A0A093H3M9_STRCA Loading...

Twisted gastrulation protein 1

AlphaFold DB , UniProt , Accession A0A093H3M9, Species STRCA (Struthio camelus australis), Gene n/a, Length 223 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	48.7	Very low	54	Low	242 Å²	242	128.7 Å²	128.7	100%	1.192	66%	0.658	S	S	*	*				0	60.8	0	-70.7	174.7	154.9	0	0	111.7
2	R	49.8	Very low	54.8	Low	235 Å²	235	124.1 Å²	124.1	89%	0.887	64%	0.64	S	S	*	*			trans	-143.8	5.5	-176.9	-141.7	174.9	174.1	-169.5	-3	114.7
3	S	47.5	Very low	55.8	Low	93 Å²	93	121.2 Å²	121.2	65%	0.65	63%	0.631	S	S	*	*	S	Bend	trans	-103.5	-22.9	-175.3	176	0	0	0	0	113
4	Q	49.5	Very low	56.2	Low	160 Å²	160	120.1 Å²	120.1	75%	0.748	63%	0.626	S	S	*	*	H	α-helix	trans	-80.5	-14.2	-177.2	-70	176	-26.3	0	0	114.5	T7	Q4-T7 PolarHBondContact O-OG1 3.33Å
5	Y	51.4	Low	56.6	Low	205 Å²	205	117.3 Å²	117.3	80%	0.804	61%	0.611	S	S	*	*	H	α-helix	trans	-87.6	-15.9	179.9	-88.6	-84.6	0	0	0	113.9	P9	Y5-P9 VanDerWaalsContact O-CD 3.24Å; Y5-P9 WeakPolarHBondContact O-CD 3.24Å
6	V	52.7	Low	56.8	Low	96 Å²	96	118.6 Å²	118.6	58%	0.582	61%	0.611	S	S	*	*	H	α-helix	trans	-92.7	-26.9	-179.8	-177.1	0	0	0	0	111.5	P9 T10	V6-P9 WeakPolarHBondContact O-CD 3.35Å; V6-P9 WeakPolarHBondContact O-CG 3.27Å; V6-T10 PolarHBondContact O-OG1 2.83Å
7	T	53.4	Low	56.8	Low	74 Å²	74	117.9 Å²	117.9	45%	0.454	61%	0.608	S	S	.	*	H	α-helix	trans	-75.2	-33.4	-177.6	50.8	0	0	0	0	113.4	Q4 T10 V11	Q4-T7 PolarHBondContact O-OG1 3.33Å; T7-T10 WeakPolarHBondContact CA-OG1 3.1Å; T7-T10 PolarHBondContact O-OG1 2.8Å; T7-V11 VanDerWaalsContact O-CG2 3.27Å; T7-V11 WeakPolarHBondContact O-CG2 3.39Å; T7-V11 PolarHBondContact O-N 3.41Å; T7-V11 VanDerWaalsContact O-N 3.14Å
8	V	56.7	Low	56.7	Low	93 Å²	93	117.3 Å²	117.3	56%	0.564	61%	0.605	S	S	*	*	H	α-helix	trans	-62.3	-51.2	179.4	-178.4	0	0	0	0	112.7	T10 V11 T12	V8-T10 VanDerWaalsContact C-N 3.32Å; V8-T10 PolarHBondContact O-N 3.25Å; V8-V11 PolarHBondContact O-N 2.96Å; V8-T12 PolarHBondContact O-N 2.98Å; V8-T12 PolarHBondContact O-OG1 3.31Å
9	P	57.4	Low	56.4	Low	64 Å²	64	120.4 Å²	120.4	42%	0.416	61%	0.608	S	S	.	*	H	α-helix	trans	-66.9	-32.4	-179.6	25	-34	0	0	0	112.7	Y5 V6 T12 V13	Y5-P9 VanDerWaalsContact O-CD 3.24Å; Y5-P9 WeakPolarHBondContact O-CD 3.24Å; V6-P9 WeakPolarHBondContact O-CD 3.35Å; V6-P9 WeakPolarHBondContact O-CG 3.27Å; P9-T12 VanDerWaalsContact CA-OG1 3.31Å; P9-T12 WeakPolarHBondContact CA-OG1 3.32Å; P9-T12 PolarHBondContact O-OG1 3.2Å; P9-V13 VanDerWaalsContact O-CG2 3.28Å; P9-V13 WeakPolarHBondContact O-CG2 3.4Å; P9-V13 PolarHBondContact O-N 2.8Å; P9-V13 VanDerWaalsContact O-N 3.08Å
10	T	60.3	Low	56.1	Low	72 Å²	72	120 Å²	120	44%	0.442	61%	0.607	S	S	.	*	H	α-helix	trans	-67.9	-38.9	177.5	47	0	0	0	0	112.3	V6 T7 V8 V13 L14	V6-T10 PolarHBondContact O-OG1 2.83Å; T7-T10 WeakPolarHBondContact CA-OG1 3.1Å; T7-T10 PolarHBondContact O-OG1 2.8Å; V8-T10 VanDerWaalsContact C-N 3.32Å; V8-T10 PolarHBondContact O-N 3.25Å; T10-V13 PolarHBondContact O-N 2.88Å; T10-L14 WeakPolarHBondContact O-CB 3.26Å; T10-L14 WeakPolarHBondContact O-CD1 3.39Å; T10-L14 PolarHBondContact O-N 2.8Å
11	V	66.2	Low	55.6	Low	82 Å²	82	122 Å²	122	50%	0.497	61%	0.614	S	S	.	*	H	α-helix	trans	-69.8	-37.9	178.6	172.8	0	0	0	0	111	T7 V8 L14 L15	T7-V11 VanDerWaalsContact O-CG2 3.27Å; T7-V11 WeakPolarHBondContact O-CG2 3.39Å; T7-V11 PolarHBondContact O-N 3.41Å; T7-V11 VanDerWaalsContact O-N 3.14Å; V8-V11 PolarHBondContact O-N 2.96Å; V11-L14 PolarHBondContact O-N 2.86Å; V11-L15 HydrophobicContact CG1-CD1 3.94Å; V11-L15 WeakPolarHBondContact O-CB 3.33Å; V11-L15 WeakPolarHBondContact O-CG 3.24Å; V11-L15 PolarHBondContact O-N 3.07Å
12	T	63.5	Low	55.3	Low	73 Å²	73	115.5 Å²	115.5	45%	0.448	59%	0.592	S	S	.	*	H	α-helix	trans	-67.2	-36.6	175.6	46.9	0	0	0	0	113	V8 P9 F16	V8-T12 PolarHBondContact O-N 2.98Å; V8-T12 PolarHBondContact O-OG1 3.31Å; P9-T12 VanDerWaalsContact CA-OG1 3.31Å; P9-T12 WeakPolarHBondContact CA-OG1 3.32Å; P9-T12 PolarHBondContact O-OG1 3.2Å; T12-F16 PolarHBondContact O-N 2.71Å
13	V	68.8	Low	55.1	Low	86 Å²	86	108.6 Å²	108.6	52%	0.521	58%	0.581	S	S	.	*	H	α-helix	trans	-70.3	-40.7	175.7	171.4	0	0	0	0	111	P9 T10 F16 L17	P9-V13 VanDerWaalsContact O-CG2 3.28Å; P9-V13 WeakPolarHBondContact O-CG2 3.4Å; P9-V13 PolarHBondContact O-N 2.8Å; P9-V13 VanDerWaalsContact O-N 3.08Å; T10-V13 PolarHBondContact O-N 2.88Å; V13-F16 PolarHBondContact O-N 2.94Å; V13-L17 HydrophobicContact CG1-CD1 4.04Å; V13-L17 HydrophobicContact CG1-CG 4.46Å; V13-L17 VanDerWaalsContact O-CG 3.32Å; V13-L17 WeakPolarHBondContact O-CG 3.35Å; V13-L17 PolarHBondContact O-N 2.8Å
14	L	61.1	Low	55.5	Low	106 Å²	106	110.1 Å²	110.1	56%	0.555	59%	0.586	S	S	*	*	H	α-helix	trans	-63.3	-40.4	174.3	-92.9	147.2	0	0	0	112.5	T10 V11 F16 L17 L18	T10-L14 WeakPolarHBondContact O-CB 3.26Å; T10-L14 WeakPolarHBondContact O-CD1 3.39Å; T10-L14 PolarHBondContact O-N 2.8Å; V11-L14 PolarHBondContact O-N 2.86Å; L14-F16 VanDerWaalsContact C-N 3.33Å; L14-L17 PolarHBondContact O-N 3.49Å; L14-L18 WeakPolarHBondContact O-CD1 3.29Å; L14-L18 WeakPolarHBondContact O-CG 3.44Å; L14-L18 PolarHBondContact O-N 2.89Å; L14-L18 VanDerWaalsContact O-N 3.08Å
15	L	61.9	Low	56.2	Low	79 Å²	79	104.1 Å²	104.1	41%	0.414	57%	0.567	S	S	.	*	H	α-helix	trans	-64.2	-37.6	172.5	-78.1	162.3	0	0	0	111.9	V11 L18 W19	V11-L15 HydrophobicContact CG1-CD1 3.94Å; V11-L15 WeakPolarHBondContact O-CB 3.33Å; V11-L15 WeakPolarHBondContact O-CG 3.24Å; V11-L15 PolarHBondContact O-N 3.07Å; L15-L18 PolarHBondContact O-N 3.06Å; L15-W19 HydrophobicContact CB-CH2 3.86Å; L15-W19 HydrophobicContact CB-CZ2 4.23Å; L15-W19 HydrophobicContact CB-CZ3 4.27Å; L15-W19 VanDerWaalsContact O-CE3 3.3Å; L15-W19 PolarHBondContact O-N 3.32Å
16	F	59.9	Low	57.7	Low	138 Å²	138	95.4 Å²	95.4	61%	0.605	54%	0.536	S	S	*	.	H	α-helix	trans	-66	-40.5	174.8	-120.3	-85.5	0	0	0	113.4	T12 V13 L14 L18 W19 I20	T12-F16 PolarHBondContact O-N 2.71Å; V13-F16 PolarHBondContact O-N 2.94Å; L14-F16 VanDerWaalsContact C-N 3.33Å; F16-L18 VanDerWaalsContact C-N 3.31Å; F16-L18 PolarHBondContact O-N 3.21Å; F16-W19 VanDerWaalsContact CA-CE3 3.45Å; F16-W19 HydrophobicContact CB-CE3 4.25Å; F16-W19 HydrophobicContact CB-CZ3 4.36Å; F16-W19 HydrophobicContact CD1-CE3 4.34Å; F16-W19 AromaticContact CD2-CE3 3.86Å; F16-W19 HydrophobicContact CD2-CE3 3.86Å; F16-W19 AromaticContact CD2-CZ3 3.5Å; F16-W19 HydrophobicContact CD2-CZ3 3.5Å; F16-W19 VanDerWaalsContact CD2-CZ3 3.5Å; F16-W19 HydrophobicContact CE2-CE3 4.24Å; F16-W19 AromaticContact CE2-CZ3 3.9Å; F16-W19 HydrophobicContact CE2-CZ3 3.9Å; F16-W19 AromaticContact CG-CE3 3.9Å; F16-W19 HydrophobicContact CG-CE3 3.9Å; F16-W19 AromaticContact CG-CZ3 3.99Å; F16-W19 HydrophobicContact CG-CZ3 3.99Å; F16-W19 PolarHBondContact O-N 3.27Å; F16-I20 WeakPolarHBondContact O-CG1 3.35Å
17	L	57.1	Low	59.2	Low	106 Å²	106	95 Å²	95	56%	0.555	53%	0.53	S	S	*	.	H	α-helix	trans	-69.3	-29.1	176.8	-68.3	169.3	0	0	0	112.4	V13 L14 W19 I20	V13-L17 HydrophobicContact CG1-CD1 4.04Å; V13-L17 HydrophobicContact CG1-CG 4.46Å; V13-L17 VanDerWaalsContact O-CG 3.32Å; V13-L17 WeakPolarHBondContact O-CG 3.35Å; V13-L17 PolarHBondContact O-N 2.8Å; L14-L17 PolarHBondContact O-N 3.49Å; L17-W19 VanDerWaalsContact C-N 3.3Å; L17-W19 PolarHBondContact O-N 2.8Å; L17-I20 HydrophobicContact CD2-CD1 4.15Å; L17-I20 PolarHBondContact O-N 3.05Å
18	L	55.6	Low	60.7	Low	108 Å²	108	99.3 Å²	99.3	57%	0.565	54%	0.543	S	S	*	.	H	α-helix	trans	-71.8	-19.9	173.1	-75.8	160.9	0	0	0	113.4	L14 L15 F16 I20	L14-L18 WeakPolarHBondContact O-CD1 3.29Å; L14-L18 WeakPolarHBondContact O-CG 3.44Å; L14-L18 PolarHBondContact O-N 2.89Å; L14-L18 VanDerWaalsContact O-N 3.08Å; L15-L18 PolarHBondContact O-N 3.06Å; F16-L18 VanDerWaalsContact C-N 3.31Å; F16-L18 PolarHBondContact O-N 3.21Å; L18-I20 VanDerWaalsContact C-N 3.34Å
19	W	50.2	Low	62	Low	175 Å²	175	99.1 Å²	99.1	66%	0.663	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-11.3	172.4	-65.9	-45.6	0	0	0	113.6	L15 F16 L17 Q21	L15-W19 HydrophobicContact CB-CH2 3.86Å; L15-W19 HydrophobicContact CB-CZ2 4.23Å; L15-W19 HydrophobicContact CB-CZ3 4.27Å; L15-W19 VanDerWaalsContact O-CE3 3.3Å; L15-W19 PolarHBondContact O-N 3.32Å; F16-W19 VanDerWaalsContact CA-CE3 3.45Å; F16-W19 HydrophobicContact CB-CE3 4.25Å; F16-W19 HydrophobicContact CB-CZ3 4.36Å; F16-W19 HydrophobicContact CD1-CE3 4.34Å; F16-W19 AromaticContact CD2-CE3 3.86Å; F16-W19 HydrophobicContact CD2-CE3 3.86Å; F16-W19 AromaticContact CD2-CZ3 3.5Å; F16-W19 HydrophobicContact CD2-CZ3 3.5Å; F16-W19 VanDerWaalsContact CD2-CZ3 3.5Å; F16-W19 HydrophobicContact CE2-CE3 4.24Å; F16-W19 AromaticContact CE2-CZ3 3.9Å; F16-W19 HydrophobicContact CE2-CZ3 3.9Å; F16-W19 AromaticContact CG-CE3 3.9Å; F16-W19 HydrophobicContact CG-CE3 3.9Å; F16-W19 AromaticContact CG-CZ3 3.99Å; F16-W19 HydrophobicContact CG-CZ3 3.99Å; F16-W19 PolarHBondContact O-N 3.27Å; L17-W19 VanDerWaalsContact C-N 3.3Å; L17-W19 PolarHBondContact O-N 2.8Å; W19-Q21 PolarHBondContact O-N 2.95Å; W19-Q21 VanDerWaalsContact O-N 3.16Å
20	I	50.6	Low	63.3	Low	112 Å²	112	99.9 Å²	99.9	57%	0.574	55%	0.551	S	S	*	*			trans	-88.7	41.8	174.9	-41.7	175.5	0	0	0	109.8	F16 L17 L18 S22	F16-I20 WeakPolarHBondContact O-CG1 3.35Å; L17-I20 HydrophobicContact CD2-CD1 4.15Å; L17-I20 PolarHBondContact O-N 3.05Å; L18-I20 VanDerWaalsContact C-N 3.34Å; I20-S22 PolarHBondContact O-N 3.17Å
21	Q	45.6	Very low	64.7	Low	162 Å²	162	96.5 Å²	96.5	76%	0.757	53%	0.531	S	S	*	.			trans	-72.1	92.5	160.9	-71.7	-172.5	-25.7	0	0	106.8	W19 S23	W19-Q21 PolarHBondContact O-N 2.95Å; W19-Q21 VanDerWaalsContact O-N 3.16Å; Q21-S23 VanDerWaalsContact C-N 3.28Å; Q21-S23 PolarHBondContact O-N 3.4Å
22	S	42.8	Very low	65.8	Low	106 Å²	106	95 Å²	95	74%	0.741	53%	0.527	S	S	*	.			trans	-54	98.2	164.3	-54.2	0	0	0	0	107.3	I20 T24	I20-S22 PolarHBondContact O-N 3.17Å; S22-T24 PolarHBondContact O-N 3.05Å
23	S	44.5	Very low	67.2	Low	91 Å²	91	95.7 Å²	95.7	64%	0.636	53%	0.534	S	S	*	.			trans	-65.1	118	175.6	58.3	0	0	0	0	107.5	Q21 G25	Q21-S23 VanDerWaalsContact C-N 3.28Å; Q21-S23 PolarHBondContact O-N 3.4Å; S23-G25 PolarHBondContact O-N 2.87Å
24	T	56.8	Low	68.2	Low	124 Å²	124	93.7 Å²	93.7	76%	0.761	52%	0.521	S	S	*	.	S	Bend	trans	-67.3	63.9	154.5	48.7	0	0	0	0	108.4	S22	S22-T24 PolarHBondContact O-N 3.05Å
25	G	64.1	Low	69.6	Low	34 Å²	34	89.2 Å²	89.2	35%	0.351	50%	0.498	S	S	.	.	S	Bend	trans	-164	157.4	-172.2	0	0	0	0	0	110.6	S23 N27	S23-G25 PolarHBondContact O-N 2.87Å; G25-N27 PolarHBondContact O-N 3.27Å
26	C	81.9	Confident	71	Confident	23 Å²	23	88.4 Å²	88.4	16%	0.155	50%	0.499	C	S	.	.			trans	-56.2	131.8	-169	-174.6	0	0	0	0	113.8	K28 D72 C73	C26-K28 PolarHBondContact O-N 3.28Å; C26-D72 HydrophobicContact CB-CB 3.84Å; C26-C73 HydrophobicContact CB-CB 3.78Å; C26-C73 WeakPolarHBondContact CB-SG 3.33Å; C26-C73 WeakPolarHBondContact SG-CB 3.49Å; C26-C73 CovalentContact SG-SG 2Å; C26-C73 PolarHBondContact SG-SG 3.01Å
27	N	85.4	Confident	72.6	Confident	87 Å²	87	86.8 Å²	86.8	47%	0.465	49%	0.492	S	S	.	.			trans	-74.8	88.2	170.8	-173.4	-19.8	0	0	0	110.4	G25 A29 L30 C31	G25-N27 PolarHBondContact O-N 3.27Å; N27-A29 PolarHBondContact O-N 3.01Å; N27-A29 VanDerWaalsContact O-N 3.1Å; N27-A29 PolarHBondContact OD1-N 3.45Å; N27-L30 HydrophobicContact CB-CB 4.14Å; N27-L30 PolarHBondContact O-N 3.29Å; N27-L30 PolarHBondContact OD1-N 3.03Å; N27-C31 WeakPolarHBondContact O-CB 3.27Å; N27-C31 PolarHBondContact O-N 2.9Å; N27-C31 PolarHBondContact O-SG 3.14Å
28	K	84.3	Confident	74.3	Confident	164 Å²	164	81.8 Å²	81.8	71%	0.713	47%	0.465	S	S	*	.	H	α-helix	trans	-57.1	-27.8	-178.2	-64.2	-177.6	-178.5	-178.3	0	113.6	C26 A32	C26-K28 PolarHBondContact O-N 3.28Å; K28-A32 WeakPolarHBondContact O-CA 3.33Å; K28-A32 WeakPolarHBondContact O-CB 3.39Å; K28-A32 PolarHBondContact O-N 3.22Å
29	A	84.9	Confident	75.9	Confident	90 Å²	90	79.8 Å²	79.8	74%	0.744	46%	0.455	S	S	*	.	H	α-helix	trans	-72.8	-42.7	179.9	0	0	0	0	0	111.9	N27	N27-A29 PolarHBondContact O-N 3.01Å; N27-A29 VanDerWaalsContact O-N 3.1Å; N27-A29 PolarHBondContact OD1-N 3.45Å
30	L	84.1	Confident	77.9	Confident	80 Å²	80	78 Å²	78	42%	0.419	46%	0.457	S	S	.	.	H	α-helix	trans	-69.6	-44.9	175.6	-176.3	65.5	0	0	0	111.2	N27 L66 E69	N27-L30 HydrophobicContact CB-CB 4.14Å; N27-L30 PolarHBondContact O-N 3.29Å; N27-L30 PolarHBondContact OD1-N 3.03Å; L30-L66 HydrophobicContact CD1-CD2 4.33Å; L30-L66 HydrophobicContact CD2-CD2 4.19Å; L30-L66 HydrophobicContact CG-CD2 4.01Å; L30-E69 HydrophobicContact CD2-CB 4.37Å; L30-E69 WeakPolarHBondContact CD2-OE2 3.44Å
31	C	89.2	Confident	79.8	Confident	1 Å²	1	77.6 Å²	77.6	1%	0.007	45%	0.453	C	S	.	.	H	α-helix	trans	-84	-13.2	-171	-59.4	0	0	0	0	114.3	N27 S33 V35 C70	N27-C31 WeakPolarHBondContact O-CB 3.27Å; N27-C31 PolarHBondContact O-N 2.9Å; N27-C31 PolarHBondContact O-SG 3.14Å; C31-S33 VanDerWaalsContact C-N 3.34Å; C31-S33 PolarHBondContact O-N 3.19Å; C31-V35 HydrophobicContact CB-CG2 3.8Å; C31-V35 WeakPolarHBondContact O-CB 3.1Å; C31-V35 VanDerWaalsContact O-CG2 3.23Å; C31-V35 WeakPolarHBondContact O-CG2 3.3Å; C31-V35 PolarHBondContact O-N 3.45Å; C31-C70 WeakPolarHBondContact CA-SG 3.32Å; C31-C70 HydrophobicContact CB-CB 3.69Å; C31-C70 WeakPolarHBondContact CB-SG 3.3Å; C31-C70 WeakPolarHBondContact SG-CA 3.32Å; C31-C70 WeakPolarHBondContact SG-CB 3.29Å; C31-C70 CovalentContact SG-SG 2.02Å; C31-C70 PolarHBondContact SG-SG 2.96Å
32	A	90.4	Very high	81.8	Confident	50 Å²	50	76.5 Å²	76.5	41%	0.413	45%	0.448	S	S	.	.	H	α-helix	trans	-53.3	-46.8	-171.5	0	0	0	0	0	113.4	K28 S36	K28-A32 WeakPolarHBondContact O-CA 3.33Å; K28-A32 WeakPolarHBondContact O-CB 3.39Å; K28-A32 PolarHBondContact O-N 3.22Å; A32-S36 WeakPolarHBondContact O-CB 3.48Å; A32-S36 PolarHBondContact O-N 3.35Å; A32-S36 VanDerWaalsContact O-N 3.09Å; A32-S36 PolarHBondContact O-OG 3Å
33	S	91.5	Very high	83.8	Confident	87 Å²	87	74 Å²	74	61%	0.608	43%	0.426	S	S	*	.	H	α-helix	trans	-65.9	-58.6	-175.6	177.6	0	0	0	0	111.5	C31 S36 K37	C31-S33 VanDerWaalsContact C-N 3.34Å; C31-S33 PolarHBondContact O-N 3.19Å; S33-S36 PolarHBondContact O-N 2.03Å; S33-K37 WeakPolarHBondContact O-CB 3.43Å; S33-K37 PolarHBondContact O-N 2.69Å
34	D	90.4	Very high	85.8	Confident	45 Å²	45	70 Å²	70	24%	0.241	40%	0.397	C	S	.	.	H	α-helix	trans	-71.6	-38.4	-173.9	-66.3	-81.2	0	0	0	112.5	S36 K37 C38 L63 L66	D34-S36 PolarHBondContact O-N 3.34Å; D34-K37 PolarHBondContact O-N 3.28Å; D34-C38 WeakPolarHBondContact O-CB 3.39Å; D34-C38 PolarHBondContact O-N 3.19Å; D34-C38 PolarHBondContact O-SG 3.45Å; D34-L63 HydrophobicContact CB-CD2 4.23Å; D34-L66 HydrophobicContact CB-CD1 4.06Å; D34-L66 WeakPolarHBondContact OD2-CD1 3.31Å
35	V	90.9	Very high	87	Confident	12 Å²	12	70 Å²	70	7%	0.073	39%	0.388	C	S	.	.	H	α-helix	trans	-62.8	-43.9	173.2	173.1	0	0	0	0	110.7	C31 K37 C38 L39 L63 C70 C73 V74	C31-V35 HydrophobicContact CB-CG2 3.8Å; C31-V35 WeakPolarHBondContact O-CB 3.1Å; C31-V35 VanDerWaalsContact O-CG2 3.23Å; C31-V35 WeakPolarHBondContact O-CG2 3.3Å; C31-V35 PolarHBondContact O-N 3.45Å; V35-K37 PolarHBondContact O-N 2.84Å; V35-C38 PolarHBondContact O-N 3.39Å; V35-L39 HydrophobicContact CG1-CD1 3.66Å; V35-L39 HydrophobicContact CG1-CG 4.22Å; V35-L39 WeakPolarHBondContact O-CB 3.31Å; V35-L39 VanDerWaalsContact O-CG 3.25Å; V35-L39 WeakPolarHBondContact O-CG 3.28Å; V35-L39 PolarHBondContact O-N 3.16Å; V35-L63 HydrophobicContact CG2-CD2 3.83Å; V35-C70 HydrophobicContact CG2-CB 4.09Å; V35-C73 HydrophobicContact CG1-CB 4.35Å; V35-C73 HydrophobicContact CG2-CB 4.01Å; V35-V74 HydrophobicContact CG1-CG1 3.76Å; V35-V74 HydrophobicContact CG2-CG1 4.38Å
36	S	91.6	Very high	87.6	Confident	61 Å²	61	69.2 Å²	69.2	43%	0.427	38%	0.378	S	S	.	.	H	α-helix	trans	-62.7	-43.8	177.2	-61.5	0	0	0	0	111.5	A32 S33 D34 C38 L39 I40	A32-S36 WeakPolarHBondContact O-CB 3.48Å; A32-S36 PolarHBondContact O-N 3.35Å; A32-S36 VanDerWaalsContact O-N 3.09Å; A32-S36 PolarHBondContact O-OG 3Å; S33-S36 PolarHBondContact O-N 2.03Å; D34-S36 PolarHBondContact O-N 3.34Å; S36-C38 PolarHBondContact O-N 3.08Å; S36-L39 PolarHBondContact O-N 2.88Å; S36-I40 WeakPolarHBondContact O-CB 3.27Å; S36-I40 WeakPolarHBondContact O-CD1 3.41Å; S36-I40 WeakPolarHBondContact O-CG1 3.43Å; S36-I40 PolarHBondContact O-N 2.73Å
37	K	93.1	Very high	86.9	Confident	105 Å²	105	77.7 Å²	77.7	46%	0.457	41%	0.407	S	S	.	.	H	α-helix	trans	-57.5	-49.4	175.8	178.8	-172.6	171.8	-165.2	0	111.4	S33 D34 V35 L39 I40 Q41	S33-K37 WeakPolarHBondContact O-CB 3.43Å; S33-K37 PolarHBondContact O-N 2.69Å; D34-K37 PolarHBondContact O-N 3.28Å; V35-K37 PolarHBondContact O-N 2.84Å; K37-L39 PolarHBondContact O-N 2.82Å; K37-I40 PolarHBondContact O-N 2.95Å; K37-Q41 WeakPolarHBondContact O-CG 3.04Å; K37-Q41 PolarHBondContact O-N 3.06Å
38	C	91.7	Very high	85.8	Confident	0 Å²	0	76.3 Å²	76.3	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-70.3	-30.8	-177.8	-60.3	0	0	0	0	113.4	D34 V35 S36 E42 L43 C44 C62	D34-C38 WeakPolarHBondContact O-CB 3.39Å; D34-C38 PolarHBondContact O-N 3.19Å; D34-C38 PolarHBondContact O-SG 3.45Å; V35-C38 PolarHBondContact O-N 3.39Å; S36-C38 PolarHBondContact O-N 3.08Å; C38-E42 PolarHBondContact O-N 2.98Å; C38-L43 PolarHBondContact O-N 3.22Å; C38-C44 HydrophobicContact CB-CB 4.23Å; C38-C44 WeakPolarHBondContact CB-SG 3.41Å; C38-C44 PolarHBondContact O-N 2.95Å; C38-C62 WeakPolarHBondContact CA-SG 3.44Å; C38-C62 HydrophobicContact CB-CB 3.83Å; C38-C62 WeakPolarHBondContact CB-SG 3.35Å; C38-C62 WeakPolarHBondContact SG-CB 3.48Å; C38-C62 CovalentContact SG-SG 2.02Å; C38-C62 PolarHBondContact SG-SG 3.31Å
39	L	89.1	Confident	84.7	Confident	66 Å²	66	72.4 Å²	72.4	35%	0.346	41%	0.409	S	S	.	.	H	α-helix	trans	-71.1	-39.3	173.3	-75	170.5	0	0	0	112.5	V35 S36 K37 Q41 E42 C44 Q45	V35-L39 HydrophobicContact CG1-CD1 3.66Å; V35-L39 HydrophobicContact CG1-CG 4.22Å; V35-L39 WeakPolarHBondContact O-CB 3.31Å; V35-L39 VanDerWaalsContact O-CG 3.25Å; V35-L39 WeakPolarHBondContact O-CG 3.28Å; V35-L39 PolarHBondContact O-N 3.16Å; S36-L39 PolarHBondContact O-N 2.88Å; K37-L39 PolarHBondContact O-N 2.82Å; L39-Q41 VanDerWaalsContact C-N 3.32Å; L39-E42 PolarHBondContact O-N 2.85Å; L39-E42 VanDerWaalsContact O-N 3.14Å; L39-C44 HydrophobicContact CD2-CB 4.01Å; L39-C44 HydrophobicContact CG-CB 4.41Å; L39-Q45 HydrophobicContact CD2-CG 4.32Å; L39-Q45 PolarHBondContact O-NE2 3.09Å; L39-Q45 VanDerWaalsContact O-NE2 3.08Å
40	I	92.6	Very high	83.5	Confident	138 Å²	138	75.9 Å²	75.9	71%	0.708	41%	0.41	S	S	*	.	H	α-helix	trans	-67.3	-35.1	176.2	-70	166	0	0	0	111	S36 K37 E42	S36-I40 WeakPolarHBondContact O-CB 3.27Å; S36-I40 WeakPolarHBondContact O-CD1 3.41Å; S36-I40 WeakPolarHBondContact O-CG1 3.43Å; S36-I40 PolarHBondContact O-N 2.73Å; K37-I40 PolarHBondContact O-N 2.95Å; I40-E42 PolarHBondContact O-N 3.24Å
41	Q	90.3	Very high	82.3	Confident	104 Å²	104	75.9 Å²	75.9	49%	0.486	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	4	174.1	-68.6	-177.5	-17.6	0	0	113.4	K37 L39 L43	K37-Q41 WeakPolarHBondContact O-CG 3.04Å; K37-Q41 PolarHBondContact O-N 3.06Å; L39-Q41 VanDerWaalsContact C-N 3.32Å; Q41-L43 HydrophobicContact CB-CD1 3.97Å; Q41-L43 HydrophobicContact CB-CG 3.83Å; Q41-L43 PolarHBondContact O-N 3.18Å
42	E	87.3	Confident	81	Confident	139 Å²	139	82 Å²	82	65%	0.65	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	60	12.5	-178.3	-52.2	-172.7	163.3	0	0	114.4	C38 L39 I40	C38-E42 PolarHBondContact O-N 2.98Å; L39-E42 PolarHBondContact O-N 2.85Å; L39-E42 VanDerWaalsContact O-N 3.14Å; I40-E42 PolarHBondContact O-N 3.24Å
43	L	85.8	Confident	80.2	Confident	54 Å²	54	81.5 Å²	81.5	28%	0.283	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-28.5	-178.3	-57.6	177.9	0	0	0	111.9	C38 Q41 E58 C59 C62	C38-L43 PolarHBondContact O-N 3.22Å; Q41-L43 HydrophobicContact CB-CD1 3.97Å; Q41-L43 HydrophobicContact CB-CG 3.83Å; Q41-L43 PolarHBondContact O-N 3.18Å; L43-E58 HydrophobicContact CB-CB 4.44Å; L43-E58 HydrophobicContact CD2-CB 4.16Å; L43-C59 WeakPolarHBondContact O-CB 3.46Å; L43-C59 PolarHBondContact O-N 3.24Å; L43-C62 HydrophobicContact CB-CB 4.25Å; L43-C62 HydrophobicContact CD1-CB 3.69Å
44	C	85.8	Confident	79.6	Confident	6 Å²	6	82.1 Å²	82.1	4%	0.041	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	19.6	-177	-67.2	0	0	0	0	114.8	C38 L39 C46 C59 V74 M76	C38-C44 HydrophobicContact CB-CB 4.23Å; C38-C44 WeakPolarHBondContact CB-SG 3.41Å; C38-C44 PolarHBondContact O-N 2.95Å; L39-C44 HydrophobicContact CD2-CB 4.01Å; L39-C44 HydrophobicContact CG-CB 4.41Å; C44-C46 VanDerWaalsContact C-N 3.27Å; C44-C46 PolarHBondContact O-N 2.99Å; C44-C46 VanDerWaalsContact O-N 3.17Å; C44-C59 HydrophobicContact CB-CB 3.91Å; C44-C59 WeakPolarHBondContact CB-SG 3.35Å; C44-C59 WeakPolarHBondContact SG-CA 3.3Å; C44-C59 WeakPolarHBondContact SG-CB 3.26Å; C44-C59 CovalentContact SG-SG 2.03Å; C44-C59 PolarHBondContact SG-SG 2.95Å; C44-V74 HydrophobicContact CB-CG1 4.13Å; C44-M76 HydrophobicContact CB-CE 3.89Å; C44-M76 WeakPolarHBondContact O-CE 2.98Å
45	Q	82.3	Confident	79.2	Confident	123 Å²	123	81.3 Å²	81.3	58%	0.575	46%	0.457	S	S	*	.			trans	-88.7	53.1	178.8	-67	-176	12.1	0	0	112.5	L39	L39-Q45 HydrophobicContact CD2-CG 4.32Å; L39-Q45 PolarHBondContact O-NE2 3.09Å; L39-Q45 VanDerWaalsContact O-NE2 3.08Å
46	C	76.1	Confident	78.9	Confident	19 Å²	19	82.4 Å²	82.4	13%	0.128	47%	0.465	C	S	.	.			trans	-94.6	153	-176.2	-53.7	0	0	0	0	113.3	C44 C53 C55 M76	C44-C46 VanDerWaalsContact C-N 3.27Å; C44-C46 PolarHBondContact O-N 2.99Å; C44-C46 VanDerWaalsContact O-N 3.17Å; C46-C53 VanDerWaalsContact CB-SG 3.59Å; C46-C55 WeakPolarHBondContact CA-SG 3.2Å; C46-C55 WeakPolarHBondContact CB-SG 3.27Å; C46-C55 WeakPolarHBondContact SG-CB 3.43Å; C46-C55 CovalentContact SG-SG 2.01Å; C46-C55 PolarHBondContact SG-SG 3.28Å; C46-M76 HydrophobicContact CB-CE 4.17Å; C46-M76 HydrophobicContact CB-CG 4.39Å; C46-M76 HydrophobicContact CB-SD 3.56Å; C46-M76 VanDerWaalsContact CB-SD 3.56Å; C46-M76 PolarHBondContact SG-SD 3.17Å
47	R	68	Low	78.5	Confident	201 Å²	201	86.1 Å²	86.1	76%	0.758	47%	0.473	S	S	*	.			trans	-118.3	88.3	165.4	-73.1	-174.8	-179.2	157.9	2.8	110	G49	R47-G49 PolarHBondContact O-N 2.84Å; R47-G49 VanDerWaalsContact O-N 3.16Å
48	P	62.5	Low	78.2	Confident	57 Å²	57	84.9 Å²	84.9	37%	0.37	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-66.5	-17.1	-173.6	-22.4	35.2	0	0	0	114.7	E50 G51 M76	P48-E50 PolarHBondContact O-N 3.14Å; P48-E50 VanDerWaalsContact O-N 3.15Å; P48-G51 PolarHBondContact O-N 3.36Å; P48-M76 HydrophobicContact CG-CG 3.71Å
49	G	60.6	Low	77.9	Confident	83 Å²	83	84.9 Å²	84.9	86%	0.856	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-66.4	-11.1	-175.6	0	0	0	0	0	116	R47	R47-G49 PolarHBondContact O-N 2.84Å; R47-G49 VanDerWaalsContact O-N 3.16Å
50	E	60.9	Low	77.7	Confident	162 Å²	162	85.8 Å²	85.8	76%	0.757	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-102.2	8.6	-177.7	-65.3	179.9	-166.5	0	0	113.2	P48 N52	P48-E50 PolarHBondContact O-N 3.14Å; P48-E50 VanDerWaalsContact O-N 3.15Å; E50-N52 PolarHBondContact O-N 2.8Å
51	G	58.8	Low	77.3	Confident	80 Å²	80	84.8 Å²	84.8	83%	0.825	47%	0.468	S	S	*	.	S	Bend	trans	75	-11.4	174.8	0	0	0	0	0	115.3	P48	P48-G51 PolarHBondContact O-N 3.36Å
52	N	62.2	Low	77.2	Confident	130 Å²	130	81 Å²	81	70%	0.695	45%	0.452	S	S	*	.			trans	-111.6	105.9	171.4	-168.4	-2.1	0	0	0	109.9	E50	E50-N52 PolarHBondContact O-N 2.8Å
53	C	72.4	Confident	77.3	Confident	40 Å²	40	74.6 Å²	74.6	27%	0.27	42%	0.422	S	S	.	.			trans	-116	79.8	176.6	-166.7	0	0	0	0	111.6	C46 C55 C56	C46-C53 VanDerWaalsContact CB-SG 3.59Å; C53-C55 PolarHBondContact O-N 3.37Å; C53-C56 HydrophobicContact CB-CB 3.89Å; C53-C56 WeakPolarHBondContact CB-SG 3.35Å; C53-C56 PolarHBondContact O-N 3.14Å; C53-C56 WeakPolarHBondContact SG-CB 3.4Å; C53-C56 PolarHBondContact SG-N 3.18Å; C53-C56 VanDerWaalsContact SG-N 3.39Å; C53-C56 CovalentContact SG-SG 2.02Å; C53-C56 PolarHBondContact SG-SG 2.81Å
54	S	79.6	Confident	77.4	Confident	100 Å²	100	74 Å²	74	70%	0.699	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-14	-179	59.1	0	0	0	0	114.8	E58	S54-E58 VanDerWaalsContact O-OE2 3.08Å
55	C	82.2	Confident	77.3	Confident	28 Å²	28	80.5 Å²	80.5	19%	0.189	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-4.1	-177.7	50.8	0	0	0	0	114	C46 C53 K57 E58 C59	C46-C55 WeakPolarHBondContact CA-SG 3.2Å; C46-C55 WeakPolarHBondContact CB-SG 3.27Å; C46-C55 WeakPolarHBondContact SG-CB 3.43Å; C46-C55 CovalentContact SG-SG 2.01Å; C46-C55 PolarHBondContact SG-SG 3.28Å; C53-C55 PolarHBondContact O-N 3.37Å; C55-K57 VanDerWaalsContact C-N 3.25Å; C55-K57 PolarHBondContact O-N 3.21Å; C55-E58 WeakPolarHBondContact CA-OE2 3.37Å; C55-E58 PolarHBondContact O-N 2.85Å; C55-C59 PolarHBondContact O-N 2.89Å
56	C	83.6	Confident	77.5	Confident	35 Å²	35	76.1 Å²	76.1	24%	0.236	45%	0.45	C	S	.	.	H	α-helix	trans	-60.5	-37.9	-177.4	-84.2	0	0	0	0	111.8	C53 M60 M76	C53-C56 HydrophobicContact CB-CB 3.89Å; C53-C56 WeakPolarHBondContact CB-SG 3.35Å; C53-C56 PolarHBondContact O-N 3.14Å; C53-C56 WeakPolarHBondContact SG-CB 3.4Å; C53-C56 PolarHBondContact SG-N 3.18Å; C53-C56 VanDerWaalsContact SG-N 3.39Å; C53-C56 CovalentContact SG-SG 2.02Å; C53-C56 PolarHBondContact SG-SG 2.81Å; C56-M60 WeakPolarHBondContact O-CB 3.37Å; C56-M60 PolarHBondContact O-N 3.2Å; C56-M76 HydrophobicContact CB-SD 4.43Å
57	K	83.8	Confident	78	Confident	139 Å²	139	77 Å²	77	60%	0.604	45%	0.45	S	S	*	.	H	α-helix	trans	-66.4	-45.2	180	-178.7	-176.6	176.9	-174.7	0	111.2	C55 C59 M60 L61	C55-K57 VanDerWaalsContact C-N 3.25Å; C55-K57 PolarHBondContact O-N 3.21Å; K57-C59 VanDerWaalsContact C-N 3.35Å; K57-M60 PolarHBondContact O-N 3.01Å; K57-L61 HydrophobicContact CG-CD1 4.37Å; K57-L61 WeakPolarHBondContact O-CG 3.21Å; K57-L61 PolarHBondContact O-N 2.89Å
58	E	86.4	Confident	78.7	Confident	78 Å²	78	73.5 Å²	73.5	36%	0.364	45%	0.447	S	S	.	.	H	α-helix	trans	-66.9	-38.9	179.5	-68.5	69.4	-153.3	0	0	110.9	L43 S54 C55 L61 C62	L43-E58 HydrophobicContact CB-CB 4.44Å; L43-E58 HydrophobicContact CD2-CB 4.16Å; S54-E58 VanDerWaalsContact O-OE2 3.08Å; C55-E58 WeakPolarHBondContact CA-OE2 3.37Å; C55-E58 PolarHBondContact O-N 2.85Å; E58-L61 PolarHBondContact O-N 3.41Å; E58-C62 WeakPolarHBondContact O-CB 3.33Å; E58-C62 PolarHBondContact O-N 3.49Å
59	C	86.2	Confident	79.7	Confident	0 Å²	0	76 Å²	76	0%	0	45%	0.453	C	S	.	.	H	α-helix	trans	-62.7	-44	172.6	-174.1	0	0	0	0	112.3	L43 C44 C55 K57 L61 C62 L63 W67 M76	L43-C59 WeakPolarHBondContact O-CB 3.46Å; L43-C59 PolarHBondContact O-N 3.24Å; C44-C59 HydrophobicContact CB-CB 3.91Å; C44-C59 WeakPolarHBondContact CB-SG 3.35Å; C44-C59 WeakPolarHBondContact SG-CA 3.3Å; C44-C59 WeakPolarHBondContact SG-CB 3.26Å; C44-C59 CovalentContact SG-SG 2.03Å; C44-C59 PolarHBondContact SG-SG 2.95Å; C55-C59 PolarHBondContact O-N 2.89Å; K57-C59 VanDerWaalsContact C-N 3.35Å; C59-L61 VanDerWaalsContact C-N 3.34Å; C59-L61 PolarHBondContact O-N 2.92Å; C59-C62 PolarHBondContact O-N 3.39Å; C59-L63 PolarHBondContact O-N 3.49Å; C59-W67 HydrophobicContact CB-CZ3 4.29Å; C59-M76 HydrophobicContact CB-CE 3.75Å; C59-M76 HydrophobicContact CB-SD 4.03Å; C59-M76 WeakPolarHBondContact SG-CE 3.48Å
60	M	85.3	Confident	81	Confident	85 Å²	85	72 Å²	72	42%	0.419	41%	0.412	S	S	.	.	H	α-helix	trans	-60.2	-44.5	176.7	-172.9	-169	78.8	0	0	111.8	C56 K57 C62 G64 W67	C56-M60 WeakPolarHBondContact O-CB 3.37Å; C56-M60 PolarHBondContact O-N 3.2Å; K57-M60 PolarHBondContact O-N 3.01Å; M60-C62 VanDerWaalsContact C-N 3.3Å; M60-C62 PolarHBondContact O-N 3.08Å; M60-G64 PolarHBondContact O-N 3.34Å; M60-W67 VanDerWaalsContact CA-CZ3 3.47Å; M60-W67 HydrophobicContact CB-CD2 4.06Å; M60-W67 HydrophobicContact CB-CE3 3.85Å; M60-W67 HydrophobicContact CB-CH2 4.04Å; M60-W67 HydrophobicContact CB-CZ2 4.31Å; M60-W67 HydrophobicContact CB-CZ3 3.82Å; M60-W67 HydrophobicContact CG-CD2 3.7Å; M60-W67 HydrophobicContact CG-CE3 3.99Å; M60-W67 HydrophobicContact CG-CG 3.97Å; M60-W67 HydrophobicContact CG-CZ2 4.36Å; M60-W67 HydrophobicContact CG-CZ3 4.39Å
61	L	84.2	Confident	82.2	Confident	117 Å²	117	64.6 Å²	64.6	61%	0.613	38%	0.378	S	S	*	.	H	α-helix	trans	-66.7	-32.5	176.4	-69.5	172.6	0	0	0	112.6	K57 E58 C59	K57-L61 HydrophobicContact CG-CD1 4.37Å; K57-L61 WeakPolarHBondContact O-CG 3.21Å; K57-L61 PolarHBondContact O-N 2.89Å; E58-L61 PolarHBondContact O-N 3.41Å; C59-L61 VanDerWaalsContact C-N 3.34Å; C59-L61 PolarHBondContact O-N 2.92Å
62	C	87.6	Confident	83.4	Confident	24 Å²	24	63.5 Å²	63.5	16%	0.162	35%	0.353	C	S	.	.	H	α-helix	trans	-71.3	-42.3	177.9	-173.8	0	0	0	0	112.8	C38 L43 E58 C59 M60	C38-C62 WeakPolarHBondContact CA-SG 3.44Å; C38-C62 HydrophobicContact CB-CB 3.83Å; C38-C62 WeakPolarHBondContact CB-SG 3.35Å; C38-C62 WeakPolarHBondContact SG-CB 3.48Å; C38-C62 CovalentContact SG-SG 2.02Å; C38-C62 PolarHBondContact SG-SG 3.31Å; L43-C62 HydrophobicContact CB-CB 4.25Å; L43-C62 HydrophobicContact CD1-CB 3.69Å; E58-C62 WeakPolarHBondContact O-CB 3.33Å; E58-C62 PolarHBondContact O-N 3.49Å; C59-C62 PolarHBondContact O-N 3.39Å; M60-C62 VanDerWaalsContact C-N 3.3Å; M60-C62 PolarHBondContact O-N 3.08Å
63	L	88.7	Confident	84.6	Confident	5 Å²	5	59.6 Å²	59.6	3%	0.026	34%	0.336	C	S	.	.	H	α-helix	trans	-74.9	-28.4	176.1	-70.2	174.3	0	0	0	112.4	D34 V35 C59 T65 L66 W67 C70 V74	D34-L63 HydrophobicContact CB-CD2 4.23Å; V35-L63 HydrophobicContact CG2-CD2 3.83Å; C59-L63 PolarHBondContact O-N 3.49Å; L63-T65 PolarHBondContact O-N 3.1Å; L63-L66 WeakPolarHBondContact O-CB 3.5Å; L63-L66 PolarHBondContact O-N 3.4Å; L63-L66 VanDerWaalsContact O-N 3.11Å; L63-W67 HydrophobicContact CB-CB 4.46Å; L63-W67 HydrophobicContact CB-CE3 4.17Å; L63-W67 HydrophobicContact CD1-CE3 3.66Å; L63-W67 HydrophobicContact CD1-CZ3 3.99Å; L63-W67 HydrophobicContact CG-CE3 4.46Å; L63-C70 HydrophobicContact CD2-CB 4.44Å; L63-V74 HydrophobicContact CD1-CG2 4.1Å
64	G	88.2	Confident	85.3	Confident	42 Å²	42	58.7 Å²	58.7	43%	0.433	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	57.6	-123.2	173.6	0	0	0	0	0	112.3	M60 L66 W67	M60-G64 PolarHBondContact O-N 3.34Å; G64-L66 PolarHBondContact O-N 3.19Å; G64-W67 VanDerWaalsContact O-CB 3.29Å; G64-W67 WeakPolarHBondContact O-CB 3.16Å; G64-W67 PolarHBondContact O-N 2.94Å
65	T	83	Confident	85.4	Confident	142 Å²	142	56.6 Å²	56.6	87%	0.871	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-67.3	-20.3	-177.9	56	0	0	0	0	113.6	L63 W67	L63-T65 PolarHBondContact O-N 3.1Å; T65-W67 VanDerWaalsContact C-N 3.27Å
66	L	86.4	Confident	85.3	Confident	31 Å²	31	55.8 Å²	55.8	16%	0.162	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-84	-0.3	177.8	-73.4	156.3	0	0	0	112.5	L30 D34 L63 G64 D68 E69 C70	L30-L66 HydrophobicContact CD1-CD2 4.33Å; L30-L66 HydrophobicContact CD2-CD2 4.19Å; L30-L66 HydrophobicContact CG-CD2 4.01Å; D34-L66 HydrophobicContact CB-CD1 4.06Å; D34-L66 WeakPolarHBondContact OD2-CD1 3.31Å; L63-L66 WeakPolarHBondContact O-CB 3.5Å; L63-L66 PolarHBondContact O-N 3.4Å; L63-L66 VanDerWaalsContact O-N 3.11Å; G64-L66 PolarHBondContact O-N 3.19Å; L66-D68 PolarHBondContact O-N 2.99Å; L66-E69 PolarHBondContact O-N 2.02Å; L66-C70 WeakPolarHBondContact O-CB 3.29Å; L66-C70 PolarHBondContact O-N 2.87Å; L66-C70 PolarHBondContact O-SG 2.92Å; L66-C70 VanDerWaalsContact O-SG 3.41Å
67	W	86.7	Confident	85	Confident	39 Å²	39	55.4 Å²	55.4	15%	0.148	31%	0.314	C	S	.	.	H	α-helix	trans	-54.8	-51.4	-175	173.8	-99.8	0	0	0	113.1	C59 M60 L63 G64 T65 E69 C70 C71 M76	C59-W67 HydrophobicContact CB-CZ3 4.29Å; M60-W67 VanDerWaalsContact CA-CZ3 3.47Å; M60-W67 HydrophobicContact CB-CD2 4.06Å; M60-W67 HydrophobicContact CB-CE3 3.85Å; M60-W67 HydrophobicContact CB-CH2 4.04Å; M60-W67 HydrophobicContact CB-CZ2 4.31Å; M60-W67 HydrophobicContact CB-CZ3 3.82Å; M60-W67 HydrophobicContact CG-CD2 3.7Å; M60-W67 HydrophobicContact CG-CE3 3.99Å; M60-W67 HydrophobicContact CG-CG 3.97Å; M60-W67 HydrophobicContact CG-CZ2 4.36Å; M60-W67 HydrophobicContact CG-CZ3 4.39Å; L63-W67 HydrophobicContact CB-CB 4.46Å; L63-W67 HydrophobicContact CB-CE3 4.17Å; L63-W67 HydrophobicContact CD1-CE3 3.66Å; L63-W67 HydrophobicContact CD1-CZ3 3.99Å; L63-W67 HydrophobicContact CG-CE3 4.46Å; G64-W67 VanDerWaalsContact O-CB 3.29Å; G64-W67 WeakPolarHBondContact O-CB 3.16Å; G64-W67 PolarHBondContact O-N 2.94Å; T65-W67 VanDerWaalsContact C-N 3.27Å; W67-E69 PolarHBondContact O-N 2.89Å; W67-C70 PolarHBondContact O-N 3.33Å; W67-C71 HydrophobicContact CD2-CB 4Å; W67-C71 HydrophobicContact CE3-CB 4.26Å; W67-C71 HydrophobicContact CH2-CB 4.42Å; W67-C71 HydrophobicContact CZ2-CB 4.1Å; W67-C71 HydrophobicContact CZ3-CB 4.48Å; W67-C71 WeakPolarHBondContact O-CA 3.38Å; W67-C71 WeakPolarHBondContact O-CB 3.07Å; W67-C71 PolarHBondContact O-N 3.42Å; W67-C71 PolarHBondContact O-SG 3.05Å; W67-C71 VanDerWaalsContact O-SG 3.4Å; W67-M76 HydrophobicContact CH2-CB 3.73Å; W67-M76 HydrophobicContact CZ2-CB 4.41Å; W67-M76 WeakPolarHBondContact CZ2-O 3.3Å; W67-M76 HydrophobicContact CZ3-CB 4.48Å
68	D	82.9	Confident	84.3	Confident	127 Å²	127	54.3 Å²	54.3	68%	0.679	32%	0.315	S	S	*	.	H	α-helix	trans	-65.9	-27.9	-175.3	-66.7	-39.5	0	0	0	112.8	L66	L66-D68 PolarHBondContact O-N 2.99Å
69	E	84.1	Confident	83.1	Confident	108 Å²	108	55.5 Å²	55.5	51%	0.505	33%	0.329	S	S	.	.	H	α-helix	trans	-86.7	-27.3	179.5	-60.5	178.7	154	0	0	112.3	L30 L66 W67	L30-E69 HydrophobicContact CD2-CB 4.37Å; L30-E69 WeakPolarHBondContact CD2-OE2 3.44Å; L66-E69 PolarHBondContact O-N 2.02Å; W67-E69 PolarHBondContact O-N 2.89Å
70	C	88.6	Confident	81.5	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-116.1	-8.1	-170.2	-59.4	0	0	0	0	115.1	C31 V35 L63 L66 W67 D72 C73	C31-C70 WeakPolarHBondContact CA-SG 3.32Å; C31-C70 HydrophobicContact CB-CB 3.69Å; C31-C70 WeakPolarHBondContact CB-SG 3.3Å; C31-C70 WeakPolarHBondContact SG-CA 3.32Å; C31-C70 WeakPolarHBondContact SG-CB 3.29Å; C31-C70 CovalentContact SG-SG 2.02Å; C31-C70 PolarHBondContact SG-SG 2.96Å; V35-C70 HydrophobicContact CG2-CB 4.09Å; L63-C70 HydrophobicContact CD2-CB 4.44Å; L66-C70 WeakPolarHBondContact O-CB 3.29Å; L66-C70 PolarHBondContact O-N 2.87Å; L66-C70 PolarHBondContact O-SG 2.92Å; L66-C70 VanDerWaalsContact O-SG 3.41Å; W67-C70 PolarHBondContact O-N 3.33Å; C70-D72 PolarHBondContact O-N 3.47Å; C70-D72 VanDerWaalsContact O-N 3.14Å; C70-C73 VanDerWaalsContact O-CB 3.29Å; C70-C73 WeakPolarHBondContact O-CB 3.02Å; C70-C73 PolarHBondContact O-N 3.29Å
71	C	85.8	Confident	79.6	Confident	6 Å²	6	63.6 Å²	63.6	4%	0.041	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-60.1	-27.7	180	61.3	0	0	0	0	112.3	W67 C73 V74 G75 M76 C77	W67-C71 HydrophobicContact CD2-CB 4Å; W67-C71 HydrophobicContact CE3-CB 4.26Å; W67-C71 HydrophobicContact CH2-CB 4.42Å; W67-C71 HydrophobicContact CZ2-CB 4.1Å; W67-C71 HydrophobicContact CZ3-CB 4.48Å; W67-C71 WeakPolarHBondContact O-CA 3.38Å; W67-C71 WeakPolarHBondContact O-CB 3.07Å; W67-C71 PolarHBondContact O-N 3.42Å; W67-C71 PolarHBondContact O-SG 3.05Å; W67-C71 VanDerWaalsContact O-SG 3.4Å; C71-C73 VanDerWaalsContact C-N 3.25Å; C71-C73 PolarHBondContact O-N 3.34Å; C71-V74 CarbonylContact O-C 3.6Å; C71-V74 VanDerWaalsContact O-CG2 3.26Å; C71-V74 WeakPolarHBondContact O-CG2 3.26Å; C71-V74 PolarHBondContact O-N 2.05Å; C71-G75 PolarHBondContact O-N 2.93Å; C71-M76 PolarHBondContact O-N 3.26Å; C71-M76 VanDerWaalsContact O-N 3.09Å; C71-C77 HydrophobicContact CB-CB 4Å; C71-C77 WeakPolarHBondContact CB-SG 3.28Å; C71-C77 WeakPolarHBondContact SG-CA 3.08Å; C71-C77 WeakPolarHBondContact SG-CB 3.03Å; C71-C77 CovalentContact SG-SG 2.03Å; C71-C77 PolarHBondContact SG-SG 3.23Å
72	D	84.5	Confident	77.8	Confident	57 Å²	57	68.5 Å²	68.5	31%	0.305	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-67.9	-27.7	177.4	-83.3	-35.2	0	0	0	110.4	C26 C70 V74 C77 R80	C26-D72 HydrophobicContact CB-CB 3.84Å; C70-D72 PolarHBondContact O-N 3.47Å; C70-D72 VanDerWaalsContact O-N 3.14Å; D72-V74 VanDerWaalsContact C-N 3.28Å; D72-V74 PolarHBondContact O-N 3.45Å; D72-C77 VanDerWaalsContact CA-SG 3.59Å; D72-C77 PolarHBondContact N-SG 3Å; D72-C77 PolarHBondContact OD1-SG 2.88Å; D72-R80 IonicContact OD1-NH2 2.69Å; D72-R80 IonicContact OD2-CZ 2.83Å; D72-R80 IonicContact OD2-NH1 4Å; D72-R80 PolarHBondContact OD2-NH1 2.04Å; D72-R80 IonicContact OD2-NH2 3.39Å; D72-R80 PolarHBondContact OD2-NH2 2.04Å
73	C	87.1	Confident	76	Confident	49 Å²	49	71.5 Å²	71.5	33%	0.331	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-70.5	-25.9	176.7	-89	0	0	0	0	112.7	C26 V35 C70 C71	C26-C73 HydrophobicContact CB-CB 3.78Å; C26-C73 WeakPolarHBondContact CB-SG 3.33Å; C26-C73 WeakPolarHBondContact SG-CB 3.49Å; C26-C73 CovalentContact SG-SG 2Å; C26-C73 PolarHBondContact SG-SG 3.01Å; V35-C73 HydrophobicContact CG1-CB 4.35Å; V35-C73 HydrophobicContact CG2-CB 4.01Å; C70-C73 VanDerWaalsContact O-CB 3.29Å; C70-C73 WeakPolarHBondContact O-CB 3.02Å; C70-C73 PolarHBondContact O-N 3.29Å; C71-C73 VanDerWaalsContact C-N 3.25Å; C71-C73 PolarHBondContact O-N 3.34Å
74	V	87.4	Confident	74.1	Confident	21 Å²	21	76.3 Å²	76.3	13%	0.127	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	3.5	-176.9	-65.4	0	0	0	0	112.1	V35 C44 L63 C71 D72 M76	V35-V74 HydrophobicContact CG1-CG1 3.76Å; V35-V74 HydrophobicContact CG2-CG1 4.38Å; C44-V74 HydrophobicContact CB-CG1 4.13Å; L63-V74 HydrophobicContact CD1-CG2 4.1Å; C71-V74 CarbonylContact O-C 3.6Å; C71-V74 VanDerWaalsContact O-CG2 3.26Å; C71-V74 WeakPolarHBondContact O-CG2 3.26Å; C71-V74 PolarHBondContact O-N 2.05Å; D72-V74 VanDerWaalsContact C-N 3.28Å; D72-V74 PolarHBondContact O-N 3.45Å; V74-M76 HydrophobicContact CB-CE 3.53Å; V74-M76 HydrophobicContact CG1-CE 4.45Å; V74-M76 HydrophobicContact CG2-CB 4.1Å; V74-M76 HydrophobicContact CG2-CE 3.61Å; V74-M76 HydrophobicContact CG2-CG 4.49Å; V74-M76 PolarHBondContact O-N 3.25Å
75	G	81.6	Confident	72.4	Confident	55 Å²	55	79 Å²	79	57%	0.567	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.1	26	177.1	0	0	0	0	0	113.7	C71	C71-G75 PolarHBondContact O-N 2.93Å
76	M	79.1	Confident	71	Confident	12 Å²	12	76 Å²	76	6%	0.059	41%	0.414	C	S	.	.			trans	-118.5	10.7	-174.7	-72.4	-175.4	-92.8	0	0	113.5	C44 C46 P48 C56 C59 W67 C71 V74 N78	C44-M76 HydrophobicContact CB-CE 3.89Å; C44-M76 WeakPolarHBondContact O-CE 2.98Å; C46-M76 HydrophobicContact CB-CE 4.17Å; C46-M76 HydrophobicContact CB-CG 4.39Å; C46-M76 HydrophobicContact CB-SD 3.56Å; C46-M76 VanDerWaalsContact CB-SD 3.56Å; C46-M76 PolarHBondContact SG-SD 3.17Å; P48-M76 HydrophobicContact CG-CG 3.71Å; C56-M76 HydrophobicContact CB-SD 4.43Å; C59-M76 HydrophobicContact CB-CE 3.75Å; C59-M76 HydrophobicContact CB-SD 4.03Å; C59-M76 WeakPolarHBondContact SG-CE 3.48Å; W67-M76 HydrophobicContact CH2-CB 3.73Å; W67-M76 HydrophobicContact CZ2-CB 4.41Å; W67-M76 WeakPolarHBondContact CZ2-O 3.3Å; W67-M76 HydrophobicContact CZ3-CB 4.48Å; C71-M76 PolarHBondContact O-N 3.26Å; C71-M76 VanDerWaalsContact O-N 3.09Å; V74-M76 HydrophobicContact CB-CE 3.53Å; V74-M76 HydrophobicContact CG1-CE 4.45Å; V74-M76 HydrophobicContact CG2-CB 4.1Å; V74-M76 HydrophobicContact CG2-CE 3.61Å; V74-M76 HydrophobicContact CG2-CG 4.49Å; V74-M76 PolarHBondContact O-N 3.25Å; M76-N78 PolarHBondContact O-N 3.38Å
77	C	76.8	Confident	69.1	Low	26 Å²	26	79.4 Å²	79.4	18%	0.176	44%	0.438	C	S	.	.	S	Bend	trans	-57.1	139.9	168.3	-64.2	0	0	0	0	109.4	C71 D72	C71-C77 HydrophobicContact CB-CB 4Å; C71-C77 WeakPolarHBondContact CB-SG 3.28Å; C71-C77 WeakPolarHBondContact SG-CA 3.08Å; C71-C77 WeakPolarHBondContact SG-CB 3.03Å; C71-C77 CovalentContact SG-SG 2.03Å; C71-C77 PolarHBondContact SG-SG 3.23Å; D72-C77 VanDerWaalsContact CA-SG 3.59Å; D72-C77 PolarHBondContact N-SG 3Å; D72-C77 PolarHBondContact OD1-SG 2.88Å
78	N	70.4	Confident	67.3	Low	117 Å²	117	78.9 Å²	78.9	63%	0.626	44%	0.439	S	S	*	.			trans	-52.1	132.3	167.1	-165.8	28.3	0	0	0	107.5	M76 R80	M76-N78 PolarHBondContact O-N 3.38Å; N78-R80 PolarHBondContact O-N 3.04Å
79	P	60.7	Low	66.1	Low	103 Å²	103	75 Å²	75	67%	0.669	42%	0.421	S	S	*	.			trans	-47.6	115.7	171.8	15.8	-30.6	0	0	0	107.8	N81	P79-N81 PolarHBondContact O-N 3.26Å
80	R	52.5	Low	65.8	Low	138 Å²	138	76.4 Å²	76.4	52%	0.521	43%	0.426	S	S	.	.			trans	-64.4	85.9	-179.7	-69.8	-172.9	176.8	123.3	5.7	107	D72 N78 Y82	D72-R80 IonicContact OD1-NH2 2.69Å; D72-R80 IonicContact OD2-CZ 2.83Å; D72-R80 IonicContact OD2-NH1 4Å; D72-R80 PolarHBondContact OD2-NH1 2.04Å; D72-R80 IonicContact OD2-NH2 3.39Å; D72-R80 PolarHBondContact OD2-NH2 2.04Å; N78-R80 PolarHBondContact O-N 3.04Å; R80-Y82 VanDerWaalsContact C-N 3.3Å; R80-Y82 PolarHBondContact O-N 2.71Å
81	N	46.4	Very low	65.7	Low	116 Å²	116	77.8 Å²	77.8	62%	0.62	44%	0.436	S	S	*	.			trans	-62.4	107.5	152.9	-98.6	-21.4	0	0	0	103.8	P79 S83 D84	P79-N81 PolarHBondContact O-N 3.26Å; N81-S83 PolarHBondContact O-N 3.43Å; N81-D84 PolarHBondContact O-N 2.91Å
82	Y	46.2	Very low	65.9	Low	220 Å²	220	80 Å²	80	86%	0.863	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	14.1	170.8	-104.9	-91.9	0	0	0	113	R80	R80-Y82 VanDerWaalsContact C-N 3.3Å; R80-Y82 PolarHBondContact O-N 2.71Å
83	S	49.6	Very low	66.4	Low	87 Å²	87	79.7 Å²	79.7	61%	0.608	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	-6.7	167.7	69.3	0	0	0	0	113.5	N81 T85	N81-S83 PolarHBondContact O-N 3.43Å; S83-T85 PolarHBondContact O-N 3.25Å
84	D	49.1	Very low	66.7	Low	107 Å²	107	80.5 Å²	80.5	57%	0.572	45%	0.448	S	S	*	.	S	Bend	trans	-69.7	102.1	172.4	-74.6	-21.9	0	0	0	107.8	N81	N81-D84 PolarHBondContact O-N 2.91Å
85	T	51	Low	67.1	Low	99 Å²	99	86 Å²	86	61%	0.607	47%	0.472	S	S	*	.			trans	-52.8	135.4	174.4	48.3	0	0	0	0	109	S83 S89	S83-T85 PolarHBondContact O-N 3.25Å; T85-S89 WeakPolarHBondContact CB-OG 3.33Å; T85-S89 PolarHBondContact O-OG 3.48Å; T85-S89 WeakPolarHBondContact OG1-CB 3.3Å; T85-S89 PolarHBondContact OG1-OG 3.36Å
86	P	54.6	Low	67.8	Low	77 Å²	77	83.8 Å²	83.8	50%	0.5	45%	0.448	S	S	.	.			trans	-53	156	-173.7	16.5	-28.9	0	0	0	111.3	T88 S89	P86-T88 PolarHBondContact O-N 2.88Å; P86-S89 WeakPolarHBondContact O-CA 3.37Å; P86-S89 WeakPolarHBondContact O-CB 3.01Å; P86-S89 PolarHBondContact O-N 3.4Å; P86-S89 PolarHBondContact O-OG 3.2Å
87	P	45.6	Very low	68.3	Low	103 Å²	103	90.8 Å²	90.8	67%	0.669	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-49.5	-27.9	-179.8	-28.2	34.6	0	0	0	114.6	S89 K90	P87-S89 PolarHBondContact O-N 3.32Å; P87-S89 VanDerWaalsContact O-N 3.17Å; P87-K90 WeakPolarHBondContact O-CB 3.03Å; P87-K90 PolarHBondContact O-N 2.69Å
88	T	48.9	Very low	69	Low	29 Å²	29	97.3 Å²	97.3	18%	0.178	51%	0.508	C	S	.	.	G	3₁₀ helix	trans	-61.1	-13.6	171	62.4	0	0	0	0	114.8	P86 N198 F223	P86-T88 PolarHBondContact O-N 2.88Å; T88-N198 HydrophobicContact CG2-CB 4.2Å; T88-F223 HydrophobicContact CG2-CD1 4.16Å
89	S	58.8	Low	70.1	Confident	44 Å²	44	94.5 Å²	94.5	31%	0.308	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-84.4	-16.9	174.8	75.4	0	0	0	0	112.7	T85 P86 P87	T85-S89 WeakPolarHBondContact CB-OG 3.33Å; T85-S89 PolarHBondContact O-OG 3.48Å; T85-S89 WeakPolarHBondContact OG1-CB 3.3Å; T85-S89 PolarHBondContact OG1-OG 3.36Å; P86-S89 WeakPolarHBondContact O-CA 3.37Å; P86-S89 WeakPolarHBondContact O-CB 3.01Å; P86-S89 PolarHBondContact O-N 3.4Å; P86-S89 PolarHBondContact O-OG 3.2Å; P87-S89 PolarHBondContact O-N 3.32Å; P87-S89 VanDerWaalsContact O-N 3.17Å
90	K	76.5	Confident	71.9	Confident	138 Å²	138	93.5 Å²	93.5	60%	0.6	48%	0.484	S	S	*	.			trans	-81.9	134.2	172.3	-64.9	-173.1	-177.7	175.5	0	108.7	P87 H197	P87-K90 WeakPolarHBondContact O-CB 3.03Å; P87-K90 PolarHBondContact O-N 2.69Å; K90-H197 PolarHBondContact O-CD2 3.01Å; K90-H197 PolarHBondContact O-N 3.48Å
91	S	87.1	Confident	73.9	Confident	30 Å²	30	89.1 Å²	89.1	21%	0.21	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	147.2	178.5	63.6	0	0	0	0	109.9	R194 W195	S91-R194 PolarHBondContact OG-NH1 3.48Å; S91-W195 CarbonylContact C-O 3.53Å; S91-W195 WeakPolarHBondContact CA-O 3.05Å; S91-W195 WeakPolarHBondContact CB-O 3.29Å
92	T	90.3	Very high	76.2	Confident	51 Å²	51	87.6 Å²	87.6	31%	0.313	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	136.1	166.4	-52.3	0	0	0	0	108.6	I178 R194 W195 H197	T92-I178 HydrophobicContact CG2-CD1 3.56Å; T92-R194 WeakPolarHBondContact O-CA 3.26Å; T92-W195 PolarHBondContact N-O 3.39Å; T92-W195 PolarHBondContact O-N 2.02Å; T92-H197 PolarHBondContact OG1-NE2 3.32Å
93	V	94	Very high	78.6	Confident	52 Å²	52	80.1 Å²	80.1	32%	0.315	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	145.5	-179.9	-65.4	0	0	0	0	110	Y193 R194 Y211	V93-Y193 WeakPolarHBondContact CA-O 3.49Å; V93-R194 HydrophobicContact CG1-CB 4Å; V93-R194 HydrophobicContact CG1-CG 3.85Å; V93-Y211 HydrophobicContact CB-CD1 3.52Å; V93-Y211 HydrophobicContact CB-CD2 4Å; V93-Y211 HydrophobicContact CB-CE1 3.69Å; V93-Y211 HydrophobicContact CB-CE2 4.17Å; V93-Y211 HydrophobicContact CB-CG 3.67Å; V93-Y211 HydrophobicContact CG1-CD1 4Å; V93-Y211 HydrophobicContact CG1-CD2 4.26Å; V93-Y211 HydrophobicContact CG1-CG 3.78Å; V93-Y211 HydrophobicContact CG2-CD1 4.17Å; V93-Y211 HydrophobicContact CG2-CD2 3.82Å; V93-Y211 HydrophobicContact CG2-CE1 4.04Å; V93-Y211 HydrophobicContact CG2-CE2 3.72Å; V93-Y211 HydrophobicContact CG2-CG 4.05Å
94	E	93.3	Very high	80.7	Confident	66 Å²	66	76 Å²	76	31%	0.308	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	146.7	177.8	169	-177.7	177.4	0	0	110.3	K182 K192 Y193	E94-K182 IonicContact OE1-NZ 3.12Å; E94-K182 PolarHBondContact OE1-NZ 3.25Å; E94-K182 IonicContact OE2-NZ 2.73Å; E94-K192 WeakPolarHBondContact O-CA 3.18Å; E94-Y193 HydrophobicContact CB-CD1 4.15Å; E94-Y193 HydrophobicContact CB-CE1 3.44Å; E94-Y193 VanDerWaalsContact CB-CE1 3.44Å; E94-Y193 HydrophobicContact CG-CE1 3.79Å; E94-Y193 PolarHBondContact N-O 3.15Å; E94-Y193 PolarHBondContact O-N 3.45Å; E94-Y193 WeakPolarHBondContact OE2-CE1 3.47Å; E94-Y193 PolarHBondContact OE2-OH 3.16Å
95	E	96.1	Very high	82.9	Confident	135 Å²	135	75.9 Å²	75.9	63%	0.631	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	131.2	171.4	-170.9	169.8	-153.2	0	0	109.4	K192	E95-K192 HydrophobicContact CB-CG 4.44Å; E95-K192 HydrophobicContact CG-CG 4.28Å
96	L	96.1	Very high	84.8	Confident	9 Å²	9	74.2 Å²	74.2	5%	0.047	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-83.1	142.1	-174.8	-66.4	176.3	0	0	0	111	K182 C185 E186 A190 S191 Y193	L96-K182 HydrophobicContact CD2-CG 3.89Å; L96-C185 HydrophobicContact CD1-CB 3.65Å; L96-E186 HydrophobicContact CB-CG 4.4Å; L96-E186 HydrophobicContact CD1-CG 4.07Å; L96-E186 HydrophobicContact CD2-CG 3.65Å; L96-E186 HydrophobicContact CG-CG 4.25Å; L96-A190 HydrophobicContact CD1-CB 4.11Å; L96-S191 PolarHBondContact N-O 3.26Å; L96-Y193 HydrophobicContact CD2-CD1 3.48Å; L96-Y193 VanDerWaalsContact CD2-CD1 3.48Å; L96-Y193 HydrophobicContact CD2-CE1 3.87Å; L96-Y193 HydrophobicContact CG-CD1 4.07Å
97	H	90.1	Very high	86.6	Confident	159 Å²	159	72.6 Å²	72.6	74%	0.736	39%	0.392	S	S	*	.	S	Bend	trans	-78.5	134.8	174.8	-144.9	67.6	0	0	0	109.1
98	E	92.1	Very high	88.8	Confident	163 Å²	163	68.5 Å²	68.5	76%	0.762	37%	0.366	S	S	*	.	S	Bend	trans	59	57.2	176.9	-53.3	-175.6	155	0	0	115.1
99	P	93.7	Very high	90.6	Very high	58 Å²	58	73.7 Å²	73.7	38%	0.377	39%	0.388	S	S	.	.			trans	-62.9	152.2	175.9	29.9	-36.5	0	0	0	111.8	P101 A190	P99-P101 VanDerWaalsContact C-CD 3.45Å; P99-P101 VanDerWaalsContact O-CD 3.26Å; P99-P101 WeakPolarHBondContact O-CD 3.33Å; P99-A190 WeakPolarHBondContact CB-O 3.34Å
100	I	97.4	Very high	91.3	Very high	82 Å²	82	74.5 Å²	74.5	42%	0.421	40%	0.404	S	S	.	.			trans	-119.4	78.5	176.8	-49.4	176.5	0	0	0	108.6	S102 L103 F104 G189	I100-S102 PolarHBondContact O-N 3.2Å; I100-S102 VanDerWaalsContact O-N 3.09Å; I100-L103 HydrophobicContact CB-CB 4.03Å; I100-L103 HydrophobicContact CG2-CB 3.66Å; I100-L103 WeakPolarHBondContact O-CB 3.08Å; I100-L103 PolarHBondContact O-N 2.87Å; I100-F104 PolarHBondContact O-N 3.35Å; I100-G189 CarbonylContact C-O 3.45Å; I100-G189 PolarHBondContact N-O 3.25Å; I100-G189 VanDerWaalsContact N-O 3.17Å
101	P	94.8	Very high	90.7	Very high	46 Å²	46	76 Å²	76	30%	0.299	42%	0.418	S	S	.	.	H	α-helix	trans	-50.4	-38.1	-176.1	-34	38.3	0	0	0	115	P99 R105 P206	P99-P101 VanDerWaalsContact C-CD 3.45Å; P99-P101 VanDerWaalsContact O-CD 3.26Å; P99-P101 WeakPolarHBondContact O-CD 3.33Å; P101-R105 WeakPolarHBondContact O-CB 3.4Å; P101-R105 VanDerWaalsContact O-CG 3.29Å; P101-R105 WeakPolarHBondContact O-CG 3.32Å; P101-R105 PolarHBondContact O-N 3.22Å; P101-P206 HydrophobicContact CB-CB 4.3Å; P101-P206 HydrophobicContact CB-CG 3.82Å; P101-P206 HydrophobicContact CG-CB 4.26Å; P101-P206 HydrophobicContact CG-CG 4.27Å
102	S	95.3	Very high	89.6	Confident	84 Å²	84	76.4 Å²	76.4	59%	0.587	42%	0.419	S	S	*	.	H	α-helix	trans	-66.5	-35.9	179.4	49.8	0	0	0	0	112.8	I100 A106	I100-S102 PolarHBondContact O-N 3.2Å; I100-S102 VanDerWaalsContact O-N 3.09Å; S102-A106 WeakPolarHBondContact O-CB 3.43Å; S102-A106 PolarHBondContact O-N 3.23Å
103	L	95.3	Very high	88.3	Confident	63 Å²	63	83.4 Å²	83.4	33%	0.33	45%	0.448	S	S	.	.	H	α-helix	trans	-70.9	-46.2	177.3	178	61	0	0	0	110.5	I100 R105 A106 L107 S187	I100-L103 HydrophobicContact CB-CB 4.03Å; I100-L103 HydrophobicContact CG2-CB 3.66Å; I100-L103 WeakPolarHBondContact O-CB 3.08Å; I100-L103 PolarHBondContact O-N 2.87Å; L103-R105 VanDerWaalsContact C-N 3.33Å; L103-R105 PolarHBondContact O-N 3.16Å; L103-A106 PolarHBondContact O-N 2.97Å; L103-L107 HydrophobicContact CD1-CD1 3.99Å; L103-L107 HydrophobicContact CD1-CG 4.12Å; L103-L107 HydrophobicContact CG-CD1 4Å; L103-L107 HydrophobicContact CG-CG 4.49Å; L103-L107 WeakPolarHBondContact O-CG 3.49Å; L103-L107 PolarHBondContact O-N 2.75Å; L103-S187 WeakPolarHBondContact CD2-O 3.44Å
104	F	95.1	Very high	87.1	Confident	0 Å²	0	84.6 Å²	84.6	0%	0	45%	0.452	C	S	.	.	H	α-helix	trans	-58.3	-46.5	178.4	-174.2	-91.2	0	0	0	111.5	I100 L107 T108 T168 V170 M188 A190 C203	I100-F104 PolarHBondContact O-N 3.35Å; F104-L107 PolarHBondContact O-N 3.05Å; F104-T108 HydrophobicContact CD1-CG2 4.26Å; F104-T108 HydrophobicContact CE1-CG2 3.89Å; F104-T108 HydrophobicContact CE2-CG2 4.35Å; F104-T108 HydrophobicContact CZ-CG2 3.96Å; F104-T108 WeakPolarHBondContact O-CB 3.47Å; F104-T108 WeakPolarHBondContact O-CG2 3.49Å; F104-T108 PolarHBondContact O-N 2.76Å; F104-T108 PolarHBondContact O-OG1 2.99Å; F104-T168 HydrophobicContact CE1-CG2 4.24Å; F104-V170 HydrophobicContact CE2-CG2 4.14Å; F104-V170 HydrophobicContact CZ-CG2 4.01Å; F104-M188 WeakPolarHBondContact CA-O 3.13Å; F104-M188 PolarHBondContact N-O 2.62Å; F104-A190 HydrophobicContact CD2-CB 3.71Å; F104-A190 HydrophobicContact CE2-CB 3.82Å; F104-C203 HydrophobicContact CE2-CB 4.18Å
105	R	94.1	Very high	86.1	Confident	105 Å²	105	87.8 Å²	87.8	40%	0.396	47%	0.472	S	S	.	.	H	α-helix	trans	-59.5	-48.1	174.3	-71.7	174.9	-170.1	154.1	3	111.8	P101 L103 L107 T108 E109 E207	P101-R105 WeakPolarHBondContact O-CB 3.4Å; P101-R105 VanDerWaalsContact O-CG 3.29Å; P101-R105 WeakPolarHBondContact O-CG 3.32Å; P101-R105 PolarHBondContact O-N 3.22Å; L103-R105 VanDerWaalsContact C-N 3.33Å; L103-R105 PolarHBondContact O-N 3.16Å; R105-L107 PolarHBondContact O-N 2.83Å; R105-T108 PolarHBondContact O-N 3.3Å; R105-T108 PolarHBondContact O-OG1 2.9Å; R105-E109 VanDerWaalsContact O-CB 3.27Å; R105-E109 WeakPolarHBondContact O-CB 3.37Å; R105-E109 VanDerWaalsContact O-CG 3.24Å; R105-E109 WeakPolarHBondContact O-CG 3.11Å; R105-E109 PolarHBondContact O-N 2.92Å; R105-E207 IonicContact CZ-OE1 3.92Å; R105-E207 IonicContact NE-OE1 3.54Å; R105-E207 PolarHBondContact NE-OE1 2.94Å; R105-E207 IonicContact NH2-OE1 2.7Å; R105-E207 PolarHBondContact NH2-OE1 2.97Å
106	A	92.3	Very high	85.7	Confident	64 Å²	64	84.5 Å²	84.5	53%	0.529	45%	0.454	S	S	.	.	H	α-helix	trans	-61.3	-29.9	179.3	0	0	0	0	0	113.6	S102 L103	S102-A106 WeakPolarHBondContact O-CB 3.43Å; S102-A106 PolarHBondContact O-N 3.23Å; L103-A106 PolarHBondContact O-N 2.97Å
107	L	92.2	Very high	85.4	Confident	43 Å²	43	86.5 Å²	86.5	23%	0.225	46%	0.464	C	S	.	.	H	α-helix	trans	-84.2	-16.7	177	-69.8	175.8	0	0	0	113.7	L103 F104 R105 W116 M188	L103-L107 HydrophobicContact CD1-CD1 3.99Å; L103-L107 HydrophobicContact CD1-CG 4.12Å; L103-L107 HydrophobicContact CG-CD1 4Å; L103-L107 HydrophobicContact CG-CG 4.49Å; L103-L107 WeakPolarHBondContact O-CG 3.49Å; L103-L107 PolarHBondContact O-N 2.75Å; F104-L107 PolarHBondContact O-N 3.05Å; R105-L107 PolarHBondContact O-N 2.83Å; L107-W116 HydrophobicContact CB-CZ3 4.42Å; L107-M188 HydrophobicContact CD1-CB 4.23Å; L107-M188 HydrophobicContact CD1-CG 4.29Å
108	T	91.6	Very high	85.5	Confident	18 Å²	18	81.3 Å²	81.3	11%	0.11	44%	0.441	C	S	.	.	H	α-helix	trans	-111.5	-16	-176.4	53.8	0	0	0	0	113.7	F104 R105 I118 T168 V170	F104-T108 HydrophobicContact CD1-CG2 4.26Å; F104-T108 HydrophobicContact CE1-CG2 3.89Å; F104-T108 HydrophobicContact CE2-CG2 4.35Å; F104-T108 HydrophobicContact CZ-CG2 3.96Å; F104-T108 WeakPolarHBondContact O-CB 3.47Å; F104-T108 WeakPolarHBondContact O-CG2 3.49Å; F104-T108 PolarHBondContact O-N 2.76Å; F104-T108 PolarHBondContact O-OG1 2.99Å; R105-T108 PolarHBondContact O-N 3.3Å; R105-T108 PolarHBondContact O-OG1 2.9Å; T108-I118 HydrophobicContact CG2-CG2 4.33Å; T108-T168 HydrophobicContact CG2-CG2 4.09Å; T108-V170 HydrophobicContact CG2-CG2 3.4Å
109	E	87.4	Confident	85.5	Confident	137 Å²	137	74.7 Å²	74.7	64%	0.64	41%	0.412	S	S	*	.	S	Bend	trans	-81.9	114.5	173.8	-73.2	174.9	-173	0	0	110.7	R105	R105-E109 VanDerWaalsContact O-CB 3.27Å; R105-E109 WeakPolarHBondContact O-CB 3.37Å; R105-E109 VanDerWaalsContact O-CG 3.24Å; R105-E109 WeakPolarHBondContact O-CG 3.11Å; R105-E109 PolarHBondContact O-N 2.92Å
110	G	73	Confident	85.3	Confident	62 Å²	62	74.7 Å²	74.7	64%	0.639	41%	0.413	S	S	*	.	S	Bend	trans	96.6	-176.1	172.9	0	0	0	0	0	114.9	T112	G110-T112 PolarHBondContact O-N 2.81Å
111	D	63.8	Low	84.9	Confident	170 Å²	170	71.8 Å²	71.8	91%	0.909	40%	0.398	S	S	*	.			trans	-84.7	93.2	-179.2	-168.6	16.8	0	0	0	109.3
112	T	63.6	Low	84.6	Confident	37 Å²	37	71.9 Å²	71.9	23%	0.227	40%	0.398	C	S	.	.			trans	-85.8	137.6	173.9	61.5	0	0	0	0	109.1	G110 L114	G110-T112 PolarHBondContact O-N 2.81Å; T112-L114 PolarHBondContact O-N 3.19Å
113	Q	62.2	Low	84.1	Confident	199 Å²	199	68.8 Å²	68.8	93%	0.93	38%	0.376	S	S	*	.	S	Bend	trans	-71.6	20.2	176.2	-63.4	-177.3	14.3	0	0	113.2
114	L	68.9	Low	83.2	Confident	76 Å²	76	69.4 Å²	69.4	40%	0.398	39%	0.39	S	S	.	.	S	Bend	trans	-92.8	135.2	-174.8	-61.2	166.8	0	0	0	107.5	T112 W116	T112-L114 PolarHBondContact O-N 3.19Å; L114-W116 HydrophobicContact CB-CD2 3.72Å; L114-W116 HydrophobicContact CB-CE3 3.86Å; L114-W116 HydrophobicContact CB-CG 4.09Å; L114-W116 HydrophobicContact CB-CZ2 4.48Å; L114-W116 HydrophobicContact CB-CZ3 4.33Å; L114-W116 HydrophobicContact CD1-CD2 4.28Å; L114-W116 HydrophobicContact CD1-CE3 3.71Å; L114-W116 HydrophobicContact CD1-CH2 3.56Å; L114-W116 HydrophobicContact CD1-CZ2 4.1Å; L114-W116 HydrophobicContact CD1-CZ3 3.32Å; L114-W116 HydrophobicContact CD2-CZ2 4.45Å; L114-W116 HydrophobicContact CG-CE3 4.38Å; L114-W116 HydrophobicContact CG-CH2 4.47Å; L114-W116 HydrophobicContact CG-CZ3 4.36Å; L114-W116 PolarHBondContact O-N 2.99Å
115	N	73.9	Confident	82.2	Confident	133 Å²	133	74.2 Å²	74.2	71%	0.711	41%	0.412	S	S	*	.	S	Bend	trans	-75.5	59.7	178	-62.1	-26.3	0	0	0	110.3
116	W	86.6	Confident	81	Confident	67 Å²	67	70 Å²	70	25%	0.254	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	142.5	-179.3	-58.7	-22.1	0	0	0	109.2	L107 L114 I118 V170 F172 M188	L107-W116 HydrophobicContact CB-CZ3 4.42Å; L114-W116 HydrophobicContact CB-CD2 3.72Å; L114-W116 HydrophobicContact CB-CE3 3.86Å; L114-W116 HydrophobicContact CB-CG 4.09Å; L114-W116 HydrophobicContact CB-CZ2 4.48Å; L114-W116 HydrophobicContact CB-CZ3 4.33Å; L114-W116 HydrophobicContact CD1-CD2 4.28Å; L114-W116 HydrophobicContact CD1-CE3 3.71Å; L114-W116 HydrophobicContact CD1-CH2 3.56Å; L114-W116 HydrophobicContact CD1-CZ2 4.1Å; L114-W116 HydrophobicContact CD1-CZ3 3.32Å; L114-W116 HydrophobicContact CD2-CZ2 4.45Å; L114-W116 HydrophobicContact CG-CE3 4.38Å; L114-W116 HydrophobicContact CG-CH2 4.47Å; L114-W116 HydrophobicContact CG-CZ3 4.36Å; L114-W116 PolarHBondContact O-N 2.99Å; W116-I118 PolarHBondContact O-N 3.22Å; W116-V170 HydrophobicContact CB-CG1 3.73Å; W116-V170 HydrophobicContact CD2-CG1 4.42Å; W116-V170 HydrophobicContact CE3-CG1 4.37Å; W116-V170 HydrophobicContact CG-CG1 4.2Å; W116-F172 AromaticContact CD1-CD1 3.69Å; W116-F172 AromaticContact CD1-CE1 3.91Å; W116-F172 HydrophobicContact CD2-CE1 4.45Å; W116-F172 AromaticContact CE2-CE1 3.72Å; W116-F172 HydrophobicContact CZ2-CE1 4.07Å; W116-F172 AromaticContact NE1-CD1 3.55Å; W116-F172 AromaticContact NE1-CE1 3.38Å; W116-M188 HydrophobicContact CE3-CE 3.76Å; W116-M188 HydrophobicContact CH2-CE 3.97Å; W116-M188 HydrophobicContact CH2-CG 4.36Å; W116-M188 HydrophobicContact CH2-SD 4.18Å; W116-M188 HydrophobicContact CZ3-CE 3.44Å; W116-M188 VanDerWaalsContact CZ3-CE 3.44Å; W116-M188 HydrophobicContact CZ3-SD 4.22Å
117	N	89.7	Confident	79.5	Confident	51 Å²	51	71 Å²	71	27%	0.273	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	99.2	176.5	-179.9	14.3	0	0	0	109.2	Y171 K217	N117-Y171 PolarHBondContact N-O 2.9Å; N117-Y171 PolarHBondContact O-N 3.4Å; N117-K217 PolarHBondContact ND2-O 3.33Å; N117-K217 VanDerWaalsContact ND2-O 3.16Å
118	I	92.8	Very high	77.8	Confident	49 Å²	49	71.6 Å²	71.6	25%	0.251	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	124.7	179.7	-56.8	164	0	0	0	108.6	T108 W116 T168 V170	T108-I118 HydrophobicContact CG2-CG2 4.33Å; W116-I118 PolarHBondContact O-N 3.22Å; I118-T168 HydrophobicContact CG2-CG2 3.82Å; I118-V170 HydrophobicContact CG1-CG1 4.34Å; I118-V170 HydrophobicContact CG1-CG2 4.19Å
119	V	91.1	Very high	75.9	Confident	25 Å²	25	76.4 Å²	76.4	15%	0.152	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	126.6	-178.9	-176.8	0	0	0	0	109.2	F121 T168 V169 Y171 K217	V119-F121 HydrophobicContact CG1-CD1 4.18Å; V119-T168 WeakPolarHBondContact O-CA 3.47Å; V119-V169 HydrophobicContact CB-CG2 3.96Å; V119-V169 PolarHBondContact N-O 3.11Å; V119-V169 PolarHBondContact O-N 2.89Å; V119-Y171 HydrophobicContact CB-CE2 4.44Å; V119-Y171 HydrophobicContact CG2-CD2 4.22Å; V119-Y171 HydrophobicContact CG2-CE2 4.02Å; V119-K217 HydrophobicContact CG2-CD 4.02Å
120	S	91.4	Very high	74.1	Confident	57 Å²	57	74.9 Å²	74.9	40%	0.399	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	130.1	173.6	-56.9	0	0	0	0	110.3	C167 T168	S120-C167 CarbonylContact C-O 3.34Å; S120-C167 VanDerWaalsContact CA-O 3.26Å; S120-C167 WeakPolarHBondContact CA-O 3.32Å; S120-T168 PolarHBondContact OG-OG1 2.98Å
121	F	88.8	Confident	72.7	Confident	21 Å²	21	78.4 Å²	78.4	9%	0.092	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	155	179.5	55.6	-90	0	0	0	110.8	V119 V123 E125 E126 M166 C167 V169	V119-F121 HydrophobicContact CG1-CD1 4.18Å; F121-V123 PolarHBondContact O-N 3.45Å; F121-E125 HydrophobicContact CD2-CB 4.09Å; F121-E126 HydrophobicContact CE2-CB 4.14Å; F121-M166 CarbonylContact O-C 3.51Å; F121-M166 WeakPolarHBondContact O-CA 3.2Å; F121-C167 HydrophobicContact CD2-CB 4.28Å; F121-C167 HydrophobicContact CE2-CB 3.9Å; F121-C167 HydrophobicContact CZ-CB 4.04Å; F121-C167 WeakPolarHBondContact CZ-SG 3.47Å; F121-C167 PolarHBondContact N-O 3.47Å; F121-C167 PolarHBondContact O-N 2.94Å; F121-V169 HydrophobicContact CE1-CG1 4.23Å; F121-V169 HydrophobicContact CE1-CG2 4.11Å
122	P	88.8	Confident	71.6	Confident	48 Å²	48	76.7 Å²	76.7	31%	0.312	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	135	177.1	-20.9	32.9	0	0	0	110.7	A124 E125	P122-A124 PolarHBondContact O-N 3.37Å; P122-E125 VanDerWaalsContact O-CB 3.27Å; P122-E125 WeakPolarHBondContact O-CB 3.46Å; P122-E125 PolarHBondContact O-N 3.11Å
123	V	83.8	Confident	70.8	Confident	20 Å²	20	81.1 Å²	81.1	12%	0.121	43%	0.427	C	S	.	.	H	α-helix	trans	-54.2	-29.4	-179.9	163.5	0	0	0	0	113.3	F121 E125 E126 H165 C167 E207 I209	F121-V123 PolarHBondContact O-N 3.45Å; V123-E125 PolarHBondContact O-N 3.28Å; V123-E126 VanDerWaalsContact O-CB 3.29Å; V123-E126 WeakPolarHBondContact O-CB 3.43Å; V123-E126 PolarHBondContact O-N 3.2Å; V123-H165 WeakPolarHBondContact CB-O 3.11Å; V123-H165 HydrophobicContact CG2-CB 4.08Å; V123-H165 WeakPolarHBondContact CG2-O 3.34Å; V123-H165 PolarHBondContact N-O 2.69Å; V123-C167 HydrophobicContact CG2-CB 3.92Å; V123-E207 VanDerWaalsContact CG2-O 3.3Å; V123-E207 WeakPolarHBondContact CG2-O 3.38Å; V123-I209 HydrophobicContact CG1-CB 4.43Å; V123-I209 HydrophobicContact CG1-CD1 3.13Å; V123-I209 HydrophobicContact CG1-CG1 3.43Å; V123-I209 VanDerWaalsContact CG1-CG1 3.43Å
124	A	77.2	Confident	69.8	Low	75 Å²	75	75.3 Å²	75.3	62%	0.62	41%	0.405	S	S	*	.	H	α-helix	trans	-61.5	-28	175	0	0	0	0	0	113.7	P122 E126 L127 S128	P122-A124 PolarHBondContact O-N 3.37Å; A124-E126 VanDerWaalsContact C-N 3.29Å; A124-E126 PolarHBondContact O-N 2.87Å; A124-L127 PolarHBondContact O-N 3.06Å; A124-S128 PolarHBondContact O-N 3.35Å
125	E	73.9	Confident	68.5	Low	101 Å²	101	75.1 Å²	75.1	47%	0.472	41%	0.41	S	S	.	.	H	α-helix	trans	-69	-29	179.1	-167.4	175.1	167.4	0	0	111.7	F121 P122 V123 L127 S128	F121-E125 HydrophobicContact CD2-CB 4.09Å; P122-E125 VanDerWaalsContact O-CB 3.27Å; P122-E125 WeakPolarHBondContact O-CB 3.46Å; P122-E125 PolarHBondContact O-N 3.11Å; V123-E125 PolarHBondContact O-N 3.28Å; E125-L127 PolarHBondContact O-N 3.09Å; E125-S128 PolarHBondContact O-N 3.28Å; E125-S128 PolarHBondContact O-OG 3.04Å
126	E	68.9	Low	66.9	Low	18 Å²	18	76.6 Å²	76.6	8%	0.084	41%	0.41	C	S	.	.	H	α-helix	trans	-59.2	-34.9	174.9	-160.5	174.5	-165.7	0	0	112	F121 V123 A124 I209 D210 Y211 G212	F121-E126 HydrophobicContact CE2-CB 4.14Å; V123-E126 VanDerWaalsContact O-CB 3.29Å; V123-E126 WeakPolarHBondContact O-CB 3.43Å; V123-E126 PolarHBondContact O-N 3.2Å; A124-E126 VanDerWaalsContact C-N 3.29Å; A124-E126 PolarHBondContact O-N 2.87Å; E126-I209 WeakPolarHBondContact OE2-CB 3.41Å; E126-I209 PolarHBondContact OE2-N 2.02Å; E126-D210 VanDerWaalsContact CD-N 3.28Å; E126-D210 HydrophobicContact CG-CB 4.32Å; E126-D210 WeakPolarHBondContact OE1-CA 3.45Å; E126-D210 VanDerWaalsContact OE1-CB 3.31Å; E126-D210 WeakPolarHBondContact OE1-CB 3.49Å; E126-D210 PolarHBondContact OE1-N 3.17Å; E126-D210 PolarHBondContact OE2-N 2.93Å; E126-Y211 PolarHBondContact OE1-N 3.33Å; E126-G212 PolarHBondContact OE1-N 2.9Å
127	L	59.7	Low	64.9	Low	85 Å²	85	80.7 Å²	80.7	45%	0.445	44%	0.436	S	S	.	.	H	α-helix	trans	-91.2	-23.4	-176.3	-65.4	170.8	0	0	0	113.6	A124 E125 H129 H130 I209	A124-L127 PolarHBondContact O-N 3.06Å; E125-L127 PolarHBondContact O-N 3.09Å; L127-H129 PolarHBondContact O-N 3.29Å; L127-H129 VanDerWaalsContact O-N 3.14Å; L127-H130 WeakPolarHBondContact O-CA 3.47Å; L127-H130 WeakPolarHBondContact O-CB 3.34Å; L127-H130 PolarHBondContact O-N 3.11Å; L127-I209 HydrophobicContact CD1-CD1 4.2Å
128	S	57.6	Low	62.7	Low	54 Å²	54	86.2 Å²	86.2	38%	0.378	46%	0.46	S	S	.	.	H	α-helix	trans	-59.8	-26.6	-178.7	70.4	0	0	0	0	113.3	A124 E125 H130	A124-S128 PolarHBondContact O-N 3.35Å; E125-S128 PolarHBondContact O-N 3.28Å; E125-S128 PolarHBondContact O-OG 3.04Å; S128-H130 PolarHBondContact O-N 3Å
129	H	51.4	Low	60.1	Low	119 Å²	119	89.2 Å²	89.2	55%	0.551	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-8.7	173.1	-69.6	-63	0	0	0	114.3	L127	L127-H129 PolarHBondContact O-N 3.29Å; L127-H129 VanDerWaalsContact O-N 3.14Å
130	H	48.2	Very low	57.7	Low	105 Å²	105	93 Å²	93	49%	0.486	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-17	178.5	-153	-90.7	0	0	0	113.1	L127 S128 N132 L133	L127-H130 WeakPolarHBondContact O-CA 3.47Å; L127-H130 WeakPolarHBondContact O-CB 3.34Å; L127-H130 PolarHBondContact O-N 3.11Å; S128-H130 PolarHBondContact O-N 3Å; H130-N132 PolarHBondContact O-N 2.74Å; H130-L133 PolarHBondContact O-N 3.17Å
131	E	44	Very low	54.9	Low	137 Å²	137	97.7 Å²	97.7	64%	0.64	53%	0.525	S	S	*	.	H	α-helix	trans	-66.6	-20.3	-175.5	-66.9	-164.8	148.3	0	0	113.9	L133 V134 S135	E131-L133 PolarHBondContact O-N 2.96Å; E131-V134 PolarHBondContact O-N 2.99Å; E131-S135 PolarHBondContact O-N 3.31Å
132	N	42	Very low	52.4	Low	134 Å²	134	105.7 Å²	105.7	72%	0.717	56%	0.562	S	S	*	*	H	α-helix	trans	-66.7	-13.5	171.4	-79.5	-37.1	0	0	0	113.9	H130	H130-N132 PolarHBondContact O-N 2.74Å
133	L	45	Very low	50.1	Low	129 Å²	129	108.6 Å²	108.6	68%	0.675	58%	0.581	S	S	*	*	H	α-helix	trans	-99.6	-25.1	175.3	-114.9	108.3	0	0	0	113.7	H130 E131	H130-L133 PolarHBondContact O-N 3.17Å; E131-L133 PolarHBondContact O-N 2.96Å
134	V	42.3	Very low	47.7	Very low	77 Å²	77	116.7 Å²	116.7	47%	0.467	62%	0.618	S	S	.	*	H	α-helix	trans	-84.9	-28.2	-177.7	-174.5	0	0	0	0	111.8	E131 F136 L137	E131-V134 PolarHBondContact O-N 2.99Å; V134-F136 PolarHBondContact O-N 2.7Å; V134-F136 VanDerWaalsContact O-N 3.11Å; V134-L137 PolarHBondContact O-N 2.76Å; V134-L137 VanDerWaalsContact O-N 3.09Å
135	S	41.5	Very low	46.1	Very low	72 Å²	72	121.8 Å²	121.8	50%	0.503	63%	0.628	S	S	.	*	H	α-helix	trans	-57.8	-26.3	175.5	177.9	0	0	0	0	113.8	E131 T139	E131-S135 PolarHBondContact O-N 3.31Å; S135-T139 PolarHBondContact O-OG1 2.83Å
136	F	39.5	Very low	44.2	Very low	164 Å²	164	125.5 Å²	125.5	72%	0.719	65%	0.646	S	S	*	*	H	α-helix	trans	-78.1	-22.5	178.8	-80.6	-82.5	0	0	0	114.5	V134	V134-F136 PolarHBondContact O-N 2.7Å; V134-F136 VanDerWaalsContact O-N 3.11Å
137	L	46	Very low	42.8	Very low	153 Å²	153	132.8 Å²	132.8	80%	0.801	69%	0.685	S	S	*	*	H	α-helix	trans	-87.5	-19.5	177.6	-67.1	177.5	0	0	0	112.6	V134	V134-L137 PolarHBondContact O-N 2.76Å; V134-L137 VanDerWaalsContact O-N 3.09Å
138	E	42.1	Very low	41.6	Very low	168 Å²	168	134.1 Å²	134.1	79%	0.785	70%	0.696	S	S	*	*	H	α-helix	trans	-88.5	-10.3	-179.6	-147.7	161.3	-163.7	0	0	113.2
139	T	39.8	Very low	41	Very low	111 Å²	111	137.3 Å²	137.3	68%	0.681	72%	0.719	S	S	*	*	S	Bend	trans	-99.1	0.1	-176.6	-41	0	0	0	0	114.1	S135	S135-T139 PolarHBondContact O-OG1 2.83Å
140	V	38.9	Very low	40.3	Very low	106 Å²	106	137.2 Å²	137.2	64%	0.642	73%	0.727	S	S	*	*	S	Bend	trans	-117.2	75.7	175.8	-169.8	0	0	0	0	110.6
141	N	33.5	Very low	39.8	Very low	154 Å²	154	137.9 Å²	137.9	82%	0.824	74%	0.74	S	S	*	*			trans	144.5	103.3	140.5	-76.9	-47.6	0	0	0	112.4
142	Q	36.8	Very low	39.4	Very low	189 Å²	189	135.6 Å²	135.6	88%	0.883	74%	0.739	S	S	*	*			trans	-128.7	150.7	149.1	-132.6	174.6	14.5	0	0	106.4
143	P	40.2	Very low	39.1	Very low	109 Å²	109	136.9 Å²	136.9	71%	0.708	75%	0.746	S	S	*	*			cis	-134.2	155.4	5.6	38.2	-20.9	0	0	0	114.6
144	Q	32.8	Very low	39	Very low	190 Å²	190	135.4 Å²	135.4	89%	0.888	74%	0.739	S	S	*	*				169.7	141.9	129	-94.2	-177.8	-12.5	0	0	112.1
145	H	43.7	Very low	38.8	Very low	183 Å²	183	138.7 Å²	138.7	85%	0.847	76%	0.759	S	S	*	*			trans	-35.9	132.5	176.4	-71.8	-92.3	0	0	0	116.4
146	Q	33.5	Very low	38.7	Very low	179 Å²	179	142.2 Å²	142.2	84%	0.836	77%	0.767	S	S	*	*			trans	-164.5	125.6	131	-106.2	169.3	10.4	0	0	111	V148	Q146-V148 PolarHBondContact O-N 2.87Å; Q146-V148 VanDerWaalsContact O-N 3.14Å
147	N	41	Very low	38.8	Very low	171 Å²	171	138.4 Å²	138.4	91%	0.914	77%	0.765	S	S	*	*			trans	-61.5	108.6	170.9	-73.7	-13.9	0	0	0	109.4
148	V	34.2	Very low	38.6	Very low	112 Å²	112	136.6 Å²	136.6	68%	0.679	76%	0.763	S	S	*	*			trans	-124.6	101.7	165.1	-173.7	0	0	0	0	107.6	Q146 V150	Q146-V148 PolarHBondContact O-N 2.87Å; Q146-V148 VanDerWaalsContact O-N 3.14Å; V148-V150 HydrophobicContact CG1-CG2 3.91Å; V148-V150 PolarHBondContact O-N 2.7Å
149	S	44.4	Very low	38.7	Very low	121 Å²	121	139.7 Å²	139.7	85%	0.846	77%	0.769	S	S	*	*			trans	-68.8	112.4	168.1	50	0	0	0	0	109.1
150	V	36.1	Very low	38.7	Very low	118 Å²	118	138.6 Å²	138.6	72%	0.715	77%	0.766	S	S	*	*			trans	-114.9	133.3	167.7	-173.1	0	0	0	0	107.8	V148 S152	V148-V150 HydrophobicContact CG1-CG2 3.91Å; V148-V150 PolarHBondContact O-N 2.7Å; V150-S152 PolarHBondContact O-N 3.47Å
151	P	37.7	Very low	38.8	Very low	118 Å²	118	138 Å²	138	77%	0.766	77%	0.766	S	S	*	*			trans	-69.7	121.3	-167.5	-13.5	28.5	0	0	0	111.9	N153	P151-N153 PolarHBondContact O-N 3.01Å
152	S	35.6	Very low	39.2	Very low	89 Å²	89	137.8 Å²	137.8	62%	0.622	77%	0.765	S	S	*	*			trans	-75	104	169.9	-163.8	0	0	0	0	109.1	V150 N154	V150-S152 PolarHBondContact O-N 3.47Å; S152-N154 WeakPolarHBondContact CB-OD1 3.17Å; S152-N154 PolarHBondContact O-N 3.05Å; S152-N154 PolarHBondContact OG-OD1 3.17Å
153	N	36.8	Very low	39.8	Very low	162 Å²	162	137.1 Å²	137.1	87%	0.866	76%	0.759	S	S	*	*			trans	-76.2	85.7	162	-89.3	-9.6	0	0	0	107.9	P151 V155	P151-N153 PolarHBondContact O-N 3.01Å; N153-V155 PolarHBondContact O-N 2.8Å
154	N	42.6	Very low	40.8	Very low	98 Å²	98	139.7 Å²	139.7	52%	0.524	76%	0.762	S	S	.	*			trans	-62.9	110	172.9	-70.1	-16.9	0	0	0	110.2	S152 H156	S152-N154 WeakPolarHBondContact CB-OD1 3.17Å; S152-N154 PolarHBondContact O-N 3.05Å; S152-N154 PolarHBondContact OG-OD1 3.17Å; N154-H156 VanDerWaalsContact C-N 3.32Å; N154-H156 PolarHBondContact OD1-CE1 3.24Å
155	V	37.6	Very low	42.9	Very low	145 Å²	145	136.1 Å²	136.1	88%	0.879	75%	0.745	S	S	*	*			trans	-98.6	74.2	146.1	-175	0	0	0	0	106.1	N153 A157	N153-V155 PolarHBondContact O-N 2.8Å; V155-A157 PolarHBondContact O-N 2.61Å; V155-A157 VanDerWaalsContact O-N 3.14Å
156	H	39.9	Very low	45.1	Very low	147 Å²	147	132 Å²	132	68%	0.681	73%	0.727	S	S	*	*			trans	-68.6	100.1	165	-80.9	32.5	0	0	0	107.4	N154	N154-H156 VanDerWaalsContact C-N 3.32Å; N154-H156 PolarHBondContact OD1-CE1 3.24Å
157	A	41.3	Very low	47.9	Very low	83 Å²	83	123.5 Å²	123.5	69%	0.686	69%	0.688	S	S	*	*			trans	-65.9	129.9	151.2	0	0	0	0	0	106.6	V155 Y159	V155-A157 PolarHBondContact O-N 2.61Å; V155-A157 VanDerWaalsContact O-N 3.14Å; A157-Y159 PolarHBondContact O-N 3.33Å
158	P	41.9	Very low	50.5	Low	116 Å²	116	116.3 Å²	116.3	75%	0.753	65%	0.65	S	S	*	*			trans	-66.7	102.8	-173	25.6	-31.8	0	0	0	110	S160	P158-S160 PolarHBondContact O-N 2.7Å
159	Y	45.6	Very low	53.4	Low	233 Å²	233	111 Å²	111	91%	0.914	62%	0.618	S	S	*	*			trans	-63.7	99.8	166.3	-170.1	-99.2	0	0	0	107.6	A157	A157-Y159 PolarHBondContact O-N 3.33Å
160	S	38.6	Very low	55.8	Low	87 Å²	87	105.2 Å²	105.2	61%	0.608	58%	0.577	S	S	*	*			trans	-103.3	111.9	-178.9	48.5	0	0	0	0	109.9	P158	P158-S160 PolarHBondContact O-N 2.7Å
161	S	40.6	Very low	58.6	Low	93 Å²	93	99.6 Å²	99.6	65%	0.65	54%	0.543	S	S	*	.	S	Bend	trans	5	121.2	158.4	-130.1	0	0	0	0	118.6	K163	S161-K163 PolarHBondContact O-N 2.8Å
162	D	42.4	Very low	61.2	Low	151 Å²	151	95 Å²	95	81%	0.807	51%	0.511	S	S	*	.	S	Bend	trans	58.5	44	137.4	-54.8	-47.5	0	0	0	119.2
163	K	50.4	Low	63.6	Low	174 Å²	174	92.5 Å²	92.5	76%	0.757	49%	0.491	S	S	*	.			trans	-127	120.2	137.7	-68.4	-175.4	-179	178.4	0	106.2	S161 H165	S161-K163 PolarHBondContact O-N 2.8Å; K163-H165 PolarHBondContact O-N 3.14Å
164	E	59.6	Low	66	Low	164 Å²	164	90 Å²	90	77%	0.766	48%	0.478	S	S	*	.			trans	-52.4	106.3	169.6	-70.5	174.8	176.9	0	0	107.4	M166	E164-M166 PolarHBondContact O-N 2.89Å
165	H	78.6	Confident	68.1	Low	115 Å²	115	88.2 Å²	88.2	53%	0.532	47%	0.472	S	S	.	.			trans	-64	114.6	174.8	-70.3	-73.4	0	0	0	106.1	V123 K163	V123-H165 WeakPolarHBondContact CB-O 3.11Å; V123-H165 HydrophobicContact CG2-CB 4.08Å; V123-H165 WeakPolarHBondContact CG2-O 3.34Å; V123-H165 PolarHBondContact N-O 2.69Å; K163-H165 PolarHBondContact O-N 3.14Å
166	M	89.6	Confident	70.6	Confident	96 Å²	96	82.5 Å²	82.5	47%	0.473	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	124.7	176.7	-61.2	-170.9	80.7	0	0	108.2	F121 E164 E207	F121-M166 CarbonylContact O-C 3.51Å; F121-M166 WeakPolarHBondContact O-CA 3.2Å; E164-M166 PolarHBondContact O-N 2.89Å; M166-E207 WeakPolarHBondContact O-CB 3.14Å
167	C	92.1	Very high	72.9	Confident	0 Å²	0	78.1 Å²	78.1	0%	0	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	124	165.8	165.7	0	0	0	0	107.5	S120 F121 V123 C208	S120-C167 CarbonylContact C-O 3.34Å; S120-C167 VanDerWaalsContact CA-O 3.26Å; S120-C167 WeakPolarHBondContact CA-O 3.32Å; F121-C167 HydrophobicContact CD2-CB 4.28Å; F121-C167 HydrophobicContact CE2-CB 3.9Å; F121-C167 HydrophobicContact CZ-CB 4.04Å; F121-C167 WeakPolarHBondContact CZ-SG 3.47Å; F121-C167 PolarHBondContact N-O 3.47Å; F121-C167 PolarHBondContact O-N 2.94Å; V123-C167 HydrophobicContact CG2-CB 3.92Å; C167-C208 VanDerWaalsContact CA-SG 3.51Å; C167-C208 HydrophobicContact CB-CB 3.91Å; C167-C208 WeakPolarHBondContact CB-SG 3.46Å; C167-C208 WeakPolarHBondContact SG-CB 3.49Å; C167-C208 CovalentContact SG-SG 2.03Å; C167-C208 PolarHBondContact SG-SG 3.1Å
168	T	94.1	Very high	75.3	Confident	20 Å²	20	77.2 Å²	77.2	12%	0.123	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	128.9	176.6	-61.4	0	0	0	0	109.6	F104 T108 I118 V119 S120 G205	F104-T168 HydrophobicContact CE1-CG2 4.24Å; T108-T168 HydrophobicContact CG2-CG2 4.09Å; I118-T168 HydrophobicContact CG2-CG2 3.82Å; V119-T168 WeakPolarHBondContact O-CA 3.47Å; S120-T168 PolarHBondContact OG-OG1 2.98Å; T168-G205 WeakPolarHBondContact O-CA 3.06Å; T168-G205 PolarHBondContact O-N 2.83Å
169	V	95.3	Very high	77.7	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	153.4	176.6	-57.6	0	0	0	0	110	V119 F121 Y171 E202 C203 I204	V119-V169 HydrophobicContact CB-CG2 3.96Å; V119-V169 PolarHBondContact N-O 3.11Å; V119-V169 PolarHBondContact O-N 2.89Å; F121-V169 HydrophobicContact CE1-CG1 4.23Å; F121-V169 HydrophobicContact CE1-CG2 4.11Å; V169-Y171 HydrophobicContact CG2-CD2 4.43Å; V169-Y171 HydrophobicContact CG2-CE2 3.63Å; V169-E202 HydrophobicContact CB-CG 4.01Å; V169-E202 HydrophobicContact CG1-CG 4.5Å; V169-E202 WeakPolarHBondContact CG1-OE1 3.17Å; V169-E202 HydrophobicContact CG2-CG 4.48Å; V169-C203 CarbonylContact C-O 3.58Å; V169-C203 VanDerWaalsContact CA-O 3.27Å; V169-C203 WeakPolarHBondContact CA-O 3.37Å; V169-I204 HydrophobicContact CG1-CB 4.5Å; V169-I204 HydrophobicContact CG1-CG1 4.22Å; V169-I204 HydrophobicContact CG1-CG2 4.41Å
170	V	95.5	Very high	80	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	126.3	178.2	-173	0	0	0	0	109.8	F104 T108 W116 I118 M188 E202 C203	F104-V170 HydrophobicContact CE2-CG2 4.14Å; F104-V170 HydrophobicContact CZ-CG2 4.01Å; T108-V170 HydrophobicContact CG2-CG2 3.4Å; W116-V170 HydrophobicContact CB-CG1 3.73Å; W116-V170 HydrophobicContact CD2-CG1 4.42Å; W116-V170 HydrophobicContact CE3-CG1 4.37Å; W116-V170 HydrophobicContact CG-CG1 4.2Å; I118-V170 HydrophobicContact CG1-CG1 4.34Å; I118-V170 HydrophobicContact CG1-CG2 4.19Å; V170-M188 HydrophobicContact CB-CE 4.13Å; V170-M188 HydrophobicContact CG1-CE 4.03Å; V170-M188 HydrophobicContact CG2-CE 3.95Å; V170-E202 CarbonylContact O-C 3.59Å; V170-E202 VanDerWaalsContact O-CA 3.3Å; V170-E202 WeakPolarHBondContact O-CA 3.37Å; V170-C203 HydrophobicContact CB-CB 4.43Å; V170-C203 PolarHBondContact N-O 3.39Å; V170-C203 PolarHBondContact O-N 2.8Å
171	Y	94.4	Very high	82.7	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	134.9	169.9	-56.6	-93.5	0	0	0	110.3	N117 V119 V169 F196 C201 E202 S213 T215 K217	N117-Y171 PolarHBondContact N-O 2.9Å; N117-Y171 PolarHBondContact O-N 3.4Å; V119-Y171 HydrophobicContact CB-CE2 4.44Å; V119-Y171 HydrophobicContact CG2-CD2 4.22Å; V119-Y171 HydrophobicContact CG2-CE2 4.02Å; V169-Y171 HydrophobicContact CG2-CD2 4.43Å; V169-Y171 HydrophobicContact CG2-CE2 3.63Å; Y171-F196 HydrophobicContact CE1-CE2 4.09Å; Y171-C201 WeakPolarHBondContact CA-O 3.35Å; Y171-E202 HydrophobicContact CD1-CB 3.87Å; Y171-E202 HydrophobicContact CD1-CG 4.15Å; Y171-E202 HydrophobicContact CE1-CB 3.72Å; Y171-E202 HydrophobicContact CE1-CG 3.7Å; Y171-E202 PolarHBondContact OH-OE1 3.2Å; Y171-S213 VanDerWaalsContact OH-CB 3.29Å; Y171-S213 WeakPolarHBondContact OH-CB 3.44Å; Y171-T215 PolarHBondContact OH-O 3.14Å; Y171-T215 VanDerWaalsContact OH-O 3.1Å; Y171-K217 HydrophobicContact CD1-CB 4.08Å; Y171-K217 HydrophobicContact CD2-CB 3.8Å; Y171-K217 HydrophobicContact CD2-CD 4.37Å; Y171-K217 HydrophobicContact CD2-CG 4.49Å; Y171-K217 HydrophobicContact CE1-CB 4.1Å; Y171-K217 HydrophobicContact CE1-CG 4.43Å; Y171-K217 HydrophobicContact CE2-CB 3.83Å; Y171-K217 HydrophobicContact CE2-CD 3.78Å; Y171-K217 HydrophobicContact CE2-CG 4.03Å; Y171-K217 HydrophobicContact CG-CB 3.91Å
172	F	92.3	Very high	85.4	Confident	22 Å²	22	65.5 Å²	65.5	10%	0.096	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	134.2	168.6	-71.5	-83	0	0	0	110.2	W116 D174 M176 M188 C201 C203 C218	W116-F172 AromaticContact CD1-CD1 3.69Å; W116-F172 AromaticContact CD1-CE1 3.91Å; W116-F172 HydrophobicContact CD2-CE1 4.45Å; W116-F172 AromaticContact CE2-CE1 3.72Å; W116-F172 HydrophobicContact CZ2-CE1 4.07Å; W116-F172 AromaticContact NE1-CD1 3.55Å; W116-F172 AromaticContact NE1-CE1 3.38Å; F172-D174 VanDerWaalsContact C-N 3.29Å; F172-D174 PolarHBondContact O-N 3.45Å; F172-M176 HydrophobicContact CB-CE 3.48Å; F172-M176 VanDerWaalsContact CB-CE 3.48Å; F172-M176 HydrophobicContact CD1-CE 4.09Å; F172-M176 HydrophobicContact CD2-CE 3.76Å; F172-M176 HydrophobicContact CD2-SD 4.4Å; F172-M176 HydrophobicContact CE2-CE 4.47Å; F172-M176 HydrophobicContact CG-CE 3.51Å; F172-M188 HydrophobicContact CE1-SD 4.24Å; F172-M188 HydrophobicContact CE2-SD 3.99Å; F172-M188 HydrophobicContact CZ-CG 4.47Å; F172-M188 HydrophobicContact CZ-SD 3.4Å; F172-M188 WeakPolarHBondContact CZ-SD 3.49Å; F172-C201 HydrophobicContact CD2-CB 4.04Å; F172-C201 PolarHBondContact N-O 3.24Å; F172-C203 VanDerWaalsContact CE2-SG 3.5Å; F172-C218 VanDerWaalsContact O-CB 3.3Å; F172-C218 WeakPolarHBondContact O-CB 2.97Å; F172-C218 PolarHBondContact O-SG 3.05Å
173	D	87.6	Confident	88	Confident	37 Å²	37	62.3 Å²	62.3	20%	0.198	31%	0.31	C	S	.	.	S	Bend	trans	-64.6	-37.9	177.9	-74	-19.6	0	0	0	111.9	M219 N220	D173-M219 HydrophobicContact CB-CB 4.36Å; D173-M219 WeakPolarHBondContact OD1-CG 3.01Å; D173-N220 WeakPolarHBondContact O-CB 2.94Å; D173-N220 PolarHBondContact O-N 3.29Å
174	D	86.3	Confident	90.2	Very high	109 Å²	109	55.5 Å²	55.5	58%	0.583	28%	0.284	S	S	*	.	S	Bend	trans	-86.1	142.3	-179.6	-67.4	-28.2	0	0	0	113	F172 N220	F172-D174 VanDerWaalsContact C-N 3.29Å; F172-D174 PolarHBondContact O-N 3.45Å; D174-N220 PolarHBondContact OD1-ND2 3.04Å
175	C	86.5	Confident	92	Very high	61 Å²	61	47.7 Å²	47.7	41%	0.412	25%	0.247	S	C	.	.			trans	-79	143.8	-179.5	-44.5	0	0	0	0	111.8	A199 N220 C221	C175-A199 WeakPolarHBondContact CA-O 3.42Å; C175-A199 HydrophobicContact CB-CB 3.93Å; C175-N220 VanDerWaalsContact SG-C 3.51Å; C175-N220 PolarHBondContact SG-O 3.42Å; C175-N220 VanDerWaalsContact SG-O 3.34Å; C175-C221 WeakPolarHBondContact CA-SG 3.02Å; C175-C221 HydrophobicContact CB-CB 4.27Å; C175-C221 WeakPolarHBondContact CB-SG 3.33Å; C175-C221 WeakPolarHBondContact SG-CA 3.36Å; C175-C221 WeakPolarHBondContact SG-CB 3.43Å; C175-C221 PolarHBondContact SG-N 3.37Å; C175-C221 VanDerWaalsContact SG-N 3.42Å; C175-C221 CovalentContact SG-SG 2.05Å; C175-C221 PolarHBondContact SG-SG 3.08Å
176	M	89.7	Confident	92.9	Very high	25 Å²	25	45.8 Å²	45.8	12%	0.123	24%	0.239	C	C	.	.			trans	-147.6	159	-176.6	65.5	-173.5	74.1	0	0	112.4	F172 Q180 C181 W195 A199 C201	F172-M176 HydrophobicContact CB-CE 3.48Å; F172-M176 VanDerWaalsContact CB-CE 3.48Å; F172-M176 HydrophobicContact CD1-CE 4.09Å; F172-M176 HydrophobicContact CD2-CE 3.76Å; F172-M176 HydrophobicContact CD2-SD 4.4Å; F172-M176 HydrophobicContact CE2-CE 4.47Å; F172-M176 HydrophobicContact CG-CE 3.51Å; M176-Q180 HydrophobicContact CB-CB 3.84Å; M176-Q180 HydrophobicContact CG-CB 4.23Å; M176-Q180 HydrophobicContact SD-CB 4.27Å; M176-C181 HydrophobicContact CG-CB 4.05Å; M176-C181 VanDerWaalsContact SD-CA 3.52Å; M176-C181 HydrophobicContact SD-CB 4.06Å; M176-W195 PolarHBondContact O-NE1 3.5Å; M176-A199 PolarHBondContact N-O 3.37Å; M176-A199 VanDerWaalsContact N-O 3.11Å; M176-C201 HydrophobicContact CE-CB 4.16Å; M176-C201 HydrophobicContact CG-CB 3.83Å; M176-C201 HydrophobicContact SD-CB 3.73Å
177	S	87.7	Confident	93.1	Very high	55 Å²	55	45.1 Å²	45.1	39%	0.385	24%	0.244	S	C	.	.			trans	-65	157.2	172.2	63.7	0	0	0	0	111.2	H179 Q180 C181	S177-H179 PolarHBondContact O-N 3.03Å; S177-Q180 PolarHBondContact O-N 2.03Å; S177-Q180 WeakPolarHBondContact OG-CB 3.09Å; S177-Q180 VanDerWaalsContact OG-CG 3.31Å; S177-Q180 WeakPolarHBondContact OG-CG 3.31Å; S177-Q180 PolarHBondContact OG-N 2.93Å; S177-Q180 PolarHBondContact OG-OE1 2.97Å; S177-C181 PolarHBondContact O-N 3.38Å
178	I	91.7	Very high	93.3	Very high	63 Å²	63	45.3 Å²	45.3	32%	0.323	25%	0.245	S	C	.	.	H	α-helix	trans	-52.6	-39.9	175.5	-172.3	172	0	0	0	112.7	T92 C181 K182 Y193 W195	T92-I178 HydrophobicContact CG2-CD1 3.56Å; I178-C181 WeakPolarHBondContact O-CB 3.13Å; I178-C181 PolarHBondContact O-N 2Å; I178-K182 PolarHBondContact O-N 2.75Å; I178-Y193 HydrophobicContact CG1-CE2 4.01Å; I178-W195 HydrophobicContact CB-CB 4.48Å; I178-W195 HydrophobicContact CB-CD2 3.88Å; I178-W195 HydrophobicContact CB-CE3 4.26Å; I178-W195 HydrophobicContact CB-CG 3.96Å; I178-W195 HydrophobicContact CD1-CE3 4.43Å; I178-W195 HydrophobicContact CG1-CB 4.06Å; I178-W195 HydrophobicContact CG1-CD2 4.29Å; I178-W195 HydrophobicContact CG1-CG 4.08Å
179	H	92.4	Very high	93.4	Very high	124 Å²	124	44.4 Å²	44.4	57%	0.574	24%	0.239	S	C	*	.	H	α-helix	trans	-67.2	-41.7	178.3	179	-92.4	0	0	0	112.2	S177 C181 K182 I183	S177-H179 PolarHBondContact O-N 3.03Å; H179-C181 VanDerWaalsContact C-N 3.34Å; H179-K182 PolarHBondContact O-N 3.22Å; H179-I183 WeakPolarHBondContact CE1-CD1 2.99Å; H179-I183 WeakPolarHBondContact O-CG1 3.2Å; H179-I183 PolarHBondContact O-N 3.26Å; H179-I183 VanDerWaalsContact O-N 3.11Å
180	Q	94.7	Very high	93.5	Very high	103 Å²	103	44.4 Å²	44.4	48%	0.481	24%	0.239	S	C	.	.	H	α-helix	trans	-65	-40.1	173.7	-75	165.8	-48.4	0	0	111.4	M176 S177 K182 I183 S184	M176-Q180 HydrophobicContact CB-CB 3.84Å; M176-Q180 HydrophobicContact CG-CB 4.23Å; M176-Q180 HydrophobicContact SD-CB 4.27Å; S177-Q180 PolarHBondContact O-N 2.03Å; S177-Q180 WeakPolarHBondContact OG-CB 3.09Å; S177-Q180 VanDerWaalsContact OG-CG 3.31Å; S177-Q180 WeakPolarHBondContact OG-CG 3.31Å; S177-Q180 PolarHBondContact OG-N 2.93Å; S177-Q180 PolarHBondContact OG-OE1 2.97Å; Q180-K182 VanDerWaalsContact C-N 3.35Å; Q180-K182 PolarHBondContact O-N 2.88Å; Q180-I183 PolarHBondContact O-N 3.41Å; Q180-S184 WeakPolarHBondContact O-CB 3Å; Q180-S184 PolarHBondContact O-N 3.1Å; Q180-S184 PolarHBondContact O-OG 2.02Å
181	C	95.9	Very high	93.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-58.4	-47.9	176	-176.7	0	0	0	0	111.5	M176 S177 I178 H179 S184 C185 Y193 C201	M176-C181 HydrophobicContact CG-CB 4.05Å; M176-C181 VanDerWaalsContact SD-CA 3.52Å; M176-C181 HydrophobicContact SD-CB 4.06Å; S177-C181 PolarHBondContact O-N 3.38Å; I178-C181 WeakPolarHBondContact O-CB 3.13Å; I178-C181 PolarHBondContact O-N 2Å; H179-C181 VanDerWaalsContact C-N 3.34Å; C181-S184 PolarHBondContact O-N 3.14Å; C181-C185 WeakPolarHBondContact O-CB 3.13Å; C181-C185 PolarHBondContact O-N 3.4Å; C181-C185 PolarHBondContact O-SG 2.95Å; C181-Y193 HydrophobicContact CB-CD2 4.5Å; C181-C201 WeakPolarHBondContact CA-SG 3.03Å; C181-C201 HydrophobicContact CB-CB 3.7Å; C181-C201 WeakPolarHBondContact CB-SG 3.18Å; C181-C201 VanDerWaalsContact SG-CA 3.53Å; C181-C201 WeakPolarHBondContact SG-CB 3.29Å; C181-C201 CovalentContact SG-SG 2.04Å; C181-C201 PolarHBondContact SG-SG 3.39Å
182	K	96.6	Very high	93.7	Very high	57 Å²	57	46.4 Å²	46.4	25%	0.248	25%	0.25	C	C	.	.	H	α-helix	trans	-55	-55.5	175	177.8	170	178.4	164.9	0	112	E94 L96 I178 H179 Q180 S184 C185 E186 Y193	E94-K182 IonicContact OE1-NZ 3.12Å; E94-K182 PolarHBondContact OE1-NZ 3.25Å; E94-K182 IonicContact OE2-NZ 2.73Å; L96-K182 HydrophobicContact CD2-CG 3.89Å; I178-K182 PolarHBondContact O-N 2.75Å; H179-K182 PolarHBondContact O-N 3.22Å; Q180-K182 VanDerWaalsContact C-N 3.35Å; Q180-K182 PolarHBondContact O-N 2.88Å; K182-S184 VanDerWaalsContact C-N 3.32Å; K182-S184 PolarHBondContact O-N 3.03Å; K182-C185 PolarHBondContact O-N 3.41Å; K182-E186 WeakPolarHBondContact CE-OE1 3.45Å; K182-E186 HydrophobicContact CG-CG 4.41Å; K182-E186 WeakPolarHBondContact O-CG 3.35Å; K182-E186 PolarHBondContact O-N 3.17Å; K182-Y193 HydrophobicContact CB-CD1 4.36Å; K182-Y193 HydrophobicContact CB-CE1 3.83Å; K182-Y193 HydrophobicContact CD-CE1 4.15Å; K182-Y193 HydrophobicContact CG-CD1 4.48Å; K182-Y193 HydrophobicContact CG-CE1 3.92Å
183	I	96.7	Very high	93.9	Very high	83 Å²	83	45.6 Å²	45.6	43%	0.426	25%	0.246	S	C	.	.	H	α-helix	trans	-60.2	-43.1	-178.5	-69.7	175.1	0	0	0	111.3	H179 Q180 E186 S187	H179-I183 WeakPolarHBondContact CE1-CD1 2.99Å; H179-I183 WeakPolarHBondContact O-CG1 3.2Å; H179-I183 PolarHBondContact O-N 3.26Å; H179-I183 VanDerWaalsContact O-N 3.11Å; Q180-I183 PolarHBondContact O-N 3.41Å; I183-E186 PolarHBondContact O-N 3.18Å; I183-S187 WeakPolarHBondContact O-CB 3.47Å; I183-S187 PolarHBondContact O-N 3.11Å; I183-S187 PolarHBondContact O-OG 3.3Å
184	S	96.3	Very high	94.3	Very high	31 Å²	31	44.7 Å²	44.7	22%	0.217	24%	0.24	C	C	.	.	H	α-helix	trans	-59.5	-49.4	177.3	-68	0	0	0	0	111.1	Q180 C181 K182 E186 S187 M188	Q180-S184 WeakPolarHBondContact O-CB 3Å; Q180-S184 PolarHBondContact O-N 3.1Å; Q180-S184 PolarHBondContact O-OG 2.02Å; C181-S184 PolarHBondContact O-N 3.14Å; K182-S184 VanDerWaalsContact C-N 3.32Å; K182-S184 PolarHBondContact O-N 3.03Å; S184-E186 PolarHBondContact O-N 3.28Å; S184-S187 PolarHBondContact O-N 3.04Å; S184-S187 PolarHBondContact O-OG 3.09Å; S184-M188 WeakPolarHBondContact O-CG 2.98Å; S184-M188 PolarHBondContact O-N 3.22Å
185	C	97.3	Very high	94.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66.3	-37	178.8	-63.5	0	0	0	0	113.2	L96 C181 K182 M188 G189 A190 C203	L96-C185 HydrophobicContact CD1-CB 3.65Å; C181-C185 WeakPolarHBondContact O-CB 3.13Å; C181-C185 PolarHBondContact O-N 3.4Å; C181-C185 PolarHBondContact O-SG 2.95Å; K182-C185 PolarHBondContact O-N 3.41Å; C185-M188 PolarHBondContact O-N 3.24Å; C185-G189 PolarHBondContact O-N 3.09Å; C185-A190 HydrophobicContact CB-CB 4.03Å; C185-A190 WeakPolarHBondContact O-CB 3Å; C185-A190 PolarHBondContact O-N 2.89Å; C185-C203 WeakPolarHBondContact CA-SG 3.36Å; C185-C203 HydrophobicContact CB-CB 3.81Å; C185-C203 WeakPolarHBondContact CB-SG 3.04Å; C185-C203 WeakPolarHBondContact SG-CA 3.05Å; C185-C203 WeakPolarHBondContact SG-CB 3.25Å; C185-C203 CovalentContact SG-SG 2.04Å; C185-C203 PolarHBondContact SG-SG 3.49Å
186	E	97.3	Very high	94.8	Very high	75 Å²	75	38.8 Å²	38.8	35%	0.35	20%	0.201	S	C	.	.	H	α-helix	trans	-59.8	-47.6	172	-74.3	174.3	166.8	0	0	110.7	L96 K182 I183 S184 M188 G189	L96-E186 HydrophobicContact CB-CG 4.4Å; L96-E186 HydrophobicContact CD1-CG 4.07Å; L96-E186 HydrophobicContact CD2-CG 3.65Å; L96-E186 HydrophobicContact CG-CG 4.25Å; K182-E186 WeakPolarHBondContact CE-OE1 3.45Å; K182-E186 HydrophobicContact CG-CG 4.41Å; K182-E186 WeakPolarHBondContact O-CG 3.35Å; K182-E186 PolarHBondContact O-N 3.17Å; I183-E186 PolarHBondContact O-N 3.18Å; S184-E186 PolarHBondContact O-N 3.28Å; E186-M188 PolarHBondContact O-N 3.4Å; E186-G189 PolarHBondContact O-N 2.92Å
187	S	95.6	Very high	94.6	Very high	83 Å²	83	41.8 Å²	41.8	58%	0.58	22%	0.215	S	C	*	.	H	α-helix	trans	-64.7	-25.5	178.7	75.3	0	0	0	0	113.9	L103 I183 S184 G189	L103-S187 WeakPolarHBondContact CD2-O 3.44Å; I183-S187 WeakPolarHBondContact O-CB 3.47Å; I183-S187 PolarHBondContact O-N 3.11Å; I183-S187 PolarHBondContact O-OG 3.3Å; S184-S187 PolarHBondContact O-N 3.04Å; S184-S187 PolarHBondContact O-OG 3.09Å; S187-G189 VanDerWaalsContact C-N 3.28Å
188	M	95.1	Very high	94.3	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.02	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-9.4	173.6	-70.3	-173.9	68.2	0	0	112.9	F104 L107 W116 V170 F172 S184 C185 E186 A190	F104-M188 WeakPolarHBondContact CA-O 3.13Å; F104-M188 PolarHBondContact N-O 2.62Å; L107-M188 HydrophobicContact CD1-CB 4.23Å; L107-M188 HydrophobicContact CD1-CG 4.29Å; W116-M188 HydrophobicContact CE3-CE 3.76Å; W116-M188 HydrophobicContact CH2-CE 3.97Å; W116-M188 HydrophobicContact CH2-CG 4.36Å; W116-M188 HydrophobicContact CH2-SD 4.18Å; W116-M188 HydrophobicContact CZ3-CE 3.44Å; W116-M188 VanDerWaalsContact CZ3-CE 3.44Å; W116-M188 HydrophobicContact CZ3-SD 4.22Å; V170-M188 HydrophobicContact CB-CE 4.13Å; V170-M188 HydrophobicContact CG1-CE 4.03Å; V170-M188 HydrophobicContact CG2-CE 3.95Å; F172-M188 HydrophobicContact CE1-SD 4.24Å; F172-M188 HydrophobicContact CE2-SD 3.99Å; F172-M188 HydrophobicContact CZ-CG 4.47Å; F172-M188 HydrophobicContact CZ-SD 3.4Å; F172-M188 WeakPolarHBondContact CZ-SD 3.49Å; S184-M188 WeakPolarHBondContact O-CG 2.98Å; S184-M188 PolarHBondContact O-N 3.22Å; C185-M188 PolarHBondContact O-N 3.24Å; E186-M188 PolarHBondContact O-N 3.4Å; M188-A190 VanDerWaalsContact C-N 3.34Å
189	G	96.6	Very high	94.1	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.01	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.5	19.4	-175.7	0	0	0	0	0	114.1	I100 C185 E186 S187	I100-G189 CarbonylContact C-O 3.45Å; I100-G189 PolarHBondContact N-O 3.25Å; I100-G189 VanDerWaalsContact N-O 3.17Å; C185-G189 PolarHBondContact O-N 3.09Å; E186-G189 PolarHBondContact O-N 2.92Å; S187-G189 VanDerWaalsContact C-N 3.28Å
190	A	97.3	Very high	94	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.168	C	C	.	.			trans	-64.1	157.7	178.3	0	0	0	0	0	111.8	L96 P99 F104 C185 M188 C203	L96-A190 HydrophobicContact CD1-CB 4.11Å; P99-A190 WeakPolarHBondContact CB-O 3.34Å; F104-A190 HydrophobicContact CD2-CB 3.71Å; F104-A190 HydrophobicContact CE2-CB 3.82Å; C185-A190 HydrophobicContact CB-CB 4.03Å; C185-A190 WeakPolarHBondContact O-CB 3Å; C185-A190 PolarHBondContact O-N 2.89Å; M188-A190 VanDerWaalsContact C-N 3.34Å; A190-C203 HydrophobicContact CB-CB 3.89Å
191	S	97	Very high	94	Very high	15 Å²	15	27.4 Å²	27.4	11%	0.105	15%	0.145	C	C	.	.	S	Bend	trans	-89.3	-33.3	178.5	-65.4	0	0	0	0	113.2	L96 I204 P206	L96-S191 PolarHBondContact N-O 3.26Å; S191-I204 PolarHBondContact N-O 2.9Å; S191-P206 VanDerWaalsContact OG-CA 3.3Å; S191-P206 WeakPolarHBondContact OG-CA 3.33Å; S191-P206 WeakPolarHBondContact OG-CB 3.38Å
192	K	97.1	Very high	94	Very high	27 Å²	27	27.4 Å²	27.4	12%	0.117	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	165.8	-179.1	-53.2	156.8	-174.3	163.2	0	108.5	E94 E95 I204 C208 I209 D210 Y211	E94-K192 WeakPolarHBondContact O-CA 3.18Å; E95-K192 HydrophobicContact CB-CG 4.44Å; E95-K192 HydrophobicContact CG-CG 4.28Å; K192-I204 HydrophobicContact CB-CB 4.01Å; K192-I204 HydrophobicContact CB-CD1 3.99Å; K192-I204 HydrophobicContact CB-CG2 4.33Å; K192-I204 HydrophobicContact CD-CG2 4.32Å; K192-I204 PolarHBondContact N-O 3.48Å; K192-I204 PolarHBondContact O-N 3.35Å; K192-C208 PolarHBondContact NZ-O 3.35Å; K192-I209 PolarHBondContact NZ-O 2.96Å; K192-D210 WeakPolarHBondContact CD-O 3.36Å; K192-D210 WeakPolarHBondContact CE-O 3.43Å; K192-D210 PolarHBondContact NZ-O 3.47Å; K192-Y211 HydrophobicContact CB-CD1 3.9Å; K192-Y211 HydrophobicContact CB-CE1 4.09Å; K192-Y211 HydrophobicContact CD-CD1 4.01Å; K192-Y211 HydrophobicContact CD-CE1 4.15Å; K192-Y211 HydrophobicContact CG-CD1 4.27Å; K192-Y211 HydrophobicContact CG-CE1 4.17Å
193	Y	96.8	Very high	94	Very high	5 Å²	5	24.7 Å²	24.7	2%	0.02	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	153.9	165.3	77.3	-85.6	0	0	0	111.4	V93 E94 L96 I178 C181 K182 W195 E202	V93-Y193 WeakPolarHBondContact CA-O 3.49Å; E94-Y193 HydrophobicContact CB-CD1 4.15Å; E94-Y193 HydrophobicContact CB-CE1 3.44Å; E94-Y193 VanDerWaalsContact CB-CE1 3.44Å; E94-Y193 HydrophobicContact CG-CE1 3.79Å; E94-Y193 PolarHBondContact N-O 3.15Å; E94-Y193 PolarHBondContact O-N 3.45Å; E94-Y193 WeakPolarHBondContact OE2-CE1 3.47Å; E94-Y193 PolarHBondContact OE2-OH 3.16Å; L96-Y193 HydrophobicContact CD2-CD1 3.48Å; L96-Y193 VanDerWaalsContact CD2-CD1 3.48Å; L96-Y193 HydrophobicContact CD2-CE1 3.87Å; L96-Y193 HydrophobicContact CG-CD1 4.07Å; I178-Y193 HydrophobicContact CG1-CE2 4.01Å; C181-Y193 HydrophobicContact CB-CD2 4.5Å; K182-Y193 HydrophobicContact CB-CD1 4.36Å; K182-Y193 HydrophobicContact CB-CE1 3.83Å; K182-Y193 HydrophobicContact CD-CE1 4.15Å; K182-Y193 HydrophobicContact CG-CD1 4.48Å; K182-Y193 HydrophobicContact CG-CE1 3.92Å; Y193-W195 HydrophobicContact CD2-CB 4.29Å; Y193-W195 HydrophobicContact CE2-CB 4.12Å; Y193-E202 CarbonylContact C-O 3.53Å; Y193-E202 VanDerWaalsContact CA-O 3.3Å; Y193-E202 WeakPolarHBondContact CA-O 3.49Å
194	R	95	Very high	94	Very high	17 Å²	17	20.7 Å²	20.7	6%	0.064	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	126.7	166.9	179	-173	-59.7	-87.9	4.1	108.3	S91 T92 V93 F196 E202 I204 Y211 S213	S91-R194 PolarHBondContact OG-NH1 3.48Å; T92-R194 WeakPolarHBondContact O-CA 3.26Å; V93-R194 HydrophobicContact CG1-CB 4Å; V93-R194 HydrophobicContact CG1-CG 3.85Å; R194-F196 HydrophobicContact CG-CD2 4.27Å; R194-F196 HydrophobicContact CG-CE1 4.43Å; R194-F196 HydrophobicContact CG-CE2 3.99Å; R194-F196 HydrophobicContact CG-CZ 4.11Å; R194-E202 HydrophobicContact CB-CB 4.23Å; R194-E202 VanDerWaalsContact CD-OE2 3.32Å; R194-E202 WeakPolarHBondContact CD-OE2 2.99Å; R194-E202 PolarHBondContact N-O 3.49Å; R194-E202 IonicContact NE-OE2 3.54Å; R194-E202 PolarHBondContact O-N 2.92Å; R194-I204 HydrophobicContact CB-CD1 4.05Å; R194-Y211 PolarHBondContact NE-O 3.37Å; R194-Y211 PolarHBondContact NH2-O 3.41Å; R194-S213 PolarHBondContact NE-O 2.01Å
195	W	93.9	Very high	94	Very high	46 Å²	46	19.2 Å²	19.2	17%	0.174	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	112.3	171.2	-177.6	79.8	0	0	0	109.1	S91 T92 M176 I178 Y193 H197 A199	S91-W195 CarbonylContact C-O 3.53Å; S91-W195 WeakPolarHBondContact CA-O 3.05Å; S91-W195 WeakPolarHBondContact CB-O 3.29Å; T92-W195 PolarHBondContact N-O 3.39Å; T92-W195 PolarHBondContact O-N 2.02Å; M176-W195 PolarHBondContact O-NE1 3.5Å; I178-W195 HydrophobicContact CB-CB 4.48Å; I178-W195 HydrophobicContact CB-CD2 3.88Å; I178-W195 HydrophobicContact CB-CE3 4.26Å; I178-W195 HydrophobicContact CB-CG 3.96Å; I178-W195 HydrophobicContact CD1-CE3 4.43Å; I178-W195 HydrophobicContact CG1-CB 4.06Å; I178-W195 HydrophobicContact CG1-CD2 4.29Å; I178-W195 HydrophobicContact CG1-CG 4.08Å; Y193-W195 HydrophobicContact CD2-CB 4.29Å; Y193-W195 HydrophobicContact CE2-CB 4.12Å; W195-H197 AromaticContact CE3-CD2 3.65Å; W195-H197 HydrophobicContact CZ3-CB 4.39Å; W195-H197 AromaticContact CZ3-CD2 3.37Å; W195-H197 WeakPolarHBondContact CZ3-CD2 3.4Å; W195-A199 HydrophobicContact CZ2-CB 4.25Å
196	F	90.1	Very high	93.8	Very high	1 Å²	1	21.2 Å²	21.2	0%	0.004	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	146.9	176.1	-63.3	-92.1	0	0	0	110.1	Y171 R194 N198 A199 C200 E202 V216	Y171-F196 HydrophobicContact CE1-CE2 4.09Å; R194-F196 HydrophobicContact CG-CD2 4.27Å; R194-F196 HydrophobicContact CG-CE1 4.43Å; R194-F196 HydrophobicContact CG-CE2 3.99Å; R194-F196 HydrophobicContact CG-CZ 4.11Å; F196-N198 WeakPolarHBondContact CB-OD1 3.29Å; F196-N198 PolarHBondContact O-N 2.97Å; F196-A199 PolarHBondContact O-N 2.03Å; F196-C200 HydrophobicContact CB-CB 4.12Å; F196-C200 HydrophobicContact CD2-CB 4.04Å; F196-C200 HydrophobicContact CG-CB 4.46Å; F196-C200 PolarHBondContact N-O 2.99Å; F196-E202 HydrophobicContact CE2-CB 4.1Å; F196-V216 HydrophobicContact CB-CG2 3.93Å; F196-V216 HydrophobicContact CD1-CG2 3.31Å; F196-V216 HydrophobicContact CD2-CG2 4.04Å; F196-V216 HydrophobicContact CE1-CG2 3.65Å; F196-V216 HydrophobicContact CE2-CG2 4.34Å; F196-V216 HydrophobicContact CG-CG2 3.5Å; F196-V216 HydrophobicContact CZ-CG2 4.14Å
197	H	86	Confident	93.6	Very high	88 Å²	88	20 Å²	20	41%	0.407	11%	0.11	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	0.2	-175.4	-69.2	-166.1	0	0	0	113.8	K90 T92 W195 A199	K90-H197 PolarHBondContact O-CD2 3.01Å; K90-H197 PolarHBondContact O-N 3.48Å; T92-H197 PolarHBondContact OG1-NE2 3.32Å; W195-H197 AromaticContact CE3-CD2 3.65Å; W195-H197 HydrophobicContact CZ3-CB 4.39Å; W195-H197 AromaticContact CZ3-CD2 3.37Å; W195-H197 WeakPolarHBondContact CZ3-CD2 3.4Å; H197-A199 VanDerWaalsContact C-N 3.34Å
198	N	80.9	Confident	93.3	Very high	14 Å²	14	16.4 Å²	16.4	8%	0.075	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	20.6	165.4	76.5	-24.8	0	0	0	113.4	T88 F196 C200 C221 F223	T88-N198 HydrophobicContact CG2-CB 4.2Å; F196-N198 WeakPolarHBondContact CB-OD1 3.29Å; F196-N198 PolarHBondContact O-N 2.97Å; N198-C200 PolarHBondContact O-N 3.29Å; N198-C200 VanDerWaalsContact OD1-CB 3.26Å; N198-C200 WeakPolarHBondContact OD1-CB 3.12Å; N198-C200 PolarHBondContact OD1-N 2.95Å; N198-C221 WeakPolarHBondContact O-CB 3.3Å; N198-F223 WeakPolarHBondContact CB-OXT 3.36Å
199	A	86.9	Confident	93	Very high	28 Å²	28	21 Å²	21	23%	0.231	11%	0.108	C	C	.	.	S	Bend	trans	65.7	13.4	-179.7	0	0	0	0	0	116.4	C175 M176 W195 F196 H197	C175-A199 WeakPolarHBondContact CA-O 3.42Å; C175-A199 HydrophobicContact CB-CB 3.93Å; M176-A199 PolarHBondContact N-O 3.37Å; M176-A199 VanDerWaalsContact N-O 3.11Å; W195-A199 HydrophobicContact CZ2-CB 4.25Å; F196-A199 PolarHBondContact O-N 2.03Å; H197-A199 VanDerWaalsContact C-N 3.34Å
200	C	90.8	Very high	92.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.125	C	C	.	.			trans	-75.7	134.7	169.9	175.1	0	0	0	0	111.2	F196 N198 V216 C218 C221	F196-C200 HydrophobicContact CB-CB 4.12Å; F196-C200 HydrophobicContact CD2-CB 4.04Å; F196-C200 HydrophobicContact CG-CB 4.46Å; F196-C200 PolarHBondContact N-O 2.99Å; N198-C200 PolarHBondContact O-N 3.29Å; N198-C200 VanDerWaalsContact OD1-CB 3.26Å; N198-C200 WeakPolarHBondContact OD1-CB 3.12Å; N198-C200 PolarHBondContact OD1-N 2.95Å; C200-V216 HydrophobicContact CB-CG1 3.73Å; C200-C218 WeakPolarHBondContact CA-SG 3.4Å; C200-C218 HydrophobicContact CB-CB 3.67Å; C200-C218 WeakPolarHBondContact CB-SG 3.23Å; C200-C218 WeakPolarHBondContact SG-CB 3.15Å; C200-C218 CovalentContact SG-SG 2.02Å; C200-C218 PolarHBondContact SG-SG 3.3Å; C200-C221 HydrophobicContact CB-CB 4.41Å
201	C	94.5	Very high	92.1	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	129.7	179.1	-177.5	0	0	0	0	111.1	Y171 F172 M176 C181 C218	Y171-C201 WeakPolarHBondContact CA-O 3.35Å; F172-C201 HydrophobicContact CD2-CB 4.04Å; F172-C201 PolarHBondContact N-O 3.24Å; M176-C201 HydrophobicContact CE-CB 4.16Å; M176-C201 HydrophobicContact CG-CB 3.83Å; M176-C201 HydrophobicContact SD-CB 3.73Å; C181-C201 WeakPolarHBondContact CA-SG 3.03Å; C181-C201 HydrophobicContact CB-CB 3.7Å; C181-C201 WeakPolarHBondContact CB-SG 3.18Å; C181-C201 VanDerWaalsContact SG-CA 3.53Å; C181-C201 WeakPolarHBondContact SG-CB 3.29Å; C181-C201 CovalentContact SG-SG 2.04Å; C181-C201 PolarHBondContact SG-SG 3.39Å; C201-C218 PolarHBondContact N-SG 3.02Å
202	E	95.9	Very high	91.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	120.1	174.7	179.5	-172.2	-166.2	0	0	109.7	V169 V170 Y171 Y193 R194 F196 I204 S213	V169-E202 HydrophobicContact CB-CG 4.01Å; V169-E202 HydrophobicContact CG1-CG 4.5Å; V169-E202 WeakPolarHBondContact CG1-OE1 3.17Å; V169-E202 HydrophobicContact CG2-CG 4.48Å; V170-E202 CarbonylContact O-C 3.59Å; V170-E202 VanDerWaalsContact O-CA 3.3Å; V170-E202 WeakPolarHBondContact O-CA 3.37Å; Y171-E202 HydrophobicContact CD1-CB 3.87Å; Y171-E202 HydrophobicContact CD1-CG 4.15Å; Y171-E202 HydrophobicContact CE1-CB 3.72Å; Y171-E202 HydrophobicContact CE1-CG 3.7Å; Y171-E202 PolarHBondContact OH-OE1 3.2Å; Y193-E202 CarbonylContact C-O 3.53Å; Y193-E202 VanDerWaalsContact CA-O 3.3Å; Y193-E202 WeakPolarHBondContact CA-O 3.49Å; R194-E202 HydrophobicContact CB-CB 4.23Å; R194-E202 VanDerWaalsContact CD-OE2 3.32Å; R194-E202 WeakPolarHBondContact CD-OE2 2.99Å; R194-E202 PolarHBondContact N-O 3.49Å; R194-E202 IonicContact NE-OE2 3.54Å; R194-E202 PolarHBondContact O-N 2.92Å; F196-E202 HydrophobicContact CE2-CB 4.1Å; E202-I204 HydrophobicContact CG-CG1 4.11Å; E202-S213 PolarHBondContact OE1-N 3.06Å; E202-S213 VanDerWaalsContact OE2-O 3.11Å
203	C	97.3	Very high	90.8	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	132.7	170.1	-56	0	0	0	0	110.1	F104 V169 V170 F172 C185 A190	F104-C203 HydrophobicContact CE2-CB 4.18Å; V169-C203 CarbonylContact C-O 3.58Å; V169-C203 VanDerWaalsContact CA-O 3.27Å; V169-C203 WeakPolarHBondContact CA-O 3.37Å; V170-C203 HydrophobicContact CB-CB 4.43Å; V170-C203 PolarHBondContact N-O 3.39Å; V170-C203 PolarHBondContact O-N 2.8Å; F172-C203 VanDerWaalsContact CE2-SG 3.5Å; C185-C203 WeakPolarHBondContact CA-SG 3.36Å; C185-C203 HydrophobicContact CB-CB 3.81Å; C185-C203 WeakPolarHBondContact CB-SG 3.04Å; C185-C203 WeakPolarHBondContact SG-CA 3.05Å; C185-C203 WeakPolarHBondContact SG-CB 3.25Å; C185-C203 CovalentContact SG-SG 2.04Å; C185-C203 PolarHBondContact SG-SG 3.49Å; A190-C203 HydrophobicContact CB-CB 3.89Å
204	I	96.9	Very high	90	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	128.1	-168.9	-60.4	148.8	0	0	0	109.4	V169 S191 K192 R194 E202 C208 Y211	V169-I204 HydrophobicContact CG1-CB 4.5Å; V169-I204 HydrophobicContact CG1-CG1 4.22Å; V169-I204 HydrophobicContact CG1-CG2 4.41Å; S191-I204 PolarHBondContact N-O 2.9Å; K192-I204 HydrophobicContact CB-CB 4.01Å; K192-I204 HydrophobicContact CB-CD1 3.99Å; K192-I204 HydrophobicContact CB-CG2 4.33Å; K192-I204 HydrophobicContact CD-CG2 4.32Å; K192-I204 PolarHBondContact N-O 3.48Å; K192-I204 PolarHBondContact O-N 3.35Å; R194-I204 HydrophobicContact CB-CD1 4.05Å; E202-I204 HydrophobicContact CG-CG1 4.11Å; I204-C208 HydrophobicContact CG2-CB 3.54Å; I204-Y211 VanDerWaalsContact CD1-C 3.45Å; I204-Y211 HydrophobicContact CD1-CD1 4.28Å; I204-Y211 WeakPolarHBondContact CD1-O 3.2Å
205	G	95.5	Very high	89.5	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.172	C	C	.	.			trans	-71.6	164	-178.4	0	0	0	0	0	114.3	T168 E207 C208	T168-G205 WeakPolarHBondContact O-CA 3.06Å; T168-G205 PolarHBondContact O-N 2.83Å; G205-E207 PolarHBondContact O-N 3.32Å; G205-C208 PolarHBondContact O-N 3.48Å
206	P	93.7	Very high	89.1	Confident	41 Å²	41	33.4 Å²	33.4	27%	0.266	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-19.5	-179.5	22.3	-28.8	0	0	0	114.1	P101 S191 C208	P101-P206 HydrophobicContact CB-CB 4.3Å; P101-P206 HydrophobicContact CB-CG 3.82Å; P101-P206 HydrophobicContact CG-CB 4.26Å; P101-P206 HydrophobicContact CG-CG 4.27Å; S191-P206 VanDerWaalsContact OG-CA 3.3Å; S191-P206 WeakPolarHBondContact OG-CA 3.33Å; S191-P206 WeakPolarHBondContact OG-CB 3.38Å; P206-C208 VanDerWaalsContact C-N 3.33Å
207	E	91.9	Very high	89	Confident	51 Å²	51	37.2 Å²	37.2	24%	0.238	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-13	-179.9	-63.4	73.1	-158.6	0	0	113.6	R105 V123 M166 G205	R105-E207 IonicContact CZ-OE1 3.92Å; R105-E207 IonicContact NE-OE1 3.54Å; R105-E207 PolarHBondContact NE-OE1 2.94Å; R105-E207 IonicContact NH2-OE1 2.7Å; R105-E207 PolarHBondContact NH2-OE1 2.97Å; V123-E207 VanDerWaalsContact CG2-O 3.3Å; V123-E207 WeakPolarHBondContact CG2-O 3.38Å; M166-E207 WeakPolarHBondContact O-CB 3.14Å; G205-E207 PolarHBondContact O-N 3.32Å
208	C	90.6	Very high	89.1	Confident	6 Å²	6	33.7 Å²	33.7	4%	0.041	18%	0.179	C	C	.	.			trans	-79.6	136.1	-179.3	-53.7	0	0	0	0	111.4	C167 K192 I204 G205 P206	C167-C208 VanDerWaalsContact CA-SG 3.51Å; C167-C208 HydrophobicContact CB-CB 3.91Å; C167-C208 WeakPolarHBondContact CB-SG 3.46Å; C167-C208 WeakPolarHBondContact SG-CB 3.49Å; C167-C208 CovalentContact SG-SG 2.03Å; C167-C208 PolarHBondContact SG-SG 3.1Å; K192-C208 PolarHBondContact NZ-O 3.35Å; I204-C208 HydrophobicContact CG2-CB 3.54Å; G205-C208 PolarHBondContact O-N 3.48Å; P206-C208 VanDerWaalsContact C-N 3.33Å
209	I	87.6	Confident	89.1	Confident	102 Å²	102	39.8 Å²	39.8	52%	0.523	21%	0.209	S	C	.	.	S	Bend	trans	-73.4	-49.2	-177.7	-69.6	176.5	0	0	0	110.2	V123 E126 L127 K192	V123-I209 HydrophobicContact CG1-CB 4.43Å; V123-I209 HydrophobicContact CG1-CD1 3.13Å; V123-I209 HydrophobicContact CG1-CG1 3.43Å; V123-I209 VanDerWaalsContact CG1-CG1 3.43Å; E126-I209 WeakPolarHBondContact OE2-CB 3.41Å; E126-I209 PolarHBondContact OE2-N 2.02Å; L127-I209 HydrophobicContact CD1-CD1 4.2Å; K192-I209 PolarHBondContact NZ-O 2.96Å
210	D	87.1	Confident	88.9	Confident	68 Å²	68	43.1 Å²	43.1	36%	0.364	22%	0.223	S	C	.	.	S	Bend	trans	-109.8	-135.4	-176.7	-168.6	28.5	0	0	0	109.7	E126 K192	E126-D210 VanDerWaalsContact CD-N 3.28Å; E126-D210 HydrophobicContact CG-CB 4.32Å; E126-D210 WeakPolarHBondContact OE1-CA 3.45Å; E126-D210 VanDerWaalsContact OE1-CB 3.31Å; E126-D210 WeakPolarHBondContact OE1-CB 3.49Å; E126-D210 PolarHBondContact OE1-N 3.17Å; E126-D210 PolarHBondContact OE2-N 2.93Å; K192-D210 WeakPolarHBondContact CD-O 3.36Å; K192-D210 WeakPolarHBondContact CE-O 3.43Å; K192-D210 PolarHBondContact NZ-O 3.47Å
211	Y	88.1	Confident	88.1	Confident	58 Å²	58	43.9 Å²	43.9	23%	0.227	23%	0.228	C	C	.	.	S	Bend	trans	-105.7	41.5	-176.2	-67.1	-80.5	0	0	0	112.5	V93 E126 K192 R194 I204	V93-Y211 HydrophobicContact CB-CD1 3.52Å; V93-Y211 HydrophobicContact CB-CD2 4Å; V93-Y211 HydrophobicContact CB-CE1 3.69Å; V93-Y211 HydrophobicContact CB-CE2 4.17Å; V93-Y211 HydrophobicContact CB-CG 3.67Å; V93-Y211 HydrophobicContact CG1-CD1 4Å; V93-Y211 HydrophobicContact CG1-CD2 4.26Å; V93-Y211 HydrophobicContact CG1-CG 3.78Å; V93-Y211 HydrophobicContact CG2-CD1 4.17Å; V93-Y211 HydrophobicContact CG2-CD2 3.82Å; V93-Y211 HydrophobicContact CG2-CE1 4.04Å; V93-Y211 HydrophobicContact CG2-CE2 3.72Å; V93-Y211 HydrophobicContact CG2-CG 4.05Å; E126-Y211 PolarHBondContact OE1-N 3.33Å; K192-Y211 HydrophobicContact CB-CD1 3.9Å; K192-Y211 HydrophobicContact CB-CE1 4.09Å; K192-Y211 HydrophobicContact CD-CD1 4.01Å; K192-Y211 HydrophobicContact CD-CE1 4.15Å; K192-Y211 HydrophobicContact CG-CD1 4.27Å; K192-Y211 HydrophobicContact CG-CE1 4.17Å; R194-Y211 PolarHBondContact NE-O 3.37Å; R194-Y211 PolarHBondContact NH2-O 3.41Å; I204-Y211 VanDerWaalsContact CD1-C 3.45Å; I204-Y211 HydrophobicContact CD1-CD1 4.28Å; I204-Y211 WeakPolarHBondContact CD1-O 3.2Å
212	G	85.4	Confident	86.3	Confident	5 Å²	5	52 Å²	52	5%	0.052	27%	0.268	C	S	.	.	S	Bend	trans	67.1	-148	173.9	0	0	0	0	0	112.9	E126	E126-G212 PolarHBondContact OE1-N 2.9Å
213	S	81.1	Confident	84.1	Confident	21 Å²	21	62.2 Å²	62.2	15%	0.147	31%	0.313	C	S	.	.			trans	-83.7	140.3	-174.5	177.3	0	0	0	0	111.5	Y171 R194 E202 T215	Y171-S213 VanDerWaalsContact OH-CB 3.29Å; Y171-S213 WeakPolarHBondContact OH-CB 3.44Å; R194-S213 PolarHBondContact NE-O 2.01Å; E202-S213 PolarHBondContact OE1-N 3.06Å; E202-S213 VanDerWaalsContact OE2-O 3.11Å; S213-T215 PolarHBondContact O-N 3.08Å; S213-T215 PolarHBondContact OG-N 3.17Å; S213-T215 PolarHBondContact OG-OG1 3.25Å
214	K	81.8	Confident	83.5	Confident	105 Å²	105	65.4 Å²	65.4	46%	0.457	33%	0.328	S	S	.	.	S	Bend	trans	-81.4	3.5	173.8	-62.3	178.5	-176	174	0	112.7
215	T	83	Confident	82.8	Confident	66 Å²	66	68.8 Å²	68.8	41%	0.405	35%	0.346	S	S	.	.	S	Bend	trans	-100.7	132.4	-179.4	65.9	0	0	0	0	111	Y171 S213 K217	Y171-T215 PolarHBondContact OH-O 3.14Å; Y171-T215 VanDerWaalsContact OH-O 3.1Å; S213-T215 PolarHBondContact O-N 3.08Å; S213-T215 PolarHBondContact OG-N 3.17Å; S213-T215 PolarHBondContact OG-OG1 3.25Å; T215-K217 WeakPolarHBondContact OG1-CE 3.43Å
216	V	85.8	Confident	82.1	Confident	48 Å²	48	72.6 Å²	72.6	29%	0.291	37%	0.365	S	S	.	.			trans	-74.2	130.4	173.9	177.6	0	0	0	0	109.7	F196 C200	F196-V216 HydrophobicContact CB-CG2 3.93Å; F196-V216 HydrophobicContact CD1-CG2 3.31Å; F196-V216 HydrophobicContact CD2-CG2 4.04Å; F196-V216 HydrophobicContact CE1-CG2 3.65Å; F196-V216 HydrophobicContact CE2-CG2 4.34Å; F196-V216 HydrophobicContact CG-CG2 3.5Å; F196-V216 HydrophobicContact CZ-CG2 4.14Å; C200-V216 HydrophobicContact CB-CG1 3.73Å
217	K	89	Confident	81.4	Confident	80 Å²	80	74.5 Å²	74.5	35%	0.348	37%	0.371	S	S	.	.			trans	-131.9	12.1	178.1	-57.9	-170.9	177.7	-167.3	0	115.2	N117 V119 Y171 T215	N117-K217 PolarHBondContact ND2-O 3.33Å; N117-K217 VanDerWaalsContact ND2-O 3.16Å; V119-K217 HydrophobicContact CG2-CD 4.02Å; Y171-K217 HydrophobicContact CD1-CB 4.08Å; Y171-K217 HydrophobicContact CD2-CB 3.8Å; Y171-K217 HydrophobicContact CD2-CD 4.37Å; Y171-K217 HydrophobicContact CD2-CG 4.49Å; Y171-K217 HydrophobicContact CE1-CB 4.1Å; Y171-K217 HydrophobicContact CE1-CG 4.43Å; Y171-K217 HydrophobicContact CE2-CB 3.83Å; Y171-K217 HydrophobicContact CE2-CD 3.78Å; Y171-K217 HydrophobicContact CE2-CG 4.03Å; Y171-K217 HydrophobicContact CG-CB 3.91Å; T215-K217 WeakPolarHBondContact OG1-CE 3.43Å
218	C	87.3	Confident	80.7	Confident	14 Å²	14	75.9 Å²	75.9	10%	0.095	38%	0.379	C	S	.	.			trans	-68.9	139.9	172.8	-59	0	0	0	0	110.8	F172 C200 C201 C221	F172-C218 VanDerWaalsContact O-CB 3.3Å; F172-C218 WeakPolarHBondContact O-CB 2.97Å; F172-C218 PolarHBondContact O-SG 3.05Å; C200-C218 WeakPolarHBondContact CA-SG 3.4Å; C200-C218 HydrophobicContact CB-CB 3.67Å; C200-C218 WeakPolarHBondContact CB-SG 3.23Å; C200-C218 WeakPolarHBondContact SG-CB 3.15Å; C200-C218 CovalentContact SG-SG 2.02Å; C200-C218 PolarHBondContact SG-SG 3.3Å; C201-C218 PolarHBondContact N-SG 3.02Å; C218-C221 HydrophobicContact CB-CB 4.24Å
219	M	81.9	Confident	80.1	Confident	142 Å²	142	80.6 Å²	80.6	70%	0.7	40%	0.402	S	S	*	.	S	Bend	trans	-82.3	-35.4	-173.2	-65.7	-67.3	-80.8	0	0	113.9	D173	D173-M219 HydrophobicContact CB-CB 4.36Å; D173-M219 WeakPolarHBondContact OD1-CG 3.01Å
220	N	81.2	Confident	79.5	Confident	99 Å²	99	79.1 Å²	79.1	53%	0.529	39%	0.393	S	S	.	.	S	Bend	trans	-102	6.4	-171.3	-58.2	-35.8	0	0	0	114.1	D173 D174 C175	D173-N220 WeakPolarHBondContact O-CB 2.94Å; D173-N220 PolarHBondContact O-N 3.29Å; D174-N220 PolarHBondContact OD1-ND2 3.04Å; C175-N220 VanDerWaalsContact SG-C 3.51Å; C175-N220 PolarHBondContact SG-O 3.42Å; C175-N220 VanDerWaalsContact SG-O 3.34Å
221	C	73.9	Confident	79	Confident	16 Å²	16	79.9 Å²	79.9	11%	0.108	40%	0.395	C	S	.	.			trans	-99.2	100	-176.5	-56.2	0	0	0	0	111.9	C175 N198 C200 C218	C175-C221 WeakPolarHBondContact CA-SG 3.02Å; C175-C221 HydrophobicContact CB-CB 4.27Å; C175-C221 WeakPolarHBondContact CB-SG 3.33Å; C175-C221 WeakPolarHBondContact SG-CA 3.36Å; C175-C221 WeakPolarHBondContact SG-CB 3.43Å; C175-C221 PolarHBondContact SG-N 3.37Å; C175-C221 VanDerWaalsContact SG-N 3.42Å; C175-C221 CovalentContact SG-SG 2.05Å; C175-C221 PolarHBondContact SG-SG 3.08Å; N198-C221 WeakPolarHBondContact O-CB 3.3Å; C200-C221 HydrophobicContact CB-CB 4.41Å; C218-C221 HydrophobicContact CB-CB 4.24Å
222	M	58.4	Low	78.2	Confident	170 Å²	170	81.8 Å²	81.8	84%	0.837	41%	0.409	S	S	*	.			trans	-80.9	138.2	169.7	-64.9	-133.8	-156.7	0	0	110.5
223	F	49.7	Very low	77.6	Confident	215 Å²	215	88.7 Å²	88.7	94%	0.943	44%	0.442	S	S	*	.			trans	1.8	0	169.7	-62.7	-80.6	0	0	0	117.9	T88 N198	T88-F223 HydrophobicContact CG2-CD1 4.16Å; N198-F223 WeakPolarHBondContact CB-OXT 3.36Å

Retrieved 223 of 223 residues in 127.3 ms (Link to these results)

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