A0A077YWN7_TRITR Loading...

Lipopolysaccharide induced tumor necrosis

AlphaFold DB , UniProt , Accession A0A077YWN7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 126 aa.

						>A0A077YWN7_TRITR|A0A077YWN7
MLSFFPPLYFGRQNRKSVTRLVPIIFAFYDFFFAGIPPQPPMTAVVTVIPPFGADPVHVQCSNCGSMVLTEVKPVAGTLSWVLCMTCALFGLFFGCCLIPFCVPSLQDIEHHCPNCKTLLGTYRRM
					

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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	39.9	Very low	36.4	Very low	249 Å²	249	151.7 Å²	151.7	100%	1.227	80%	0.795	S	S	*	*				0	118	0	-81.1	169.1	174.3	0	0	107.5
2	L	30	Very low	37.4	Very low	161 Å²	161	160.7 Å²	160.7	84%	0.843	81%	0.81	S	S	*	*			trans	-79.2	124.9	-176.4	-67.8	158.2	0	0	0	109.7
3	S	39.6	Very low	38.6	Very low	123 Å²	123	162.1 Å²	162.1	86%	0.86	81%	0.812	S	S	*	*			trans	-111.9	97.8	155.4	36.9	0	0	0	0	108.3
4	F	37.9	Very low	39	Very low	175 Å²	175	158.6 Å²	158.6	77%	0.768	80%	0.797	S	S	*	*			trans	-64.6	127.5	170.4	-109.2	-112.4	0	0	0	110.6
5	F	37.6	Very low	40.1	Very low	166 Å²	166	162.3 Å²	162.3	73%	0.728	80%	0.798	S	S	*	*			trans	30.1	141.3	145.4	-89.5	-97.3	0	0	0	121.8	P7	F5-P7 HydrophobicContact CD1-CB 4.5Å
6	P	34.7	Very low	41.1	Very low	121 Å²	121	163 Å²	163	79%	0.786	80%	0.795	S	S	*	*				-126.7	154.3	108.9	30.2	-18.2	0	0	0	113.2
7	P	40.8	Very low	41.8	Very low	99 Å²	99	157.4 Å²	157.4	64%	0.643	78%	0.776	S	S	*	*			trans	-85	140.8	-161.5	34.2	-33.3	0	0	0	113.1	F5 Y9	F5-P7 HydrophobicContact CD1-CB 4.5Å; P7-Y9 PolarHBondContact O-N 2.88Å
8	L	32.2	Very low	42.3	Very low	137 Å²	137	152.2 Å²	152.2	72%	0.717	75%	0.754	S	S	*	*			trans	-2.5	101.6	148.2	-75.9	165.1	0	0	0	116.1	F10	L8-F10 HydrophobicContact CB-CB 4.34Å; L8-F10 HydrophobicContact CD2-CD2 3.82Å; L8-F10 PolarHBondContact O-N 3.16Å; L8-F10 VanDerWaalsContact O-N 3.09Å
9	Y	30	Very low	43	Very low	240 Å²	240	149.6 Å²	149.6	94%	0.941	75%	0.748	S	S	*	*			trans	-77.4	77	150	-106.3	-98.1	0	0	0	108.2	P7 G11	P7-Y9 PolarHBondContact O-N 2.88Å; Y9-G11 PolarHBondContact O-N 3.15Å; Y9-G11 VanDerWaalsContact O-N 3.15Å
10	F	40.4	Very low	43.7	Very low	137 Å²	137	152.3 Å²	152.3	60%	0.601	75%	0.749	S	S	*	*			trans	-86.5	80.4	179.7	-149.6	-108	0	0	0	109.6	L8 R12	L8-F10 HydrophobicContact CB-CB 4.34Å; L8-F10 HydrophobicContact CD2-CD2 3.82Å; L8-F10 PolarHBondContact O-N 3.16Å; L8-F10 VanDerWaalsContact O-N 3.09Å; F10-R12 PolarHBondContact O-N 3.1Å
11	G	37	Very low	44.2	Very low	61 Å²	61	146.5 Å²	146.5	63%	0.629	72%	0.721	S	S	*	*			trans	-57.8	132.3	167.3	0	0	0	0	0	110.3	Y9 Q13	Y9-G11 PolarHBondContact O-N 3.15Å; Y9-G11 VanDerWaalsContact O-N 3.15Å; G11-Q13 VanDerWaalsContact C-N 3.29Å; G11-Q13 PolarHBondContact O-N 3.36Å
12	R	48.8	Very low	44.9	Very low	259 Å²	259	138.7 Å²	138.7	98%	0.977	69%	0.687	S	S	*	*			trans	-70.1	72	-170.2	-157.1	-179	-167	170.4	2.8	111.6	F10	F10-R12 PolarHBondContact O-N 3.1Å
13	Q	52.6	Low	46	Very low	179 Å²	179	134.7 Å²	134.7	84%	0.836	67%	0.671	S	S	*	*			trans	-127.5	101.5	175.4	-149.9	167.5	7.3	0	0	112.2	G11	G11-Q13 VanDerWaalsContact C-N 3.29Å; G11-Q13 PolarHBondContact O-N 3.36Å
14	N	45.1	Very low	46.9	Very low	113 Å²	113	133.4 Å²	133.4	60%	0.604	65%	0.653	S	S	*	*			trans	49.1	82.9	159.9	-150.5	0.4	0	0	0	118.7	K16 S17	N14-K16 PolarHBondContact O-N 3.14Å; N14-S17 PolarHBondContact O-N 3.27Å; N14-S17 VanDerWaalsContact O-N 3.1Å
15	R	54.5	Low	47.8	Very low	215 Å²	215	128.6 Å²	128.6	81%	0.811	64%	0.635	S	S	*	*	H	α-helix	trans	-47.2	-20.3	175.7	-71.5	-175.2	-172.1	-179.8	1.8	116.2	T19	R15-T19 PolarHBondContact O-OG1 2.98Å
16	K	55.9	Low	48.9	Very low	173 Å²	173	127.4 Å²	127.4	75%	0.752	63%	0.63	S	S	*	*	H	α-helix	trans	-78.4	-22.4	-178.5	-61.9	-172.5	-179.3	-172.9	0	113.7	N14	N14-K16 PolarHBondContact O-N 3.14Å
17	S	53.1	Low	50	Low	67 Å²	67	124.4 Å²	124.4	47%	0.469	62%	0.615	S	S	.	*	H	α-helix	trans	-84.6	-41.2	-178.7	-166.3	0	0	0	0	112.2	N14 T19 R20 L21	N14-S17 PolarHBondContact O-N 3.27Å; N14-S17 VanDerWaalsContact O-N 3.1Å; S17-T19 PolarHBondContact O-N 3.35Å; S17-R20 PolarHBondContact O-N 3.48Å; S17-R20 VanDerWaalsContact O-N 3.14Å; S17-L21 PolarHBondContact O-N 3.07Å
18	V	52	Low	50.8	Low	64 Å²	64	125 Å²	125	39%	0.388	61%	0.608	S	S	.	*	H	α-helix	trans	-60	-43.5	-175.3	178.3	0	0	0	0	111.8	R20 L21 V22	V18-R20 VanDerWaalsContact C-N 3.25Å; V18-R20 PolarHBondContact O-N 2.8Å; V18-L21 PolarHBondContact O-N 3.4Å; V18-L21 VanDerWaalsContact O-N 3.15Å; V18-V22 WeakPolarHBondContact O-CG2 3.42Å; V18-V22 PolarHBondContact O-N 3.33Å
19	T	54.7	Low	51.9	Low	104 Å²	104	125.6 Å²	125.6	64%	0.638	60%	0.602	S	S	*	*	H	α-helix	trans	-67.6	-22.3	-178.6	9.6	0	0	0	0	113.8	R15 S17 P23	R15-T19 PolarHBondContact O-OG1 2.98Å; S17-T19 PolarHBondContact O-N 3.35Å; T19-P23 WeakPolarHBondContact O-CD 3.25Å
20	R	57.4	Low	53	Low	203 Å²	203	118.5 Å²	118.5	77%	0.766	58%	0.58	S	S	*	*	H	α-helix	trans	-82.2	-23.5	174.6	-81.1	-175.3	158.8	179.4	-5.8	113.3	S17 V18 P23	S17-R20 PolarHBondContact O-N 3.48Å; S17-R20 VanDerWaalsContact O-N 3.14Å; V18-R20 VanDerWaalsContact C-N 3.25Å; V18-R20 PolarHBondContact O-N 2.8Å; R20-P23 WeakPolarHBondContact O-CD 3.42Å; R20-P23 WeakPolarHBondContact O-CG 3.42Å
21	L	54	Low	53.8	Low	31 Å²	31	120.1 Å²	120.1	16%	0.162	59%	0.587	C	S	.	*	H	α-helix	trans	-83.3	-31.1	-179.6	-73	163.4	0	0	0	112.9	S17 V18 I24 I25 L89	S17-L21 PolarHBondContact O-N 3.07Å; V18-L21 PolarHBondContact O-N 3.4Å; V18-L21 VanDerWaalsContact O-N 3.15Å; L21-I24 PolarHBondContact O-N 3.38Å; L21-I25 WeakPolarHBondContact O-CG1 3.44Å; L21-I25 PolarHBondContact O-N 3.02Å; L21-L89 HydrophobicContact CD2-CD2 4.45Å
22	V	54.7	Low	54.6	Low	84 Å²	84	121.9 Å²	121.9	51%	0.509	58%	0.578	S	S	.	*	H	α-helix	trans	-50.9	-49	178.1	-175.2	0	0	0	0	113.4	V18 I24 I25 F26	V18-V22 WeakPolarHBondContact O-CG2 3.42Å; V18-V22 PolarHBondContact O-N 3.33Å; V22-I24 VanDerWaalsContact C-N 3.3Å; V22-I24 PolarHBondContact O-N 3.06Å; V22-I25 PolarHBondContact O-N 3.26Å; V22-F26 PolarHBondContact O-N 3.11Å; V22-F26 VanDerWaalsContact O-N 3.07Å
23	P	53.6	Low	54.8	Low	78 Å²	78	115.8 Å²	115.8	51%	0.506	56%	0.558	S	S	.	*	H	α-helix	trans	-68.4	-27.7	179.6	26.1	-34.9	0	0	0	113.4	T19 R20 A27	T19-P23 WeakPolarHBondContact O-CD 3.25Å; R20-P23 WeakPolarHBondContact O-CD 3.42Å; R20-P23 WeakPolarHBondContact O-CG 3.42Å; P23-A27 VanDerWaalsContact O-CB 3.25Å; P23-A27 WeakPolarHBondContact O-CB 3.41Å; P23-A27 PolarHBondContact O-N 3.4Å
24	I	58.4	Low	54.9	Low	95 Å²	95	111.4 Å²	111.4	49%	0.487	55%	0.553	S	S	.	*	H	α-helix	trans	-72.6	-42.4	178.3	-60.2	168.4	0	0	0	109.9	L21 V22 F26 F28	L21-I24 PolarHBondContact O-N 3.38Å; V22-I24 VanDerWaalsContact C-N 3.3Å; V22-I24 PolarHBondContact O-N 3.06Å; I24-F26 VanDerWaalsContact C-N 3.35Å; I24-F28 WeakPolarHBondContact O-CB 3.32Å; I24-F28 PolarHBondContact O-N 3.25Å
25	I	56.9	Low	55.1	Low	75 Å²	75	108.5 Å²	108.5	39%	0.385	55%	0.55	S	S	.	*	H	α-helix	trans	-64	-42.1	176.7	-63.9	168.1	0	0	0	110.5	L21 V22 F28 Y29 F90	L21-I25 WeakPolarHBondContact O-CG1 3.44Å; L21-I25 PolarHBondContact O-N 3.02Å; V22-I25 PolarHBondContact O-N 3.26Å; I25-F28 PolarHBondContact O-N 3.09Å; I25-Y29 PolarHBondContact O-N 3.03Å; I25-F90 HydrophobicContact CD1-CE2 3.88Å; I25-F90 HydrophobicContact CD1-CZ 3.76Å
26	F	59.4	Low	55.1	Low	140 Å²	140	103.9 Å²	103.9	61%	0.614	54%	0.54	S	S	*	.	H	α-helix	trans	-66.7	-47.8	179.4	-150.2	-92.5	0	0	0	111.7	V22 I24 F28 Y29 D30	V22-F26 PolarHBondContact O-N 3.11Å; V22-F26 VanDerWaalsContact O-N 3.07Å; I24-F26 VanDerWaalsContact C-N 3.35Å; F26-F28 PolarHBondContact O-N 3.15Å; F26-Y29 PolarHBondContact O-N 3.18Å; F26-D30 WeakPolarHBondContact CD1-OD2 3.48Å; F26-D30 PolarHBondContact O-N 2.98Å
27	A	59	Low	55	Low	59 Å²	59	100.2 Å²	100.2	49%	0.488	53%	0.534	S	S	.	.	H	α-helix	trans	-61.8	-31.5	176.6	0	0	0	0	0	112.8	P23 F31	P23-A27 VanDerWaalsContact O-CB 3.25Å; P23-A27 WeakPolarHBondContact O-CB 3.41Å; P23-A27 PolarHBondContact O-N 3.4Å; A27-F31 WeakPolarHBondContact O-CB 3.34Å; A27-F31 PolarHBondContact O-N 3.02Å; A27-F31 VanDerWaalsContact O-N 3.11Å
28	F	56.6	Low	55	Low	110 Å²	110	102.9 Å²	102.9	48%	0.482	55%	0.55	S	S	.	.	H	α-helix	trans	-76	-36.5	177.2	-146.3	-100.2	0	0	0	112.4	I24 I25 F26 F31 F32	I24-F28 WeakPolarHBondContact O-CB 3.32Å; I24-F28 PolarHBondContact O-N 3.25Å; I25-F28 PolarHBondContact O-N 3.09Å; F26-F28 PolarHBondContact O-N 3.15Å; F28-F31 PolarHBondContact O-N 3.42Å; F28-F32 AromaticContact CD1-CD2 3.84Å; F28-F32 HydrophobicContact CD1-CD2 3.84Å; F28-F32 AromaticContact CD1-CE2 3.93Å; F28-F32 HydrophobicContact CD1-CE2 3.93Å; F28-F32 AromaticContact CE1-CD2 3.71Å; F28-F32 HydrophobicContact CE1-CD2 3.71Å; F28-F32 AromaticContact CE1-CE2 3.29Å; F28-F32 HydrophobicContact CE1-CE2 3.29Å; F28-F32 HydrophobicContact CE1-CZ 4.23Å; F28-F32 HydrophobicContact CZ-CD2 4.36Å; F28-F32 AromaticContact CZ-CE2 3.68Å; F28-F32 HydrophobicContact CZ-CE2 3.68Å; F28-F32 PolarHBondContact O-N 3.34Å; F28-F32 VanDerWaalsContact O-N 3.17Å
29	Y	54.8	Low	55.3	Low	151 Å²	151	106.7 Å²	106.7	59%	0.592	56%	0.563	S	S	*	*	H	α-helix	trans	-62.8	-44.9	172.6	-154.5	-98.1	0	0	0	110.7	I25 F26 F31 F32 F33	I25-Y29 PolarHBondContact O-N 3.03Å; F26-Y29 PolarHBondContact O-N 3.18Å; Y29-F31 PolarHBondContact O-N 3.38Å; Y29-F32 PolarHBondContact O-N 3.23Å; Y29-F33 AromaticContact CD1-CD2 3.62Å; Y29-F33 HydrophobicContact CD1-CD2 3.62Å; Y29-F33 AromaticContact CD1-CE2 3.74Å; Y29-F33 HydrophobicContact CD1-CE2 3.74Å; Y29-F33 HydrophobicContact CD2-CE2 4.11Å; Y29-F33 AromaticContact CE1-CD2 3.49Å; Y29-F33 HydrophobicContact CE1-CD2 3.49Å; Y29-F33 VanDerWaalsContact CE1-CD2 3.49Å; Y29-F33 AromaticContact CE1-CE2 3.19Å; Y29-F33 HydrophobicContact CE1-CE2 3.19Å; Y29-F33 AromaticContact CE1-CZ 3.98Å; Y29-F33 HydrophobicContact CE1-CZ 3.98Å; Y29-F33 HydrophobicContact CE2-CD2 4.4Å; Y29-F33 AromaticContact CE2-CE2 3.62Å; Y29-F33 HydrophobicContact CE2-CE2 3.62Å; Y29-F33 HydrophobicContact CE2-CZ 4.46Å; Y29-F33 HydrophobicContact CG-CD2 4.15Å; Y29-F33 HydrophobicContact CG-CE2 4.17Å; Y29-F33 AromaticContact CZ-CD2 3.92Å; Y29-F33 AromaticContact CZ-CE2 3.12Å; Y29-F33 AromaticContact CZ-CZ 3.76Å; Y29-F33 WeakPolarHBondContact O-CD2 3.44Å; Y29-F33 PolarHBondContact O-N 3.06Å; Y29-F33 WeakPolarHBondContact OH-CE2 3.36Å
30	D	54.9	Low	55.4	Low	90 Å²	90	106.7 Å²	106.7	48%	0.481	57%	0.565	S	S	.	*	H	α-helix	trans	-62	-40.8	176.9	-71.4	-37	0	0	0	112.3	F26 F32 A34	F26-D30 WeakPolarHBondContact CD1-OD2 3.48Å; F26-D30 PolarHBondContact O-N 2.98Å; D30-F32 VanDerWaalsContact C-N 3.32Å; D30-F32 PolarHBondContact O-N 3Å; D30-A34 WeakPolarHBondContact O-CB 3.26Å; D30-A34 PolarHBondContact O-N 3.29Å
31	F	55.9	Low	55.6	Low	171 Å²	171	103.3 Å²	103.3	75%	0.75	57%	0.569	S	S	*	*	H	α-helix	trans	-67.4	-32.5	178.8	-148.7	-89.9	0	0	0	112.6	A27 F28 Y29	A27-F31 WeakPolarHBondContact O-CB 3.34Å; A27-F31 PolarHBondContact O-N 3.02Å; A27-F31 VanDerWaalsContact O-N 3.11Å; F28-F31 PolarHBondContact O-N 3.42Å; Y29-F31 PolarHBondContact O-N 3.38Å
32	F	53.7	Low	55.8	Low	99 Å²	99	109 Å²	109	43%	0.434	60%	0.597	S	S	.	*	H	α-helix	trans	-83.7	-36.1	-178	-97.4	-94.1	0	0	0	114	F28 Y29 D30 A34 G35	F28-F32 AromaticContact CD1-CD2 3.84Å; F28-F32 HydrophobicContact CD1-CD2 3.84Å; F28-F32 AromaticContact CD1-CE2 3.93Å; F28-F32 HydrophobicContact CD1-CE2 3.93Å; F28-F32 AromaticContact CE1-CD2 3.71Å; F28-F32 HydrophobicContact CE1-CD2 3.71Å; F28-F32 AromaticContact CE1-CE2 3.29Å; F28-F32 HydrophobicContact CE1-CE2 3.29Å; F28-F32 HydrophobicContact CE1-CZ 4.23Å; F28-F32 HydrophobicContact CZ-CD2 4.36Å; F28-F32 AromaticContact CZ-CE2 3.68Å; F28-F32 HydrophobicContact CZ-CE2 3.68Å; F28-F32 PolarHBondContact O-N 3.34Å; F28-F32 VanDerWaalsContact O-N 3.17Å; Y29-F32 PolarHBondContact O-N 3.23Å; D30-F32 VanDerWaalsContact C-N 3.32Å; D30-F32 PolarHBondContact O-N 3Å; F32-A34 VanDerWaalsContact C-N 3.34Å; F32-G35 PolarHBondContact O-N 3.28Å
33	F	54.1	Low	56.1	Low	130 Å²	130	111.5 Å²	111.5	57%	0.57	61%	0.612	S	S	*	*	H	α-helix	trans	-72.6	-27.8	174.5	-84.5	-87.5	0	0	0	112.8	Y29 G35	Y29-F33 AromaticContact CD1-CD2 3.62Å; Y29-F33 HydrophobicContact CD1-CD2 3.62Å; Y29-F33 AromaticContact CD1-CE2 3.74Å; Y29-F33 HydrophobicContact CD1-CE2 3.74Å; Y29-F33 HydrophobicContact CD2-CE2 4.11Å; Y29-F33 AromaticContact CE1-CD2 3.49Å; Y29-F33 HydrophobicContact CE1-CD2 3.49Å; Y29-F33 VanDerWaalsContact CE1-CD2 3.49Å; Y29-F33 AromaticContact CE1-CE2 3.19Å; Y29-F33 HydrophobicContact CE1-CE2 3.19Å; Y29-F33 AromaticContact CE1-CZ 3.98Å; Y29-F33 HydrophobicContact CE1-CZ 3.98Å; Y29-F33 HydrophobicContact CE2-CD2 4.4Å; Y29-F33 AromaticContact CE2-CE2 3.62Å; Y29-F33 HydrophobicContact CE2-CE2 3.62Å; Y29-F33 HydrophobicContact CE2-CZ 4.46Å; Y29-F33 HydrophobicContact CG-CD2 4.15Å; Y29-F33 HydrophobicContact CG-CE2 4.17Å; Y29-F33 AromaticContact CZ-CD2 3.92Å; Y29-F33 AromaticContact CZ-CE2 3.12Å; Y29-F33 AromaticContact CZ-CZ 3.76Å; Y29-F33 WeakPolarHBondContact O-CD2 3.44Å; Y29-F33 PolarHBondContact O-N 3.06Å; Y29-F33 WeakPolarHBondContact OH-CE2 3.36Å; F33-G35 PolarHBondContact O-N 3.44Å
34	A	55.2	Low	56.3	Low	87 Å²	87	111.4 Å²	111.4	72%	0.719	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	-10.9	175.8	0	0	0	0	0	113.8	D30 F32	D30-A34 WeakPolarHBondContact O-CB 3.26Å; D30-A34 PolarHBondContact O-N 3.29Å; F32-A34 VanDerWaalsContact C-N 3.34Å
35	G	49.1	Very low	56.2	Low	53 Å²	53	112.3 Å²	112.3	55%	0.546	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.5	2.4	-169.6	0	0	0	0	0	116.5	F32 F33 P37	F32-G35 PolarHBondContact O-N 3.28Å; F33-G35 PolarHBondContact O-N 3.44Å; G35-P37 WeakPolarHBondContact O-CD 3.34Å; G35-P37 VanDerWaalsContact O-N 3.16Å
36	I	53	Low	56.1	Low	117 Å²	117	115 Å²	115	60%	0.6	65%	0.648	S	S	*	*			trans	-72.1	105.9	175.8	-56.4	169.8	0	0	0	107.3
37	P	54.3	Low	55.8	Low	96 Å²	96	112.2 Å²	112.2	62%	0.623	64%	0.642	S	S	*	*			trans	-64.3	142.2	175.4	29.6	-34.1	0	0	0	108.4	G35 Q39	G35-P37 WeakPolarHBondContact O-CD 3.34Å; G35-P37 VanDerWaalsContact O-N 3.16Å; P37-Q39 PolarHBondContact O-N 3.26Å
38	P	53.8	Low	55.7	Low	123 Å²	123	116 Å²	116	80%	0.799	66%	0.659	S	S	*	*			trans	-56.5	114.4	175.4	23.8	-32.3	0	0	0	107.9
39	Q	57.6	Low	55.7	Low	144 Å²	144	114.4 Å²	114.4	67%	0.673	66%	0.655	S	S	*	*			trans	-58.9	129.3	177.7	-68.7	-174.2	-6.7	0	0	107.4	P37	P37-Q39 PolarHBondContact O-N 3.26Å
40	P	55.8	Low	55.9	Low	105 Å²	105	109.5 Å²	109.5	68%	0.682	64%	0.642	S	S	*	*			trans	-56.3	148.5	175.5	24.3	-32.4	0	0	0	108.8	M42	P40-M42 VanDerWaalsContact C-N 3.33Å; P40-M42 PolarHBondContact O-N 3.45Å
41	P	62.9	Low	56.4	Low	131 Å²	131	110.9 Å²	110.9	85%	0.851	66%	0.656	S	S	*	*			trans	-57.9	99.2	-178.2	23.6	-32.5	0	0	0	108.7	T43	P41-T43 PolarHBondContact O-N 3.44Å
42	M	58.8	Low	57	Low	150 Å²	150	105 Å²	105	74%	0.739	63%	0.629	S	S	*	*			trans	-68.8	118.8	174.7	54	179.1	-174.8	0	0	106.6	P40 A44	P40-M42 VanDerWaalsContact C-N 3.33Å; P40-M42 PolarHBondContact O-N 3.45Å; M42-A44 VanDerWaalsContact C-N 3.26Å; M42-A44 PolarHBondContact O-N 3.17Å
43	T	60.7	Low	57.8	Low	137 Å²	137	101.2 Å²	101.2	84%	0.84	62%	0.619	S	S	*	*			trans	-63.4	99.3	162.1	-14.2	0	0	0	0	105.3	P41 V45	P41-T43 PolarHBondContact O-N 3.44Å; T43-V45 PolarHBondContact O-N 2.96Å
44	A	57.3	Low	58.5	Low	77 Å²	77	96.6 Å²	96.6	64%	0.636	61%	0.605	S	S	*	*			trans	-65.5	91.3	171.3	0	0	0	0	0	106.4	M42 V46	M42-A44 VanDerWaalsContact C-N 3.26Å; M42-A44 PolarHBondContact O-N 3.17Å; A44-V46 VanDerWaalsContact C-N 3.34Å; A44-V46 PolarHBondContact O-N 3.18Å
45	V	56.6	Low	59.5	Low	114 Å²	114	98 Å²	98	69%	0.691	60%	0.6	S	S	*	*			trans	-58.8	112.6	156.8	-177.6	0	0	0	0	103.2	T43 T47	T43-V45 PolarHBondContact O-N 2.96Å; V45-T47 VanDerWaalsContact CG1-OG1 3.25Å; V45-T47 WeakPolarHBondContact CG1-OG1 3.49Å; V45-T47 PolarHBondContact O-N 3.4Å
46	V	54.7	Low	61	Low	131 Å²	131	98.3 Å²	98.3	79%	0.794	59%	0.593	S	S	*	*			trans	-70	63.3	169.8	-172.7	0	0	0	0	106.6	A44 V48	A44-V46 VanDerWaalsContact C-N 3.34Å; A44-V46 PolarHBondContact O-N 3.18Å; V46-V48 PolarHBondContact O-N 3.36Å
47	T	53.6	Low	62.3	Low	81 Å²	81	94 Å²	94	50%	0.497	57%	0.571	S	S	.	*			trans	-69.8	124	157.1	-46.8	0	0	0	0	102.9	V45 I49	V45-T47 VanDerWaalsContact CG1-OG1 3.25Å; V45-T47 WeakPolarHBondContact CG1-OG1 3.49Å; V45-T47 PolarHBondContact O-N 3.4Å; T47-I49 HydrophobicContact CG2-CD1 3.82Å; T47-I49 HydrophobicContact CG2-CG1 3.43Å; T47-I49 VanDerWaalsContact CG2-CG1 3.43Å; T47-I49 PolarHBondContact O-N 3.28Å
48	V	56.6	Low	63.8	Low	138 Å²	138	94.9 Å²	94.9	84%	0.836	57%	0.567	S	S	*	*			trans	-68.4	61.6	171	-171.5	0	0	0	0	107.4	V46	V46-V48 PolarHBondContact O-N 3.36Å
49	I	57.2	Low	65.1	Low	77 Å²	77	89.5 Å²	89.5	40%	0.395	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-83.1	116.6	167.8	-56.7	168.4	0	0	0	102.3	T47 F52 V59	T47-I49 HydrophobicContact CG2-CD1 3.82Å; T47-I49 HydrophobicContact CG2-CG1 3.43Å; T47-I49 VanDerWaalsContact CG2-CG1 3.43Å; T47-I49 PolarHBondContact O-N 3.28Å; I49-F52 HydrophobicContact CG2-CD2 4.13Å; I49-F52 HydrophobicContact CG2-CE1 4.34Å; I49-F52 HydrophobicContact CG2-CE2 3.49Å; I49-F52 VanDerWaalsContact CG2-CE2 3.49Å; I49-F52 HydrophobicContact CG2-CZ 3.61Å; I49-V59 HydrophobicContact CG2-CG1 4Å
50	P	58.6	Low	66.4	Low	49 Å²	49	89.5 Å²	89.5	32%	0.318	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-49.9	130.6	171.5	23.5	-35.2	0	0	0	107.4	F52 V57 V59	P50-F52 PolarHBondContact O-N 2.73Å; P50-V57 HydrophobicContact CB-CG2 3.55Å; P50-V57 HydrophobicContact CG-CG2 3.22Å; P50-V59 HydrophobicContact CG-CG1 3.85Å
51	P	64.1	Low	67.7	Low	119 Å²	119	84.5 Å²	84.5	77%	0.773	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-50.7	119.6	-172.7	20.3	-32.2	0	0	0	108.5	G53	P51-G53 PolarHBondContact O-N 2.96Å
52	F	68.4	Low	68.7	Low	46 Å²	46	84.3 Å²	84.3	20%	0.202	50%	0.501	C	S	.	.			trans	-57.2	109.3	174.4	-70.4	-71	0	0	0	106.5	I49 P50 V57 V59 T70 H111 L120 Y123	I49-F52 HydrophobicContact CG2-CD2 4.13Å; I49-F52 HydrophobicContact CG2-CE1 4.34Å; I49-F52 HydrophobicContact CG2-CE2 3.49Å; I49-F52 VanDerWaalsContact CG2-CE2 3.49Å; I49-F52 HydrophobicContact CG2-CZ 3.61Å; P50-F52 PolarHBondContact O-N 2.73Å; F52-V57 HydrophobicContact CD1-CG1 3.71Å; F52-V57 HydrophobicContact CE1-CG1 3.97Å; F52-V59 HydrophobicContact CE1-CG1 4.09Å; F52-V59 HydrophobicContact CE1-CG2 4.37Å; F52-V59 HydrophobicContact CZ-CG1 4.38Å; F52-T70 HydrophobicContact CE1-CG2 4.33Å; F52-H111 HydrophobicContact CD1-CB 4.15Å; F52-H111 AromaticContact CD1-CD2 3.89Å; F52-H111 AromaticContact CD1-CG 3.75Å; F52-H111 AromaticContact CD1-ND1 3.97Å; F52-H111 HydrophobicContact CE1-CB 4.29Å; F52-L120 HydrophobicContact CE1-CB 4.2Å; F52-L120 HydrophobicContact CZ-CB 3.98Å; F52-Y123 WeakPolarHBondContact O-CD2 3.37Å
53	G	72	Confident	70	Confident	21 Å²	21	82.5 Å²	82.5	22%	0.216	49%	0.494	C	S	.	.			trans	-108.5	-160.5	-173.8	0	0	0	0	0	111.4	P51 D55 H111 Y123	P51-G53 PolarHBondContact O-N 2.96Å; G53-D55 PolarHBondContact O-N 2.87Å; G53-H111 PolarHBondContact O-NE2 3.01Å; G53-H111 VanDerWaalsContact O-NE2 3.17Å; G53-Y123 VanDerWaalsContact C-CD1 3.49Å; G53-Y123 WeakPolarHBondContact O-CD1 3.23Å
54	A	68.2	Low	71.3	Confident	32 Å²	32	78 Å²	78	26%	0.264	47%	0.468	S	S	.	.	S	Bend	trans	-62.8	-26.1	170.6	0	0	0	0	0	113.5	I109	A54-I109 VanDerWaalsContact O-CD1 3.25Å; A54-I109 WeakPolarHBondContact O-CD1 3.39Å
55	D	77.1	Confident	72.6	Confident	118 Å²	118	76.4 Å²	76.4	63%	0.631	46%	0.459	S	S	*	.	S	Bend	trans	-108.3	150	-166	-62.1	-57.8	0	0	0	111.2	G53 V57 H111	G53-D55 PolarHBondContact O-N 2.87Å; D55-V57 PolarHBondContact O-N 3.38Å; D55-H111 PolarHBondContact O-CE1 3.21Å
56	P	80.1	Confident	74	Confident	59 Å²	59	73 Å²	73	38%	0.383	44%	0.44	S	S	.	.			trans	-60.5	135.5	175	28	-35.5	0	0	0	110.1	L69 T70 V72	P56-L69 HydrophobicContact CB-CD1 4.01Å; P56-L69 HydrophobicContact CB-CG 4.17Å; P56-T70 WeakPolarHBondContact CB-O 3.04Å; P56-V72 HydrophobicContact CB-CG1 4.16Å; P56-V72 HydrophobicContact CB-CG2 4.41Å
57	V	79.8	Confident	75.6	Confident	25 Å²	25	73.7 Å²	73.7	15%	0.152	44%	0.437	C	S	.	.			trans	-124.4	144.4	-172	66	0	0	0	0	111.2	P50 F52 D55 V59 T70	P50-V57 HydrophobicContact CB-CG2 3.55Å; P50-V57 HydrophobicContact CG-CG2 3.22Å; F52-V57 HydrophobicContact CD1-CG1 3.71Å; F52-V57 HydrophobicContact CE1-CG1 3.97Å; D55-V57 PolarHBondContact O-N 3.38Å; V57-V59 HydrophobicContact CG1-CG1 3.8Å; V57-V59 HydrophobicContact CG2-CG1 4.4Å; V57-V59 PolarHBondContact O-N 3.04Å; V57-T70 HydrophobicContact CG1-CG2 4.36Å; V57-T70 PolarHBondContact N-OG1 3.13Å; V57-T70 VanDerWaalsContact N-OG1 3.13Å; V57-T70 PolarHBondContact O-N 3.34Å; V57-T70 PolarHBondContact O-OG1 2.95Å
58	H	85.6	Confident	77.2	Confident	116 Å²	116	70.7 Å²	70.7	54%	0.537	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	114.1	174.5	-79.7	-82.1	0	0	0	109.8	M67	H58-M67 HydrophobicContact CB-CE 4.28Å
59	V	81.1	Confident	78.7	Confident	10 Å²	10	67.9 Å²	67.9	6%	0.061	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	150.7	179.9	-64.5	0	0	0	0	109.7	I49 P50 F52 V57 V68 T70 L120	I49-V59 HydrophobicContact CG2-CG1 4Å; P50-V59 HydrophobicContact CG-CG1 3.85Å; F52-V59 HydrophobicContact CE1-CG1 4.09Å; F52-V59 HydrophobicContact CE1-CG2 4.37Å; F52-V59 HydrophobicContact CZ-CG1 4.38Å; V57-V59 HydrophobicContact CG1-CG1 3.8Å; V57-V59 HydrophobicContact CG2-CG1 4.4Å; V57-V59 PolarHBondContact O-N 3.04Å; V59-V68 PolarHBondContact N-O 3.35Å; V59-V68 PolarHBondContact O-N 2.99Å; V59-T70 HydrophobicContact CG2-CG2 3.35Å; V59-L120 HydrophobicContact CB-CD2 4.44Å; V59-L120 HydrophobicContact CG2-CD2 3.31Å
60	Q	84.8	Confident	80.2	Confident	144 Å²	144	64.3 Å²	64.3	67%	0.673	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	117.4	171.9	-169.3	175.8	-10.9	0	0	108.6	S62 G65	Q60-S62 PolarHBondContact O-N 3.31Å; Q60-G65 WeakPolarHBondContact CG-O 3.32Å; Q60-G65 PolarHBondContact NE2-O 2.87Å
61	C	84.1	Confident	81.5	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	39%	0.387	C	S	.	.			trans	-74.3	129.2	179.9	175.6	0	0	0	0	110	N63 C64 G65 S66 V68 L120	C61-N63 PolarHBondContact O-N 3.34Å; C61-C64 WeakPolarHBondContact CB-SG 3.39Å; C61-G65 VanDerWaalsContact O-CA 3.23Å; C61-G65 WeakPolarHBondContact O-CA 3.45Å; C61-G65 PolarHBondContact O-N 2.9Å; C61-S66 PolarHBondContact N-O 3.45Å; C61-V68 HydrophobicContact CB-CG2 4.05Å; C61-L120 HydrophobicContact CB-CD2 4.34Å
62	S	83.3	Confident	82.4	Confident	127 Å²	127	63.5 Å²	63.5	89%	0.888	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-24.4	179.6	52.6	0	0	0	0	113.8	Q60	Q60-S62 PolarHBondContact O-N 3.31Å
63	N	85.9	Confident	83	Confident	111 Å²	111	65.9 Å²	65.9	59%	0.594	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-42.8	-178.8	-169.1	26.4	0	0	0	112.5	C61 T118	C61-N63 PolarHBondContact O-N 3.34Å; N63-T118 HydrophobicContact CB-CG2 4.31Å
64	C	88.3	Confident	83.1	Confident	43 Å²	43	68.7 Å²	68.7	29%	0.291	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-7.7	-179	60.8	0	0	0	0	114.4	C61 S66 C113	C61-C64 WeakPolarHBondContact CB-SG 3.39Å; C64-S66 PolarHBondContact O-N 3.1Å; C64-S66 PolarHBondContact O-OG 2.95Å; C64-S66 PolarHBondContact SG-OG 3.06Å; C64-C113 VanDerWaalsContact SG-SG 3.62Å
65	G	85.5	Confident	83.3	Confident	43 Å²	43	69.7 Å²	69.7	44%	0.443	39%	0.392	S	S	.	.			trans	66.4	-9.1	178.9	0	0	0	0	0	115.6	Q60 C61	Q60-G65 WeakPolarHBondContact CG-O 3.32Å; Q60-G65 PolarHBondContact NE2-O 2.87Å; C61-G65 VanDerWaalsContact O-CA 3.23Å; C61-G65 WeakPolarHBondContact O-CA 3.45Å; C61-G65 PolarHBondContact O-N 2.9Å
66	S	84.5	Confident	82.8	Confident	42 Å²	42	66.2 Å²	66.2	29%	0.294	38%	0.38	S	S	.	.	S	Bend	trans	-85.5	145.5	-179	33.3	0	0	0	0	111.8	C61 C64 V68	C61-S66 PolarHBondContact N-O 3.45Å; C64-S66 PolarHBondContact O-N 3.1Å; C64-S66 PolarHBondContact O-OG 2.95Å; C64-S66 PolarHBondContact SG-OG 3.06Å; S66-V68 PolarHBondContact O-N 3.08Å
67	M	88.8	Confident	82.1	Confident	147 Å²	147	63.8 Å²	63.8	72%	0.724	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.9	116.4	171.5	-166.7	173.2	-158.3	0	0	108.7	H58	H58-M67 HydrophobicContact CB-CE 4.28Å
68	V	86.4	Confident	81.3	Confident	17 Å²	17	66.9 Å²	66.9	10%	0.103	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	150.1	-175.1	-65.7	0	0	0	0	110	V59 C61 S66 P114	V59-V68 PolarHBondContact N-O 3.35Å; V59-V68 PolarHBondContact O-N 2.99Å; C61-V68 HydrophobicContact CB-CG2 4.05Å; S66-V68 PolarHBondContact O-N 3.08Å; V68-P114 HydrophobicContact CB-CG 3.99Å; V68-P114 HydrophobicContact CG1-CG 4.35Å
69	L	89.7	Confident	80.2	Confident	79 Å²	79	63.8 Å²	63.8	41%	0.414	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	120.6	166.1	-175.7	62.6	0	0	0	107.4	P56 P114	P56-L69 HydrophobicContact CB-CD1 4.01Å; P56-L69 HydrophobicContact CB-CG 4.17Å; L69-P114 VanDerWaalsContact O-CD 3.31Å; L69-P114 WeakPolarHBondContact O-CD 3.37Å; L69-P114 WeakPolarHBondContact O-CG 3.47Å
70	T	87.1	Confident	79.4	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.012	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-63.7	139.3	179.8	59.6	0	0	0	0	111	F52 P56 V57 V59 H111 H112 L120	F52-T70 HydrophobicContact CE1-CG2 4.33Å; P56-T70 WeakPolarHBondContact CB-O 3.04Å; V57-T70 HydrophobicContact CG1-CG2 4.36Å; V57-T70 PolarHBondContact N-OG1 3.13Å; V57-T70 VanDerWaalsContact N-OG1 3.13Å; V57-T70 PolarHBondContact O-N 3.34Å; V57-T70 PolarHBondContact O-OG1 2.95Å; V59-T70 HydrophobicContact CG2-CG2 3.35Å; T70-H111 HydrophobicContact CG2-CB 4.07Å; T70-H111 PolarHBondContact OG1-ND1 3.04Å; T70-H112 CarbonylContact C-O 3.59Å; T70-H112 WeakPolarHBondContact CA-O 3.5Å; T70-L120 HydrophobicContact CG2-CD1 4.35Å; T70-L120 HydrophobicContact CG2-CD2 4.08Å
71	E	86.4	Confident	78.5	Confident	100 Å²	100	65.3 Å²	65.3	47%	0.467	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	123.1	165	-70.2	-169.9	166.3	0	0	109.8	H111 H112 P114	E71-H111 WeakPolarHBondContact O-CA 3.44Å; E71-H112 PolarHBondContact N-O 3.49Å; E71-H112 PolarHBondContact O-N 3.21Å; E71-P114 HydrophobicContact CG-CB 4.21Å
72	V	84	Confident	77.7	Confident	52 Å²	52	67.8 Å²	67.8	32%	0.315	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	125	174.1	-72.6	0	0	0	0	110	P56 I109 E110 H111	P56-V72 HydrophobicContact CB-CG1 4.16Å; P56-V72 HydrophobicContact CB-CG2 4.41Å; V72-I109 HydrophobicContact CB-CG2 3.61Å; V72-I109 HydrophobicContact CG1-CG2 3.6Å; V72-E110 CarbonylContact C-O 3.58Å; V72-E110 WeakPolarHBondContact CA-O 3.45Å; V72-H111 WeakPolarHBondContact CG1-CE1 3.1Å
73	K	80.5	Confident	76.8	Confident	96 Å²	96	64.3 Å²	64.3	42%	0.417	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	119.9	173.6	-70	-173.8	179.5	170.5	0	109.6	V75 E110	K73-V75 PolarHBondContact O-N 3.3Å; K73-E110 PolarHBondContact N-O 2.84Å; K73-E110 PolarHBondContact O-N 2.82Å
74	P	74.7	Confident	75.7	Confident	79 Å²	79	61.1 Å²	61.1	51%	0.513	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	128.2	172	29.5	-32.5	0	0	0	108.7	Q107 D108	P74-Q107 HydrophobicContact CB-CB 4.38Å; P74-D108 WeakPolarHBondContact CA-O 3.25Å
75	V	71.2	Confident	74.8	Confident	54 Å²	54	64.5 Å²	64.5	33%	0.327	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	132.4	176.4	-179	0	0	0	0	108.5	K73 G77 Q107 D108 E110	K73-V75 PolarHBondContact O-N 3.3Å; V75-G77 PolarHBondContact O-N 3.08Å; V75-Q107 WeakPolarHBondContact O-CB 3.39Å; V75-D108 PolarHBondContact N-O 3.38Å; V75-D108 PolarHBondContact O-N 3.05Å; V75-E110 HydrophobicContact CB-CG 4.37Å; V75-E110 HydrophobicContact CG2-CB 4.22Å; V75-E110 HydrophobicContact CG2-CG 3.53Å
76	A	66.8	Low	73.9	Confident	44 Å²	44	65 Å²	65	36%	0.364	35%	0.351	S	S	.	.			trans	-62.8	99.3	177.1	0	0	0	0	0	109.7	S80	A76-S80 WeakPolarHBondContact CA-OG 3.45Å
77	G	65.4	Low	73	Confident	9 Å²	9	63.4 Å²	63.4	9%	0.093	34%	0.34	C	S	.	.			trans	-71.5	-178.2	175.8	0	0	0	0	0	111.9	V75 L79 S80 D108	V75-G77 PolarHBondContact O-N 3.08Å; G77-L79 PolarHBondContact O-N 3.06Å; G77-L79 VanDerWaalsContact O-N 3.13Å; G77-S80 WeakPolarHBondContact O-CB 3.46Å; G77-S80 PolarHBondContact O-N 3.31Å; G77-S80 PolarHBondContact O-OG 3.12Å; G77-D108 WeakPolarHBondContact CA-OD2 3.49Å
78	T	62.4	Low	71.9	Confident	90 Å²	90	59.6 Å²	59.6	55%	0.552	33%	0.332	S	S	*	.	H	α-helix	trans	-54	-32.2	174.7	49.8	0	0	0	0	112.3	S80 W81 V82	T78-S80 VanDerWaalsContact C-N 3.34Å; T78-S80 PolarHBondContact O-N 3.21Å; T78-W81 WeakPolarHBondContact O-CB 3.38Å; T78-W81 PolarHBondContact O-N 3.39Å; T78-V82 WeakPolarHBondContact O-CG2 3.46Å; T78-V82 PolarHBondContact O-N 3.08Å
79	L	63.9	Low	70.9	Confident	50 Å²	50	63.3 Å²	63.3	26%	0.262	35%	0.35	S	S	.	.	H	α-helix	trans	-60.7	-37.8	177	-67.8	172.1	0	0	0	113.6	G77 W81 V82 L83 L106 M126	G77-L79 PolarHBondContact O-N 3.06Å; G77-L79 VanDerWaalsContact O-N 3.13Å; L79-W81 VanDerWaalsContact C-N 3.26Å; L79-W81 PolarHBondContact O-N 3.38Å; L79-V82 PolarHBondContact O-N 3.03Å; L79-L83 PolarHBondContact O-N 3.27Å; L79-L106 HydrophobicContact CD1-CB 4.3Å; L79-L106 HydrophobicContact CD1-CD2 3.98Å; L79-L106 WeakPolarHBondContact CD1-O 3.46Å; L79-M126 HydrophobicContact CD1-CE 4.17Å; L79-M126 HydrophobicContact CD1-CG 4.37Å; L79-M126 HydrophobicContact CD1-SD 3.6Å; L79-M126 VanDerWaalsContact CD1-SD 3.6Å; L79-M126 HydrophobicContact CD2-SD 4.38Å
80	S	64.2	Low	69.9	Low	6 Å²	6	64.4 Å²	64.4	4%	0.042	35%	0.352	C	S	.	.	H	α-helix	trans	-59.8	-43	177.9	-48.5	0	0	0	0	110.6	A76 G77 T78 C84	A76-S80 WeakPolarHBondContact CA-OG 3.45Å; G77-S80 WeakPolarHBondContact O-CB 3.46Å; G77-S80 PolarHBondContact O-N 3.31Å; G77-S80 PolarHBondContact O-OG 3.12Å; T78-S80 VanDerWaalsContact C-N 3.34Å; T78-S80 PolarHBondContact O-N 3.21Å; S80-C84 PolarHBondContact O-N 2.73Å; S80-C84 VanDerWaalsContact O-N 3.08Å; S80-C84 PolarHBondContact O-SG 3.36Å
81	W	66	Low	68.6	Low	180 Å²	180	67 Å²	67	68%	0.682	38%	0.379	S	S	*	.	H	α-helix	trans	-66.8	-41.4	176.2	-73.4	85.4	0	0	0	112.5	T78 L79 C84 M85	T78-W81 WeakPolarHBondContact O-CB 3.38Å; T78-W81 PolarHBondContact O-N 3.39Å; L79-W81 VanDerWaalsContact C-N 3.26Å; L79-W81 PolarHBondContact O-N 3.38Å; W81-C84 PolarHBondContact O-N 2.79Å; W81-M85 WeakPolarHBondContact O-CG 3.36Å; W81-M85 PolarHBondContact O-N 3.03Å
82	V	66.9	Low	67.1	Low	53 Å²	53	66.8 Å²	66.8	32%	0.321	38%	0.381	S	S	.	.	H	α-helix	trans	-61.3	-45.8	177.6	172.2	0	0	0	0	111.2	T78 L79 M85 T86	T78-V82 WeakPolarHBondContact O-CG2 3.46Å; T78-V82 PolarHBondContact O-N 3.08Å; L79-V82 PolarHBondContact O-N 3.03Å; V82-M85 PolarHBondContact O-N 3.17Å; V82-T86 WeakPolarHBondContact O-CB 3.35Å; V82-T86 PolarHBondContact O-N 3.21Å; V82-T86 PolarHBondContact O-OG1 3.42Å
83	L	65.4	Low	65.8	Low	54 Å²	54	73 Å²	73	28%	0.283	40%	0.404	S	S	.	.	H	α-helix	trans	-64.6	-41.6	177.5	-74	172.6	0	0	0	111.4	L79 T86 C87 P100	L79-L83 PolarHBondContact O-N 3.27Å; L83-T86 PolarHBondContact O-N 3.26Å; L83-C87 WeakPolarHBondContact O-CB 3.44Å; L83-C87 PolarHBondContact O-N 2.9Å; L83-C87 PolarHBondContact O-SG 3.22Å; L83-P100 HydrophobicContact CB-CB 3.74Å; L83-P100 HydrophobicContact CB-CG 3.74Å; L83-P100 HydrophobicContact CD1-CB 3.65Å; L83-P100 HydrophobicContact CD1-CG 4.31Å; L83-P100 HydrophobicContact CG-CB 4.33Å
84	C	62.5	Low	64.5	Low	44 Å²	44	78.8 Å²	78.8	30%	0.297	43%	0.429	S	S	.	.	H	α-helix	trans	-59.4	-48.4	174.1	-75.1	0	0	0	0	112.3	S80 W81 T86 C87 A88	S80-C84 PolarHBondContact O-N 2.73Å; S80-C84 VanDerWaalsContact O-N 3.08Å; S80-C84 PolarHBondContact O-SG 3.36Å; W81-C84 PolarHBondContact O-N 2.79Å; C84-T86 VanDerWaalsContact C-N 3.32Å; C84-T86 PolarHBondContact O-N 2.9Å; C84-C87 PolarHBondContact O-N 2.88Å; C84-A88 WeakPolarHBondContact O-CB 3.43Å; C84-A88 PolarHBondContact O-N 3.09Å
85	M	68.4	Low	63.5	Low	113 Å²	113	77.4 Å²	77.4	56%	0.557	43%	0.43	S	S	*	.	H	α-helix	trans	-61.1	-42.5	177	-77.4	-66.9	-165.7	0	0	111.8	W81 V82 A88 L89	W81-M85 WeakPolarHBondContact O-CG 3.36Å; W81-M85 PolarHBondContact O-N 3.03Å; V82-M85 PolarHBondContact O-N 3.17Å; M85-A88 PolarHBondContact O-N 3.01Å; M85-L89 WeakPolarHBondContact O-CB 3.25Å; M85-L89 WeakPolarHBondContact O-CG 3.38Å; M85-L89 PolarHBondContact O-N 3.48Å
86	T	67.8	Low	62.6	Low	54 Å²	54	76.7 Å²	76.7	33%	0.331	43%	0.426	S	S	.	.	H	α-helix	trans	-60.8	-49.5	176.7	-58.3	0	0	0	0	110.3	V82 L83 C84 A88 L89 F90	V82-T86 WeakPolarHBondContact O-CB 3.35Å; V82-T86 PolarHBondContact O-N 3.21Å; V82-T86 PolarHBondContact O-OG1 3.42Å; L83-T86 PolarHBondContact O-N 3.26Å; C84-T86 VanDerWaalsContact C-N 3.32Å; C84-T86 PolarHBondContact O-N 2.9Å; T86-A88 VanDerWaalsContact C-N 3.3Å; T86-A88 PolarHBondContact O-N 3.23Å; T86-L89 PolarHBondContact O-N 2.76Å; T86-F90 HydrophobicContact CG2-CD2 3.62Å; T86-F90 HydrophobicContact CG2-CE2 3.69Å; T86-F90 VanDerWaalsContact O-CD2 3.26Å; T86-F90 WeakPolarHBondContact O-CD2 3.26Å; T86-F90 PolarHBondContact O-N 2.96Å
87	C	64.8	Low	61.8	Low	8 Å²	8	77.3 Å²	77.3	5%	0.054	43%	0.428	C	S	.	.	H	α-helix	trans	-60.1	-40.6	179	-65.4	0	0	0	0	112.4	L83 C84 G91 L92 C96 C97	L83-C87 WeakPolarHBondContact O-CB 3.44Å; L83-C87 PolarHBondContact O-N 2.9Å; L83-C87 PolarHBondContact O-SG 3.22Å; C84-C87 PolarHBondContact O-N 2.88Å; C87-G91 PolarHBondContact O-N 2.79Å; C87-L92 PolarHBondContact O-N 2.91Å; C87-C96 HydrophobicContact CB-CB 4.39Å; C87-C96 WeakPolarHBondContact SG-CB 3.44Å; C87-C97 VanDerWaalsContact CB-SG 3.57Å
88	A	65.4	Low	61.2	Low	68 Å²	68	82.4 Å²	82.4	56%	0.562	45%	0.452	S	S	*	.	H	α-helix	trans	-63.6	-43.2	176	0	0	0	0	0	112.3	C84 M85 T86 G91	C84-A88 WeakPolarHBondContact O-CB 3.43Å; C84-A88 PolarHBondContact O-N 3.09Å; M85-A88 PolarHBondContact O-N 3.01Å; T86-A88 VanDerWaalsContact C-N 3.3Å; T86-A88 PolarHBondContact O-N 3.23Å; A88-G91 PolarHBondContact O-N 3Å
89	L	65.5	Low	60.9	Low	94 Å²	94	81.8 Å²	81.8	49%	0.492	45%	0.445	S	S	.	.	H	α-helix	trans	-68.2	-38	179.9	-75.3	170.2	0	0	0	113.3	L21 M85 T86 G91	L21-L89 HydrophobicContact CD2-CD2 4.45Å; M85-L89 WeakPolarHBondContact O-CB 3.25Å; M85-L89 WeakPolarHBondContact O-CG 3.38Å; M85-L89 PolarHBondContact O-N 3.48Å; T86-L89 PolarHBondContact O-N 2.76Å; L89-G91 PolarHBondContact O-N 3.43Å
90	F	67.9	Low	60.3	Low	103 Å²	103	79.5 Å²	79.5	45%	0.452	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-2.1	-179.8	-79.7	-83	0	0	0	113.3	I25 T86 L92	I25-F90 HydrophobicContact CD1-CE2 3.88Å; I25-F90 HydrophobicContact CD1-CZ 3.76Å; T86-F90 HydrophobicContact CG2-CD2 3.62Å; T86-F90 HydrophobicContact CG2-CE2 3.69Å; T86-F90 VanDerWaalsContact O-CD2 3.26Å; T86-F90 WeakPolarHBondContact O-CD2 3.26Å; T86-F90 PolarHBondContact O-N 2.96Å; F90-L92 HydrophobicContact CB-CD1 3.51Å; F90-L92 PolarHBondContact O-N 2.81Å
91	G	61.5	Low	59.8	Low	56 Å²	56	85.3 Å²	85.3	58%	0.577	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	67	15.5	-179.5	0	0	0	0	0	113.6	C87 A88 L89 F93	C87-G91 PolarHBondContact O-N 2.79Å; A88-G91 PolarHBondContact O-N 3Å; L89-G91 PolarHBondContact O-N 3.43Å; G91-F93 PolarHBondContact O-N 2.66Å
92	L	54	Low	59.1	Low	95 Å²	95	80.9 Å²	80.9	50%	0.497	45%	0.453	S	S	.	.			trans	-80.4	71.8	175.1	-83	95.3	0	0	0	109.9	C87 F90 F94 C96	C87-L92 PolarHBondContact O-N 2.91Å; F90-L92 HydrophobicContact CB-CD1 3.51Å; F90-L92 PolarHBondContact O-N 2.81Å; L92-F94 PolarHBondContact O-N 3.33Å; L92-C96 HydrophobicContact CB-CB 4.35Å; L92-C96 HydrophobicContact CD2-CB 4.4Å
93	F	56.4	Low	58.6	Low	184 Å²	184	80.7 Å²	80.7	81%	0.807	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-16.5	177.2	-122.9	-94.6	0	0	0	113.4	G91	G91-F93 PolarHBondContact O-N 2.66Å
94	F	52.9	Low	58.1	Low	216 Å²	216	81.4 Å²	81.4	95%	0.947	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	13.2	-163.2	-96.7	-79.8	0	0	0	117.6	L92	L92-F94 PolarHBondContact O-N 3.33Å
95	G	55.3	Low	57.8	Low	51 Å²	51	83.2 Å²	83.2	53%	0.526	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	177.8	-10.3	170.9	0	0	0	0	0	119.1
96	C	51.9	Low	57.1	Low	38 Å²	38	80.6 Å²	80.6	26%	0.257	46%	0.461	S	S	.	.	S	Bend	trans	-93.9	-21.4	-169.6	-147.5	0	0	0	0	113.5	C87 L92 L98 I99 P100	C87-C96 HydrophobicContact CB-CB 4.39Å; C87-C96 WeakPolarHBondContact SG-CB 3.44Å; L92-C96 HydrophobicContact CB-CB 4.35Å; L92-C96 HydrophobicContact CD2-CB 4.4Å; C96-L98 PolarHBondContact O-N 2.99Å; C96-L98 VanDerWaalsContact O-N 3.1Å; C96-I99 HydrophobicContact CB-CD1 4.46Å; C96-I99 WeakPolarHBondContact O-CB 3.36Å; C96-I99 WeakPolarHBondContact O-CG1 3.48Å; C96-I99 PolarHBondContact O-N 3.17Å; C96-I99 WeakPolarHBondContact SG-CD1 2.95Å; C96-P100 WeakPolarHBondContact O-CD 3.5Å
97	C	50.2	Low	56.9	Low	58 Å²	58	78.8 Å²	78.8	39%	0.392	45%	0.449	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-16.6	178.9	-62.8	0	0	0	0	114.3	C87 P100	C87-C97 VanDerWaalsContact CB-SG 3.57Å; C97-P100 WeakPolarHBondContact O-CD 3.5Å; C97-P100 WeakPolarHBondContact O-CG 2.93Å
98	L	51.6	Low	57	Low	116 Å²	116	80 Å²	80	61%	0.607	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-21.9	176	-76.7	141.1	0	0	0	112.8	C96 F101 C102	C96-L98 PolarHBondContact O-N 2.99Å; C96-L98 VanDerWaalsContact O-N 3.1Å; L98-F101 CarbonylContact O-C 3.53Å; L98-F101 PolarHBondContact O-N 2.97Å; L98-C102 WeakPolarHBondContact O-CB 3.42Å; L98-C102 PolarHBondContact O-N 2.71Å; L98-C102 PolarHBondContact O-SG 2.86Å
99	I	56.7	Low	57.6	Low	77 Å²	77	77.3 Å²	77.3	40%	0.395	43%	0.431	S	S	.	.	H	α-helix	trans	-57.1	-44.9	-179.6	-54.8	-176.1	0	0	0	112.9	C96 F101 C102 V103	C96-I99 HydrophobicContact CB-CD1 4.46Å; C96-I99 WeakPolarHBondContact O-CB 3.36Å; C96-I99 WeakPolarHBondContact O-CG1 3.48Å; C96-I99 PolarHBondContact O-N 3.17Å; C96-I99 WeakPolarHBondContact SG-CD1 2.95Å; I99-F101 PolarHBondContact O-N 2.85Å; I99-C102 PolarHBondContact O-N 2.82Å; I99-C102 VanDerWaalsContact O-N 3.17Å; I99-V103 HydrophobicContact CG2-CG2 3.94Å; I99-V103 WeakPolarHBondContact O-CG2 3.46Å; I99-V103 PolarHBondContact O-N 2.89Å
100	P	51.9	Low	58.5	Low	2 Å²	2	75.6 Å²	75.6	1%	0.013	42%	0.42	C	S	.	.	H	α-helix	trans	-58.7	-31.5	175.5	15.2	-27	0	0	0	113.8	L83 C96 C97 Q107	L83-P100 HydrophobicContact CB-CB 3.74Å; L83-P100 HydrophobicContact CB-CG 3.74Å; L83-P100 HydrophobicContact CD1-CB 3.65Å; L83-P100 HydrophobicContact CD1-CG 4.31Å; L83-P100 HydrophobicContact CG-CB 4.33Å; C96-P100 WeakPolarHBondContact O-CD 3.5Å; C97-P100 WeakPolarHBondContact O-CD 3.5Å; C97-P100 WeakPolarHBondContact O-CG 2.93Å; P100-Q107 PolarHBondContact O-NE2 2.95Å
101	F	54	Low	59.2	Low	127 Å²	127	70.7 Å²	70.7	56%	0.557	40%	0.399	S	S	*	.	H	α-helix	trans	-85.4	-28.9	178.5	-70.7	-78.6	0	0	0	112.6	L98 I99 Q107	L98-F101 CarbonylContact O-C 3.53Å; L98-F101 PolarHBondContact O-N 2.97Å; I99-F101 PolarHBondContact O-N 2.85Å; F101-Q107 PolarHBondContact O-NE2 3.42Å
102	C	50.7	Low	60.4	Low	88 Å²	88	69.3 Å²	69.3	60%	0.595	38%	0.377	S	S	*	.	H	α-helix	trans	-83.7	-16.9	-179.4	-70.5	0	0	0	0	114	L98 I99 P104	L98-C102 WeakPolarHBondContact O-CB 3.42Å; L98-C102 PolarHBondContact O-N 2.71Å; L98-C102 PolarHBondContact O-SG 2.86Å; I99-C102 PolarHBondContact O-N 2.82Å; I99-C102 VanDerWaalsContact O-N 3.17Å; C102-P104 WeakPolarHBondContact O-CD 3.39Å
103	V	55.5	Low	62.1	Low	48 Å²	48	64.8 Å²	64.8	29%	0.291	35%	0.353	S	S	.	.			trans	-104.9	82.6	177.8	-171.4	0	0	0	0	109.8	I99 S105 L106	I99-V103 HydrophobicContact CG2-CG2 3.94Å; I99-V103 WeakPolarHBondContact O-CG2 3.46Å; I99-V103 PolarHBondContact O-N 2.89Å; V103-S105 PolarHBondContact O-N 3.42Å; V103-S105 VanDerWaalsContact O-N 3.08Å; V103-L106 HydrophobicContact CB-CD1 3.89Å; V103-L106 HydrophobicContact CG1-CB 4.39Å; V103-L106 HydrophobicContact CG1-CD1 3.58Å; V103-L106 HydrophobicContact CG1-CG 3.98Å; V103-L106 PolarHBondContact O-N 3.45Å; V103-L106 VanDerWaalsContact O-N 3.12Å
104	P	55.2	Low	63.7	Low	70 Å²	70	58.6 Å²	58.6	46%	0.455	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-62.3	-15.3	175.7	26.7	-35.1	0	0	0	112.5	C102 L106 Q107 R125	C102-P104 WeakPolarHBondContact O-CD 3.39Å; P104-L106 PolarHBondContact O-N 3.13Å; P104-Q107 PolarHBondContact O-N 3.42Å; P104-R125 PolarHBondContact O-NH1 2.88Å
105	S	56.5	Low	65.4	Low	82 Å²	82	53.5 Å²	53.5	57%	0.573	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-66.1	-22.9	174.7	-49.6	0	0	0	0	113.7	V103 R125	V103-S105 PolarHBondContact O-N 3.42Å; V103-S105 VanDerWaalsContact O-N 3.08Å; S105-R125 VanDerWaalsContact O-CD 3.25Å; S105-R125 WeakPolarHBondContact O-CD 3.25Å
106	L	53.2	Low	67.1	Low	58 Å²	58	53 Å²	53	30%	0.304	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-94.9	-4.9	176.9	-73.5	154.3	0	0	0	112.5	L79 V103 P104 M126	L79-L106 HydrophobicContact CD1-CB 4.3Å; L79-L106 HydrophobicContact CD1-CD2 3.98Å; L79-L106 WeakPolarHBondContact CD1-O 3.46Å; V103-L106 HydrophobicContact CB-CD1 3.89Å; V103-L106 HydrophobicContact CG1-CB 4.39Å; V103-L106 HydrophobicContact CG1-CD1 3.58Å; V103-L106 HydrophobicContact CG1-CG 3.98Å; V103-L106 PolarHBondContact O-N 3.45Å; V103-L106 VanDerWaalsContact O-N 3.12Å; P104-L106 PolarHBondContact O-N 3.13Å; L106-M126 HydrophobicContact CD2-CE 3.73Å
107	Q	62.9	Low	68.8	Low	15 Å²	15	59 Å²	59	7%	0.07	32%	0.324	C	S	.	.	S	Bend	trans	-93.5	146.7	-178.6	-67.6	177.7	42.6	0	0	110	P74 V75 P100 F101 P104 R125	P74-Q107 HydrophobicContact CB-CB 4.38Å; V75-Q107 WeakPolarHBondContact O-CB 3.39Å; P100-Q107 PolarHBondContact O-NE2 2.95Å; F101-Q107 PolarHBondContact O-NE2 3.42Å; P104-Q107 PolarHBondContact O-N 3.42Å; Q107-R125 PolarHBondContact O-NH1 3.45Å; Q107-R125 VanDerWaalsContact O-NH1 3.09Å
108	D	68.5	Low	70.5	Confident	33 Å²	33	58.6 Å²	58.6	18%	0.176	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	151.6	172.8	-63	-49.3	0	0	0	108.9	P74 V75 G77 R124	P74-D108 WeakPolarHBondContact CA-O 3.25Å; V75-D108 PolarHBondContact N-O 3.38Å; V75-D108 PolarHBondContact O-N 3.05Å; G77-D108 WeakPolarHBondContact CA-OD2 3.49Å; D108-R124 VanDerWaalsContact OD1-CA 3.26Å; D108-R124 WeakPolarHBondContact OD1-CA 3.46Å
109	I	77.4	Confident	72	Confident	12 Å²	12	57 Å²	57	6%	0.062	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	127.5	-177.3	-67.6	177.9	0	0	0	109.8	A54 V72 T122 Y123 R125	A54-I109 VanDerWaalsContact O-CD1 3.25Å; A54-I109 WeakPolarHBondContact O-CD1 3.39Å; V72-I109 HydrophobicContact CB-CG2 3.61Å; V72-I109 HydrophobicContact CG1-CG2 3.6Å; I109-T122 CarbonylContact O-C 3.55Å; I109-T122 WeakPolarHBondContact O-CA 3.39Å; I109-Y123 PolarHBondContact N-O 2.93Å; I109-Y123 PolarHBondContact O-N 3.27Å; I109-R125 VanDerWaalsContact CD1-CZ 3.43Å; I109-R125 VanDerWaalsContact CD1-NH1 3.33Å
110	E	84.2	Confident	73.3	Confident	58 Å²	58	55.4 Å²	55.4	27%	0.271	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	131.6	171.8	-65	-166.4	166.6	0	0	110.8	V72 K73 V75 H112 L119 T122	V72-E110 CarbonylContact C-O 3.58Å; V72-E110 WeakPolarHBondContact CA-O 3.45Å; K73-E110 PolarHBondContact N-O 2.84Å; K73-E110 PolarHBondContact O-N 2.82Å; V75-E110 HydrophobicContact CB-CG 4.37Å; V75-E110 HydrophobicContact CG2-CB 4.22Å; V75-E110 HydrophobicContact CG2-CG 3.53Å; E110-H112 WeakPolarHBondContact CB-NE2 3.42Å; E110-H112 IonicContact OE2-CE1 3.58Å; E110-H112 IonicContact OE2-NE2 2.95Å; E110-H112 PolarHBondContact OE2-NE2 2.98Å; E110-L119 HydrophobicContact CB-CD1 3.71Å; E110-L119 HydrophobicContact CG-CD1 4.08Å; E110-T122 HydrophobicContact CB-CG2 4.43Å; E110-T122 HydrophobicContact CG-CG2 3.75Å
111	H	83.7	Confident	74.7	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	116.2	176.4	-67.5	-97.3	0	0	0	110.2	F52 G53 D55 T70 E71 V72 L120 G121	F52-H111 HydrophobicContact CD1-CB 4.15Å; F52-H111 AromaticContact CD1-CD2 3.89Å; F52-H111 AromaticContact CD1-CG 3.75Å; F52-H111 AromaticContact CD1-ND1 3.97Å; F52-H111 HydrophobicContact CE1-CB 4.29Å; G53-H111 PolarHBondContact O-NE2 3.01Å; G53-H111 VanDerWaalsContact O-NE2 3.17Å; D55-H111 PolarHBondContact O-CE1 3.21Å; T70-H111 HydrophobicContact CG2-CB 4.07Å; T70-H111 PolarHBondContact OG1-ND1 3.04Å; E71-H111 WeakPolarHBondContact O-CA 3.44Å; V72-H111 WeakPolarHBondContact CG1-CE1 3.1Å; H111-L120 PolarHBondContact O-N 2.9Å; H111-G121 PolarHBondContact N-O 2.77Å
112	H	85.8	Confident	75.8	Confident	27 Å²	27	53.1 Å²	53.1	13%	0.125	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	144.8	179.7	-68.6	-94	0	0	0	110.9	T70 E71 E110 T118	T70-H112 CarbonylContact C-O 3.59Å; T70-H112 WeakPolarHBondContact CA-O 3.5Å; E71-H112 PolarHBondContact N-O 3.49Å; E71-H112 PolarHBondContact O-N 3.21Å; E110-H112 WeakPolarHBondContact CB-NE2 3.42Å; E110-H112 IonicContact OE2-CE1 3.58Å; E110-H112 IonicContact OE2-NE2 2.95Å; E110-H112 PolarHBondContact OE2-NE2 2.98Å; H112-T118 CarbonylContact C-O 3.58Å; H112-T118 WeakPolarHBondContact CA-O 3.4Å
113	C	89	Confident	77	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.291	C	S	.	.			trans	-74.7	127	173	-179	0	0	0	0	109.7	C64 N115 C116 K117 T118 L120	C64-C113 VanDerWaalsContact SG-SG 3.62Å; C113-N115 PolarHBondContact O-N 2.8Å; C113-N115 PolarHBondContact SG-N 3.38Å; C113-C116 WeakPolarHBondContact CB-SG 3.4Å; C113-C116 PolarHBondContact SG-SG 3.31Å; C113-K117 WeakPolarHBondContact O-CA 3.04Å; C113-K117 PolarHBondContact O-N 3.45Å; C113-T118 HydrophobicContact CB-CG2 3.97Å; C113-T118 PolarHBondContact N-O 3.23Å; C113-L120 HydrophobicContact CB-CD1 3.69Å
114	P	89.9	Confident	77.5	Confident	54 Å²	54	59 Å²	59	35%	0.351	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-26.5	177.3	25.5	-34.7	0	0	0	113.2	V68 L69 E71	V68-P114 HydrophobicContact CB-CG 3.99Å; V68-P114 HydrophobicContact CG1-CG 4.35Å; L69-P114 VanDerWaalsContact O-CD 3.31Å; L69-P114 WeakPolarHBondContact O-CD 3.37Å; L69-P114 WeakPolarHBondContact O-CG 3.47Å; E71-P114 HydrophobicContact CG-CB 4.21Å
115	N	89.8	Confident	77.9	Confident	109 Å²	109	59.5 Å²	59.5	58%	0.583	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-53.2	-177.3	-165.6	-5.1	0	0	0	112	C113	C113-N115 PolarHBondContact O-N 2.8Å; C113-N115 PolarHBondContact SG-N 3.38Å
116	C	90.2	Very high	77.6	Confident	42 Å²	42	63.8 Å²	63.8	28%	0.284	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-4.3	-176.8	63.7	0	0	0	0	115.1	C113 T118	C113-C116 WeakPolarHBondContact CB-SG 3.4Å; C113-C116 PolarHBondContact SG-SG 3.31Å; C116-T118 PolarHBondContact O-N 3.47Å; C116-T118 WeakPolarHBondContact SG-CG2 3.35Å
117	K	87.7	Confident	78.8	Confident	163 Å²	163	64.1 Å²	64.1	71%	0.709	32%	0.315	S	S	*	.			trans	55.7	19.2	-177.3	-57.8	176.4	-178.4	174.2	0	114.5	C113	C113-K117 WeakPolarHBondContact O-CA 3.04Å; C113-K117 PolarHBondContact O-N 3.45Å
118	T	85.2	Confident	79.7	Confident	49 Å²	49	66.7 Å²	66.7	30%	0.301	33%	0.328	S	S	.	.			trans	-71.9	146.9	173.1	-158.1	0	0	0	0	109.8	N63 H112 C113 C116 L120	N63-T118 HydrophobicContact CB-CG2 4.31Å; H112-T118 CarbonylContact C-O 3.58Å; H112-T118 WeakPolarHBondContact CA-O 3.4Å; C113-T118 HydrophobicContact CB-CG2 3.97Å; C113-T118 PolarHBondContact N-O 3.23Å; C116-T118 PolarHBondContact O-N 3.47Å; C116-T118 WeakPolarHBondContact SG-CG2 3.35Å; T118-L120 HydrophobicContact CG2-CD1 4.25Å; T118-L120 WeakPolarHBondContact O-CD1 3.31Å
119	L	84.7	Confident	80.3	Confident	82 Å²	82	68.6 Å²	68.6	43%	0.429	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	115.9	173.3	-177.2	79.9	0	0	0	108.6	E110 T122	E110-L119 HydrophobicContact CB-CD1 3.71Å; E110-L119 HydrophobicContact CG-CD1 4.08Å; L119-T122 HydrophobicContact CD1-CG2 4.06Å; L119-T122 HydrophobicContact CD2-CG2 3.97Å; L119-T122 HydrophobicContact CG-CG2 4.4Å
120	L	83.8	Confident	80.5	Confident	44 Å²	44	71.9 Å²	71.9	23%	0.23	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-32.6	177.3	-67	85.6	0	0	0	112	F52 V59 C61 T70 H111 C113 T118	F52-L120 HydrophobicContact CE1-CB 4.2Å; F52-L120 HydrophobicContact CZ-CB 3.98Å; V59-L120 HydrophobicContact CB-CD2 4.44Å; V59-L120 HydrophobicContact CG2-CD2 3.31Å; C61-L120 HydrophobicContact CB-CD2 4.34Å; T70-L120 HydrophobicContact CG2-CD1 4.35Å; T70-L120 HydrophobicContact CG2-CD2 4.08Å; H111-L120 PolarHBondContact O-N 2.9Å; C113-L120 HydrophobicContact CB-CD1 3.69Å; T118-L120 HydrophobicContact CG2-CD1 4.25Å; T118-L120 WeakPolarHBondContact O-CD1 3.31Å
121	G	81	Confident	80.3	Confident	15 Å²	15	72.8 Å²	72.8	16%	0.155	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.7	160.9	-176.5	0	0	0	0	0	112.3	H111	H111-G121 PolarHBondContact N-O 2.77Å
122	T	76.4	Confident	80	Confident	66 Å²	66	77.6 Å²	77.6	41%	0.405	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	129.8	174.3	61.4	0	0	0	0	108.8	I109 E110 L119	I109-T122 CarbonylContact O-C 3.55Å; I109-T122 WeakPolarHBondContact O-CA 3.39Å; E110-T122 HydrophobicContact CB-CG2 4.43Å; E110-T122 HydrophobicContact CG-CG2 3.75Å; L119-T122 HydrophobicContact CD1-CG2 4.06Å; L119-T122 HydrophobicContact CD2-CG2 3.97Å; L119-T122 HydrophobicContact CG-CG2 4.4Å
123	Y	76.9	Confident	79.6	Confident	87 Å²	87	81.2 Å²	81.2	34%	0.341	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	109.1	174	-179.2	-114.5	0	0	0	108.6	F52 G53 I109 R125	F52-Y123 WeakPolarHBondContact O-CD2 3.37Å; G53-Y123 VanDerWaalsContact C-CD1 3.49Å; G53-Y123 WeakPolarHBondContact O-CD1 3.23Å; I109-Y123 PolarHBondContact N-O 2.93Å; I109-Y123 PolarHBondContact O-N 3.27Å; Y123-R125 HydrophobicContact CD1-CG 3.9Å; Y123-R125 HydrophobicContact CE1-CG 3.43Å; Y123-R125 VanDerWaalsContact CE1-CG 3.43Å
124	R	66.3	Low	78.9	Confident	172 Å²	172	87.5 Å²	87.5	65%	0.649	43%	0.43	S	S	*	.			trans	-92.1	125.4	173.3	-63.8	-172.4	-177.1	165.5	1.3	109.3	D108	D108-R124 VanDerWaalsContact OD1-CA 3.26Å; D108-R124 WeakPolarHBondContact OD1-CA 3.46Å
125	R	62.3	Low	78	Confident	81 Å²	81	90.3 Å²	90.3	31%	0.306	44%	0.437	S	S	.	.			trans	-84.5	-12.5	-179.6	-76.5	-176.6	-179.4	125.3	-11.1	113.3	P104 S105 Q107 I109 Y123	P104-R125 PolarHBondContact O-NH1 2.88Å; S105-R125 VanDerWaalsContact O-CD 3.25Å; S105-R125 WeakPolarHBondContact O-CD 3.25Å; Q107-R125 PolarHBondContact O-NH1 3.45Å; Q107-R125 VanDerWaalsContact O-NH1 3.09Å; I109-R125 VanDerWaalsContact CD1-CZ 3.43Å; I109-R125 VanDerWaalsContact CD1-NH1 3.33Å; Y123-R125 HydrophobicContact CD1-CG 3.9Å; Y123-R125 HydrophobicContact CE1-CG 3.43Å; Y123-R125 VanDerWaalsContact CE1-CG 3.43Å
126	M	51.4	Low	76.9	Confident	173 Å²	173	88.5 Å²	88.5	85%	0.852	42%	0.424	S	S	*	.			trans	-140.3	0	176.8	-63.9	-167.8	-169.9	0	0	111.5	L79 L106	L79-M126 HydrophobicContact CD1-CE 4.17Å; L79-M126 HydrophobicContact CD1-CG 4.37Å; L79-M126 HydrophobicContact CD1-SD 3.6Å; L79-M126 VanDerWaalsContact CD1-SD 3.6Å; L79-M126 HydrophobicContact CD2-SD 4.38Å; L106-M126 HydrophobicContact CD2-CE 3.73Å

Retrieved 126 of 126 residues in 19.5 ms (Link to these results)

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