A0A077JJN3_HUMAN Loading...

Carcinoembryonic antigen-related cell adhesion molecule 4-sv2

AlphaFold DB , UniProt , Accession A0A077JJN3, Species HUMAN (Homo sapiens, Human), Gene CEACAM4, Length 239 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	48.9	Very low	51.7	Low	254 Å²	254	123.7 Å²	123.7	100%	1.251	82%	0.816	S	S	*	*				0	113	0	-76.3	172.4	169.5	0	0	107.4
2	G	43.2	Very low	52.4	Low	71 Å²	71	128.8 Å²	128.8	73%	0.732	82%	0.819	S	S	*	*			trans	-124	139.9	172.4	0	0	0	0	0	109.2
3	P	68.1	Low	53.2	Low	126 Å²	126	133.8 Å²	133.8	82%	0.818	81%	0.812	S	S	*	*			trans	-80.4	159.1	165.6	36	-29.7	0	0	0	108.2
4	P	55.2	Low	53.8	Low	124 Å²	124	131.9 Å²	131.9	81%	0.805	80%	0.804	S	S	*	*			cis	-144.9	-178.3	48.2	37.5	-13.6	0	0	0	112
5	S	43.7	Very low	54.3	Low	118 Å²	118	134.9 Å²	134.9	83%	0.825	80%	0.796	S	S	*	*				-178.2	144	90.8	-158.3	0	0	0	0	111.7
6	A	47.7	Very low	55	Low	84 Å²	84	132.2 Å²	132.2	69%	0.694	77%	0.772	S	S	*	*			trans	-52.9	153.6	-176.9	0	0	0	0	0	115.7
7	A	54.6	Low	56	Low	95 Å²	95	127 Å²	127	79%	0.785	75%	0.754	S	S	*	*			trans	-65.7	149.4	148.9	0	0	0	0	0	110
8	P	47.2	Very low	57.1	Low	115 Å²	115	126 Å²	126	75%	0.747	74%	0.743	S	S	*	*			trans	-131.7	113.9	132.8	26.4	-9.7	0	0	0	111.8
9	R	52.9	Low	58.1	Low	235 Å²	235	124.6 Å²	124.6	89%	0.887	73%	0.732	S	S	*	*				38.7	99.7	126.9	-61.9	-178.8	-172	-139.4	0.4	115.4	G11	R9-G11 PolarHBondContact O-N 3.49Å
10	G	54.7	Low	58.8	Low	78 Å²	78	123.8 Å²	123.8	80%	0.804	72%	0.723	S	S	*	*			trans	-63.3	82.8	153.9	0	0	0	0	0	110	H12	G10-H12 PolarHBondContact O-N 3.19Å; G10-H12 VanDerWaalsContact O-N 3.12Å
11	G	52.3	Low	59.2	Low	61 Å²	61	122 Å²	122	63%	0.629	71%	0.713	S	S	*	*			trans	-75.8	90	168.8	0	0	0	0	0	108.9	R9 R13	R9-G11 PolarHBondContact O-N 3.49Å; G11-R13 PolarHBondContact O-N 2.84Å
12	H	60.3	Low	60.1	Low	184 Å²	184	112.2 Å²	112.2	85%	0.852	67%	0.674	S	S	*	*			trans	-54.7	113.9	160.4	-78.8	-80.6	0	0	0	107.4	G10 P14	G10-H12 PolarHBondContact O-N 3.19Å; G10-H12 VanDerWaalsContact O-N 3.12Å; H12-P14 WeakPolarHBondContact O-CD 3.45Å; H12-P14 VanDerWaalsContact O-N 3.17Å
13	R	62.6	Low	61.4	Low	194 Å²	194	112 Å²	112	73%	0.732	66%	0.661	S	S	*	*			trans	-70.2	108.8	-176.5	-68.6	-166	-177.7	-165.1	3	108.3	G11 W15 Q16	G11-R13 PolarHBondContact O-N 2.84Å; R13-W15 PolarHBondContact O-N 3.48Å; R13-Q16 VanDerWaalsContact CB-OE1 3.28Å; R13-Q16 PolarHBondContact O-N 3.34Å; R13-Q16 VanDerWaalsContact O-N 3.13Å
14	P	61.3	Low	61.4	Low	108 Å²	108	110.6 Å²	110.6	70%	0.701	65%	0.646	S	S	*	*	H	α-helix	trans	-61.8	-18.1	-174.3	24	-32.8	0	0	0	112.8	H12 L18	H12-P14 WeakPolarHBondContact O-CD 3.45Å; H12-P14 VanDerWaalsContact O-N 3.17Å; P14-L18 PolarHBondContact O-N 2.74Å
15	W	61.3	Low	62	Low	177 Å²	177	110.5 Å²	110.5	67%	0.67	64%	0.638	S	S	*	*	H	α-helix	trans	-68.7	-33.2	176.9	-94.4	69.1	0	0	0	114.6	R13 L18 L19	R13-W15 PolarHBondContact O-N 3.48Å; W15-L18 PolarHBondContact O-N 2.92Å; W15-L19 HydrophobicContact CE3-CD1 4.47Å; W15-L19 HydrophobicContact CE3-CG 4.45Å; W15-L19 WeakPolarHBondContact O-CB 3.19Å; W15-L19 VanDerWaalsContact O-CG 3.27Å; W15-L19 WeakPolarHBondContact O-CG 3.42Å; W15-L19 PolarHBondContact O-N 3.28Å
16	Q	66.4	Low	62.9	Low	91 Å²	91	109.9 Å²	109.9	43%	0.425	63%	0.629	S	S	.	*	H	α-helix	trans	-63.1	-44.5	177.4	-101.1	81.7	-7.6	0	0	111.5	R13 L18 L19 I20	R13-Q16 VanDerWaalsContact CB-OE1 3.28Å; R13-Q16 PolarHBondContact O-N 3.34Å; R13-Q16 VanDerWaalsContact O-N 3.13Å; Q16-L18 VanDerWaalsContact C-N 3.3Å; Q16-L18 PolarHBondContact O-N 3.38Å; Q16-L19 PolarHBondContact O-N 3.32Å; Q16-I20 VanDerWaalsContact O-CG1 3.31Å; Q16-I20 WeakPolarHBondContact O-CG1 3.39Å; Q16-I20 PolarHBondContact O-N 3.11Å; Q16-I20 VanDerWaalsContact O-N 3.09Å
17	G	72.1	Confident	63.4	Low	44 Å²	44	114 Å²	114	45%	0.454	63%	0.632	S	S	.	*	H	α-helix	trans	-63	-38.9	176.8	0	0	0	0	0	112	I20 T21	G17-I20 PolarHBondContact O-N 2.78Å; G17-T21 PolarHBondContact O-N 3.29Å; G17-T21 PolarHBondContact O-OG1 3.04Å
18	L	75	Confident	63.9	Low	109 Å²	109	119.3 Å²	119.3	57%	0.571	63%	0.632	S	S	*	*	H	α-helix	trans	-69.2	-36.7	179.7	-153.7	133.7	0	0	0	112.5	P14 W15 Q16 T21 A22	P14-L18 PolarHBondContact O-N 2.74Å; W15-L18 PolarHBondContact O-N 2.92Å; Q16-L18 VanDerWaalsContact C-N 3.3Å; Q16-L18 PolarHBondContact O-N 3.38Å; L18-T21 WeakPolarHBondContact CA-OG1 3.41Å; L18-T21 PolarHBondContact O-OG1 2.69Å; L18-A22 WeakPolarHBondContact O-CB 3.23Å; L18-A22 PolarHBondContact O-N 2.87Å
19	L	77.3	Confident	64.3	Low	100 Å²	100	120.2 Å²	120.2	52%	0.524	63%	0.626	S	S	.	*	H	α-helix	trans	-68.9	-41.2	174.3	-71.2	171.3	0	0	0	112.1	W15 Q16 A22 S23	W15-L19 HydrophobicContact CE3-CD1 4.47Å; W15-L19 HydrophobicContact CE3-CG 4.45Å; W15-L19 WeakPolarHBondContact O-CB 3.19Å; W15-L19 VanDerWaalsContact O-CG 3.27Å; W15-L19 WeakPolarHBondContact O-CG 3.42Å; W15-L19 PolarHBondContact O-N 3.28Å; Q16-L19 PolarHBondContact O-N 3.32Å; L19-A22 PolarHBondContact O-N 3.05Å; L19-S23 WeakPolarHBondContact O-CB 3.36Å; L19-S23 PolarHBondContact O-N 3.05Å
20	I	71.7	Confident	64.5	Low	107 Å²	107	113.9 Å²	113.9	55%	0.549	62%	0.615	S	S	.	*	H	α-helix	trans	-63.7	-44.3	175.8	-67.5	165.5	0	0	0	110.4	Q16 G17 S23 L24	Q16-I20 VanDerWaalsContact O-CG1 3.31Å; Q16-I20 WeakPolarHBondContact O-CG1 3.39Å; Q16-I20 PolarHBondContact O-N 3.11Å; Q16-I20 VanDerWaalsContact O-N 3.09Å; G17-I20 PolarHBondContact O-N 2.78Å; I20-S23 PolarHBondContact O-N 2.76Å; I20-L24 HydrophobicContact CG2-CD1 3.83Å; I20-L24 WeakPolarHBondContact O-CB 3.32Å; I20-L24 WeakPolarHBondContact O-CG 3.26Å; I20-L24 PolarHBondContact O-N 2.89Å
21	T	67.1	Low	64.6	Low	86 Å²	86	115.7 Å²	115.7	53%	0.528	61%	0.613	S	S	.	*	H	α-helix	trans	-65.2	-42	176.7	21.5	0	0	0	0	112.1	G17 L18 S23 L24 L25	G17-T21 PolarHBondContact O-N 3.29Å; G17-T21 PolarHBondContact O-OG1 3.04Å; L18-T21 WeakPolarHBondContact CA-OG1 3.41Å; L18-T21 PolarHBondContact O-OG1 2.69Å; T21-S23 PolarHBondContact O-N 2.93Å; T21-L24 PolarHBondContact O-N 3.34Å; T21-L25 WeakPolarHBondContact O-CB 3.4Å; T21-L25 PolarHBondContact O-N 3.27Å
22	A	68.3	Low	64.9	Low	50 Å²	50	119.4 Å²	119.4	41%	0.413	62%	0.623	S	S	.	*	H	α-helix	trans	-62.3	-40.5	175.1	0	0	0	0	0	112.4	L18 L19 L25 T26	L18-A22 WeakPolarHBondContact O-CB 3.23Å; L18-A22 PolarHBondContact O-N 2.87Å; L19-A22 PolarHBondContact O-N 3.05Å; A22-L25 WeakPolarHBondContact O-CB 3.3Å; A22-L25 PolarHBondContact O-N 2.89Å; A22-T26 PolarHBondContact O-N 2.94Å; A22-T26 VanDerWaalsContact O-N 3.12Å
23	S	68.9	Low	64.8	Low	67 Å²	67	116.1 Å²	116.1	47%	0.469	62%	0.616	S	S	.	*	H	α-helix	trans	-65.2	-46	177.4	-170.3	0	0	0	0	112.3	L19 I20 T21 L25 T26 F27	L19-S23 WeakPolarHBondContact O-CB 3.36Å; L19-S23 PolarHBondContact O-N 3.05Å; I20-S23 PolarHBondContact O-N 2.76Å; T21-S23 PolarHBondContact O-N 2.93Å; S23-L25 VanDerWaalsContact C-N 3.28Å; S23-L25 PolarHBondContact O-N 2.88Å; S23-T26 PolarHBondContact O-N 3.16Å; S23-T26 PolarHBondContact O-OG1 3.49Å; S23-F27 PolarHBondContact O-N 3.33Å
24	L	68.7	Low	65	Low	96 Å²	96	111.7 Å²	111.7	50%	0.503	61%	0.61	S	S	.	*	H	α-helix	trans	-60.8	-38.6	174.7	-78.2	159.2	0	0	0	111.5	I20 T21 T26 F27 W28	I20-L24 HydrophobicContact CG2-CD1 3.83Å; I20-L24 WeakPolarHBondContact O-CB 3.32Å; I20-L24 WeakPolarHBondContact O-CG 3.26Å; I20-L24 PolarHBondContact O-N 2.89Å; T21-L24 PolarHBondContact O-N 3.34Å; L24-T26 VanDerWaalsContact C-N 3.31Å; L24-T26 PolarHBondContact O-N 2.77Å; L24-F27 PolarHBondContact O-N 2.7Å; L24-W28 WeakPolarHBondContact O-CB 3.38Å; L24-W28 PolarHBondContact O-N 3.16Å
25	L	67.9	Low	65.9	Low	122 Å²	122	113.9 Å²	113.9	64%	0.639	61%	0.611	S	S	*	*	H	α-helix	trans	-63.2	-37.7	177.1	-143	73.1	0	0	0	111.7	T21 A22 S23 H29	T21-L25 WeakPolarHBondContact O-CB 3.4Å; T21-L25 PolarHBondContact O-N 3.27Å; A22-L25 WeakPolarHBondContact O-CB 3.3Å; A22-L25 PolarHBondContact O-N 2.89Å; S23-L25 VanDerWaalsContact C-N 3.28Å; S23-L25 PolarHBondContact O-N 2.88Å; L25-H29 PolarHBondContact O-CE1 2.87Å; L25-H29 PolarHBondContact O-ND1 3.01Å
26	T	62.4	Low	67.3	Low	104 Å²	104	106.9 Å²	106.9	64%	0.638	59%	0.586	S	S	*	*	H	α-helix	trans	-73.3	-31.4	175.8	57.1	0	0	0	0	113.6	A22 S23 L24	A22-T26 PolarHBondContact O-N 2.94Å; A22-T26 VanDerWaalsContact O-N 3.12Å; S23-T26 PolarHBondContact O-N 3.16Å; S23-T26 PolarHBondContact O-OG1 3.49Å; L24-T26 VanDerWaalsContact C-N 3.31Å; L24-T26 PolarHBondContact O-N 2.77Å
27	F	59.4	Low	68.7	Low	170 Å²	170	105 Å²	105	75%	0.746	58%	0.58	S	S	*	*	H	α-helix	trans	-74.5	-27.5	176	-171.1	-103.4	0	0	0	112.7	S23 L24 H29	S23-F27 PolarHBondContact O-N 3.33Å; L24-F27 PolarHBondContact O-N 2.7Å; F27-H29 VanDerWaalsContact C-N 3.28Å; F27-H29 PolarHBondContact O-N 3.31Å
28	W	64.9	Low	69.9	Low	207 Å²	207	103.8 Å²	103.8	78%	0.784	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	-2.8	-178.2	-152.8	-80.7	0	0	0	114.2	L24 P30	L24-W28 WeakPolarHBondContact O-CB 3.38Å; L24-W28 PolarHBondContact O-N 3.16Å; W28-P30 WeakPolarHBondContact O-CD 3.41Å
29	H	54.8	Low	70.9	Confident	135 Å²	135	103.5 Å²	103.5	63%	0.625	56%	0.559	S	S	*	*	S	Bend	trans	-76.3	106.3	173.8	-70.8	75.2	0	0	0	108.2	L25 F27	L25-H29 PolarHBondContact O-CE1 2.87Å; L25-H29 PolarHBondContact O-ND1 3.01Å; F27-H29 VanDerWaalsContact C-N 3.28Å; F27-H29 PolarHBondContact O-N 3.31Å
30	P	57.8	Low	71.8	Confident	102 Å²	102	99.5 Å²	99.5	66%	0.662	54%	0.541	S	S	*	.			trans	-58.4	140	176.4	25.5	-33.1	0	0	0	108.4	W28 T32	W28-P30 WeakPolarHBondContact O-CD 3.41Å; P30-T32 PolarHBondContact O-N 2.95Å
31	P	57	Low	73	Confident	116 Å²	116	98.2 Å²	98.2	75%	0.753	53%	0.534	S	S	*	.			trans	-49.9	128.7	170.2	-21.6	30.5	0	0	0	108.6	T33	P31-T33 VanDerWaalsContact C-N 3.26Å; P31-T33 PolarHBondContact O-N 3.46Å
32	T	57.3	Low	74.3	Confident	138 Å²	138	97.5 Å²	97.5	85%	0.847	53%	0.531	S	S	*	.			trans	-68.1	92.9	171.4	-50.2	0	0	0	0	107.2	P30 V34	P30-T32 PolarHBondContact O-N 2.95Å; T32-V34 PolarHBondContact O-N 3.43Å; T32-V34 VanDerWaalsContact O-N 3.09Å
33	T	59.3	Low	75.5	Confident	115 Å²	115	99.4 Å²	99.4	71%	0.706	54%	0.542	S	S	*	.			trans	-59.1	113.7	173.2	-55.6	0	0	0	0	107.6	P31 Q35	P31-T33 VanDerWaalsContact C-N 3.26Å; P31-T33 PolarHBondContact O-N 3.46Å; T33-Q35 PolarHBondContact O-N 3.11Å; T33-Q35 VanDerWaalsContact O-N 3.15Å
34	V	66.2	Low	76.7	Confident	101 Å²	101	98.9 Å²	98.9	61%	0.612	54%	0.538	S	S	*	.			trans	-66	114.2	172.1	177.9	0	0	0	0	106.6	T32 N57	T32-V34 PolarHBondContact O-N 3.43Å; T32-V34 VanDerWaalsContact O-N 3.09Å; V34-N57 HydrophobicContact CG1-CB 3.76Å
35	Q	81.1	Confident	78	Confident	155 Å²	155	94.4 Å²	94.4	72%	0.724	52%	0.515	S	S	*	.			trans	-80.8	142.4	178.3	-68	-176.2	-26.4	0	0	110.1	T33	T33-Q35 PolarHBondContact O-N 3.11Å; T33-Q35 VanDerWaalsContact O-N 3.15Å
36	F	91	Very high	79.3	Confident	29 Å²	29	89.6 Å²	89.6	13%	0.127	49%	0.493	C	S	.	.			trans	-60.5	135.9	169	165.9	-125.1	0	0	0	110.3	I38 A55 C56 I58 L122 T124 A134	F36-I38 HydrophobicContact CE1-CD1 4.17Å; F36-I38 HydrophobicContact CE2-CD1 3.9Å; F36-I38 HydrophobicContact CZ-CD1 3.31Å; F36-I38 HydrophobicContact CZ-CG1 4.14Å; F36-A55 HydrophobicContact CE2-CB 3.69Å; F36-A55 HydrophobicContact CZ-CB 3.92Å; F36-C56 WeakPolarHBondContact CD2-O 3.39Å; F36-I58 HydrophobicContact CD2-CB 4.32Å; F36-I58 HydrophobicContact CD2-CD1 4.2Å; F36-I58 HydrophobicContact CD2-CG1 3.22Å; F36-I58 HydrophobicContact CE2-CD1 3.64Å; F36-I58 HydrophobicContact CE2-CG1 3.17Å; F36-I58 HydrophobicContact CG-CG1 4.16Å; F36-I58 HydrophobicContact CZ-CD1 4.15Å; F36-I58 HydrophobicContact CZ-CG1 3.99Å; F36-L122 HydrophobicContact CE1-CB 4.05Å; F36-L122 HydrophobicContact CE1-CD2 3.89Å; F36-L122 HydrophobicContact CE1-CG 3.96Å; F36-L122 HydrophobicContact CE2-CD2 4.34Å; F36-L122 HydrophobicContact CZ-CB 4.09Å; F36-L122 HydrophobicContact CZ-CD2 3.36Å; F36-L122 HydrophobicContact CZ-CG 3.93Å; F36-T124 HydrophobicContact CE1-CG2 4.2Å; F36-A134 HydrophobicContact CD1-CB 3.36Å; F36-A134 HydrophobicContact CE1-CB 3.42Å; F36-A134 VanDerWaalsContact CE1-CB 3.42Å; F36-A134 HydrophobicContact CG-CB 4.09Å; F36-A134 HydrophobicContact CZ-CB 4.13Å; F36-A134 WeakPolarHBondContact O-CB 3.32Å
37	T	94.6	Very high	81	Confident	52 Å²	52	88 Å²	88	32%	0.319	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	156.8	-177.5	58.3	0	0	0	0	113	C56	T37-C56 PolarHBondContact N-O 3.4Å; T37-C56 PolarHBondContact O-N 2.98Å
38	I	97.2	Very high	82.7	Confident	18 Å²	18	81.5 Å²	81.5	9%	0.092	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	131.6	173.4	-61.2	-55.9	0	0	0	110.2	F36 L53 L54 A55 W67 L122 A134	F36-I38 HydrophobicContact CE1-CD1 4.17Å; F36-I38 HydrophobicContact CE2-CD1 3.9Å; F36-I38 HydrophobicContact CZ-CD1 3.31Å; F36-I38 HydrophobicContact CZ-CG1 4.14Å; I38-L53 HydrophobicContact CG2-CB 4.16Å; I38-L54 CarbonylContact C-O 3.44Å; I38-L54 WeakPolarHBondContact CA-O 3.44Å; I38-A55 HydrophobicContact CD1-CB 3.84Å; I38-W67 HydrophobicContact CB-CH2 4.49Å; I38-W67 HydrophobicContact CD1-CH2 3.47Å; I38-W67 VanDerWaalsContact CD1-CH2 3.47Å; I38-W67 HydrophobicContact CD1-CZ2 3.84Å; I38-W67 HydrophobicContact CD1-CZ3 4.45Å; I38-W67 HydrophobicContact CG1-CH2 3.84Å; I38-W67 HydrophobicContact CG1-CZ3 4.45Å; I38-W67 HydrophobicContact CG2-CH2 3.79Å; I38-W67 HydrophobicContact CG2-CZ3 4.43Å; I38-L122 HydrophobicContact CD1-CB 3.99Å; I38-L122 HydrophobicContact CD1-CD2 4.21Å; I38-L122 HydrophobicContact CG1-CB 4.46Å; I38-A134 HydrophobicContact CG1-CB 4.1Å
39	E	96.1	Very high	84.3	Confident	104 Å²	104	77.8 Å²	77.8	49%	0.486	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	129.2	174	-64.9	-175	178.3	0	0	110.6	L41 L53 L54	E39-L41 HydrophobicContact CB-CD1 3.88Å; E39-L53 CarbonylContact O-C 3.21Å; E39-L54 PolarHBondContact N-O 2.76Å; E39-L54 WeakPolarHBondContact O-CB 3.25Å; E39-L54 PolarHBondContact O-N 3.46Å
40	A	96.6	Very high	86.3	Confident	16 Å²	16	75.4 Å²	75.4	13%	0.132	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	126.5	173.9	0	0	0	0	0	110.4	P42 S43 V51 L53 Q137	A40-P42 CarbonylContact C-O 3.56Å; A40-P42 CarbonylContact O-C 3.57Å; A40-S43 VanDerWaalsContact O-CA 3.23Å; A40-S43 WeakPolarHBondContact O-CA 3.45Å; A40-S43 PolarHBondContact O-N 3.44Å; A40-S43 VanDerWaalsContact O-N 3.07Å; A40-V51 HydrophobicContact CB-CG1 4.45Å; A40-L53 HydrophobicContact CB-CD2 3.81Å; A40-Q137 WeakPolarHBondContact CB-O 3.26Å
41	L	96.8	Very high	88.2	Confident	80 Å²	80	70.6 Å²	70.6	42%	0.419	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	113.4	179.6	-88	76.7	0	0	0	110.8	E39 L52 L54	E39-L41 HydrophobicContact CB-CD1 3.88Å; L41-L52 HydrophobicContact CB-CB 4.43Å; L41-L52 PolarHBondContact N-O 3.04Å; L41-L52 PolarHBondContact O-N 2.73Å; L41-L54 HydrophobicContact CD1-CB 4.07Å; L41-L54 HydrophobicContact CD1-CD2 4.19Å; L41-L54 HydrophobicContact CD2-CD2 4.41Å
42	P	95.2	Very high	90.2	Very high	71 Å²	71	67.2 Å²	67.2	46%	0.461	39%	0.385	S	S	.	.	S	Bend	cis	-66.7	160.3	-10.7	31.3	-36.9	0	0	0	112	A40 S44 A45	A40-P42 CarbonylContact C-O 3.56Å; A40-P42 CarbonylContact O-C 3.57Å; P42-S44 PolarHBondContact O-N 2.97Å; P42-A45 HydrophobicContact CG-CB 3.95Å
43	S	91.7	Very high	92.1	Very high	90 Å²	90	60.7 Å²	60.7	63%	0.629	34%	0.344	S	S	*	.	S	Bend	trans	-65.9	-22.9	-178.2	56.5	0	0	0	0	113.9	A40	A40-S43 VanDerWaalsContact O-CA 3.23Å; A40-S43 WeakPolarHBondContact O-CA 3.45Å; A40-S43 PolarHBondContact O-N 3.44Å; A40-S43 VanDerWaalsContact O-N 3.07Å
44	S	94.9	Very high	93.9	Very high	55 Å²	55	56.5 Å²	56.5	39%	0.385	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	126.1	169.1	-178.6	0	0	0	0	108.6	P42 H139 H141	P42-S44 PolarHBondContact O-N 2.97Å; S44-H139 WeakPolarHBondContact CA-O 3.42Å; S44-H141 PolarHBondContact OG-ND1 3.06Å
45	A	95.3	Very high	95.3	Very high	3 Å²	3	52.3 Å²	52.3	3%	0.025	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	147.1	-176.5	0	0	0	0	0	111.3	P42 V51 I112 H139 V140 H141	P42-A45 HydrophobicContact CG-CB 3.95Å; A45-V51 HydrophobicContact CB-CG2 3.25Å; A45-I112 HydrophobicContact CB-CD1 3.34Å; A45-H139 PolarHBondContact N-O 2.91Å; A45-V140 CarbonylContact O-C 3.57Å; A45-V140 VanDerWaalsContact O-CA 3.26Å; A45-V140 WeakPolarHBondContact O-CA 3.29Å; A45-H141 PolarHBondContact O-CE1 3.13Å; A45-H141 PolarHBondContact O-N 2.84Å; A45-H141 PolarHBondContact O-ND1 3.23Å; A45-H141 VanDerWaalsContact O-ND1 3.11Å
46	A	96.4	Very high	95.9	Very high	21 Å²	21	45.8 Å²	45.8	17%	0.174	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	146.4	170.8	0	0	0	0	0	109.5	G48 K49 H141 P143	A46-G48 PolarHBondContact O-N 3.21Å; A46-K49 HydrophobicContact CB-CG 4.12Å; A46-K49 VanDerWaalsContact O-CB 3.26Å; A46-K49 WeakPolarHBondContact O-CB 3.32Å; A46-K49 WeakPolarHBondContact O-CG 3.43Å; A46-K49 PolarHBondContact O-N 2.84Å; A46-K49 VanDerWaalsContact O-N 3.16Å; A46-H141 CarbonylContact C-O 3.54Å; A46-H141 WeakPolarHBondContact CA-O 3.38Å; A46-H141 PolarHBondContact N-CE1 2.57Å; A46-H141 VanDerWaalsContact N-CE1 3.31Å; A46-P143 HydrophobicContact CB-CG 4.48Å
47	E	97	Very high	95.8	Very high	69 Å²	69	48.5 Å²	48.5	32%	0.322	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	140.1	168.2	165.9	172.8	-113.7	0	0	110.7	I112 L114 V140 H141	E47-I112 CarbonylContact C-O 3.56Å; E47-I112 WeakPolarHBondContact CA-O 3.42Å; E47-L114 PolarHBondContact OE1-N 2.89Å; E47-V140 HydrophobicContact CB-CG1 4.08Å; E47-H141 PolarHBondContact N-O 3.22Å
48	G	96.5	Very high	95.5	Very high	35 Å²	35	47.8 Å²	47.8	36%	0.361	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.8	3	-173.9	0	0	0	0	0	115.1	A46 N111 I112	A46-G48 PolarHBondContact O-N 3.21Å; G48-N111 VanDerWaalsContact CA-OD1 3.3Å; G48-N111 WeakPolarHBondContact CA-OD1 3.36Å; G48-I112 PolarHBondContact N-O 2.83Å
49	K	96.9	Very high	94.8	Very high	129 Å²	129	50.3 Å²	50.3	56%	0.561	29%	0.294	S	S	*	.			trans	-102	164.8	176.9	-60.5	-58.4	-177.3	-173.8	0	112.3	A46 N111 I112	A46-K49 HydrophobicContact CB-CG 4.12Å; A46-K49 VanDerWaalsContact O-CB 3.26Å; A46-K49 WeakPolarHBondContact O-CB 3.32Å; A46-K49 WeakPolarHBondContact O-CG 3.43Å; A46-K49 PolarHBondContact O-N 2.84Å; A46-K49 VanDerWaalsContact O-N 3.16Å; K49-N111 PolarHBondContact O-N 3.39Å; K49-I112 VanDerWaalsContact O-CG1 3.32Å; K49-I112 WeakPolarHBondContact O-CG1 3.3Å; K49-I112 PolarHBondContact O-N 2.93Å
50	D	97.4	Very high	93.8	Very high	84 Å²	84	54.9 Å²	54.9	45%	0.449	32%	0.315	S	S	.	.			trans	-92.8	142.9	174.9	-59.7	-8.6	0	0	0	109.6	L108 F109 Q110 N111	D50-L108 HydrophobicContact CB-CD1 4.44Å; D50-F109 WeakPolarHBondContact CA-O 3.45Å; D50-Q110 VanDerWaalsContact OD1-CA 3.23Å; D50-Q110 WeakPolarHBondContact OD1-CA 3.41Å; D50-N111 PolarHBondContact OD1-N 2.83Å
51	V	97.7	Very high	93.4	Very high	2 Å²	2	58 Å²	58	1%	0.012	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	142.2	174.2	171.1	0	0	0	0	109.6	A40 A45 L53 F109 I112 L138	A40-V51 HydrophobicContact CB-CG1 4.45Å; A45-V51 HydrophobicContact CB-CG2 3.25Å; V51-L53 HydrophobicContact CG1-CD2 4.33Å; V51-F109 PolarHBondContact N-O 3.15Å; V51-F109 PolarHBondContact O-N 3Å; V51-I112 HydrophobicContact CG2-CD1 3.63Å; V51-L138 HydrophobicContact CB-CD1 4.07Å; V51-L138 HydrophobicContact CG1-CD1 3.7Å; V51-L138 HydrophobicContact CG2-CD1 3.95Å
52	L	98.3	Very high	93.3	Very high	45 Å²	45	55 Å²	55	24%	0.236	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	120.6	168.5	-171.3	72.6	0	0	0	109.3	L41 L54 Y102 L107 L108	L41-L52 HydrophobicContact CB-CB 4.43Å; L41-L52 PolarHBondContact N-O 3.04Å; L41-L52 PolarHBondContact O-N 2.73Å; L52-L54 HydrophobicContact CD2-CB 4.4Å; L52-L54 HydrophobicContact CD2-CD1 4.03Å; L52-L54 PolarHBondContact O-N 2.73Å; L52-Y102 HydrophobicContact CD1-CD2 4.04Å; L52-Y102 HydrophobicContact CD1-CE2 3.92Å; L52-L107 WeakPolarHBondContact CA-O 3.22Å; L52-L108 HydrophobicContact CD1-CB 4.41Å
53	L	98.1	Very high	93.3	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	93.3	162.6	-57	179	0	0	0	107.4	I38 E39 A40 V51 W67 S106 L107 Y120	I38-L53 HydrophobicContact CG2-CB 4.16Å; E39-L53 CarbonylContact O-C 3.21Å; A40-L53 HydrophobicContact CB-CD2 3.81Å; V51-L53 HydrophobicContact CG1-CD2 4.33Å; L53-W67 HydrophobicContact CB-CH2 3.6Å; L53-W67 HydrophobicContact CB-CZ2 4.04Å; L53-W67 HydrophobicContact CB-CZ3 4.21Å; L53-W67 HydrophobicContact CD1-CE3 4.29Å; L53-W67 HydrophobicContact CD1-CH2 4.02Å; L53-W67 HydrophobicContact CD1-CZ3 3.74Å; L53-W67 HydrophobicContact CG-CH2 4.47Å; L53-S106 VanDerWaalsContact O-CA 3.31Å; L53-S106 WeakPolarHBondContact O-CA 3.29Å; L53-S106 WeakPolarHBondContact O-CB 3.42Å; L53-L107 HydrophobicContact CB-CB 4.18Å; L53-L107 HydrophobicContact CD1-CD2 4.05Å; L53-L107 PolarHBondContact N-O 2.81Å; L53-L107 PolarHBondContact O-N 3.4Å; L53-Y120 HydrophobicContact CD1-CD1 3.97Å; L53-Y120 HydrophobicContact CD1-CD2 4.14Å; L53-Y120 HydrophobicContact CD1-CG 3.61Å
54	L	97.4	Very high	93.6	Very high	28 Å²	28	50.8 Å²	50.8	15%	0.147	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	130	-177.1	-175.7	68.4	0	0	0	109.9	I38 E39 L41 L52	I38-L54 CarbonylContact C-O 3.44Å; I38-L54 WeakPolarHBondContact CA-O 3.44Å; E39-L54 PolarHBondContact N-O 2.76Å; E39-L54 WeakPolarHBondContact O-CB 3.25Å; E39-L54 PolarHBondContact O-N 3.46Å; L41-L54 HydrophobicContact CD1-CB 4.07Å; L41-L54 HydrophobicContact CD1-CD2 4.19Å; L41-L54 HydrophobicContact CD2-CD2 4.41Å; L52-L54 HydrophobicContact CD2-CB 4.4Å; L52-L54 HydrophobicContact CD2-CD1 4.03Å; L52-L54 PolarHBondContact O-N 2.73Å
55	A	95.8	Very high	93.7	Very high	13 Å²	13	49 Å²	49	11%	0.107	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	116.8	178.9	0	0	0	0	0	109.6	F36 I38 I58 S106 L122	F36-A55 HydrophobicContact CE2-CB 3.69Å; F36-A55 HydrophobicContact CZ-CB 3.92Å; I38-A55 HydrophobicContact CD1-CB 3.84Å; A55-I58 HydrophobicContact CB-CD1 3.34Å; A55-I58 HydrophobicContact CB-CG1 4.27Å; A55-S106 PolarHBondContact N-OG 2.85Å; A55-S106 VanDerWaalsContact N-OG 3.11Å; A55-L122 HydrophobicContact CB-CD2 3.86Å
56	C	92.1	Very high	93.9	Very high	17 Å²	17	52 Å²	52	12%	0.115	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	143	-170.2	-70.1	0	0	0	0	111.8	F36 T37 I58	F36-C56 WeakPolarHBondContact CD2-O 3.39Å; T37-C56 PolarHBondContact N-O 3.4Å; T37-C56 PolarHBondContact O-N 2.98Å; C56-I58 VanDerWaalsContact C-N 3.33Å; C56-I58 PolarHBondContact O-N 3.13Å
57	N	90.5	Very high	94	Very high	86 Å²	86	51 Å²	51	46%	0.46	27%	0.27	S	S	.	.	S	Bend	trans	61.5	36.5	179.6	-47	-44.9	0	0	0	113.8	V34	V34-N57 HydrophobicContact CG1-CB 3.76Å
58	I	88.3	Confident	94.1	Very high	37 Å²	37	48.8 Å²	48.8	19%	0.19	26%	0.26	C	S	.	.			trans	-77.2	139	171.5	-60.7	167.5	0	0	0	109.5	F36 A55 C56 I62 Y65 N104 L122	F36-I58 HydrophobicContact CD2-CB 4.32Å; F36-I58 HydrophobicContact CD2-CD1 4.2Å; F36-I58 HydrophobicContact CD2-CG1 3.22Å; F36-I58 HydrophobicContact CE2-CD1 3.64Å; F36-I58 HydrophobicContact CE2-CG1 3.17Å; F36-I58 HydrophobicContact CG-CG1 4.16Å; F36-I58 HydrophobicContact CZ-CD1 4.15Å; F36-I58 HydrophobicContact CZ-CG1 3.99Å; A55-I58 HydrophobicContact CB-CD1 3.34Å; A55-I58 HydrophobicContact CB-CG1 4.27Å; C56-I58 VanDerWaalsContact C-N 3.33Å; C56-I58 PolarHBondContact O-N 3.13Å; I58-I62 HydrophobicContact CG2-CD1 4.26Å; I58-I62 HydrophobicContact CG2-CG1 3.45Å; I58-I62 VanDerWaalsContact CG2-CG1 3.45Å; I58-Y65 HydrophobicContact CD1-CE1 3.92Å; I58-Y65 HydrophobicContact CG2-CE1 4.13Å; I58-N104 VanDerWaalsContact CD1-O 3.25Å; I58-N104 WeakPolarHBondContact CD1-O 3.4Å; I58-L122 HydrophobicContact CD1-CD2 4.36Å
59	S	81.1	Confident	94.1	Very high	72 Å²	72	50.8 Å²	50.8	50%	0.503	26%	0.258	S	S	.	.			trans	-61.7	147.5	171	-177.3	0	0	0	0	111.7	T61 I62	S59-T61 PolarHBondContact O-N 2.97Å; S59-T61 VanDerWaalsContact O-N 3.15Å; S59-T61 PolarHBondContact OG-OG1 3.36Å; S59-I62 WeakPolarHBondContact O-CG1 3.48Å
60	E	75.3	Confident	94.1	Very high	199 Å²	199	45.4 Å²	45.4	93%	0.93	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-10.9	-177.8	-63.3	-174.5	171.3	0	0	113.8
61	T	87.9	Confident	94.1	Very high	82 Å²	82	48.7 Å²	48.7	50%	0.503	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	40.2	-171.6	62.5	0	0	0	0	114	S59 N126 A127	S59-T61 PolarHBondContact O-N 2.97Å; S59-T61 VanDerWaalsContact O-N 3.15Å; S59-T61 PolarHBondContact OG-OG1 3.36Å; T61-N126 WeakPolarHBondContact O-CA 3.36Å; T61-A127 PolarHBondContact O-N 3.15Å
62	I	95.4	Very high	94.1	Very high	16 Å²	16	51.7 Å²	51.7	8%	0.082	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	131.3	177.8	-59.1	-50.7	0	0	0	111.4	I58 S59 A64 Y65 T84 I125 N126	I58-I62 HydrophobicContact CG2-CD1 4.26Å; I58-I62 HydrophobicContact CG2-CG1 3.45Å; I58-I62 VanDerWaalsContact CG2-CG1 3.45Å; S59-I62 WeakPolarHBondContact O-CG1 3.48Å; I62-A64 WeakPolarHBondContact CG2-O 3.23Å; I62-Y65 HydrophobicContact CB-CE1 4.04Å; I62-Y65 HydrophobicContact CG1-CE1 4.18Å; I62-Y65 HydrophobicContact CG2-CD1 3.93Å; I62-Y65 HydrophobicContact CG2-CD2 4.41Å; I62-Y65 HydrophobicContact CG2-CE1 3.52Å; I62-Y65 HydrophobicContact CG2-CE2 4.05Å; I62-Y65 HydrophobicContact CG2-CG 4.35Å; I62-T84 WeakPolarHBondContact O-CG2 3.38Å; I62-T84 PolarHBondContact O-OG1 3.49Å; I62-I125 WeakPolarHBondContact CG2-O 3.46Å; I62-N126 HydrophobicContact CD1-CB 4.19Å
63	Q	96.3	Very high	93.9	Very high	69 Å²	69	50 Å²	50	32%	0.322	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	-32.3	174.4	-71.3	-171.9	-11.9	0	0	112.7	T84 I125 A127	Q63-T84 VanDerWaalsContact CA-OG1 3.3Å; Q63-T84 WeakPolarHBondContact CA-OG1 3.34Å; Q63-T84 PolarHBondContact O-N 3.43Å; Q63-T84 PolarHBondContact O-OG1 2.85Å; Q63-I125 PolarHBondContact N-O 3.1Å; Q63-A127 HydrophobicContact CG-CB 4.44Å
64	A	97	Very high	93.8	Very high	5 Å²	5	58.4 Å²	58.4	4%	0.041	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	146.9	-179.5	0	0	0	0	0	113.4	I62 Y66 Y82 I83 T124 I125	I62-A64 WeakPolarHBondContact CG2-O 3.23Å; A64-Y66 HydrophobicContact CB-CD2 4.32Å; A64-Y66 HydrophobicContact CB-CE2 3.48Å; A64-Y66 VanDerWaalsContact CB-CE2 3.48Å; A64-Y82 CarbonylContact C-O 3.49Å; A64-Y82 VanDerWaalsContact CA-O 3.25Å; A64-Y82 WeakPolarHBondContact CA-O 3.23Å; A64-I83 HydrophobicContact CB-CD1 3.88Å; A64-T124 WeakPolarHBondContact O-CA 3.42Å; A64-I125 HydrophobicContact CB-CB 4.34Å; A64-I125 PolarHBondContact N-O 2.84Å; A64-I125 PolarHBondContact O-N 2.62Å
65	Y	98	Very high	93.6	Very high	16 Å²	16	61.2 Å²	61.2	6%	0.063	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	138.4	171.7	-58.9	-75.1	0	0	0	109.2	I58 I62 G81 Y82 T84 P103 G105 L122 R123 T124	I58-Y65 HydrophobicContact CD1-CE1 3.92Å; I58-Y65 HydrophobicContact CG2-CE1 4.13Å; I62-Y65 HydrophobicContact CB-CE1 4.04Å; I62-Y65 HydrophobicContact CG1-CE1 4.18Å; I62-Y65 HydrophobicContact CG2-CD1 3.93Å; I62-Y65 HydrophobicContact CG2-CD2 4.41Å; I62-Y65 HydrophobicContact CG2-CE1 3.52Å; I62-Y65 HydrophobicContact CG2-CE2 4.05Å; I62-Y65 HydrophobicContact CG2-CG 4.35Å; Y65-G81 CarbonylContact O-C 3.6Å; Y65-G81 WeakPolarHBondContact O-CA 3.41Å; Y65-Y82 AromaticContact CD2-CD1 3.88Å; Y65-Y82 HydrophobicContact CD2-CD1 3.88Å; Y65-Y82 HydrophobicContact CD2-CG 4.47Å; Y65-Y82 HydrophobicContact CE2-CD1 4.38Å; Y65-Y82 PolarHBondContact N-O 3.37Å; Y65-Y82 PolarHBondContact O-N 2.86Å; Y65-T84 HydrophobicContact CD2-CG2 4.24Å; Y65-T84 HydrophobicContact CE2-CG2 3.77Å; Y65-P103 WeakPolarHBondContact CE2-O 3.17Å; Y65-G105 VanDerWaalsContact CD1-CA 3.48Å; Y65-L122 HydrophobicContact CD1-CD1 4.17Å; Y65-L122 HydrophobicContact CD1-CD2 4.1Å; Y65-R123 CarbonylContact C-O 3.54Å; Y65-T124 HydrophobicContact CD1-CG2 3.89Å; Y65-T124 HydrophobicContact CE1-CG2 4.11Å
66	Y	98.3	Very high	93.7	Very high	67 Å²	67	61.7 Å²	61.7	26%	0.263	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	113.9	176.3	-61.9	-78.6	0	0	0	110.2	A64 H68 L78 I83 R123 I125	A64-Y66 HydrophobicContact CB-CD2 4.32Å; A64-Y66 HydrophobicContact CB-CE2 3.48Å; A64-Y66 VanDerWaalsContact CB-CE2 3.48Å; Y66-H68 PolarHBondContact O-CD2 3.06Å; Y66-L78 HydrophobicContact CD1-CD1 3.99Å; Y66-L78 HydrophobicContact CG-CD1 4.41Å; Y66-I83 HydrophobicContact CE1-CD1 4.4Å; Y66-I83 WeakPolarHBondContact OH-CD1 3.32Å; Y66-R123 PolarHBondContact N-O 2.9Å; Y66-R123 PolarHBondContact O-N 3.24Å; Y66-I125 HydrophobicContact CD2-CG1 4.18Å; Y66-I125 HydrophobicContact CE2-CG1 3.78Å
67	W	98.6	Very high	93.9	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	128.7	177	-83.8	98.8	0	0	0	111	I38 L53 L78 I79 A80 G105 L107 L122	I38-W67 HydrophobicContact CB-CH2 4.49Å; I38-W67 HydrophobicContact CD1-CH2 3.47Å; I38-W67 VanDerWaalsContact CD1-CH2 3.47Å; I38-W67 HydrophobicContact CD1-CZ2 3.84Å; I38-W67 HydrophobicContact CD1-CZ3 4.45Å; I38-W67 HydrophobicContact CG1-CH2 3.84Å; I38-W67 HydrophobicContact CG1-CZ3 4.45Å; I38-W67 HydrophobicContact CG2-CH2 3.79Å; I38-W67 HydrophobicContact CG2-CZ3 4.43Å; L53-W67 HydrophobicContact CB-CH2 3.6Å; L53-W67 HydrophobicContact CB-CZ2 4.04Å; L53-W67 HydrophobicContact CB-CZ3 4.21Å; L53-W67 HydrophobicContact CD1-CE3 4.29Å; L53-W67 HydrophobicContact CD1-CH2 4.02Å; L53-W67 HydrophobicContact CD1-CZ3 3.74Å; L53-W67 HydrophobicContact CG-CH2 4.47Å; W67-L78 WeakPolarHBondContact O-CD1 3.45Å; W67-I79 HydrophobicContact CB-CB 4.33Å; W67-I79 WeakPolarHBondContact O-CB 3.4Å; W67-I79 PolarHBondContact O-N 2.97Å; W67-A80 PolarHBondContact N-O 2.98Å; W67-G105 PolarHBondContact NE1-O 3.33Å; W67-L107 HydrophobicContact CB-CD1 4.35Å; W67-L107 HydrophobicContact CB-CD2 4.36Å; W67-L107 HydrophobicContact CD2-CB 3.92Å; W67-L107 HydrophobicContact CD2-CD2 4.12Å; W67-L107 HydrophobicContact CD2-CG 4.48Å; W67-L107 HydrophobicContact CE3-CD2 4.36Å; W67-L107 HydrophobicContact CG-CB 4.13Å; W67-L107 HydrophobicContact CG-CD1 4.06Å; W67-L107 HydrophobicContact CG-CD2 4.14Å; W67-L107 HydrophobicContact CG-CG 4.37Å; W67-L107 HydrophobicContact CZ2-CB 3.97Å; W67-L122 HydrophobicContact CD2-CB 3.99Å; W67-L122 HydrophobicContact CD2-CD1 4.25Å; W67-L122 HydrophobicContact CE3-CB 4.05Å; W67-L122 HydrophobicContact CG-CD1 4.23Å; W67-L122 HydrophobicContact CH2-CB 3.86Å; W67-L122 HydrophobicContact CZ2-CB 3.76Å; W67-L122 HydrophobicContact CZ2-CD2 3.99Å; W67-L122 HydrophobicContact CZ2-CG 4.3Å; W67-L122 HydrophobicContact CZ3-CB 3.98Å
68	H	98.6	Very high	94.3	Very high	23 Å²	23	62 Å²	62	11%	0.106	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	142.2	179	-64.4	-104.9	0	0	0	110.9	Y66 G70 A73 S76 P77 Y120 T121	Y66-H68 PolarHBondContact O-CD2 3.06Å; H68-G70 PolarHBondContact O-N 3.3Å; H68-A73 PolarHBondContact CE1-O 3.26Å; H68-A73 PolarHBondContact ND1-O 3.19Å; H68-S76 PolarHBondContact ND1-O 2.8Å; H68-P77 WeakPolarHBondContact CA-O 3.41Å; H68-Y120 WeakPolarHBondContact O-CA 3.23Å; H68-T121 PolarHBondContact N-O 3.42Å; H68-T121 PolarHBondContact O-N 3.22Å
69	K	97.8	Very high	94.8	Very high	76 Å²	76	60.3 Å²	60.3	33%	0.33	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	89.3	172	-167.5	171.1	-178.3	173.2	0	109	P77 I79 E115 D116 Y120	K69-P77 HydrophobicContact CB-CG 4.32Å; K69-P77 PolarHBondContact N-O 2.77Å; K69-I79 HydrophobicContact CB-CD1 3.92Å; K69-I79 HydrophobicContact CB-CG1 3.98Å; K69-E115 PolarHBondContact NZ-O 2.76Å; K69-D116 IonicContact NZ-OD1 3.69Å; K69-Y120 HydrophobicContact CB-CE1 4.43Å; K69-Y120 HydrophobicContact CG-CE1 4.06Å
70	G	97.3	Very high	95.6	Very high	16 Å²	16	56.9 Å²	56.9	17%	0.165	31%	0.31	C	S	.	.	S	Bend	trans	163.6	-178.4	178.2	0	0	0	0	0	114.1	H68 S76 S119 Y120 T121	H68-G70 PolarHBondContact O-N 3.3Å; G70-S76 WeakPolarHBondContact CA-OG 3.43Å; G70-S119 CarbonylContact C-O 3.59Å; G70-S119 VanDerWaalsContact CA-O 3.3Å; G70-S119 WeakPolarHBondContact CA-O 3.32Å; G70-S119 PolarHBondContact N-O 2.79Å; G70-S119 CarbonylContact O-C 3.55Å; G70-Y120 CarbonylContact O-C 3.38Å; G70-T121 PolarHBondContact O-N 3.49Å; G70-T121 PolarHBondContact O-OG1 3.24Å
71	K	96.6	Very high	96.7	Very high	153 Å²	153	47.4 Å²	47.4	67%	0.665	27%	0.265	S	S	*	.	S	Bend	trans	-79.2	-17.3	-177.9	-69.7	-179.5	-180	178.3	0	114.3	S119 T121 T135	K71-S119 WeakPolarHBondContact CG-OG 3.44Å; K71-T121 PolarHBondContact O-OG1 3.45Å; K71-T135 PolarHBondContact O-OG1 3.14Å; K71-T135 VanDerWaalsContact O-OG1 3.1Å
72	T	96.6	Very high	97.2	Very high	66 Å²	66	44.1 Å²	44.1	41%	0.405	24%	0.244	S	C	.	.	S	Bend	trans	-141.1	150.9	-178.5	51.4	0	0	0	0	108.7	E74 S76 T121	T72-E74 VanDerWaalsContact C-N 3.34Å; T72-E74 PolarHBondContact OG1-O 3.27Å; T72-S76 WeakPolarHBondContact O-CB 3.4Å; T72-S76 PolarHBondContact O-OG 3.3Å; T72-T121 PolarHBondContact N-OG1 2.99Å
73	A	95.8	Very high	97.3	Very high	10 Å²	10	44.8 Å²	44.8	8%	0.083	25%	0.247	C	C	.	.	S	Bend	trans	-67.6	-39	173.8	0	0	0	0	0	111.5	H68 G75 S76 T121 R123	H68-A73 PolarHBondContact CE1-O 3.26Å; H68-A73 PolarHBondContact ND1-O 3.19Å; A73-G75 PolarHBondContact O-N 3.07Å; A73-S76 PolarHBondContact O-N 2.99Å; A73-T121 HydrophobicContact CB-CG2 4.34Å; A73-R123 HydrophobicContact CB-CB 3.94Å; A73-R123 HydrophobicContact CB-CG 4.39Å
74	E	94.5	Very high	97.3	Very high	175 Å²	175	43.5 Å²	43.5	82%	0.818	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.7	130.2	176.8	-167.4	166.6	-165.7	0	0	111.2	T72 S76	T72-E74 VanDerWaalsContact C-N 3.34Å; T72-E74 PolarHBondContact OG1-O 3.27Å; E74-S76 PolarHBondContact O-N 3.04Å
75	G	93.8	Very high	97.2	Very high	87 Å²	87	49.3 Å²	49.3	90%	0.897	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	-11.7	-178.9	0	0	0	0	0	115.6	A73	A73-G75 PolarHBondContact O-N 3.07Å
76	S	97.5	Very high	97	Very high	23 Å²	23	54 Å²	54	16%	0.161	30%	0.3	C	S	.	.	S	Bend	trans	-93.1	138.9	178.7	-59.5	0	0	0	0	111.4	H68 G70 T72 A73 E74 L78	H68-S76 PolarHBondContact ND1-O 2.8Å; G70-S76 WeakPolarHBondContact CA-OG 3.43Å; T72-S76 WeakPolarHBondContact O-CB 3.4Å; T72-S76 PolarHBondContact O-OG 3.3Å; A73-S76 PolarHBondContact O-N 2.99Å; E74-S76 PolarHBondContact O-N 3.04Å; S76-L78 PolarHBondContact O-N 3.45Å
77	P	97.8	Very high	96.9	Very high	64 Å²	64	57.9 Å²	57.9	42%	0.416	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-64.3	137	-179.5	28.6	-36.4	0	0	0	111.4	H68 K69 A94	H68-P77 WeakPolarHBondContact CA-O 3.41Å; K69-P77 HydrophobicContact CB-CG 4.32Å; K69-P77 PolarHBondContact N-O 2.77Å; P77-A94 HydrophobicContact CB-CB 3.88Å; P77-A94 HydrophobicContact CG-CB 4.1Å
78	L	98.4	Very high	96.8	Very high	45 Å²	45	59.5 Å²	59.5	24%	0.236	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	130.2	175.5	-177.4	73.6	0	0	0	109.7	Y66 W67 S76 G92 A93 A94	Y66-L78 HydrophobicContact CD1-CD1 3.99Å; Y66-L78 HydrophobicContact CG-CD1 4.41Å; W67-L78 WeakPolarHBondContact O-CD1 3.45Å; S76-L78 PolarHBondContact O-N 3.45Å; L78-G92 CarbonylContact O-C 3.59Å; L78-G92 VanDerWaalsContact O-CA 3.29Å; L78-G92 WeakPolarHBondContact O-CA 3.25Å; L78-A93 PolarHBondContact O-N 2.86Å; L78-A94 PolarHBondContact O-N 2.88Å
79	I	98.6	Very high	96.8	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.01	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-60.2	171.5	-60.5	167.7	0	0	0	108.7	W67 K69 G92 A94 Y95 E99 L107 Y120	W67-I79 HydrophobicContact CB-CB 4.33Å; W67-I79 WeakPolarHBondContact O-CB 3.4Å; W67-I79 PolarHBondContact O-N 2.97Å; K69-I79 HydrophobicContact CB-CD1 3.92Å; K69-I79 HydrophobicContact CB-CG1 3.98Å; I79-G92 PolarHBondContact O-N 3Å; I79-A94 HydrophobicContact CG1-CB 4.16Å; I79-Y95 WeakPolarHBondContact O-CB 3.36Å; I79-E99 HydrophobicContact CG2-CB 3.74Å; I79-E99 HydrophobicContact CG2-CG 3.56Å; I79-L107 HydrophobicContact CD1-CD2 4.41Å; I79-Y120 HydrophobicContact CD1-CD1 3.45Å; I79-Y120 VanDerWaalsContact CD1-CD1 3.45Å; I79-Y120 HydrophobicContact CD1-CE1 3.51Å
80	A	98.4	Very high	96.7	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.008	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158	144.7	-179.5	0	0	0	0	0	110.6	W67 I90 V101	W67-A80 PolarHBondContact N-O 2.98Å; A80-I90 CarbonylContact C-O 3.17Å; A80-I90 VanDerWaalsContact CA-O 3.29Å; A80-I90 WeakPolarHBondContact CA-O 3.42Å; A80-V101 HydrophobicContact CB-CG2 3.66Å
81	G	98.1	Very high	96.8	Very high	0 Å²	0	65 Å²	65	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	154.4	165.4	0	0	0	0	0	111.2	Y65 N89 I90	Y65-G81 CarbonylContact O-C 3.6Å; Y65-G81 WeakPolarHBondContact O-CA 3.41Å; G81-N89 CarbonylContact O-C 3.4Å; G81-N89 VanDerWaalsContact O-CA 3.28Å; G81-N89 WeakPolarHBondContact O-CA 3.49Å; G81-I90 PolarHBondContact N-O 3.36Å; G81-I90 PolarHBondContact O-N 3.11Å
82	Y	98.4	Very high	96.8	Very high	12 Å²	12	58.5 Å²	58.5	5%	0.047	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	123.5	167	-177.1	-88.2	0	0	0	108.9	A64 Y65 T84 Q87 A88 N89 V101 P103	A64-Y82 CarbonylContact C-O 3.49Å; A64-Y82 VanDerWaalsContact CA-O 3.25Å; A64-Y82 WeakPolarHBondContact CA-O 3.23Å; Y65-Y82 AromaticContact CD2-CD1 3.88Å; Y65-Y82 HydrophobicContact CD2-CD1 3.88Å; Y65-Y82 HydrophobicContact CD2-CG 4.47Å; Y65-Y82 HydrophobicContact CE2-CD1 4.38Å; Y65-Y82 PolarHBondContact N-O 3.37Å; Y65-Y82 PolarHBondContact O-N 2.86Å; Y82-T84 HydrophobicContact CD1-CG2 4.04Å; Y82-T84 HydrophobicContact CE1-CG2 4Å; Y82-Q87 WeakPolarHBondContact OH-CA 3.5Å; Y82-Q87 WeakPolarHBondContact OH-CB 3.19Å; Y82-A88 WeakPolarHBondContact CA-O 3.49Å; Y82-N89 WeakPolarHBondContact CD2-ND2 3.42Å; Y82-V101 HydrophobicContact CG-CG1 4.36Å; Y82-P103 HydrophobicContact CE1-CB 4.23Å; Y82-P103 WeakPolarHBondContact OH-CG 3.3Å
83	I	97.4	Very high	96.9	Very high	30 Å²	30	60.2 Å²	60.2	15%	0.154	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	123.7	176.8	-40.6	-60.3	0	0	0	108.4	A64 Y66 D85 I86 Q87 A88 I90	A64-I83 HydrophobicContact CB-CD1 3.88Å; Y66-I83 HydrophobicContact CE1-CD1 4.4Å; Y66-I83 WeakPolarHBondContact OH-CD1 3.32Å; I83-D85 WeakPolarHBondContact CG2-OD1 3.28Å; I83-I86 HydrophobicContact CB-CD1 4.38Å; I83-I86 HydrophobicContact CB-CG1 3.95Å; I83-I86 HydrophobicContact CG2-CG1 4.4Å; I83-Q87 WeakPolarHBondContact O-CA 3.45Å; I83-Q87 PolarHBondContact O-N 2.85Å; I83-A88 PolarHBondContact N-O 2.99Å; I83-A88 PolarHBondContact O-N 2.79Å; I83-I90 HydrophobicContact CD1-CD1 3.92Å; I83-I90 HydrophobicContact CG1-CD1 3.55Å; I83-I90 HydrophobicContact CG1-CG1 4.35Å
84	T	95.8	Very high	96.9	Very high	43 Å²	43	61 Å²	61	26%	0.264	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-28.3	-169.3	60.1	0	0	0	0	113.3	I62 Q63 Y65 Y82	I62-T84 WeakPolarHBondContact O-CG2 3.38Å; I62-T84 PolarHBondContact O-OG1 3.49Å; Q63-T84 VanDerWaalsContact CA-OG1 3.3Å; Q63-T84 WeakPolarHBondContact CA-OG1 3.34Å; Q63-T84 PolarHBondContact O-N 3.43Å; Q63-T84 PolarHBondContact O-OG1 2.85Å; Y65-T84 HydrophobicContact CD2-CG2 4.24Å; Y65-T84 HydrophobicContact CE2-CG2 3.77Å; Y82-T84 HydrophobicContact CD1-CG2 4.04Å; Y82-T84 HydrophobicContact CE1-CG2 4Å
85	D	94.4	Very high	97.1	Very high	127 Å²	127	57.5 Å²	57.5	68%	0.679	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-44.6	-179.1	68.2	-20	0	0	0	112.9	I83	I83-D85 WeakPolarHBondContact CG2-OD1 3.28Å
86	I	95.4	Very high	97.3	Very high	114 Å²	114	56.1 Å²	56.1	59%	0.585	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-2.1	-179.8	61.9	169.4	0	0	0	112.7	I83 A88	I83-I86 HydrophobicContact CB-CD1 4.38Å; I83-I86 HydrophobicContact CB-CG1 3.95Å; I83-I86 HydrophobicContact CG2-CG1 4.4Å; I86-A88 VanDerWaalsContact C-N 3.26Å; I86-A88 HydrophobicContact CD1-CB 3.69Å; I86-A88 HydrophobicContact CG1-CB 3.75Å; I86-A88 PolarHBondContact O-N 3.03Å
87	Q	96	Very high	97.3	Very high	149 Å²	149	57.3 Å²	57.3	70%	0.696	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	43.6	179.5	-58.2	-177.5	1.6	0	0	113.2	Y82 I83	Y82-Q87 WeakPolarHBondContact OH-CA 3.5Å; Y82-Q87 WeakPolarHBondContact OH-CB 3.19Å; I83-Q87 WeakPolarHBondContact O-CA 3.45Å; I83-Q87 PolarHBondContact O-N 2.85Å
88	A	95.9	Very high	97.3	Very high	33 Å²	33	56.7 Å²	56.7	27%	0.273	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	138.9	-172.2	0	0	0	0	0	112	Y82 I83 I86	Y82-A88 WeakPolarHBondContact CA-O 3.49Å; I83-A88 PolarHBondContact N-O 2.99Å; I83-A88 PolarHBondContact O-N 2.79Å; I86-A88 VanDerWaalsContact C-N 3.26Å; I86-A88 HydrophobicContact CD1-CB 3.69Å; I86-A88 HydrophobicContact CG1-CB 3.75Å; I86-A88 PolarHBondContact O-N 3.03Å
89	N	97.4	Very high	97.3	Very high	70 Å²	70	54.9 Å²	54.9	37%	0.374	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	133.6	167.1	-86.6	-93.5	0	0	0	109.8	G81 Y82 V101	G81-N89 CarbonylContact O-C 3.4Å; G81-N89 VanDerWaalsContact O-CA 3.28Å; G81-N89 WeakPolarHBondContact O-CA 3.49Å; Y82-N89 WeakPolarHBondContact CD2-ND2 3.42Å; N89-V101 PolarHBondContact ND2-O 3.11Å; N89-V101 WeakPolarHBondContact OD1-CA 3.36Å; N89-V101 WeakPolarHBondContact OD1-CB 3.36Å; N89-V101 WeakPolarHBondContact OD1-CG2 3.5Å; N89-V101 PolarHBondContact OD1-N 3.31Å; N89-V101 PolarHBondContact OD1-O 3Å
90	I	97.3	Very high	97.2	Very high	77 Å²	77	57.2 Å²	57.2	40%	0.395	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	112.5	176.4	-55.9	178.1	0	0	0	107.8	A80 G81 I83	A80-I90 CarbonylContact C-O 3.17Å; A80-I90 VanDerWaalsContact CA-O 3.29Å; A80-I90 WeakPolarHBondContact CA-O 3.42Å; G81-I90 PolarHBondContact N-O 3.36Å; G81-I90 PolarHBondContact O-N 3.11Å; I83-I90 HydrophobicContact CD1-CD1 3.92Å; I83-I90 HydrophobicContact CG1-CD1 3.55Å; I83-I90 HydrophobicContact CG1-CG1 4.35Å
91	P	97.9	Very high	97.2	Very high	83 Å²	83	57.3 Å²	57.3	54%	0.539	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	140.6	179.6	28.5	-34.1	0	0	0	111.2	Y95	P91-Y95 HydrophobicContact CB-CD1 3.48Å; P91-Y95 VanDerWaalsContact CB-CD1 3.48Å; P91-Y95 HydrophobicContact CB-CD2 4.2Å; P91-Y95 HydrophobicContact CB-CE1 4.01Å; P91-Y95 HydrophobicContact CB-CG 3.59Å
92	G	97.8	Very high	97.2	Very high	18 Å²	18	62 Å²	62	19%	0.186	36%	0.357	C	S	.	.			trans	-103.9	-175.4	175.3	0	0	0	0	0	113.4	L78 I79 A94 Y95	L78-G92 CarbonylContact O-C 3.59Å; L78-G92 VanDerWaalsContact O-CA 3.29Å; L78-G92 WeakPolarHBondContact O-CA 3.25Å; I79-G92 PolarHBondContact O-N 3Å; G92-A94 VanDerWaalsContact C-N 3.27Å; G92-A94 PolarHBondContact O-N 2.57Å; G92-Y95 WeakPolarHBondContact O-CB 3.31Å; G92-Y95 PolarHBondContact O-N 3.48Å; G92-Y95 VanDerWaalsContact O-N 3.11Å
93	A	97.8	Very high	97	Very high	101 Å²	101	65.3 Å²	65.3	84%	0.835	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-25.6	-178.2	0	0	0	0	0	114.3	L78	L78-A93 PolarHBondContact O-N 2.86Å
94	A	97.4	Very high	96.9	Very high	28 Å²	28	67.4 Å²	67.4	23%	0.231	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	10	175.4	0	0	0	0	0	113.1	P77 L78 I79 G92 S96	P77-A94 HydrophobicContact CB-CB 3.88Å; P77-A94 HydrophobicContact CG-CB 4.1Å; L78-A94 PolarHBondContact O-N 2.88Å; I79-A94 HydrophobicContact CG1-CB 4.16Å; G92-A94 VanDerWaalsContact C-N 3.27Å; G92-A94 PolarHBondContact O-N 2.57Å; A94-S96 PolarHBondContact O-N 2.86Å
95	Y	97.9	Very high	96.8	Very high	100 Å²	100	65.3 Å²	65.3	39%	0.392	38%	0.379	S	S	.	.			trans	-66.1	124.5	175.9	-170.7	-116.3	0	0	0	110.7	I79 P91 G92 G97 E99	I79-Y95 WeakPolarHBondContact O-CB 3.36Å; P91-Y95 HydrophobicContact CB-CD1 3.48Å; P91-Y95 VanDerWaalsContact CB-CD1 3.48Å; P91-Y95 HydrophobicContact CB-CD2 4.2Å; P91-Y95 HydrophobicContact CB-CE1 4.01Å; P91-Y95 HydrophobicContact CB-CG 3.59Å; G92-Y95 WeakPolarHBondContact O-CB 3.31Å; G92-Y95 PolarHBondContact O-N 3.48Å; G92-Y95 VanDerWaalsContact O-N 3.11Å; Y95-G97 VanDerWaalsContact CE1-CA 3.5Å; Y95-E99 HydrophobicContact CD2-CB 4.31Å; Y95-E99 WeakPolarHBondContact CD2-OE2 3.28Å; Y95-E99 HydrophobicContact CE2-CB 4.14Å; Y95-E99 VanDerWaalsContact CE2-O 3.29Å; Y95-E99 WeakPolarHBondContact CE2-O 2.91Å; Y95-E99 PolarHBondContact OH-O 3.01Å
96	S	97.2	Very high	97	Very high	58 Å²	58	59.3 Å²	59.3	41%	0.406	35%	0.346	S	S	.	.			trans	-105.7	0.3	178.2	72.8	0	0	0	0	113.4	A94 R98 E99	A94-S96 PolarHBondContact O-N 2.86Å; S96-R98 PolarHBondContact OG-NE 3.21Å; S96-R98 PolarHBondContact OG-NH2 3.38Å; S96-E99 WeakPolarHBondContact CB-OE1 3.36Å; S96-E99 PolarHBondContact N-OE1 3.19Å; S96-E99 PolarHBondContact N-OE2 2.87Å; S96-E99 PolarHBondContact OG-OE1 3.36Å; S96-E99 PolarHBondContact OG-OE2 3.4Å; S96-E99 VanDerWaalsContact OG-OE2 3.13Å
97	G	97.5	Very high	97.1	Very high	48 Å²	48	53.9 Å²	53.9	50%	0.495	32%	0.318	S	S	.	.	S	Bend	trans	82.9	1.1	-174.9	0	0	0	0	0	113.7	Y95 E99	Y95-G97 VanDerWaalsContact CE1-CA 3.5Å; G97-E99 PolarHBondContact N-OE2 3.39Å
98	R	97.9	Very high	97.3	Very high	52 Å²	52	48 Å²	48	20%	0.196	29%	0.292	C	S	.	.			trans	-104.4	-7.8	-179.1	-63.3	178.4	-65.7	154.2	4	112.6	S96 F109 Q110 N111 D116	S96-R98 PolarHBondContact OG-NE 3.21Å; S96-R98 PolarHBondContact OG-NH2 3.38Å; R98-F109 HydrophobicContact CB-CD2 4.18Å; R98-F109 HydrophobicContact CB-CE2 4.01Å; R98-Q110 WeakPolarHBondContact CB-O 3.33Å; R98-Q110 PolarHBondContact O-N 2.89Å; R98-N111 PolarHBondContact NH1-O 3.24Å; R98-D116 IonicContact CZ-OD1 3.98Å; R98-D116 IonicContact CZ-OD2 3.32Å; R98-D116 VanDerWaalsContact CZ-OD2 3.32Å; R98-D116 IonicContact NH1-OD2 2.73Å; R98-D116 PolarHBondContact NH1-OD2 3.26Å; R98-D116 IonicContact NH2-OD1 2.98Å; R98-D116 PolarHBondContact NH2-OD1 3.01Å; R98-D116 IonicContact NH2-OD2 3.04Å; R98-D116 PolarHBondContact NH2-OD2 3.35Å
99	E	98.3	Very high	97.3	Very high	6 Å²	6	46.6 Å²	46.6	3%	0.028	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	142.3	-174.4	-52.7	88.4	171	0	0	111	I79 Y95 S96 G97 L107 L108 F109	I79-E99 HydrophobicContact CG2-CB 3.74Å; I79-E99 HydrophobicContact CG2-CG 3.56Å; Y95-E99 HydrophobicContact CD2-CB 4.31Å; Y95-E99 WeakPolarHBondContact CD2-OE2 3.28Å; Y95-E99 HydrophobicContact CE2-CB 4.14Å; Y95-E99 VanDerWaalsContact CE2-O 3.29Å; Y95-E99 WeakPolarHBondContact CE2-O 2.91Å; Y95-E99 PolarHBondContact OH-O 3.01Å; S96-E99 WeakPolarHBondContact CB-OE1 3.36Å; S96-E99 PolarHBondContact N-OE1 3.19Å; S96-E99 PolarHBondContact N-OE2 2.87Å; S96-E99 PolarHBondContact OG-OE1 3.36Å; S96-E99 PolarHBondContact OG-OE2 3.4Å; S96-E99 VanDerWaalsContact OG-OE2 3.13Å; G97-E99 PolarHBondContact N-OE2 3.39Å; E99-L107 HydrophobicContact CB-CD1 4.13Å; E99-L108 CarbonylContact C-O 3.52Å; E99-L108 VanDerWaalsContact CA-O 3.32Å; E99-L108 WeakPolarHBondContact CA-O 3.42Å; E99-F109 HydrophobicContact CG-CD1 4.5Å; E99-F109 HydrophobicContact CG-CD2 4Å; E99-F109 HydrophobicContact CG-CE1 4.44Å; E99-F109 HydrophobicContact CG-CE2 3.94Å; E99-F109 HydrophobicContact CG-CG 4.27Å; E99-F109 HydrophobicContact CG-CZ 4.16Å; E99-F109 WeakPolarHBondContact OE1-CZ 3.37Å
100	T	97.9	Very high	97.4	Very high	52 Å²	52	47.1 Å²	47.1	32%	0.319	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	124.1	174.7	-62.4	0	0	0	0	109.2	L108	T100-L108 PolarHBondContact N-O 2.8Å; T100-L108 PolarHBondContact O-N 2.83Å
101	V	98.3	Very high	97.4	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.012	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	128.9	175.1	-169.9	0	0	0	0	108.7	A80 Y82 N89 L107	A80-V101 HydrophobicContact CB-CG2 3.66Å; Y82-V101 HydrophobicContact CG-CG1 4.36Å; N89-V101 PolarHBondContact ND2-O 3.11Å; N89-V101 WeakPolarHBondContact OD1-CA 3.36Å; N89-V101 WeakPolarHBondContact OD1-CB 3.36Å; N89-V101 WeakPolarHBondContact OD1-CG2 3.5Å; N89-V101 PolarHBondContact OD1-N 3.31Å; N89-V101 PolarHBondContact OD1-O 3Å; V101-L107 HydrophobicContact CG2-CD1 3.66Å
102	Y	97.1	Very high	97.3	Very high	99 Å²	99	44 Å²	44	39%	0.388	26%	0.259	S	S	.	.			trans	-86.2	159.1	175.3	-74.8	-60.1	0	0	0	112	L52 N104 G105 S106 L108	L52-Y102 HydrophobicContact CD1-CD2 4.04Å; L52-Y102 HydrophobicContact CD1-CE2 3.92Å; Y102-N104 VanDerWaalsContact CB-OD1 3.25Å; Y102-N104 WeakPolarHBondContact CB-OD1 3.29Å; Y102-N104 PolarHBondContact O-N 2.95Å; Y102-G105 WeakPolarHBondContact O-CA 3.25Å; Y102-G105 PolarHBondContact O-N 2.77Å; Y102-S106 PolarHBondContact N-O 3.03Å; Y102-L108 HydrophobicContact CD2-CB 4.48Å; Y102-L108 HydrophobicContact CE2-CB 3.74Å
103	P	94.7	Very high	97.3	Very high	81 Å²	81	45 Å²	45	53%	0.526	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-21.2	178.4	-23	31.2	0	0	0	114.9	Y65 Y82 G105	Y65-P103 WeakPolarHBondContact CE2-O 3.17Å; Y82-P103 HydrophobicContact CE1-CB 4.23Å; Y82-P103 WeakPolarHBondContact OH-CG 3.3Å; P103-G105 PolarHBondContact O-N 3.02Å
104	N	94.1	Very high	97.2	Very high	74 Å²	74	42.7 Å²	42.7	40%	0.396	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	7.9	175.1	70.5	-7.6	0	0	0	113.3	I58 Y102 S106	I58-N104 VanDerWaalsContact CD1-O 3.25Å; I58-N104 WeakPolarHBondContact CD1-O 3.4Å; Y102-N104 VanDerWaalsContact CB-OD1 3.25Å; Y102-N104 WeakPolarHBondContact CB-OD1 3.29Å; Y102-N104 PolarHBondContact O-N 2.95Å; N104-S106 VanDerWaalsContact C-N 3.28Å; N104-S106 PolarHBondContact ND2-OG 2.89Å; N104-S106 PolarHBondContact O-N 2.84Å; N104-S106 VanDerWaalsContact OD1-CB 3.23Å; N104-S106 WeakPolarHBondContact OD1-CB 3.46Å; N104-S106 PolarHBondContact OD1-N 2.78Å; N104-S106 PolarHBondContact OD1-OG 2.88Å; N104-S106 VanDerWaalsContact OD1-OG 3.13Å
105	G	95.8	Very high	97.2	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.262	C	S	.	.	S	Bend	trans	80.2	-3.7	-178	0	0	0	0	0	115.2	Y65 W67 Y102 P103 L122	Y65-G105 VanDerWaalsContact CD1-CA 3.48Å; W67-G105 PolarHBondContact NE1-O 3.33Å; Y102-G105 WeakPolarHBondContact O-CA 3.25Å; Y102-G105 PolarHBondContact O-N 2.77Å; P103-G105 PolarHBondContact O-N 3.02Å; G105-L122 WeakPolarHBondContact O-CD2 3.16Å
106	S	97.7	Very high	97.1	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.245	C	C	.	.			trans	-74.5	146.5	178.7	-56.5	0	0	0	0	111.5	L53 A55 Y102 N104	L53-S106 VanDerWaalsContact O-CA 3.31Å; L53-S106 WeakPolarHBondContact O-CA 3.29Å; L53-S106 WeakPolarHBondContact O-CB 3.42Å; A55-S106 PolarHBondContact N-OG 2.85Å; A55-S106 VanDerWaalsContact N-OG 3.11Å; Y102-S106 PolarHBondContact N-O 3.03Å; N104-S106 VanDerWaalsContact C-N 3.28Å; N104-S106 PolarHBondContact ND2-OG 2.89Å; N104-S106 PolarHBondContact O-N 2.84Å; N104-S106 VanDerWaalsContact OD1-CB 3.23Å; N104-S106 WeakPolarHBondContact OD1-CB 3.46Å; N104-S106 PolarHBondContact OD1-N 2.78Å; N104-S106 PolarHBondContact OD1-OG 2.88Å; N104-S106 VanDerWaalsContact OD1-OG 3.13Å
107	L	98.3	Very high	97.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	118.9	177.4	-171.4	73.4	0	0	0	110.3	L52 L53 W67 I79 E99 V101	L52-L107 WeakPolarHBondContact CA-O 3.22Å; L53-L107 HydrophobicContact CB-CB 4.18Å; L53-L107 HydrophobicContact CD1-CD2 4.05Å; L53-L107 PolarHBondContact N-O 2.81Å; L53-L107 PolarHBondContact O-N 3.4Å; W67-L107 HydrophobicContact CB-CD1 4.35Å; W67-L107 HydrophobicContact CB-CD2 4.36Å; W67-L107 HydrophobicContact CD2-CB 3.92Å; W67-L107 HydrophobicContact CD2-CD2 4.12Å; W67-L107 HydrophobicContact CD2-CG 4.48Å; W67-L107 HydrophobicContact CE3-CD2 4.36Å; W67-L107 HydrophobicContact CG-CB 4.13Å; W67-L107 HydrophobicContact CG-CD1 4.06Å; W67-L107 HydrophobicContact CG-CD2 4.14Å; W67-L107 HydrophobicContact CG-CG 4.37Å; W67-L107 HydrophobicContact CZ2-CB 3.97Å; I79-L107 HydrophobicContact CD1-CD2 4.41Å; E99-L107 HydrophobicContact CB-CD1 4.13Å; V101-L107 HydrophobicContact CG2-CD1 3.66Å
108	L	98.3	Very high	97.1	Very high	27 Å²	27	43.5 Å²	43.5	14%	0.141	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	127	161.3	-179.4	65.3	0	0	0	108.8	D50 L52 E99 T100 Y102 Q110	D50-L108 HydrophobicContact CB-CD1 4.44Å; L52-L108 HydrophobicContact CD1-CB 4.41Å; E99-L108 CarbonylContact C-O 3.52Å; E99-L108 VanDerWaalsContact CA-O 3.32Å; E99-L108 WeakPolarHBondContact CA-O 3.42Å; T100-L108 PolarHBondContact N-O 2.8Å; T100-L108 PolarHBondContact O-N 2.83Å; Y102-L108 HydrophobicContact CD2-CB 4.48Å; Y102-L108 HydrophobicContact CE2-CB 3.74Å; L108-Q110 HydrophobicContact CD1-CG 4.47Å; L108-Q110 HydrophobicContact CD2-CG 3.81Å; L108-Q110 HydrophobicContact CG-CG 3.86Å
109	F	97.6	Very high	97.1	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.009	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	106.9	172.3	-158.1	158.2	0	0	0	108.8	D50 V51 R98 E99 I112 D116 Y120 L138	D50-F109 WeakPolarHBondContact CA-O 3.45Å; V51-F109 PolarHBondContact N-O 3.15Å; V51-F109 PolarHBondContact O-N 3Å; R98-F109 HydrophobicContact CB-CD2 4.18Å; R98-F109 HydrophobicContact CB-CE2 4.01Å; E99-F109 HydrophobicContact CG-CD1 4.5Å; E99-F109 HydrophobicContact CG-CD2 4Å; E99-F109 HydrophobicContact CG-CE1 4.44Å; E99-F109 HydrophobicContact CG-CE2 3.94Å; E99-F109 HydrophobicContact CG-CG 4.27Å; E99-F109 HydrophobicContact CG-CZ 4.16Å; E99-F109 WeakPolarHBondContact OE1-CZ 3.37Å; F109-I112 HydrophobicContact CB-CG2 4.16Å; F109-I112 HydrophobicContact CD1-CG2 4.44Å; F109-I112 HydrophobicContact CD2-CG2 4Å; F109-I112 HydrophobicContact CG-CG2 3.92Å; F109-D116 HydrophobicContact CE1-CB 3.92Å; F109-D116 HydrophobicContact CZ-CB 3.88Å; F109-D116 VanDerWaalsContact CZ-CG 3.46Å; F109-D116 WeakPolarHBondContact CZ-OD1 3.46Å; F109-Y120 HydrophobicContact CD1-CE1 4.31Å; F109-Y120 AromaticContact CE1-CE1 3.96Å; F109-Y120 HydrophobicContact CE1-CE1 3.96Å; F109-Y120 AromaticContact CE1-CZ 3.92Å; F109-Y120 WeakPolarHBondContact CE1-OH 3.41Å; F109-L138 HydrophobicContact CD1-CD2 4.09Å; F109-L138 HydrophobicContact CE1-CD2 4.49Å
110	Q	98	Very high	97.1	Very high	82 Å²	82	41.5 Å²	41.5	38%	0.383	23%	0.229	S	C	.	.			trans	-87.1	150.2	-177.3	-58.9	-175.1	-55.3	0	0	112.1	D50 R98 L108 I112	D50-Q110 VanDerWaalsContact OD1-CA 3.23Å; D50-Q110 WeakPolarHBondContact OD1-CA 3.41Å; R98-Q110 WeakPolarHBondContact CB-O 3.33Å; R98-Q110 PolarHBondContact O-N 2.89Å; L108-Q110 HydrophobicContact CD1-CG 4.47Å; L108-Q110 HydrophobicContact CD2-CG 3.81Å; L108-Q110 HydrophobicContact CG-CG 3.86Å; Q110-I112 PolarHBondContact O-N 2.96Å
111	N	97.2	Very high	97.1	Very high	93 Å²	93	39 Å²	39	50%	0.497	21%	0.213	S	C	.	.	S	Bend	trans	46.4	56.8	171	-170.2	22.2	0	0	0	112.7	G48 K49 D50 R98	G48-N111 VanDerWaalsContact CA-OD1 3.3Å; G48-N111 WeakPolarHBondContact CA-OD1 3.36Å; K49-N111 PolarHBondContact O-N 3.39Å; D50-N111 PolarHBondContact OD1-N 2.83Å; R98-N111 PolarHBondContact NH1-O 3.24Å
112	I	97.1	Very high	97.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.213	C	C	.	.			trans	-67.2	150	-175.1	71.2	-169.4	0	0	0	111.5	A45 E47 G48 K49 V51 F109 Q110 V140	A45-I112 HydrophobicContact CB-CD1 3.34Å; E47-I112 CarbonylContact C-O 3.56Å; E47-I112 WeakPolarHBondContact CA-O 3.42Å; G48-I112 PolarHBondContact N-O 2.83Å; K49-I112 VanDerWaalsContact O-CG1 3.32Å; K49-I112 WeakPolarHBondContact O-CG1 3.3Å; K49-I112 PolarHBondContact O-N 2.93Å; V51-I112 HydrophobicContact CG2-CD1 3.63Å; F109-I112 HydrophobicContact CB-CG2 4.16Å; F109-I112 HydrophobicContact CD1-CG2 4.44Å; F109-I112 HydrophobicContact CD2-CG2 4Å; F109-I112 HydrophobicContact CG-CG2 3.92Å; Q110-I112 PolarHBondContact O-N 2.96Å; I112-V140 HydrophobicContact CD1-CB 4.48Å; I112-V140 HydrophobicContact CD1-CG1 4.03Å; I112-V140 HydrophobicContact CD1-CG2 3.76Å; I112-V140 HydrophobicContact CG1-CG1 3.97Å; I112-V140 HydrophobicContact CG1-CG2 4.13Å
113	T	96.9	Very high	97.2	Very high	41 Å²	41	38.7 Å²	38.7	25%	0.252	21%	0.212	S	C	.	.			trans	-115.3	169.6	175.7	67.3	0	0	0	0	111	E115 D116	T113-E115 PolarHBondContact O-N 2.73Å; T113-E115 PolarHBondContact OG1-N 3.01Å; T113-D116 WeakPolarHBondContact CB-OD2 3.45Å; T113-D116 PolarHBondContact N-OD2 3.46Å; T113-D116 WeakPolarHBondContact O-CB 3.36Å; T113-D116 PolarHBondContact O-N 3.49Å; T113-D116 PolarHBondContact OG1-OD2 3.06Å
114	L	96.9	Very high	97.3	Very high	51 Å²	51	35.2 Å²	35.2	27%	0.267	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-59.9	-28.1	173.5	-68.7	169.4	0	0	0	113.3	E47 D116 A117 V140 R142	E47-L114 PolarHBondContact OE1-N 2.89Å; L114-D116 PolarHBondContact O-N 2.82Å; L114-A117 WeakPolarHBondContact O-CB 3.11Å; L114-A117 PolarHBondContact O-N 2.62Å; L114-V140 HydrophobicContact CD2-CG1 4.24Å; L114-R142 HydrophobicContact CD1-CG 3.71Å; L114-R142 VanDerWaalsContact CD1-CZ 3.43Å; L114-R142 HydrophobicContact CD2-CG 4.23Å; L114-R142 HydrophobicContact CG-CG 4.44Å
115	E	96.4	Very high	97.4	Very high	169 Å²	169	32.8 Å²	32.8	79%	0.79	18%	0.175	S	C	*	.	G	3₁₀ helix	trans	-75.5	-12.6	177.7	-58.5	-174.9	-178.7	0	0	113.2	K69 T113 A117	K69-E115 PolarHBondContact NZ-O 2.76Å; T113-E115 PolarHBondContact O-N 2.73Å; T113-E115 PolarHBondContact OG1-N 3.01Å; E115-A117 VanDerWaalsContact C-N 3.35Å
116	D	96.8	Very high	97.3	Very high	8 Å²	8	34.2 Å²	34.2	4%	0.043	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-86.1	-10.1	175.1	-58.6	-48	0	0	0	111.9	K69 R98 F109 T113 L114 G118 Y120	K69-D116 IonicContact NZ-OD1 3.69Å; R98-D116 IonicContact CZ-OD1 3.98Å; R98-D116 IonicContact CZ-OD2 3.32Å; R98-D116 VanDerWaalsContact CZ-OD2 3.32Å; R98-D116 IonicContact NH1-OD2 2.73Å; R98-D116 PolarHBondContact NH1-OD2 3.26Å; R98-D116 IonicContact NH2-OD1 2.98Å; R98-D116 PolarHBondContact NH2-OD1 3.01Å; R98-D116 IonicContact NH2-OD2 3.04Å; R98-D116 PolarHBondContact NH2-OD2 3.35Å; F109-D116 HydrophobicContact CE1-CB 3.92Å; F109-D116 HydrophobicContact CZ-CB 3.88Å; F109-D116 VanDerWaalsContact CZ-CG 3.46Å; F109-D116 WeakPolarHBondContact CZ-OD1 3.46Å; T113-D116 WeakPolarHBondContact CB-OD2 3.45Å; T113-D116 PolarHBondContact N-OD2 3.46Å; T113-D116 WeakPolarHBondContact O-CB 3.36Å; T113-D116 PolarHBondContact O-N 3.49Å; T113-D116 PolarHBondContact OG1-OD2 3.06Å; L114-D116 PolarHBondContact O-N 2.82Å; D116-G118 PolarHBondContact O-N 3.24Å; D116-Y120 VanDerWaalsContact O-CE2 3.28Å; D116-Y120 WeakPolarHBondContact O-CE2 3.4Å; D116-Y120 PolarHBondContact O-OH 3.45Å
117	A	97.1	Very high	97	Very high	45 Å²	45	36.8 Å²	36.8	37%	0.372	20%	0.204	S	C	.	.			trans	-62.3	138.2	174.1	0	0	0	0	0	111.3	L114 E115 L138 V140	L114-A117 WeakPolarHBondContact O-CB 3.11Å; L114-A117 PolarHBondContact O-N 2.62Å; E115-A117 VanDerWaalsContact C-N 3.35Å; A117-L138 WeakPolarHBondContact CA-O 3.43Å; A117-V140 HydrophobicContact CB-CB 4.22Å; A117-V140 HydrophobicContact CB-CG2 4.09Å
118	G	97.1	Very high	96.7	Very high	29 Å²	29	40.9 Å²	40.9	30%	0.299	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	146.6	-165.6	177.9	0	0	0	0	0	114.3	D116 Y120 Q137 L138	D116-G118 PolarHBondContact O-N 3.24Å; G118-Y120 WeakPolarHBondContact O-CD2 3.38Å; G118-Q137 VanDerWaalsContact C-OE1 3.23Å; G118-Q137 PolarHBondContact O-OE1 2.99Å; G118-L138 PolarHBondContact N-O 3.01Å; G118-L138 PolarHBondContact O-N 3.03Å
119	S	97.9	Very high	96.3	Very high	15 Å²	15	48.2 Å²	48.2	11%	0.105	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	138.6	-179.3	-53.7	0	0	0	0	111.4	G70 K71 G136 Q137	G70-S119 CarbonylContact C-O 3.59Å; G70-S119 VanDerWaalsContact CA-O 3.3Å; G70-S119 WeakPolarHBondContact CA-O 3.32Å; G70-S119 PolarHBondContact N-O 2.79Å; G70-S119 CarbonylContact O-C 3.55Å; K71-S119 WeakPolarHBondContact CG-OG 3.44Å; S119-G136 WeakPolarHBondContact CA-O 3.44Å; S119-Q137 VanDerWaalsContact CB-OE1 3.3Å; S119-Q137 VanDerWaalsContact N-OE1 3.13Å; S119-Q137 VanDerWaalsContact OG-CD 3.25Å; S119-Q137 PolarHBondContact OG-NE2 2.91Å; S119-Q137 PolarHBondContact OG-OE1 3.36Å
120	Y	98.3	Very high	96	Very high	1 Å²	1	52.6 Å²	52.6	0%	0.004	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	132.4	176.6	-70	-96.9	0	0	0	108.5	L53 H68 K69 G70 I79 F109 D116 G118 T135 G136 L138	L53-Y120 HydrophobicContact CD1-CD1 3.97Å; L53-Y120 HydrophobicContact CD1-CD2 4.14Å; L53-Y120 HydrophobicContact CD1-CG 3.61Å; H68-Y120 WeakPolarHBondContact O-CA 3.23Å; K69-Y120 HydrophobicContact CB-CE1 4.43Å; K69-Y120 HydrophobicContact CG-CE1 4.06Å; G70-Y120 CarbonylContact O-C 3.38Å; I79-Y120 HydrophobicContact CD1-CD1 3.45Å; I79-Y120 VanDerWaalsContact CD1-CD1 3.45Å; I79-Y120 HydrophobicContact CD1-CE1 3.51Å; F109-Y120 HydrophobicContact CD1-CE1 4.31Å; F109-Y120 AromaticContact CE1-CE1 3.96Å; F109-Y120 HydrophobicContact CE1-CE1 3.96Å; F109-Y120 AromaticContact CE1-CZ 3.92Å; F109-Y120 WeakPolarHBondContact CE1-OH 3.41Å; D116-Y120 VanDerWaalsContact O-CE2 3.28Å; D116-Y120 WeakPolarHBondContact O-CE2 3.4Å; D116-Y120 PolarHBondContact O-OH 3.45Å; G118-Y120 WeakPolarHBondContact O-CD2 3.38Å; Y120-T135 CarbonylContact O-C 3.56Å; Y120-T135 WeakPolarHBondContact O-CA 3.26Å; Y120-G136 PolarHBondContact N-O 3.19Å; Y120-G136 PolarHBondContact O-N 2.88Å; Y120-L138 HydrophobicContact CD2-CB 3.83Å; Y120-L138 HydrophobicContact CE2-CB 3.63Å; Y120-L138 HydrophobicContact CE2-CD2 3.81Å; Y120-L138 HydrophobicContact CE2-CG 4.33Å
121	T	98.4	Very high	95.7	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	126.4	-178.3	-62	0	0	0	0	109.7	H68 G70 K71 T72 A73 Q133 A134 T135	H68-T121 PolarHBondContact N-O 3.42Å; H68-T121 PolarHBondContact O-N 3.22Å; G70-T121 PolarHBondContact O-N 3.49Å; G70-T121 PolarHBondContact O-OG1 3.24Å; K71-T121 PolarHBondContact O-OG1 3.45Å; T72-T121 PolarHBondContact N-OG1 2.99Å; A73-T121 HydrophobicContact CB-CG2 4.34Å; T121-Q133 HydrophobicContact CG2-CB 4.01Å; T121-A134 CarbonylContact C-O 3.48Å; T121-A134 WeakPolarHBondContact CA-O 3.23Å; T121-T135 PolarHBondContact OG1-OG1 3.18Å
122	L	98.3	Very high	95.6	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	121.5	167.5	175.3	53.5	0	0	0	108.7	F36 I38 A55 I58 Y65 W67 G105 T124 Q133 A134	F36-L122 HydrophobicContact CE1-CB 4.05Å; F36-L122 HydrophobicContact CE1-CD2 3.89Å; F36-L122 HydrophobicContact CE1-CG 3.96Å; F36-L122 HydrophobicContact CE2-CD2 4.34Å; F36-L122 HydrophobicContact CZ-CB 4.09Å; F36-L122 HydrophobicContact CZ-CD2 3.36Å; F36-L122 HydrophobicContact CZ-CG 3.93Å; I38-L122 HydrophobicContact CD1-CB 3.99Å; I38-L122 HydrophobicContact CD1-CD2 4.21Å; I38-L122 HydrophobicContact CG1-CB 4.46Å; A55-L122 HydrophobicContact CB-CD2 3.86Å; I58-L122 HydrophobicContact CD1-CD2 4.36Å; Y65-L122 HydrophobicContact CD1-CD1 4.17Å; Y65-L122 HydrophobicContact CD1-CD2 4.1Å; W67-L122 HydrophobicContact CD2-CB 3.99Å; W67-L122 HydrophobicContact CD2-CD1 4.25Å; W67-L122 HydrophobicContact CE3-CB 4.05Å; W67-L122 HydrophobicContact CG-CD1 4.23Å; W67-L122 HydrophobicContact CH2-CB 3.86Å; W67-L122 HydrophobicContact CZ2-CB 3.76Å; W67-L122 HydrophobicContact CZ2-CD2 3.99Å; W67-L122 HydrophobicContact CZ2-CG 4.3Å; W67-L122 HydrophobicContact CZ3-CB 3.98Å; G105-L122 WeakPolarHBondContact O-CD2 3.16Å; L122-T124 HydrophobicContact CD2-CG2 4.22Å; L122-T124 HydrophobicContact CG-CG2 4.06Å; L122-Q133 CarbonylContact O-C 3.58Å; L122-Q133 WeakPolarHBondContact O-CA 3.47Å; L122-A134 PolarHBondContact N-O 3.43Å; L122-A134 PolarHBondContact O-N 2.83Å
123	R	97.8	Very high	95.5	Very high	95 Å²	95	56.5 Å²	56.5	36%	0.358	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	134.1	164.9	-174.3	-178.8	-174	-145.9	-1.1	109.4	Y65 Y66 A73 S131 D132	Y65-R123 CarbonylContact C-O 3.54Å; Y66-R123 PolarHBondContact N-O 2.9Å; Y66-R123 PolarHBondContact O-N 3.24Å; A73-R123 HydrophobicContact CB-CB 3.94Å; A73-R123 HydrophobicContact CB-CG 4.39Å; R123-S131 PolarHBondContact NE-OG 2.99Å; R123-S131 PolarHBondContact NH2-OG 3Å; R123-D132 CarbonylContact C-O 3.58Å; R123-D132 WeakPolarHBondContact CA-O 3.33Å
124	T	97	Very high	95.5	Very high	7 Å²	7	55 Å²	55	4%	0.043	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	143.5	176.4	67	0	0	0	0	109.6	F36 A64 Y65 L122 S131 D132	F36-T124 HydrophobicContact CE1-CG2 4.2Å; A64-T124 WeakPolarHBondContact O-CA 3.42Å; Y65-T124 HydrophobicContact CD1-CG2 3.89Å; Y65-T124 HydrophobicContact CE1-CG2 4.11Å; L122-T124 HydrophobicContact CD2-CG2 4.22Å; L122-T124 HydrophobicContact CG-CG2 4.06Å; T124-S131 VanDerWaalsContact O-CA 3.23Å; T124-S131 WeakPolarHBondContact O-CA 3.06Å; T124-D132 PolarHBondContact N-O 3.29Å; T124-D132 PolarHBondContact O-N 3.39Å
125	I	95.8	Very high	95.5	Very high	23 Å²	23	55.5 Å²	55.5	12%	0.118	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	121.4	171.7	-55.3	-57.3	0	0	0	108.2	I62 Q63 A64 Y66 D130 S131	I62-I125 WeakPolarHBondContact CG2-O 3.46Å; Q63-I125 PolarHBondContact N-O 3.1Å; A64-I125 HydrophobicContact CB-CB 4.34Å; A64-I125 PolarHBondContact N-O 2.84Å; A64-I125 PolarHBondContact O-N 2.62Å; Y66-I125 HydrophobicContact CD2-CG1 4.18Å; Y66-I125 HydrophobicContact CE2-CG1 3.78Å; I125-D130 WeakPolarHBondContact CA-O 3.19Å; I125-S131 VanDerWaalsContact CD1-CB 3.45Å
126	N	93.7	Very high	95.5	Very high	31 Å²	31	47.7 Å²	47.7	17%	0.166	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	176.2	178.4	77.6	9.3	0	0	0	112	T61 I62 S128 Y129 D130	T61-N126 WeakPolarHBondContact O-CA 3.36Å; I62-N126 HydrophobicContact CD1-CB 4.19Å; N126-S128 PolarHBondContact O-N 3.45Å; N126-S128 VanDerWaalsContact OD1-C 3.28Å; N126-S128 VanDerWaalsContact OD1-CA 3.26Å; N126-S128 WeakPolarHBondContact OD1-CA 3.49Å; N126-S128 WeakPolarHBondContact OD1-CB 3.1Å; N126-S128 PolarHBondContact OD1-N 3.26Å; N126-Y129 PolarHBondContact O-N 3.33Å; N126-Y129 PolarHBondContact OD1-N 3.46Å; N126-D130 PolarHBondContact N-O 3.09Å; N126-D130 WeakPolarHBondContact ND2-CB 3.47Å; N126-D130 PolarHBondContact ND2-OD2 3.36Å; N126-D130 PolarHBondContact OD1-N 2.84Å
127	A	91.3	Very high	95.6	Very high	53 Å²	53	51.7 Å²	51.7	44%	0.438	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-20.4	177.6	0	0	0	0	0	115.4	T61 Q63 Y129	T61-A127 PolarHBondContact O-N 3.15Å; Q63-A127 HydrophobicContact CG-CB 4.44Å; A127-Y129 VanDerWaalsContact C-N 3.31Å
128	S	91.9	Very high	95.6	Very high	87 Å²	87	49.6 Å²	49.6	61%	0.608	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	3.9	174.6	-55.4	0	0	0	0	113	N126 D130	N126-S128 PolarHBondContact O-N 3.45Å; N126-S128 VanDerWaalsContact OD1-C 3.28Å; N126-S128 VanDerWaalsContact OD1-CA 3.26Å; N126-S128 WeakPolarHBondContact OD1-CA 3.49Å; N126-S128 WeakPolarHBondContact OD1-CB 3.1Å; N126-S128 PolarHBondContact OD1-N 3.26Å; S128-D130 WeakPolarHBondContact CB-OD2 3.4Å; S128-D130 PolarHBondContact O-N 3.06Å
129	Y	90.1	Very high	95.6	Very high	180 Å²	180	53.4 Å²	53.4	71%	0.706	28%	0.281	S	S	*	.	S	Bend	trans	65	15.3	-173	-56.4	-86.6	0	0	0	115.2	N126 A127	N126-Y129 PolarHBondContact O-N 3.33Å; N126-Y129 PolarHBondContact OD1-N 3.46Å; A127-Y129 VanDerWaalsContact C-N 3.31Å
130	D	92	Very high	95.6	Very high	94 Å²	94	53.7 Å²	53.7	50%	0.503	28%	0.282	S	S	.	.			trans	-74.2	150.6	168.8	-50.2	-54.2	0	0	0	109.9	I125 N126 S128	I125-D130 WeakPolarHBondContact CA-O 3.19Å; N126-D130 PolarHBondContact N-O 3.09Å; N126-D130 WeakPolarHBondContact ND2-CB 3.47Å; N126-D130 PolarHBondContact ND2-OD2 3.36Å; N126-D130 PolarHBondContact OD1-N 2.84Å; S128-D130 WeakPolarHBondContact CB-OD2 3.4Å; S128-D130 PolarHBondContact O-N 3.06Å
131	S	92.7	Very high	95.5	Very high	55 Å²	55	57.8 Å²	57.8	39%	0.385	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	127.9	178.1	74.3	0	0	0	0	113.1	R123 T124 I125	R123-S131 PolarHBondContact NE-OG 2.99Å; R123-S131 PolarHBondContact NH2-OG 3Å; T124-S131 VanDerWaalsContact O-CA 3.23Å; T124-S131 WeakPolarHBondContact O-CA 3.06Å; I125-S131 VanDerWaalsContact CD1-CB 3.45Å
132	D	93.6	Very high	95.4	Very high	107 Å²	107	66.5 Å²	66.5	57%	0.572	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.3	157.9	169.2	-74.1	-38.7	0	0	0	110.2	R123 T124	R123-D132 CarbonylContact C-O 3.58Å; R123-D132 WeakPolarHBondContact CA-O 3.33Å; T124-D132 PolarHBondContact N-O 3.29Å; T124-D132 PolarHBondContact O-N 3.39Å
133	Q	95.9	Very high	95	Very high	95 Å²	95	70 Å²	70	44%	0.444	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	150.6	175.3	64.5	172.6	44.5	0	0	112.6	T121 L122	T121-Q133 HydrophobicContact CG2-CB 4.01Å; L122-Q133 CarbonylContact O-C 3.58Å; L122-Q133 WeakPolarHBondContact O-CA 3.47Å
134	A	96.7	Very high	94.3	Very high	11 Å²	11	70.1 Å²	70.1	9%	0.091	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	150.6	167.7	0	0	0	0	0	110.5	F36 I38 T121 L122	F36-A134 HydrophobicContact CD1-CB 3.36Å; F36-A134 HydrophobicContact CE1-CB 3.42Å; F36-A134 VanDerWaalsContact CE1-CB 3.42Å; F36-A134 HydrophobicContact CG-CB 4.09Å; F36-A134 HydrophobicContact CZ-CB 4.13Å; F36-A134 WeakPolarHBondContact O-CB 3.32Å; I38-A134 HydrophobicContact CG1-CB 4.1Å; T121-A134 CarbonylContact C-O 3.48Å; T121-A134 WeakPolarHBondContact CA-O 3.23Å; L122-A134 PolarHBondContact N-O 3.43Å; L122-A134 PolarHBondContact O-N 2.83Å
135	T	97.8	Very high	93.3	Very high	61 Å²	61	74.4 Å²	74.4	37%	0.374	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	132	-175.8	-54.2	0	0	0	0	110.1	K71 Y120 T121	K71-T135 PolarHBondContact O-OG1 3.14Å; K71-T135 VanDerWaalsContact O-OG1 3.1Å; Y120-T135 CarbonylContact O-C 3.56Å; Y120-T135 WeakPolarHBondContact O-CA 3.26Å; T121-T135 PolarHBondContact OG1-OG1 3.18Å
136	G	96.3	Very high	91.5	Very high	4 Å²	4	78.4 Å²	78.4	4%	0.041	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	163.8	170.6	0	0	0	0	0	111.7	S119 Y120	S119-G136 WeakPolarHBondContact CA-O 3.44Å; Y120-G136 PolarHBondContact N-O 3.19Å; Y120-G136 PolarHBondContact O-N 2.88Å
137	Q	97.4	Very high	89.6	Confident	92 Å²	92	82.3 Å²	82.3	43%	0.43	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	131	175.3	-67.2	-73.1	39.7	0	0	110.4	A40 G118 S119	A40-Q137 WeakPolarHBondContact CB-O 3.26Å; G118-Q137 VanDerWaalsContact C-OE1 3.23Å; G118-Q137 PolarHBondContact O-OE1 2.99Å; S119-Q137 VanDerWaalsContact CB-OE1 3.3Å; S119-Q137 VanDerWaalsContact N-OE1 3.13Å; S119-Q137 VanDerWaalsContact OG-CD 3.25Å; S119-Q137 PolarHBondContact OG-NE2 2.91Å; S119-Q137 PolarHBondContact OG-OE1 3.36Å
138	L	97.4	Very high	87.5	Confident	2 Å²	2	85.7 Å²	85.7	1%	0.01	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	117.5	172.6	178.1	56.1	0	0	0	109.6	V51 F109 A117 G118 Y120 V140	V51-L138 HydrophobicContact CB-CD1 4.07Å; V51-L138 HydrophobicContact CG1-CD1 3.7Å; V51-L138 HydrophobicContact CG2-CD1 3.95Å; F109-L138 HydrophobicContact CD1-CD2 4.09Å; F109-L138 HydrophobicContact CE1-CD2 4.49Å; A117-L138 WeakPolarHBondContact CA-O 3.43Å; G118-L138 PolarHBondContact N-O 3.01Å; G118-L138 PolarHBondContact O-N 3.03Å; Y120-L138 HydrophobicContact CD2-CB 3.83Å; Y120-L138 HydrophobicContact CE2-CB 3.63Å; Y120-L138 HydrophobicContact CE2-CD2 3.81Å; Y120-L138 HydrophobicContact CE2-CG 4.33Å; L138-V140 HydrophobicContact CD1-CG2 4.4Å; L138-V140 HydrophobicContact CD2-CG2 4.43Å; L138-V140 HydrophobicContact CG-CG2 4.02Å
139	H	97.5	Very high	85.5	Confident	109 Å²	109	86.6 Å²	86.6	51%	0.505	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	127.3	173.2	-65.2	-64.2	0	0	0	110.5	S44 A45	S44-H139 WeakPolarHBondContact CA-O 3.42Å; A45-H139 PolarHBondContact N-O 2.91Å
140	V	97.6	Very high	83.4	Confident	20 Å²	20	81 Å²	81	12%	0.121	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	135.2	177.7	-169.2	0	0	0	0	109.4	A45 E47 I112 L114 A117 L138	A45-V140 CarbonylContact O-C 3.57Å; A45-V140 VanDerWaalsContact O-CA 3.26Å; A45-V140 WeakPolarHBondContact O-CA 3.29Å; E47-V140 HydrophobicContact CB-CG1 4.08Å; I112-V140 HydrophobicContact CD1-CB 4.48Å; I112-V140 HydrophobicContact CD1-CG1 4.03Å; I112-V140 HydrophobicContact CD1-CG2 3.76Å; I112-V140 HydrophobicContact CG1-CG1 3.97Å; I112-V140 HydrophobicContact CG1-CG2 4.13Å; L114-V140 HydrophobicContact CD2-CG1 4.24Å; A117-V140 HydrophobicContact CB-CB 4.22Å; A117-V140 HydrophobicContact CB-CG2 4.09Å; L138-V140 HydrophobicContact CD1-CG2 4.4Å; L138-V140 HydrophobicContact CD2-CG2 4.43Å; L138-V140 HydrophobicContact CG-CG2 4.02Å
141	H	96.8	Very high	81.3	Confident	87 Å²	87	81.3 Å²	81.3	40%	0.403	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	155.3	176.7	58.2	-89.4	0	0	0	111.5	S44 A45 A46 E47	S44-H141 PolarHBondContact OG-ND1 3.06Å; A45-H141 PolarHBondContact O-CE1 3.13Å; A45-H141 PolarHBondContact O-N 2.84Å; A45-H141 PolarHBondContact O-ND1 3.23Å; A45-H141 VanDerWaalsContact O-ND1 3.11Å; A46-H141 CarbonylContact C-O 3.54Å; A46-H141 WeakPolarHBondContact CA-O 3.38Å; A46-H141 PolarHBondContact N-CE1 2.57Å; A46-H141 VanDerWaalsContact N-CE1 3.31Å; E47-H141 PolarHBondContact N-O 3.22Å
142	R	95.6	Very high	79.1	Confident	184 Å²	184	83.1 Å²	83.1	69%	0.694	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-66.5	139.4	173.7	-75.3	-173.7	179.3	91.1	2.7	109.8	L114 A144	L114-R142 HydrophobicContact CD1-CG 3.71Å; L114-R142 VanDerWaalsContact CD1-CZ 3.43Å; L114-R142 HydrophobicContact CD2-CG 4.23Å; L114-R142 HydrophobicContact CG-CG 4.44Å; R142-A144 PolarHBondContact O-N 3.44Å
143	P	89.3	Confident	76.8	Confident	73 Å²	73	88.8 Å²	88.8	47%	0.474	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-57.2	137.7	168.6	-18.5	30.7	0	0	0	108.7	A46 S145	A46-P143 HydrophobicContact CB-CG 4.48Å; P143-S145 PolarHBondContact O-N 3.06Å
144	A	83.9	Confident	74.6	Confident	97 Å²	97	89.8 Å²	89.8	80%	0.802	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-58	119.4	169.8	0	0	0	0	0	107.4	R142 S146	R142-A144 PolarHBondContact O-N 3.44Å; A144-S146 PolarHBondContact O-N 2.96Å
145	S	75.4	Confident	72.5	Confident	97 Å²	97	97.9 Å²	97.9	68%	0.678	57%	0.567	S	S	*	*	P	Polyproline II helix	trans	-57.3	119.4	168	46.3	0	0	0	0	105.8	P143 V147	P143-S145 PolarHBondContact O-N 3.06Å; S145-V147 PolarHBondContact O-N 2.94Å
146	S	59.1	Low	70.1	Confident	108 Å²	108	100 Å²	100	76%	0.755	58%	0.583	S	S	*	*			trans	-65.1	83.6	165.2	55.5	0	0	0	0	105.8	A144 T148	A144-S146 PolarHBondContact O-N 2.96Å; S146-T148 PolarHBondContact O-N 3.33Å
147	V	53.5	Low	68.2	Low	112 Å²	112	105 Å²	105	68%	0.679	61%	0.614	S	S	*	*			trans	-60.5	94.9	159.8	177.7	0	0	0	0	103	S145 S149	S145-V147 PolarHBondContact O-N 2.94Å; V147-S149 PolarHBondContact O-N 3.18Å
148	T	46.1	Very low	65.7	Low	125 Å²	125	106.7 Å²	106.7	77%	0.767	63%	0.633	S	S	*	*			trans	-59	91.8	155.3	-62.7	0	0	0	0	103.3	S146 G150	S146-T148 PolarHBondContact O-N 3.33Å; T148-G150 PolarHBondContact O-N 2.89Å
149	S	50.2	Low	63.2	Low	106 Å²	106	115.3 Å²	115.3	74%	0.741	68%	0.678	S	S	*	*			trans	-67.7	76.5	166.8	-165.6	0	0	0	0	105.2	V147 S151	V147-S149 PolarHBondContact O-N 3.18Å; S149-S151 PolarHBondContact O-N 3.31Å
150	G	46.7	Very low	60.8	Low	62 Å²	62	114.6 Å²	114.6	64%	0.639	69%	0.691	S	S	*	*			trans	-73.7	74.1	169.2	0	0	0	0	0	107.1	T148 S152	T148-G150 PolarHBondContact O-N 2.89Å; G150-S152 PolarHBondContact O-N 3.22Å
151	S	48.5	Very low	58.3	Low	101 Å²	101	122.6 Å²	122.6	71%	0.706	73%	0.729	S	S	*	*			trans	-44.6	124.2	150.6	-178.9	0	0	0	0	108.2	S149	S149-S151 PolarHBondContact O-N 3.31Å
152	S	46.2	Very low	56.1	Low	92 Å²	92	124.5 Å²	124.5	64%	0.643	75%	0.747	S	S	*	*			trans	26.3	109.6	169.5	71.8	0	0	0	0	117.1	G150 P154	G150-S152 PolarHBondContact O-N 3.22Å; S152-P154 WeakPolarHBondContact O-CD 3.25Å
153	R	45.3	Very low	53.7	Low	227 Å²	227	120.9 Å²	120.9	86%	0.857	75%	0.747	S	S	*	*			trans	-36.9	111.6	156.2	-172.9	-179.1	-167	178.8	4.1	110.8	Q155	R153-Q155 PolarHBondContact O-N 2.89Å
154	P	49.8	Very low	51.8	Low	115 Å²	115	125.7 Å²	125.7	75%	0.747	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-66.6	128.8	164.3	-11.9	27.7	0	0	0	106.7	S152	S152-P154 WeakPolarHBondContact O-CD 3.25Å
155	Q	51.2	Low	50	Low	181 Å²	181	127.1 Å²	127.1	85%	0.846	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-55.3	140.6	172.6	-75.3	-177.1	-82.6	0	0	109.6	R153	R153-Q155 PolarHBondContact O-N 2.89Å
156	P	48.5	Very low	48.6	Very low	107 Å²	107	129.7 Å²	129.7	70%	0.695	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-64.4	129.4	173.5	26.4	-30.5	0	0	0	108.6
157	P	56	Low	48.5	Very low	109 Å²	109	129.6 Å²	129.6	71%	0.708	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-62.4	149.2	168.3	24.3	-29.5	0	0	0	109.6	L159	P157-L159 PolarHBondContact O-N 3.13Å
158	P	44.4	Very low	48	Very low	126 Å²	126	130.2 Å²	130.2	82%	0.818	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-54.6	140.3	-179.4	-21.5	31.5	0	0	0	111.1	A160	P158-A160 PolarHBondContact O-N 2.76Å
159	L	45.1	Very low	48.2	Very low	184 Å²	184	129.9 Å²	129.9	96%	0.963	78%	0.779	S	S	*	*			trans	-55.1	97.6	-179.6	-64.9	174	0	0	0	110.7	P157	P157-L159 PolarHBondContact O-N 3.13Å
160	A	48	Very low	48.3	Very low	94 Å²	94	136.2 Å²	136.2	78%	0.777	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-87.1	129.9	162.5	0	0	0	0	0	108.3	P158	P158-A160 PolarHBondContact O-N 2.76Å
161	M	45.8	Very low	47.9	Very low	188 Å²	188	138.4 Å²	138.4	93%	0.926	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-47.9	130.3	-172.1	-143.3	163.3	-165.9	0	0	113.7
162	V	49.8	Very low	47.4	Very low	127 Å²	127	141.7 Å²	141.7	77%	0.77	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-68.1	133.3	174.8	178.7	0	0	0	0	110.7
163	P	44.1	Very low	47	Very low	108 Å²	108	147.4 Å²	147.4	70%	0.701	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-94.1	121.7	152.7	3.2	16.8	0	0	0	109.5	T165	P163-T165 PolarHBondContact O-N 3.12Å; P163-T165 PolarHBondContact O-OG1 2.93Å
164	L	51	Low	46.8	Very low	174 Å²	174	142.3 Å²	142.3	91%	0.911	80%	0.803	S	S	*	*			trans	-64.1	109	173.7	-167.1	80	0	0	0	109.1
165	T	45.1	Very low	46.7	Very low	127 Å²	127	140.8 Å²	140.8	78%	0.779	80%	0.801	S	S	*	*			trans	-143.5	121.6	170	-7.7	0	0	0	0	110.1	P163	P163-T165 PolarHBondContact O-N 3.12Å; P163-T165 PolarHBondContact O-OG1 2.93Å
166	D	47.4	Very low	46.1	Very low	150 Å²	150	137.6 Å²	137.6	80%	0.802	80%	0.796	S	S	*	*			trans	11.2	135.4	174.7	-106.7	-21.1	0	0	0	121.5
167	P	55.3	Low	46	Very low	106 Å²	106	141.5 Å²	141.5	69%	0.688	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-74.6	135.2	172	32	-30.5	0	0	0	110.8
168	P	44.4	Very low	45.3	Very low	126 Å²	126	144.5 Å²	144.5	82%	0.818	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-74	135.9	171.9	28.5	-30.6	0	0	0	110.8
169	S	48.8	Very low	45.1	Very low	118 Å²	118	144.3 Å²	144.3	83%	0.825	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-48.8	135.1	177.2	-48.8	0	0	0	0	113.3
170	R	52.7	Low	45.5	Very low	239 Å²	239	143 Å²	143	90%	0.902	80%	0.801	S	S	*	*			trans	-33.8	126.4	169.3	-162	-178.2	-161.2	-175.2	4.5	112.7	L172	R170-L172 PolarHBondContact O-N 3.14Å
171	P	38.8	Very low	45.1	Very low	108 Å²	108	144.2 Å²	144.2	70%	0.701	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-71.8	124.6	166.6	23	-21.1	0	0	0	108.9	Y173	P171-Y173 PolarHBondContact O-N 3.38Å
172	L	37.3	Very low	44.8	Very low	169 Å²	169	139.1 Å²	139.1	89%	0.885	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-64.8	117.1	164.1	-145.4	98.4	0	0	0	106.6	R170 P174	R170-L172 PolarHBondContact O-N 3.14Å; L172-P174 WeakPolarHBondContact O-CD 3.4Å
173	Y	39	Very low	44.5	Very low	212 Å²	212	140.3 Å²	140.3	83%	0.831	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-59.7	129.2	172.9	-71.3	-86.5	0	0	0	109.4	P171	P171-Y173 PolarHBondContact O-N 3.38Å
174	P	41.6	Very low	44.3	Very low	120 Å²	120	144.1 Å²	144.1	78%	0.779	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-72.1	128.8	159.5	-6	23.1	0	0	0	107.9	L172	L172-P174 WeakPolarHBondContact O-CD 3.4Å
175	A	46.8	Very low	43.8	Very low	84 Å²	84	143 Å²	143	69%	0.694	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-57.1	135.2	169.1	0	0	0	0	0	109.9	E177	A175-E177 VanDerWaalsContact C-N 3.33Å; A175-E177 PolarHBondContact O-N 2.96Å
176	P	39.1	Very low	43.9	Very low	114 Å²	114	141 Å²	141	74%	0.74	77%	0.769	S	S	*	*			trans	-78.3	88.9	167.2	8.6	7.1	0	0	0	108.2	Q178	P176-Q178 HydrophobicContact CB-CG 4.43Å; P176-Q178 PolarHBondContact O-N 3.39Å; P176-Q178 VanDerWaalsContact O-N 3.11Å
177	E	45.8	Very low	43.7	Very low	188 Å²	188	141.1 Å²	141.1	88%	0.879	76%	0.759	S	S	*	*			trans	-74.4	87.2	151.5	-68.7	-133.3	129.9	0	0	106.8	A175 P179	A175-E177 VanDerWaalsContact C-N 3.33Å; A175-E177 PolarHBondContact O-N 2.96Å; E177-P179 WeakPolarHBondContact O-CD 3.32Å
178	Q	40.9	Very low	42.8	Very low	172 Å²	172	140.6 Å²	140.6	80%	0.804	75%	0.754	S	S	*	*			trans	-84.7	117.9	163.7	-71	-168.6	-90	0	0	107.7	P176 L180	P176-Q178 HydrophobicContact CB-CG 4.43Å; P176-Q178 PolarHBondContact O-N 3.39Å; P176-Q178 VanDerWaalsContact O-N 3.11Å; Q178-L180 PolarHBondContact O-N 3.06Å
179	P	40.7	Very low	42.6	Very low	122 Å²	122	139.9 Å²	139.9	79%	0.792	74%	0.743	S	S	*	*			trans	-61.2	128.7	169.1	-16.3	29.9	0	0	0	108.3	E177	E177-P179 WeakPolarHBondContact O-CD 3.32Å
180	L	52.8	Low	42.1	Very low	156 Å²	156	139.9 Å²	139.9	82%	0.817	73%	0.731	S	S	*	*			trans	-43.1	138.8	164.5	-72.8	166.1	0	0	0	109.1	Q178 S182	Q178-L180 PolarHBondContact O-N 3.06Å; L180-S182 PolarHBondContact O-N 3.49Å
181	P	40	Very low	41	Very low	120 Å²	120	135.7 Å²	135.7	78%	0.779	72%	0.722	S	S	*	*			trans	-54.7	112.6	172.6	21.2	-29.6	0	0	0	108.2	M183	P181-M183 PolarHBondContact O-N 3.06Å; P181-M183 VanDerWaalsContact O-N 3.16Å
182	S	38.8	Very low	40.6	Very low	82 Å²	82	135.1 Å²	135.1	57%	0.573	72%	0.716	S	S	*	*			trans	-46.3	118.5	-178.5	159.6	0	0	0	0	110.2	L180 R184	L180-S182 PolarHBondContact O-N 3.49Å; S182-R184 PolarHBondContact O-N 3.25Å; S182-R184 WeakPolarHBondContact OG-CB 3.24Å
183	M	44.3	Very low	40.5	Very low	152 Å²	152	134 Å²	134	75%	0.749	71%	0.705	S	S	*	*	S	Bend	trans	-59	44.5	173.9	-72.6	-151.1	-65.2	0	0	114.2	P181 Y187	P181-M183 PolarHBondContact O-N 3.06Å; P181-M183 VanDerWaalsContact O-N 3.16Å; M183-Y187 WeakPolarHBondContact O-CD2 3.46Å; M183-Y187 WeakPolarHBondContact O-CE2 3.46Å
184	R	39.3	Very low	40.2	Very low	188 Å²	188	128.5 Å²	128.5	71%	0.709	69%	0.693	S	S	*	*			trans	-108.2	0.6	-168.5	-149.2	-178.3	-70.7	-156.2	-1.5	114.2	S182 T188	S182-R184 PolarHBondContact O-N 3.25Å; S182-R184 WeakPolarHBondContact OG-CB 3.24Å; R184-T188 PolarHBondContact O-OG1 3.37Å
185	N	40.3	Very low	39.8	Very low	150 Å²	150	126.4 Å²	126.4	80%	0.802	69%	0.686	S	S	*	*	S	Bend	trans	-92.2	-20.9	-178.7	-103.3	-13.9	0	0	0	115.1
186	C	47.4	Very low	39.3	Very low	84 Å²	84	131 Å²	131	57%	0.568	69%	0.685	S	S	*	*	S	Bend	trans	-87.6	-17.3	-176.1	-53.3	0	0	0	0	113.7
187	Y	44	Very low	39.1	Very low	154 Å²	154	128.2 Å²	128.2	60%	0.604	67%	0.668	S	S	*	*	S	Bend	trans	-83.2	-20.8	-179.8	-65.6	-76.6	0	0	0	113.9	M183 L189 M190	M183-Y187 WeakPolarHBondContact O-CD2 3.46Å; M183-Y187 WeakPolarHBondContact O-CE2 3.46Å; Y187-L189 PolarHBondContact O-N 2.97Å; Y187-M190 PolarHBondContact O-N 2.96Å
188	T	35.2	Very low	38.7	Very low	94 Å²	94	123.7 Å²	123.7	58%	0.577	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-17.9	-171.7	-38.6	0	0	0	0	112.8	R184	R184-T188 PolarHBondContact O-OG1 3.37Å
189	L	41	Very low	38.5	Very low	112 Å²	112	118.7 Å²	118.7	59%	0.586	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-19.1	175.7	-156.2	70.7	0	0	0	113.1	Y187	Y187-L189 PolarHBondContact O-N 2.97Å
190	M	37.4	Very low	38.5	Very low	118 Å²	118	119.9 Å²	119.9	58%	0.581	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-30.1	178.4	-75.7	-75.6	88.5	0	0	113.3	Y187 T192 F193 T194	Y187-M190 PolarHBondContact O-N 2.96Å; M190-T192 PolarHBondContact O-N 2.77Å; M190-F193 PolarHBondContact O-N 3.2Å; M190-T194 PolarHBondContact O-N 3.12Å; M190-T194 PolarHBondContact O-OG1 3.42Å
191	Q	31	Very low	38.3	Very low	151 Å²	151	117.8 Å²	117.8	71%	0.706	61%	0.614	S	S	*	*	H	α-helix	trans	-71.9	-24.3	-175.8	-74.5	-78	22.1	0	0	114.3
192	T	30.8	Very low	37.9	Very low	96 Å²	96	117.6 Å²	117.6	59%	0.589	60%	0.604	S	S	*	*	H	α-helix	trans	-84.9	-13.9	177.2	26.3	0	0	0	0	113.8	M190	M190-T192 PolarHBondContact O-N 2.77Å
193	F	34.1	Very low	38.1	Very low	145 Å²	145	122.3 Å²	122.3	64%	0.636	61%	0.609	S	S	*	*	H	α-helix	trans	-94.7	-41.2	178.7	-109.1	-95.2	0	0	0	113.1	M190 A195 R196 S197	M190-F193 PolarHBondContact O-N 3.2Å; F193-A195 PolarHBondContact O-N 3.41Å; F193-R196 PolarHBondContact O-N 2.98Å; F193-S197 VanDerWaalsContact O-CB 3.23Å; F193-S197 WeakPolarHBondContact O-CB 2.99Å; F193-S197 PolarHBondContact O-N 3.34Å
194	T	33.8	Very low	38.1	Very low	96 Å²	96	117.9 Å²	117.9	59%	0.589	59%	0.593	S	S	*	*	H	α-helix	trans	-67.8	-34.3	-176.6	-43.4	0	0	0	0	112.6	M190	M190-T194 PolarHBondContact O-N 3.12Å; M190-T194 PolarHBondContact O-OG1 3.42Å
195	A	32.5	Very low	38.6	Very low	76 Å²	76	114.8 Å²	114.8	63%	0.628	59%	0.59	S	S	*	*	H	α-helix	trans	-79.2	-18	177.5	0	0	0	0	0	114.5	F193	F193-A195 PolarHBondContact O-N 3.41Å
196	R	36.2	Very low	39.4	Very low	180 Å²	180	116.1 Å²	116.1	68%	0.679	58%	0.584	S	S	*	*	H	α-helix	trans	-104.2	-17.6	-177.6	-167.8	176.7	-78.6	-148.6	-2.4	113.2	F193	F193-R196 PolarHBondContact O-N 2.98Å
197	S	34.4	Very low	39.5	Very low	56 Å²	56	119 Å²	119	39%	0.392	59%	0.587	S	S	.	*	H	α-helix	trans	-85.1	-29.5	-175.9	-166.8	0	0	0	0	113.9	F193 T199 Q201	F193-S197 VanDerWaalsContact O-CB 3.23Å; F193-S197 WeakPolarHBondContact O-CB 2.99Å; F193-S197 PolarHBondContact O-N 3.34Å; S197-T199 VanDerWaalsContact C-N 3.35Å; S197-T199 PolarHBondContact O-N 3.48Å; S197-Q201 WeakPolarHBondContact O-CG 3.41Å; S197-Q201 PolarHBondContact O-N 2.92Å
198	T	37.2	Very low	39.9	Very low	94 Å²	94	116.3 Å²	116.3	58%	0.577	58%	0.583	S	S	*	*	H	α-helix	trans	-72.9	-27.1	178.9	48.1	0	0	0	0	113	M202	T198-M202 WeakPolarHBondContact O-CB 3.38Å; T198-M202 PolarHBondContact O-N 3.32Å
199	T	37.1	Very low	40.4	Very low	67 Å²	67	120.1 Å²	120.1	41%	0.411	59%	0.587	S	S	.	*	H	α-helix	trans	-77.2	-51.5	177.1	-26.6	0	0	0	0	110.3	S197 Q201 M202 W203	S197-T199 VanDerWaalsContact C-N 3.35Å; S197-T199 PolarHBondContact O-N 3.48Å; T199-Q201 PolarHBondContact O-N 3.29Å; T199-M202 PolarHBondContact O-N 3.35Å; T199-W203 PolarHBondContact O-N 3.29Å
200	K	40.5	Very low	40.8	Very low	146 Å²	146	120.7 Å²	120.7	64%	0.635	59%	0.586	S	S	*	*	H	α-helix	trans	-64.1	-38.8	-174.6	-73.4	-170.8	174.2	-170.7	0	113.9	S204	K200-S204 WeakPolarHBondContact O-CB 3.42Å; K200-S204 PolarHBondContact O-N 3.16Å; K200-S204 VanDerWaalsContact O-N 3.14Å
201	Q	47.9	Very low	41.4	Very low	112 Å²	112	119.6 Å²	119.6	52%	0.523	58%	0.583	S	S	.	*	H	α-helix	trans	-73.6	-32.8	178.7	-64.3	-64.2	-12.8	0	0	112.3	S197 T199 S204 L205	S197-Q201 WeakPolarHBondContact O-CG 3.41Å; S197-Q201 PolarHBondContact O-N 2.92Å; T199-Q201 PolarHBondContact O-N 3.29Å; Q201-S204 PolarHBondContact O-N 2.94Å; Q201-L205 PolarHBondContact O-N 3.48Å
202	M	33.6	Very low	42.7	Very low	116 Å²	116	117.2 Å²	117.2	57%	0.571	57%	0.574	S	S	*	*	H	α-helix	trans	-75.3	-31.3	179.2	-162	167.6	68.1	0	0	112.6	T198 T199 R206	T198-M202 WeakPolarHBondContact O-CB 3.38Å; T198-M202 PolarHBondContact O-N 3.32Å; T199-M202 PolarHBondContact O-N 3.35Å; M202-R206 WeakPolarHBondContact O-CB 3.41Å; M202-R206 WeakPolarHBondContact O-CG 3.5Å; M202-R206 PolarHBondContact O-N 3.33Å
203	W	41.7	Very low	43.7	Very low	181 Å²	181	116.8 Å²	116.8	69%	0.686	57%	0.568	S	S	*	*	H	α-helix	trans	-70.2	-37.5	167.9	-73.4	98.4	0	0	0	111.7	T199 F207	T199-W203 PolarHBondContact O-N 3.29Å; W203-F207 VanDerWaalsContact O-CB 3.25Å; W203-F207 WeakPolarHBondContact O-CB 3.48Å; W203-F207 PolarHBondContact O-N 2.97Å
204	S	45.2	Very low	44.2	Very low	59 Å²	59	120.2 Å²	120.2	41%	0.413	58%	0.577	S	S	.	*	H	α-helix	trans	-66.8	-45.5	179.2	-173.8	0	0	0	0	112.4	K200 Q201 F207 L208	K200-S204 WeakPolarHBondContact O-CB 3.42Å; K200-S204 PolarHBondContact O-N 3.16Å; K200-S204 VanDerWaalsContact O-N 3.14Å; Q201-S204 PolarHBondContact O-N 2.94Å; S204-F207 PolarHBondContact O-N 3.47Å; S204-L208 WeakPolarHBondContact O-CB 3.32Å; S204-L208 PolarHBondContact O-N 3.2Å
205	L	50.3	Low	44.8	Very low	123 Å²	123	121.1 Å²	121.1	64%	0.644	58%	0.582	S	S	*	*	H	α-helix	trans	-67.6	-36.5	176.4	-77.8	157.3	0	0	0	112.8	Q201 W209	Q201-L205 PolarHBondContact O-N 3.48Å; L205-W209 VanDerWaalsContact O-CB 3.32Å; L205-W209 WeakPolarHBondContact O-CB 3.34Å; L205-W209 PolarHBondContact O-N 3.45Å
206	R	55.3	Low	45.2	Very low	178 Å²	178	123.9 Å²	123.9	67%	0.672	59%	0.586	S	S	*	*	H	α-helix	trans	-66.2	-41.2	172	-80.3	-171.2	180	-113.1	2.6	112	M202 W209 E210	M202-R206 WeakPolarHBondContact O-CB 3.41Å; M202-R206 WeakPolarHBondContact O-CG 3.5Å; M202-R206 PolarHBondContact O-N 3.33Å; R206-W209 PolarHBondContact O-N 3.1Å; R206-E210 WeakPolarHBondContact O-CB 3.42Å; R206-E210 VanDerWaalsContact O-CG 3.24Å; R206-E210 WeakPolarHBondContact O-CG 3.47Å; R206-E210 PolarHBondContact O-N 3.44Å
207	F	50.2	Low	45.7	Very low	145 Å²	145	118.8 Å²	118.8	64%	0.636	59%	0.589	S	S	*	*	H	α-helix	trans	-69.3	-34.4	178.7	-148	-94.9	0	0	0	112	W203 S204 L211	W203-F207 VanDerWaalsContact O-CB 3.25Å; W203-F207 WeakPolarHBondContact O-CB 3.48Å; W203-F207 PolarHBondContact O-N 2.97Å; S204-F207 PolarHBondContact O-N 3.47Å; F207-L211 HydrophobicContact CD1-CD1 3.94Å; F207-L211 HydrophobicContact CE1-CD1 3.85Å; F207-L211 WeakPolarHBondContact O-CB 3.31Å; F207-L211 PolarHBondContact O-N 2.94Å
208	L	53.2	Low	46	Very low	97 Å²	97	119.3 Å²	119.3	51%	0.508	60%	0.597	S	S	.	*	H	α-helix	trans	-70.7	-36.5	174.5	-132.6	125.6	0	0	0	112	S204 L211 L212	S204-L208 WeakPolarHBondContact O-CB 3.32Å; S204-L208 PolarHBondContact O-N 3.2Å; L208-L211 PolarHBondContact O-N 3.36Å; L208-L212 WeakPolarHBondContact O-CG 3.49Å; L208-L212 PolarHBondContact O-N 3.09Å
209	W	44.4	Very low	46.5	Very low	174 Å²	174	120.2 Å²	120.2	66%	0.659	61%	0.607	S	S	*	*	H	α-helix	trans	-67.4	-42.4	173	-173.9	-95.8	0	0	0	112.3	L205 R206 L212 L213	L205-W209 VanDerWaalsContact O-CB 3.32Å; L205-W209 WeakPolarHBondContact O-CB 3.34Å; L205-W209 PolarHBondContact O-N 3.45Å; R206-W209 PolarHBondContact O-N 3.1Å; W209-L212 PolarHBondContact O-N 3.41Å; W209-L213 WeakPolarHBondContact O-CG 3.27Å; W209-L213 PolarHBondContact O-N 3.39Å; W209-L213 VanDerWaalsContact O-N 3.14Å
210	E	50.5	Low	46.5	Very low	124 Å²	124	122.7 Å²	122.7	58%	0.579	62%	0.624	S	S	*	*	H	α-helix	trans	-66.7	-34.5	174.3	-69.8	-69.8	152.6	0	0	112.5	R206 L213 W214	R206-E210 WeakPolarHBondContact O-CB 3.42Å; R206-E210 VanDerWaalsContact O-CG 3.24Å; R206-E210 WeakPolarHBondContact O-CG 3.47Å; R206-E210 PolarHBondContact O-N 3.44Å; E210-L213 PolarHBondContact O-N 3.29Å; E210-W214 PolarHBondContact O-N 3.35Å
211	L	50.2	Low	46.3	Very low	96 Å²	96	125.5 Å²	125.5	50%	0.503	64%	0.636	S	S	.	*	H	α-helix	trans	-68.5	-39.4	174.7	-125.6	98	0	0	0	112.1	F207 L208 L213 W214 V215	F207-L211 HydrophobicContact CD1-CD1 3.94Å; F207-L211 HydrophobicContact CE1-CD1 3.85Å; F207-L211 WeakPolarHBondContact O-CB 3.31Å; F207-L211 PolarHBondContact O-N 2.94Å; L208-L211 PolarHBondContact O-N 3.36Å; L211-L213 VanDerWaalsContact C-N 3.33Å; L211-W214 PolarHBondContact O-N 3.13Å; L211-V215 WeakPolarHBondContact O-CG2 3.42Å; L211-V215 PolarHBondContact O-N 3.25Å; L211-V215 VanDerWaalsContact O-N 3.1Å
212	L	56.5	Low	45.8	Very low	101 Å²	101	127.8 Å²	127.8	53%	0.529	65%	0.651	S	S	.	*	H	α-helix	trans	-63.7	-39	175.9	-82.3	162.9	0	0	0	111.5	L208 W209 W214 V215 D216	L208-L212 WeakPolarHBondContact O-CG 3.49Å; L208-L212 PolarHBondContact O-N 3.09Å; W209-L212 PolarHBondContact O-N 3.41Å; L212-W214 PolarHBondContact O-N 2.64Å; L212-V215 PolarHBondContact O-N 2.99Å; L212-D216 PolarHBondContact O-N 2.92Å
213	L	52.8	Low	45.9	Very low	87 Å²	87	128.1 Å²	128.1	46%	0.455	66%	0.663	S	S	.	*	H	α-helix	trans	-63.9	-25.5	174.8	-71.5	170.4	0	0	0	113.5	W209 E210 L211	W209-L213 WeakPolarHBondContact O-CG 3.27Å; W209-L213 PolarHBondContact O-N 3.39Å; W209-L213 VanDerWaalsContact O-N 3.14Å; E210-L213 PolarHBondContact O-N 3.29Å; L211-L213 VanDerWaalsContact C-N 3.33Å
214	W	44.2	Very low	45.5	Very low	217 Å²	217	124.1 Å²	124.1	82%	0.822	67%	0.668	S	S	*	*	H	α-helix	trans	-90.5	-24.6	179.4	-136.6	60.1	0	0	0	113.6	E210 L211 L212	E210-W214 PolarHBondContact O-N 3.35Å; L211-W214 PolarHBondContact O-N 3.13Å; L212-W214 PolarHBondContact O-N 2.64Å
215	V	47	Very low	45	Very low	114 Å²	114	130.1 Å²	130.1	69%	0.691	69%	0.694	S	S	*	*	H	α-helix	trans	-76.8	-33.8	177	167.3	0	0	0	0	112.2	L211 L212 G217	L211-V215 WeakPolarHBondContact O-CG2 3.42Å; L211-V215 PolarHBondContact O-N 3.25Å; L211-V215 VanDerWaalsContact O-N 3.1Å; L212-V215 PolarHBondContact O-N 2.99Å; V215-G217 VanDerWaalsContact C-N 3.32Å; V215-G217 PolarHBondContact O-N 2.9Å
216	D	40.7	Very low	44.2	Very low	135 Å²	135	127 Å²	127	72%	0.722	69%	0.693	S	S	*	*	S	Bend	trans	-83.3	0.7	-174.3	-112.9	-20.3	0	0	0	115.1	L212 A218	L212-D216 PolarHBondContact O-N 2.92Å; D216-A218 PolarHBondContact O-N 3.37Å
217	G	46.1	Very low	43.3	Very low	72 Å²	72	125.2 Å²	125.2	74%	0.742	70%	0.701	S	S	*	*			trans	58.7	15.7	173.3	0	0	0	0	0	115.3	V215	V215-G217 VanDerWaalsContact C-N 3.32Å; V215-G217 PolarHBondContact O-N 2.9Å
218	A	42.2	Very low	42.5	Very low	67 Å²	67	121.7 Å²	121.7	55%	0.554	71%	0.706	S	S	*	*			trans	-98	99.7	175.1	0	0	0	0	0	109.1	D216 P220	D216-A218 PolarHBondContact O-N 3.37Å; A218-P220 WeakPolarHBondContact O-CD 3.14Å
219	S	45.7	Very low	41.8	Very low	113 Å²	113	126.5 Å²	126.5	79%	0.79	72%	0.723	S	S	*	*			trans	-59.5	125.3	163	-69.6	0	0	0	0	108.6	K221	S219-K221 PolarHBondContact O-N 2.99Å
220	P	37.3	Very low	41.4	Very low	120 Å²	120	124.6 Å²	124.6	78%	0.779	73%	0.726	S	S	*	*			trans	-67.5	104.9	172.1	25.3	-29.8	0	0	0	108.2	A218 L222	A218-P220 WeakPolarHBondContact O-CD 3.14Å; P220-L222 PolarHBondContact O-N 3.04Å; P220-L222 VanDerWaalsContact O-N 3.16Å
221	K	36.4	Very low	40.7	Very low	204 Å²	204	127 Å²	127	89%	0.887	74%	0.739	S	S	*	*			trans	-70.1	106.5	167	-142.7	174.2	-172.2	177	0	106.2	S219	S219-K221 PolarHBondContact O-N 2.99Å
222	L	38.5	Very low	40.2	Very low	160 Å²	160	130.8 Å²	130.8	84%	0.838	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-51.3	128.4	170.2	-78	156.1	0	0	0	109.2	P220 A224	P220-L222 PolarHBondContact O-N 3.04Å; P220-L222 VanDerWaalsContact O-N 3.16Å; L222-A224 PolarHBondContact O-N 3.12Å
223	P	34.6	Very low	39.8	Very low	124 Å²	124	130.8 Å²	130.8	81%	0.805	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-68.1	121	160.5	26.1	-27.3	0	0	0	107.9
224	A	33.7	Very low	39.2	Very low	97 Å²	97	134.2 Å²	134.2	80%	0.802	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-64.2	142.5	173.9	0	0	0	0	0	110.7	L222	L222-A224 PolarHBondContact O-N 3.12Å
225	L	35.6	Very low	39.7	Very low	184 Å²	184	128.3 Å²	128.3	96%	0.963	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-68.5	137.7	173.6	-178.5	71.3	0	0	0	111.7
226	G	33.6	Very low	39.5	Very low	59 Å²	59	130.3 Å²	130.3	61%	0.608	77%	0.765	S	S	*	*			trans	118.4	137	165.3	0	0	0	0	0	112.6
227	T	34.7	Very low	39.4	Very low	139 Å²	139	130.1 Å²	130.1	85%	0.853	76%	0.764	S	S	*	*			cis	-165.8	127.3	8.2	41.2	0	0	0	0	104.4
228	G	35.2	Very low	39.1	Very low	72 Å²	72	135.3 Å²	135.3	74%	0.742	77%	0.769	S	S	*	*				69.1	123.9	104.1	0	0	0	0	0	115.6
229	K	38.2	Very low	39.2	Very low	198 Å²	198	143.3 Å²	143.3	86%	0.861	80%	0.802	S	S	*	*			trans	85.3	130.2	164.2	-71.2	-177.1	178	176.7	0	115.9
230	D	35.6	Very low	38.8	Very low	133 Å²	133	144.9 Å²	144.9	71%	0.711	80%	0.802	S	S	*	*			cis	-152.2	133.9	27.4	-70.9	-59.4	0	0	0	109.7
231	M	36	Very low	38.9	Very low	175 Å²	175	146.2 Å²	146.2	86%	0.862	80%	0.803	S	S	*	*				80.5	101.8	98.6	-153.3	167.9	-74.5	0	0	115.6
232	E	39.8	Very low	39.1	Very low	175 Å²	175	142.9 Å²	142.9	82%	0.818	80%	0.799	S	S	*	*			trans	19	166.2	139.8	-111.9	-162.5	99.6	0	0	122.7
233	P	47.5	Very low	39.1	Very low	101 Å²	101	141.9 Å²	141.9	66%	0.656	80%	0.796	S	S	*	*			cis	-127.1	177	-28.1	18.9	5.2	0	0	0	113.8
234	E	40.8	Very low	39.4	Very low	159 Å²	159	143.1 Å²	143.1	74%	0.743	80%	0.796	S	S	*	*			trans	-42.7	169.9	154.8	-129.3	-135.1	121.7	0	0	112.8	E236	E234-E236 PolarHBondContact OE1-N 2.83Å; E234-E236 VanDerWaalsContact OE1-N 3.12Å
235	P	55.2	Low	39.7	Very low	94 Å²	94	146.1 Å²	146.1	61%	0.61	80%	0.796	S	S	*	*			cis	-155.6	-179.8	41.7	36.1	-8.3	0	0	0	119.6
236	E	41.2	Very low	40	Very low	155 Å²	155	143.4 Å²	143.4	72%	0.724	78%	0.784	S	S	*	*			trans	92.5	108.9	147.5	-45	-159.7	178.5	0	0	121.1	E234	E234-E236 PolarHBondContact OE1-N 2.83Å; E234-E236 VanDerWaalsContact OE1-N 3.12Å
237	N	39.8	Very low	40.5	Very low	131 Å²	131	149.9 Å²	149.9	70%	0.701	80%	0.797	S	S	*	*				56.3	120.7	111	-148.4	14	0	0	0	118.8
238	Q	39.6	Very low	41	Very low	182 Å²	182	150.8 Å²	150.8	85%	0.85	79%	0.792	S	S	*	*				-171.4	141.3	112.2	-99.4	174.9	100.3	0	0	112.7
239	L	43.3	Very low	41.5	Very low	235 Å²	235	158 Å²	158	100%	1.23	80%	0.797	S	S	*	*			trans	-27.9	0	171.6	-76.2	131.4	0	0	0	118

Retrieved 239 of 239 residues in 174 ms (Link to these results)

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