakPolarHBondContact O-CB 3.46Å; V167-V171 VanDerWaalsContact O-CG2 3.25Å; V167-V171 WeakPolarHBondContact O-CG2 3.01Å; V167-V171 PolarHBondContact O-N 2.99Å
168	A	95.9	Very high	93	Very high	57 Å²	57	90.2 Å²	90.2	47%	0.471	52%	0.524	S	S	.	.	H	α-helix	trans	-61.4	-42.9	176.8	0	0	0	0	0	112.1	V164 A165 V171 C172	V164-A168 WeakPolarHBondContact O-CB 3.21Å; V164-A168 PolarHBondContact O-N 3.26Å; A165-A168 PolarHBondContact O-N 2.87Å; A168-V171 PolarHBondContact O-N 3.34Å; A168-C172 VanDerWaalsContact O-CB 3.26Å; A168-C172 WeakPolarHBondContact O-CB 3.39Å; A168-C172 PolarHBondContact O-N 2.84Å
169	A	95.8	Very high	91.9	Very high	58 Å²	58	90.7 Å²	90.7	48%	0.479	53%	0.527	S	S	.	.	H	α-helix	trans	-63.4	-43.5	176	0	0	0	0	0	112	A165 L166 V167 C172 F173	A165-A169 WeakPolarHBondContact O-CB 3.46Å; A165-A169 PolarHBondContact O-N 3.04Å; L166-A169 PolarHBondContact O-N 3.46Å; V167-A169 PolarHBondContact O-N 3.37Å; A169-C172 PolarHBondContact O-N 3.47Å; A169-F173 WeakPolarHBondContact O-CB 3.35Å; A169-F173 PolarHBondContact O-N 2.86Å
170	L	95.8	Very high	90.4	Very high	106 Å²	106	90.1 Å²	90.1	56%	0.555	52%	0.521	S	S	*	.	H	α-helix	trans	-63.2	-45.7	177.1	-175.2	68.4	0	0	0	111.4	L166 V167 C172 F173 L174	L166-L170 WeakPolarHBondContact O-CB 3.17Å; L166-L170 PolarHBondContact O-N 3.08Å; V167-L170 PolarHBondContact O-N 3.03Å; L170-C172 PolarHBondContact O-N 2.92Å; L170-F173 PolarHBondContact O-N 3.5Å; L170-L174 HydrophobicContact CG-CD1 4.25Å; L170-L174 WeakPolarHBondContact O-CB 3.44Å; L170-L174 VanDerWaalsContact O-CG 3.28Å; L170-L174 WeakPolarHBondContact O-CG 3.27Å; L170-L174 PolarHBondContact O-N 3.05Å
171	V	95.8	Very high	88.4	Confident	76 Å²	76	97.2 Å²	97.2	46%	0.461	54%	0.539	S	S	.	.	H	α-helix	trans	-60.6	-46.1	176	171.2	0	0	0	0	110.4	V167 A168 F173 L174 L175	V167-V171 HydrophobicContact CG1-CG2 4.35Å; V167-V171 WeakPolarHBondContact O-CB 3.46Å; V167-V171 VanDerWaalsContact O-CG2 3.25Å; V167-V171 WeakPolarHBondContact O-CG2 3.01Å; V167-V171 PolarHBondContact O-N 2.99Å; A168-V171 PolarHBondContact O-N 3.34Å; V171-F173 PolarHBondContact O-N 3.07Å; V171-L174 PolarHBondContact O-N 3.38Å; V171-L175 HydrophobicContact CG1-CD1 4.07Å; V171-L175 HydrophobicContact CG1-CG 4.44Å; V171-L175 VanDerWaalsContact O-CG 3.3Å; V171-L175 WeakPolarHBondContact O-CG 3.26Å; V171-L175 PolarHBondContact O-N 3.07Å
172	C	93.9	Very high	86.3	Confident	63 Å²	63	95.3 Å²	95.3	43%	0.426	54%	0.541	S	S	.	.	H	α-helix	trans	-59	-46.9	176.6	-174.7	0	0	0	0	111.8	A168 A169 L170 L174 L175 L176	A168-C172 VanDerWaalsContact O-CB 3.26Å; A168-C172 WeakPolarHBondContact O-CB 3.39Å; A168-C172 PolarHBondContact O-N 2.84Å; A169-C172 PolarHBondContact O-N 3.47Å; L170-C172 PolarHBondContact O-N 2.92Å; C172-L174 PolarHBondContact O-N 3.03Å; C172-L175 PolarHBondContact O-N 3.35Å; C172-L176 WeakPolarHBondContact O-CB 3.37Å; C172-L176 WeakPolarHBondContact O-CG 3.23Å; C172-L176 PolarHBondContact O-N 3.23Å
173	F	93.3	Very high	84.2	Confident	138 Å²	138	95.8 Å²	95.8	61%	0.605	55%	0.548	S	S	*	.	H	α-helix	trans	-61.5	-42	176.8	-179.8	-96.9	0	0	0	112.2	A169 L170 V171 L175 L176 S177	A169-F173 WeakPolarHBondContact O-CB 3.35Å; A169-F173 PolarHBondContact O-N 2.86Å; L170-F173 PolarHBondContact O-N 3.5Å; V171-F173 PolarHBondContact O-N 3.07Å; F173-L175 VanDerWaalsContact C-N 3.35Å; F173-L176 PolarHBondContact O-N 3.45Å; F173-S177 VanDerWaalsContact O-CB 3.23Å; F173-S177 WeakPolarHBondContact O-CB 3.48Å; F173-S177 PolarHBondContact O-N 2.97Å; F173-S177 PolarHBondContact O-OG 3.42Å
174	L	91.4	Very high	82.1	Confident	100 Å²	100	101.5 Å²	101.5	52%	0.524	57%	0.57	S	S	.	*	H	α-helix	trans	-65.3	-37.8	176.5	-71.1	174.7	0	0	0	112.1	L170 V171 C172 S177 R178	L170-L174 HydrophobicContact CG-CD1 4.25Å; L170-L174 WeakPolarHBondContact O-CB 3.44Å; L170-L174 VanDerWaalsContact O-CG 3.28Å; L170-L174 WeakPolarHBondContact O-CG 3.27Å; L170-L174 PolarHBondContact O-N 3.05Å; V171-L174 PolarHBondContact O-N 3.38Å; C172-L174 PolarHBondContact O-N 3.03Å; L174-S177 WeakPolarHBondContact CA-OG 3.42Å; L174-S177 PolarHBondContact O-OG 3.34Å; L174-S177 VanDerWaalsContact O-OG 3.13Å; L174-R178 WeakPolarHBondContact O-CB 3.25Å; L174-R178 PolarHBondContact O-N 2.76Å
175	L	87.8	Confident	79.6	Confident	109 Å²	109	106 Å²	106	57%	0.571	58%	0.584	S	S	*	*	H	α-helix	trans	-65.8	-47.8	174.1	-69.3	173.7	0	0	0	111.2	V171 C172 F173 R178 T179	V171-L175 HydrophobicContact CG1-CD1 4.07Å; V171-L175 HydrophobicContact CG1-CG 4.44Å; V171-L175 VanDerWaalsContact O-CG 3.3Å; V171-L175 WeakPolarHBondContact O-CG 3.26Å; V171-L175 PolarHBondContact O-N 3.07Å; C172-L175 PolarHBondContact O-N 3.35Å; F173-L175 VanDerWaalsContact C-N 3.35Å; L175-R178 PolarHBondContact O-N 3.1Å; L175-T179 PolarHBondContact O-N 3.43Å; L175-T179 PolarHBondContact O-OG1 2.99Å
176	L	83.9	Confident	77.4	Confident	106 Å²	106	113.8 Å²	113.8	56%	0.555	60%	0.601	S	S	*	*	H	α-helix	trans	-65.9	-40.4	179.9	-72.2	171.6	0	0	0	112.8	C172 F173 R178 T179 G180	C172-L176 WeakPolarHBondContact O-CB 3.37Å; C172-L176 WeakPolarHBondContact O-CG 3.23Å; C172-L176 PolarHBondContact O-N 3.23Å; F173-L176 PolarHBondContact O-N 3.45Å; L176-R178 VanDerWaalsContact C-N 3.34Å; L176-T179 WeakPolarHBondContact CA-OG1 3.26Å; L176-T179 PolarHBondContact O-N 3.47Å; L176-T179 PolarHBondContact O-OG1 3.33Å; L176-T179 VanDerWaalsContact O-OG1 3.1Å; L176-G180 WeakPolarHBondContact O-CA 3.24Å; L176-G180 PolarHBondContact O-N 2.96Å
177	S	80.3	Confident	74.6	Confident	51 Å²	51	115.9 Å²	115.9	36%	0.357	61%	0.613	S	S	.	*	H	α-helix	trans	-69.5	-33.1	176.7	56.8	0	0	0	0	112	F173 L174	F173-S177 VanDerWaalsContact O-CB 3.23Å; F173-S177 WeakPolarHBondContact O-CB 3.48Å; F173-S177 PolarHBondContact O-N 2.97Å; F173-S177 PolarHBondContact O-OG 3.42Å; L174-S177 WeakPolarHBondContact CA-OG 3.42Å; L174-S177 PolarHBondContact O-OG 3.34Å; L174-S177 VanDerWaalsContact O-OG 3.13Å
178	R	79.8	Confident	72.3	Confident	215 Å²	215	119.6 Å²	119.6	81%	0.811	63%	0.629	S	S	*	*	H	α-helix	trans	-69.3	-35.4	172.9	-173.1	176.1	172.6	171.8	-2	112.4	L174 L175 L176	L174-R178 WeakPolarHBondContact O-CB 3.25Å; L174-R178 PolarHBondContact O-N 2.76Å; L175-R178 PolarHBondContact O-N 3.1Å; L176-R178 VanDerWaalsContact C-N 3.34Å
179	T	68.8	Low	69.8	Low	95 Å²	95	127.8 Å²	127.8	58%	0.583	65%	0.647	S	S	*	*	H	α-helix	trans	-84.8	-27.1	176.2	51.5	0	0	0	0	113.8	L175 L176 R181 A182	L175-T179 PolarHBondContact O-N 3.43Å; L175-T179 PolarHBondContact O-OG1 2.99Å; L176-T179 WeakPolarHBondContact CA-OG1 3.26Å; L176-T179 PolarHBondContact O-N 3.47Å; L176-T179 PolarHBondContact O-OG1 3.33Å; L176-T179 VanDerWaalsContact O-OG1 3.1Å; T179-R181 PolarHBondContact O-N 3.41Å; T179-A182 PolarHBondContact O-N 3.21Å
180	G	60.3	Low	67.1	Low	31 Å²	31	134 Å²	134	32%	0.32	67%	0.666	S	S	.	*	H	α-helix	trans	-75.7	-17.7	-175.9	0	0	0	0	0	115	L176 A182 S183	L176-G180 WeakPolarHBondContact O-CA 3.24Å; L176-G180 PolarHBondContact O-N 2.96Å; G180-A182 PolarHBondContact O-N 3.1Å; G180-A182 VanDerWaalsContact O-N 3.09Å; G180-S183 PolarHBondContact O-N 3.36Å; G180-S183 VanDerWaalsContact O-N 3.17Å
181	R	55.8	Low	64.3	Low	236 Å²	236	137.9 Å²	137.9	89%	0.891	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-7	169.8	-91.1	-172.9	167.7	173.8	-2.1	114.2	T179	T179-R181 PolarHBondContact O-N 3.41Å
182	A	51	Low	61.9	Low	86 Å²	86	139.9 Å²	139.9	71%	0.711	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-7.4	173.9	0	0	0	0	0	114.7	T179 G180	T179-A182 PolarHBondContact O-N 3.21Å; G180-A182 PolarHBondContact O-N 3.1Å; G180-A182 VanDerWaalsContact O-N 3.09Å
183	S	53.2	Low	60	Low	90 Å²	90	142.4 Å²	142.4	63%	0.629	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.3	-12.8	-166	-164.8	0	0	0	0	116.7	G180 Q185	G180-S183 PolarHBondContact O-N 3.36Å; G180-S183 VanDerWaalsContact O-N 3.17Å; S183-Q185 PolarHBondContact O-N 2.98Å
184	I	52.2	Low	58.3	Low	152 Å²	152	141.4 Å²	141.4	78%	0.779	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-3.4	-165.4	-65.9	-172	0	0	0	114.8
185	Q	45.6	Very low	55.3	Low	188 Å²	188	141 Å²	141	88%	0.879	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-1	-171.3	-165.3	158.8	-20.7	0	0	116.4	S183	S183-Q185 PolarHBondContact O-N 2.98Å
186	R	49.5	Very low	52.7	Low	224 Å²	224	141.6 Å²	141.6	85%	0.845	74%	0.744	S	S	*	*	S	Bend	trans	-98.6	1.1	-168.8	-70.2	-158.4	-174.1	91.5	0.7	117.8
187	D	40.3	Very low	50.5	Low	161 Å²	161	143 Å²	143	86%	0.861	76%	0.757	S	S	*	*	S	Bend	trans	-129.3	18.6	-166	-145.1	21.3	0	0	0	115.9
188	L	48.4	Very low	49	Very low	170 Å²	170	146.7 Å²	146.7	89%	0.89	78%	0.779	S	S	*	*	S	Bend	trans	-121.9	35.6	-172.9	-115.8	143.8	0	0	0	113.6
189	R	41.8	Very low	46.7	Very low	228 Å²	228	139.9 Å²	139.9	86%	0.86	78%	0.776	S	S	*	*			trans	-146	71.1	175.5	-163.3	-174.4	-163.9	-175.5	4.1	112.3
190	E	39.3	Very low	45	Very low	188 Å²	188	144.9 Å²	144.9	88%	0.879	79%	0.792	S	S	*	*			trans	-156.5	95.7	155.2	-76	-52.5	138.8	0	0	110.2
191	Q	37.3	Very low	43.7	Very low	189 Å²	189	146.7 Å²	146.7	88%	0.883	81%	0.812	S	S	*	*			trans	-158.2	148.7	154	-83.8	-153.2	-38	0	0	106.9
192	P	46.5	Very low	43.8	Very low	117 Å²	117	141.2 Å²	141.2	76%	0.76	81%	0.807	S	S	*	*			cis	-154	-150.5	45	43.2	-16.6	0	0	0	115.8
193	P	53.2	Low	43.1	Very low	117 Å²	117	141.5 Å²	141.5	76%	0.76	80%	0.803	S	S	*	*				-131.6	-142.8	-105.9	38.6	-13	0	0	0	115.7
194	P	58.3	Low	42.1	Very low	117 Å²	117	145.5 Å²	145.5	76%	0.76	81%	0.812	S	S	*	*				-122.7	172.9	-75.6	35.7	-17	0	0	0	114.9
195	A	28.8	Very low	41	Very low	92 Å²	92	149.3 Å²	149.3	76%	0.76	82%	0.816	S	S	*	*			trans	-179.8	136	143.9	0	0	0	0	0	115.7
196	S	32.1	Very low	40.7	Very low	121 Å²	121	145.1 Å²	145.1	85%	0.846	81%	0.807	S	S	*	*			trans	78.4	118.2	143.5	-49.1	0	0	0	0	122.9
197	T	37.8	Very low	40	Very low	135 Å²	135	139.7 Å²	139.7	83%	0.828	80%	0.799	S	S	*	*			trans	-71.6	-178.6	149.6	42	0	0	0	0	111.2
198	P	47.9	Very low	39.6	Very low	128 Å²	128	141.7 Å²	141.7	83%	0.831	80%	0.801	S	S	*	*			cis	-135.5	177.2	-2.5	35.9	-15.8	0	0	0	115.1
199	G	32	Very low	39	Very low	72 Å²	72	138.1 Å²	138.1	74%	0.742	79%	0.79	S	S	*	*			trans	140.9	111.7	142.4	0	0	0	0	0	120.3
200	H	33.8	Very low	39	Very low	200 Å²	200	131.6 Å²	131.6	93%	0.926	79%	0.785	S	S	*	*			trans	69.9	120.5	146.9	-81.6	-17.2	0	0	0	123
201	G	32.7	Very low	39.3	Very low	70 Å²	70	128.7 Å²	128.7	72%	0.722	78%	0.782	S	S	*	*			trans	-86.3	-137.7	168	0	0	0	0	0	112.9
202	P	58	Low	39.4	Very low	121 Å²	121	127.5 Å²	127.5	79%	0.786	78%	0.781	S	S	*	*			cis	-124.4	179.1	-26.2	39.4	-24.6	0	0	0	111.1
203	S	35.5	Very low	39.3	Very low	91 Å²	91	127.1 Å²	127.1	64%	0.636	78%	0.779	S	S	*	*			trans	169.8	122.3	135.2	-86	0	0	0	0	113.9
204	H	32.5	Very low	38.4	Very low	175 Å²	175	127.1 Å²	127.1	81%	0.81	78%	0.782	S	S	*	*			trans	49.8	130.9	134.2	-49.3	-66.5	0	0	0	118.2
205	R	29.4	Very low	38.1	Very low	232 Å²	232	126.2 Å²	126.2	88%	0.875	78%	0.776	S	S	*	*			cis	-169.6	136.7	36.2	-172.1	169.5	-176.6	-156.7	1.2	110.8
206	S	39.1	Very low	38.4	Very low	99 Å²	99	132.8 Å²	132.8	69%	0.692	78%	0.781	S	S	*	*			trans	-2.7	126.7	153.2	-50.3	0	0	0	0	119.7
207	T	35.8	Very low	38.6	Very low	111 Å²	111	132.6 Å²	132.6	68%	0.681	78%	0.775	S	S	*	*				80.5	115.6	78.1	-49.9	0	0	0	0	112.7
208	F	32.5	Very low	38.5	Very low	202 Å²	202	130.1 Å²	130.1	89%	0.886	77%	0.768	S	S	*	*				-162.1	143.2	115.7	-134.9	-99.7	0	0	0	114.1
209	S	34.8	Very low	38	Very low	95 Å²	95	130.2 Å²	130.2	66%	0.664	77%	0.766	S	S	*	*			trans	-80	158.9	-168.2	-53.3	0	0	0	0	114.8
210	A	40.9	Very low	38.5	Very low	92 Å²	92	132.1 Å²	132.1	76%	0.76	77%	0.766	S	S	*	*			trans	-62.3	168.4	161.5	0	0	0	0	0	112.4
211	P	45.5	Very low	38.7	Very low	126 Å²	126	130 Å²	130	82%	0.818	76%	0.76	S	S	*	*				-153.4	161.6	83.4	33.8	-11.5	0	0	0	118.7
212	L	39.5	Very low	38.9	Very low	164 Å²	164	136 Å²	136	86%	0.859	76%	0.762	S	S	*	*			trans	-0.6	172.2	152	-119	67.1	0	0	0	121.9
213	P	45.3	Very low	38.1	Very low	109 Å²	109	138.3 Å²	138.3	71%	0.708	76%	0.762	S	S	*	*			cis	-138.5	168.9	-4.7	25.6	0.5	0	0	0	118.2
214	S	34.8	Very low	38.1	Very low	118 Å²	118	138.9 Å²	138.9	83%	0.825	76%	0.761	S	S	*	*			trans	4.5	175.6	146.5	-98.1	0	0	0	0	123.4
215	P	52.1	Low	38.4	Very low	98 Å²	98	136.2 Å²	136.2	64%	0.636	76%	0.762	S	S	*	*			cis	-146.1	-170.9	-6.9	35.2	-10.8	0	0	0	117.2
216	R	35.4	Very low	38.8	Very low	230 Å²	230	131.4 Å²	131.4	87%	0.868	76%	0.759	S	S	*	*			trans	78.2	152.5	155.7	-69.7	-169.8	-177.4	127.4	-0.3	118.7
217	T	35.4	Very low	38.6	Very low	117 Å²	117	129.3 Å²	129.3	72%	0.718	75%	0.753	S	S	*	*			cis	179.6	149.3	-9.6	-88.4	0	0	0	0	107.8
218	A	35.6	Very low	38.7	Very low	83 Å²	83	133.4 Å²	133.4	69%	0.686	76%	0.764	S	S	*	*			trans	67.8	148	154	0	0	0	0	0	118.7
219	T	36.9	Very low	38.9	Very low	129 Å²	129	127 Å²	127	79%	0.791	76%	0.756	S	S	*	*			cis	-169.6	167.2	3.8	14.8	0	0	0	0	107.5
220	P	42.5	Very low	38.9	Very low	112 Å²	112	128.2 Å²	128.2	73%	0.727	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-83.9	148.4	-170.2	34.5	-32.8	0	0	0	113.3
221	I	39.5	Very low	38.7	Very low	156 Å²	156	129.5 Å²	129.5	80%	0.8	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-88.9	118.3	169.4	-62.1	176.9	0	0	0	107.9
222	Y	36.6	Very low	38.2	Very low	196 Å²	196	127 Å²	127	77%	0.769	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-80.8	135.3	160.2	50.4	-90.3	0	0	0	108.4	V224	Y222-V224 HydrophobicContact CD2-CG2 4.29Å
223	E	41.6	Very low	39	Very low	169 Å²	169	125.6 Å²	125.6	79%	0.79	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-91.5	121.6	167.8	-94.5	-82.4	146.4	0	0	108.6
224	V	35.3	Very low	38.5	Very low	103 Å²	103	125.5 Å²	125.5	62%	0.624	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-93.7	121.2	167.9	149.6	0	0	0	0	106.9	Y222 V226	Y222-V224 HydrophobicContact CD2-CG2 4.29Å; V224-V226 HydrophobicContact CG1-CG2 3.89Å
225	S	37.8	Very low	38.5	Very low	119 Å²	119	123.2 Å²	123.2	83%	0.832	77%	0.767	S	S	*	*			trans	-107.5	106.6	163	-80.8	0	0	0	0	109.1
226	V	37.2	Very low	37.6	Very low	131 Å²	131	123.9 Å²	123.9	79%	0.794	77%	0.774	S	S	*	*			trans	-107.7	135.2	167.4	164.2	0	0	0	0	108.4	V224	V224-V226 HydrophobicContact CG1-CG2 3.89Å
227	G	36.7	Very low	37.6	Very low	56 Å²	56	125 Å²	125	58%	0.577	78%	0.778	S	S	*	*			trans	116.9	118.6	144.4	0	0	0	0	0	115.2
228	H	37.9	Very low	37.5	Very low	196 Å²	196	122.7 Å²	122.7	91%	0.907	78%	0.778	S	S	*	*				-171.4	131.8	86.7	-94.9	64.6	0	0	0	109.7
229	G	36.4	Very low	37.7	Very low	69 Å²	69	124.9 Å²	124.9	71%	0.711	79%	0.785	S	S	*	*			trans	-108.6	166.9	169.3	0	0	0	0	0	111.2
230	C	34.8	Very low	37.6	Very low	119 Å²	119	130.2 Å²	130.2	80%	0.804	79%	0.791	S	S	*	*			trans	-154.8	113.6	156.6	-82.7	0	0	0	0	106.8
231	S	35.7	Very low	37.4	Very low	120 Å²	120	132.6 Å²	132.6	84%	0.839	80%	0.796	S	S	*	*				52.1	129.9	95	48.5	0	0	0	0	113.7
232	G	35	Very low	37.3	Very low	73 Å²	73	130.4 Å²	130.4	75%	0.753	79%	0.793	S	S	*	*			cis	176.4	178.6	9.4	0	0	0	0	0	107.4
233	P	55.6	Low	37.6	Very low	134 Å²	134	127 Å²	127	87%	0.87	80%	0.795	S	S	*	*			trans	-101.5	153.9	-158.6	37.2	-32.2	0	0	0	116
234	A	36.5	Very low	37.3	Very low	107 Å²	107	127.1 Å²	127.1	88%	0.884	80%	0.795	S	S	*	*			trans	-161.2	123.3	160	0	0	0	0	0	113.7
235	G	33.5	Very low	37.3	Very low	71 Å²	71	130.3 Å²	130.3	73%	0.732	80%	0.803	S	S	*	*				85.1	97.6	127	0	0	0	0	0	123.1
236	S	33.9	Very low	37	Very low	112 Å²	112	133 Å²	133	78%	0.783	80%	0.802	S	S	*	*				81.4	129.9	126.2	80.3	0	0	0	0	123.7
237	R	34.6	Very low	37	Very low	253 Å²	253	133.9 Å²	133.9	96%	0.955	80%	0.802	S	S	*	*			trans	70.7	118.4	147.1	-73.7	-179.8	-168.6	176.2	5.1	121
238	G	34.3	Very low	36.9	Very low	69 Å²	69	134.6 Å²	134.6	71%	0.711	80%	0.802	S	S	*	*			trans	150.6	119.6	150.8	0	0	0	0	0	113.5
239	P	38.4	Very low	36.7	Very low	128 Å²	128	132.3 Å²	132.3	83%	0.831	79%	0.792	S	S	*	*			trans	-78.1	133.8	-166.9	30.6	-31.7	0	0	0	112.4	I241	P239-I241 PolarHBondContact O-N 3.03Å
240	R	34.9	Very low	36.8	Very low	242 Å²	242	136.2 Å²	136.2	91%	0.913	80%	0.795	S	S	*	*			trans	-77.5	118.4	166.6	-88.6	-169.6	-90.3	-139.7	-2.7	109.3	C242	R240-C242 PolarHBondContact O-N 3.05Å
241	I	39.9	Very low	36.9	Very low	162 Å²	162	140.6 Å²	140.6	83%	0.831	80%	0.795	S	S	*	*			trans	-69.4	114.1	169.2	-62.5	171.7	0	0	0	107.4	P239	P239-I241 PolarHBondContact O-N 3.03Å
242	C	37.2	Very low	37	Very low	109 Å²	109	144.3 Å²	144.3	74%	0.736	80%	0.797	S	S	*	*			trans	-87.6	133	166.5	-64.2	0	0	0	0	108.9	R240 H244	R240-C242 PolarHBondContact O-N 3.05Å; C242-H244 PolarHBondContact O-N 3.01Å; C242-H244 VanDerWaalsContact O-N 3.15Å
243	P	43	Very low	36.9	Very low	126 Å²	126	152 Å²	152	82%	0.818	80%	0.803	S	S	*	*			trans	-77.9	102.2	165.6	29	-26.9	0	0	0	109.6
244	H	33.8	Very low	35.8	Very low	170 Å²	170	155 Å²	155	79%	0.787	80%	0.802	S	S	*	*			trans	7.3	108.3	147.7	-129.8	-78.9	0	0	0	117.3	C242	C242-H244 PolarHBondContact O-N 3.01Å; C242-H244 VanDerWaalsContact O-N 3.15Å
245	Q	36.8	Very low	35.9	Very low	170 Å²	170	158.6 Å²	158.6	79%	0.794	80%	0.803	S	S	*	*			trans	-71.8	127.6	150.4	-73	179.1	-21.1	0	0	108.1	L247	Q245-L247 VanDerWaalsContact C-N 3.32Å; Q245-L247 PolarHBondContact O-N 3.43Å; Q245-L247 VanDerWaalsContact O-N 3.14Å
246	H	31.6	Very low	36.4	Very low	177 Å²	177	167.6 Å²	167.6	82%	0.819	83%	0.826	S	S	*	*			trans	-83.7	81	171.5	-159	-87.9	0	0	0	108.3	A248	H246-A248 PolarHBondContact O-N 2.94Å
247	L	36	Very low	36.5	Very low	148 Å²	148	170.4 Å²	170.4	78%	0.775	83%	0.828	S	S	*	*			trans	-78.1	97.3	171.5	-163.8	81.2	0	0	0	107.9	Q245 E249	Q245-L247 VanDerWaalsContact C-N 3.32Å; Q245-L247 PolarHBondContact O-N 3.43Å; Q245-L247 VanDerWaalsContact O-N 3.14Å; L247-E249 PolarHBondContact O-N 3.49Å; L247-E249 VanDerWaalsContact O-N 3.16Å
248	A	34.3	Very low	36.6	Very low	71 Å²	71	166.1 Å²	166.1	59%	0.587	82%	0.822	S	S	*	*			trans	-73.5	99.4	167.4	0	0	0	0	0	108.6	H246 L250	H246-A248 PolarHBondContact O-N 2.94Å; A248-L250 PolarHBondContact O-N 3.31Å; A248-L250 VanDerWaalsContact O-N 3.16Å
249	E	35.3	Very low	36.8	Very low	149 Å²	149	171.4 Å²	171.4	70%	0.696	83%	0.828	S	S	*	*			trans	-66.1	102.1	167.1	-121.7	-161.6	-176.2	0	0	108.8	L247 R251	L247-E249 PolarHBondContact O-N 3.49Å; L247-E249 VanDerWaalsContact O-N 3.16Å; E249-R251 PolarHBondContact O-N 3.08Å; E249-R251 IonicContact OE2-NE 3.71Å
250	L	38.2	Very low	36.7	Very low	150 Å²	150	174 Å²	174	79%	0.785	83%	0.827	S	S	*	*			trans	-83.1	95.8	159.7	-92.8	96.4	0	0	0	108.6	A248 F252	A248-L250 PolarHBondContact O-N 3.31Å; A248-L250 VanDerWaalsContact O-N 3.16Å; L250-F252 PolarHBondContact O-N 3.37Å
251	R	35.4	Very low	36.8	Very low	212 Å²	212	169.8 Å²	169.8	80%	0.8	82%	0.822	S	S	*	*			trans	-63.3	112.3	164.9	-79.9	-172.4	-174.4	-179.2	1	109.8	E249 R253	E249-R251 PolarHBondContact O-N 3.08Å; E249-R251 IonicContact OE2-NE 3.71Å; R251-R253 PolarHBondContact O-N 3.16Å; R251-R253 VanDerWaalsContact O-N 3.16Å
252	F	38.1	Very low	36.6	Very low	198 Å²	198	170.3 Å²	170.3	87%	0.868	82%	0.822	S	S	*	*			trans	-67.8	105.7	161.8	-81.3	-92.7	0	0	0	109.4	L250 K254	L250-F252 PolarHBondContact O-N 3.37Å; F252-K254 PolarHBondContact O-N 2.98Å
253	R	34.5	Very low	36.5	Very low	234 Å²	234	174.6 Å²	174.6	88%	0.883	83%	0.828	S	S	*	*			trans	-72.4	114.8	160.4	-84.7	-165	-169.1	-137.4	5.7	108.3	R251 M255	R251-R253 PolarHBondContact O-N 3.16Å; R251-R253 VanDerWaalsContact O-N 3.16Å; R253-M255 PolarHBondContact O-N 2.89Å
254	K	31.6	Very low	36	Very low	198 Å²	198	178.4 Å²	178.4	86%	0.861	83%	0.828	S	S	*	*			trans	-71.1	114.7	163.3	-166.6	174	-173.1	176.4	0	107.6	F252	F252-K254 PolarHBondContact O-N 2.98Å
255	M	38.3	Very low	36.2	Very low	182 Å²	182	179.1 Å²	179.1	90%	0.897	83%	0.832	S	S	*	*			trans	-90.4	123.3	163.9	-74.2	-149.6	-100.9	0	0	108.4	R253	R253-M255 PolarHBondContact O-N 2.89Å
256	Q	44.6	Very low	36.2	Very low	260 Å²	260	179.9 Å²	179.9	100%	1.215	84%	0.835	S	S	*	*			trans	-82.3	0	151.6	-81.5	-179.6	-65.8	0	0	108.3

Retrieved 256 of 256 residues in 273.7 ms (Link to these results)

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