A0A077YY12_TRITR Loading...

Large ribosomal subunit protein eL30

AlphaFold DB , UniProt , Accession A0A077YY12, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 115 aa.

						>A0A077YY12_TRITR|A0A077YY12
MAPRKQKKAAEGINSRLALVIKSGKYVLGYRQTLKTLRSGKAKLVILANNTPPLRRSEIEYYAMLAKTGVHHYNGNNIELGTACGKYFRVCMMSITDQGDSDIIRTVPSIGGEQS
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	40.7	Very low	53.5	Low	246 Å²	246	135.2 Å²	135.2	100%	1.212	68%	0.676	S	S	*	*				0	130.9	0	-99.1	172.3	167.2	0	0	109.2	P3	M1-P3 WeakPolarHBondContact O-CD 3.43Å
2	A	53.1	Low	56.2	Low	84 Å²	84	125.5 Å²	125.5	69%	0.694	64%	0.636	S	S	*	*			trans	-75.3	122.3	-155.9	0	0	0	0	0	115.7	R4	A2-R4 PolarHBondContact O-N 2.99Å
3	P	53.2	Low	58.9	Low	89 Å²	89	116.2 Å²	116.2	58%	0.578	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-0.8	170.7	29.8	-32.9	0	0	0	113.8	M1 K5	M1-P3 WeakPolarHBondContact O-CD 3.43Å; P3-K5 VanDerWaalsContact C-N 3.33Å; P3-K5 PolarHBondContact O-N 3.2Å
4	R	53	Low	61.3	Low	209 Å²	209	112 Å²	112	79%	0.789	57%	0.569	S	S	*	*	H	α-helix	trans	-65.1	-29.6	-175.7	-80.1	-176.2	173	179.2	-1.8	114	A2	A2-R4 PolarHBondContact O-N 2.99Å
5	K	51.2	Low	63.3	Low	186 Å²	186	109.3 Å²	109.3	81%	0.809	56%	0.564	S	S	*	*	H	α-helix	trans	-74.8	-36.1	-176.4	-158.8	174	-177.7	-179.1	0	112.4	P3 A9	P3-K5 VanDerWaalsContact C-N 3.33Å; P3-K5 PolarHBondContact O-N 3.2Å; K5-A9 PolarHBondContact O-N 2.76Å
6	Q	51.5	Low	65.2	Low	139 Å²	139	106.2 Å²	106.2	65%	0.65	54%	0.543	S	S	*	.	H	α-helix	trans	-72.2	-40.4	179.6	-80.9	175.1	-23.7	0	0	112.9	A9 A10	Q6-A9 PolarHBondContact O-N 2.9Å; Q6-A10 PolarHBondContact O-N 2.87Å
7	K	50.7	Low	67	Low	145 Å²	145	99.9 Å²	99.9	63%	0.63	51%	0.511	S	S	*	.	H	α-helix	trans	-62.4	-43.9	178.1	-72.2	-168.8	177.2	-172.6	0	112.4	A9 A10 E11	K7-A9 VanDerWaalsContact C-N 3.29Å; K7-A9 PolarHBondContact O-N 3.29Å; K7-A10 PolarHBondContact O-N 3.11Å; K7-E11 PolarHBondContact O-N 3.1Å
8	K	54.7	Low	68.5	Low	165 Å²	165	97.5 Å²	97.5	72%	0.717	51%	0.509	S	S	*	.	H	α-helix	trans	-59.5	-38.3	175.5	-75.1	-169	175.1	-170.7	0	112.7	G12	K8-G12 PolarHBondContact O-N 3.46Å; K8-G12 VanDerWaalsContact O-N 3.14Å
9	A	59	Low	70	Confident	64 Å²	64	96.3 Å²	96.3	53%	0.529	50%	0.502	S	S	.	.	H	α-helix	trans	-69	-40.5	177	0	0	0	0	0	112.2	K5 Q6 K7 G12 I13	K5-A9 PolarHBondContact O-N 2.76Å; Q6-A9 PolarHBondContact O-N 2.9Å; K7-A9 VanDerWaalsContact C-N 3.29Å; K7-A9 PolarHBondContact O-N 3.29Å; A9-G12 PolarHBondContact O-N 2.85Å; A9-I13 PolarHBondContact O-N 2.83Å
10	A	58.3	Low	71.3	Confident	24 Å²	24	91.5 Å²	91.5	20%	0.198	48%	0.477	C	S	.	.	H	α-helix	trans	-69.3	-41.8	178.7	0	0	0	0	0	113	Q6 K7 G12 I13 N14 N74	Q6-A10 PolarHBondContact O-N 2.87Å; K7-A10 PolarHBondContact O-N 3.11Å; A10-G12 PolarHBondContact O-N 3.41Å; A10-I13 VanDerWaalsContact O-CG2 3.23Å; A10-I13 WeakPolarHBondContact O-CG2 3.25Å; A10-I13 PolarHBondContact O-N 3.29Å; A10-N14 PolarHBondContact O-N 3.38Å; A10-N74 HydrophobicContact CB-CB 4.47Å
11	E	63.3	Low	72.5	Confident	136 Å²	136	89.5 Å²	89.5	64%	0.636	47%	0.467	S	S	*	.	H	α-helix	trans	-61	-34.3	171.2	-73.8	170.9	-174.4	0	0	110.9	K7 S15	K7-E11 PolarHBondContact O-N 3.1Å; E11-S15 PolarHBondContact O-N 3.15Å; E11-S15 PolarHBondContact O-OG 3.34Å
12	G	86	Confident	75.2	Confident	19 Å²	19	86.6 Å²	86.6	20%	0.196	45%	0.447	C	S	.	.	H	α-helix	trans	-66.1	-41	174	0	0	0	0	0	114.4	K8 A9 A10 S15 R16	K8-G12 PolarHBondContact O-N 3.46Å; K8-G12 VanDerWaalsContact O-N 3.14Å; A9-G12 PolarHBondContact O-N 2.85Å; A10-G12 PolarHBondContact O-N 3.41Å; G12-S15 PolarHBondContact O-OG 2.92Å; G12-R16 WeakPolarHBondContact O-CB 3.35Å; G12-R16 WeakPolarHBondContact O-CD 3.18Å; G12-R16 WeakPolarHBondContact O-CG 3.35Å; G12-R16 PolarHBondContact O-N 3.2Å
13	I	90.4	Very high	77.3	Confident	4 Å²	4	85 Å²	85	2%	0.021	43%	0.431	C	S	.	.	H	α-helix	trans	-69.5	-34.6	-180	-167.1	67.4	0	0	0	111.9	A9 A10 R16 L17 Y73 I103	A9-I13 PolarHBondContact O-N 2.83Å; A10-I13 VanDerWaalsContact O-CG2 3.23Å; A10-I13 WeakPolarHBondContact O-CG2 3.25Å; A10-I13 PolarHBondContact O-N 3.29Å; I13-R16 PolarHBondContact O-N 3.41Å; I13-L17 HydrophobicContact CG1-CD1 4.36Å; I13-L17 HydrophobicContact CG1-CG 4.48Å; I13-L17 WeakPolarHBondContact O-CB 3.45Å; I13-L17 WeakPolarHBondContact O-CG 3.48Å; I13-L17 PolarHBondContact O-N 3.48Å; I13-Y73 HydrophobicContact CG2-CD2 4.01Å; I13-Y73 HydrophobicContact CG2-CE2 3.88Å; I13-I103 HydrophobicContact CD1-CD1 3.6Å; I13-I103 HydrophobicContact CD1-CG1 3.63Å
14	N	92.6	Very high	79.4	Confident	58 Å²	58	81.5 Å²	81.5	31%	0.31	41%	0.411	S	S	.	.	H	α-helix	trans	-69.5	-40.9	-179.8	-76.8	-17	0	0	0	112.8	A10 L17 A18 Y73 A83	A10-N14 PolarHBondContact O-N 3.38Å; N14-L17 PolarHBondContact O-N 3.3Å; N14-A18 PolarHBondContact O-N 3.09Å; N14-Y73 PolarHBondContact ND2-OH 2.93Å; N14-Y73 WeakPolarHBondContact OD1-CE2 3.19Å; N14-Y73 PolarHBondContact OD1-OH 3.4Å; N14-A83 WeakPolarHBondContact OD1-CB 3.12Å
15	S	92.6	Very high	81.5	Confident	71 Å²	71	78 Å²	78	50%	0.497	40%	0.401	S	S	.	.	H	α-helix	trans	-65.3	-40.7	174.6	60.1	0	0	0	0	111.7	E11 G12 A18 L19	E11-S15 PolarHBondContact O-N 3.15Å; E11-S15 PolarHBondContact O-OG 3.34Å; G12-S15 PolarHBondContact O-OG 2.92Å; S15-A18 PolarHBondContact O-N 3.35Å; S15-L19 PolarHBondContact O-N 3.25Å
16	R	93.7	Very high	83.8	Confident	60 Å²	60	71.9 Å²	71.9	23%	0.226	37%	0.374	C	S	.	.	H	α-helix	trans	-62.3	-42	173.3	-74.4	172.2	171	157.9	3.6	112.8	G12 I13 L19 V20 S101 D102 I103 T106	G12-R16 WeakPolarHBondContact O-CB 3.35Å; G12-R16 WeakPolarHBondContact O-CD 3.18Å; G12-R16 WeakPolarHBondContact O-CG 3.35Å; G12-R16 PolarHBondContact O-N 3.2Å; I13-R16 PolarHBondContact O-N 3.41Å; R16-L19 PolarHBondContact O-N 3.27Å; R16-V20 WeakPolarHBondContact O-CG2 3.44Å; R16-V20 PolarHBondContact O-N 3.02Å; R16-S101 PolarHBondContact O-OG 2.92Å; R16-D102 WeakPolarHBondContact CD-OD1 3.42Å; R16-D102 VanDerWaalsContact CG-OD1 3.25Å; R16-D102 WeakPolarHBondContact CG-OD1 3.45Å; R16-D102 IonicContact CZ-OD1 3.49Å; R16-D102 IonicContact CZ-OD2 3.8Å; R16-D102 IonicContact NE-OD1 3.29Å; R16-D102 PolarHBondContact NE-OD1 3.25Å; R16-D102 IonicContact NE-OD2 2.85Å; R16-D102 PolarHBondContact NE-OD2 3.24Å; R16-D102 IonicContact NH2-OD1 2.9Å; R16-D102 IonicContact NH2-OD2 3.93Å; R16-D102 PolarHBondContact NH2-OD2 3.03Å; R16-I103 HydrophobicContact CB-CB 4.01Å; R16-I103 HydrophobicContact CB-CD1 3.91Å; R16-I103 HydrophobicContact CB-CG1 3.94Å; R16-T106 PolarHBondContact NH1-OG1 2.87Å
17	L	94.6	Very high	86	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-61.7	-46.9	174.7	-85.5	173.6	0	0	0	110.7	I13 N14 L19 V20 I21 I46 L80 A83 M93 I95 I103	I13-L17 HydrophobicContact CG1-CD1 4.36Å; I13-L17 HydrophobicContact CG1-CG 4.48Å; I13-L17 WeakPolarHBondContact O-CB 3.45Å; I13-L17 WeakPolarHBondContact O-CG 3.48Å; I13-L17 PolarHBondContact O-N 3.48Å; N14-L17 PolarHBondContact O-N 3.3Å; L17-L19 PolarHBondContact O-N 3.41Å; L17-V20 CarbonylContact O-C 3.58Å; L17-V20 WeakPolarHBondContact O-CA 3.42Å; L17-V20 WeakPolarHBondContact O-CB 3.47Å; L17-V20 PolarHBondContact O-N 3.4Å; L17-I21 WeakPolarHBondContact O-CG1 3.22Å; L17-I21 PolarHBondContact O-N 3Å; L17-I46 HydrophobicContact CD1-CD1 4.31Å; L17-I46 HydrophobicContact CD2-CD1 3.54Å; L17-I46 HydrophobicContact CG-CD1 4.16Å; L17-L80 HydrophobicContact CD1-CD1 4.18Å; L17-A83 HydrophobicContact CD1-CB 4.31Å; L17-M93 HydrophobicContact CD2-CE 4.04Å; L17-M93 HydrophobicContact CD2-SD 3.69Å; L17-I95 HydrophobicContact CD2-CD1 4.35Å; L17-I103 HydrophobicContact CD2-CD1 3.88Å; L17-I103 HydrophobicContact CG-CD1 3.91Å
18	A	95.1	Very high	88.3	Confident	56 Å²	56	61.9 Å²	61.9	46%	0.463	33%	0.333	S	S	.	.	H	α-helix	trans	-55	-38.8	178.6	0	0	0	0	0	112.6	N14 S15 I21 K22	N14-A18 PolarHBondContact O-N 3.09Å; S15-A18 PolarHBondContact O-N 3.35Å; A18-I21 PolarHBondContact O-N 2.96Å; A18-K22 PolarHBondContact O-N 3.14Å; A18-K22 VanDerWaalsContact O-N 3.1Å
19	L	95.5	Very high	90.3	Very high	75 Å²	75	55.3 Å²	55.3	39%	0.393	31%	0.312	S	S	.	.	H	α-helix	trans	-65	-41.3	173.9	-69.6	175.5	0	0	0	112.9	S15 R16 L17 I21 K22 S23	S15-L19 PolarHBondContact O-N 3.25Å; R16-L19 PolarHBondContact O-N 3.27Å; L17-L19 PolarHBondContact O-N 3.41Å; L19-I21 VanDerWaalsContact C-N 3.33Å; L19-K22 PolarHBondContact O-N 3.23Å; L19-S23 PolarHBondContact O-N 3.34Å; L19-S23 PolarHBondContact O-OG 3.32Å
20	V	97.2	Very high	92.2	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64	-39.6	174.5	177.1	0	0	0	0	111	R16 L17 K22 G24 Y26 I95 S101 I103	R16-V20 WeakPolarHBondContact O-CG2 3.44Å; R16-V20 PolarHBondContact O-N 3.02Å; L17-V20 CarbonylContact O-C 3.58Å; L17-V20 WeakPolarHBondContact O-CA 3.42Å; L17-V20 WeakPolarHBondContact O-CB 3.47Å; L17-V20 PolarHBondContact O-N 3.4Å; V20-K22 PolarHBondContact O-N 3.21Å; V20-G24 CarbonylContact O-C 3.59Å; V20-G24 WeakPolarHBondContact O-CA 3.48Å; V20-G24 PolarHBondContact O-N 3.24Å; V20-Y26 HydrophobicContact CG1-CD1 4.35Å; V20-I95 HydrophobicContact CG1-CD1 4.24Å; V20-I95 HydrophobicContact CG1-CG1 4.29Å; V20-I95 HydrophobicContact CG1-CG2 3.99Å; V20-I95 HydrophobicContact CG2-CD1 4.18Å; V20-S101 VanDerWaalsContact CG2-CB 3.47Å; V20-I103 HydrophobicContact CG2-CB 4.49Å; V20-I103 HydrophobicContact CG2-CD1 4.42Å; V20-I103 HydrophobicContact CG2-CG2 3.83Å
21	I	97	Very high	94	Very high	49 Å²	49	64.2 Å²	64.2	25%	0.251	33%	0.327	S	S	.	.	H	α-helix	trans	-63.7	-34.8	177.3	-59.5	-54.1	0	0	0	111	L17 A18 L19 Y26 C84	L17-I21 WeakPolarHBondContact O-CG1 3.22Å; L17-I21 PolarHBondContact O-N 3Å; A18-I21 PolarHBondContact O-N 2.96Å; L19-I21 VanDerWaalsContact C-N 3.33Å; I21-Y26 HydrophobicContact CB-CE1 4.49Å; I21-Y26 HydrophobicContact CD1-CD1 3.85Å; I21-Y26 HydrophobicContact CD1-CD2 4.26Å; I21-Y26 HydrophobicContact CD1-CE1 3.4Å; I21-Y26 VanDerWaalsContact CD1-CE1 3.4Å; I21-Y26 HydrophobicContact CD1-CE2 3.83Å; I21-Y26 HydrophobicContact CD1-CG 4.27Å; I21-Y26 HydrophobicContact CG1-CE1 4.49Å; I21-Y26 HydrophobicContact CG2-CE1 4.49Å; I21-C84 HydrophobicContact CD1-CB 4.12Å
22	K	96.7	Very high	95.7	Very high	186 Å²	186	62.1 Å²	62.1	81%	0.809	32%	0.317	S	S	*	.	H	α-helix	trans	-79.2	-41.5	-178.8	-171.8	-179.5	178.6	-174.8	0	113.8	A18 L19 V20	A18-K22 PolarHBondContact O-N 3.14Å; A18-K22 VanDerWaalsContact O-N 3.1Å; L19-K22 PolarHBondContact O-N 3.23Å; V20-K22 PolarHBondContact O-N 3.21Å
23	S	97.2	Very high	96.3	Very high	49 Å²	49	61.2 Å²	61.2	34%	0.343	31%	0.308	S	S	.	.	H	α-helix	trans	-124.3	-19.5	-167.6	64.1	0	0	0	0	114.5	L19 D100	L19-S23 PolarHBondContact O-N 3.34Å; L19-S23 PolarHBondContact O-OG 3.32Å; S23-D100 PolarHBondContact OG-N 2.82Å
24	G	97.3	Very high	96.7	Very high	16 Å²	16	61.9 Å²	61.9	17%	0.165	31%	0.311	C	S	.	.	S	Bend	trans	-96.6	-170.5	-172.8	0	0	0	0	0	113.8	V20 D97	V20-G24 CarbonylContact O-C 3.59Å; V20-G24 WeakPolarHBondContact O-CA 3.48Å; V20-G24 PolarHBondContact O-N 3.24Å; G24-D97 WeakPolarHBondContact CA-O 3.4Å
25	K	98.2	Very high	96.9	Very high	135 Å²	135	65.1 Å²	65.1	59%	0.587	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.6	132.9	176.6	-61.8	174.4	-178.6	165.1	0	109.4	T96 D97	K25-T96 WeakPolarHBondContact CB-OG1 3.3Å; K25-T96 PolarHBondContact O-N 3.18Å; K25-T96 PolarHBondContact O-OG1 3.42Å; K25-D97 HydrophobicContact CB-CB 3.68Å; K25-D97 HydrophobicContact CD-CB 4.18Å; K25-D97 HydrophobicContact CG-CB 3.99Å; K25-D97 PolarHBondContact N-O 2.87Å; K25-D97 PolarHBondContact O-N 2.86Å
26	Y	98.1	Very high	97.2	Very high	59 Å²	59	62.3 Å²	62.3	23%	0.231	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	159.9	-177.7	64	-83.7	0	0	0	110.6	V20 I21 L28 K86 M93 S94	V20-Y26 HydrophobicContact CG1-CD1 4.35Å; I21-Y26 HydrophobicContact CB-CE1 4.49Å; I21-Y26 HydrophobicContact CD1-CD1 3.85Å; I21-Y26 HydrophobicContact CD1-CD2 4.26Å; I21-Y26 HydrophobicContact CD1-CE1 3.4Å; I21-Y26 VanDerWaalsContact CD1-CE1 3.4Å; I21-Y26 HydrophobicContact CD1-CE2 3.83Å; I21-Y26 HydrophobicContact CD1-CG 4.27Å; I21-Y26 HydrophobicContact CG1-CE1 4.49Å; I21-Y26 HydrophobicContact CG2-CE1 4.49Å; Y26-L28 HydrophobicContact CD2-CD2 3.7Å; Y26-L28 HydrophobicContact CD2-CG 3.95Å; Y26-L28 HydrophobicContact CE2-CD1 4.07Å; Y26-L28 HydrophobicContact CE2-CD2 3.86Å; Y26-L28 HydrophobicContact CE2-CG 3.87Å; Y26-K86 WeakPolarHBondContact OH-CE 3.43Å; Y26-K86 PolarHBondContact OH-NZ 2.75Å; Y26-M93 HydrophobicContact CD2-CE 3.81Å; Y26-M93 HydrophobicContact CG-CE 3.9Å; Y26-S94 CarbonylContact C-O 3.57Å; Y26-S94 WeakPolarHBondContact CA-O 3.27Å; Y26-S94 WeakPolarHBondContact CB-O 3.31Å
27	V	98.3	Very high	97.4	Very high	35 Å²	35	59.7 Å²	59.7	21%	0.212	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	147.4	169.6	-60.5	0	0	0	0	109.8	Q32 T36 M93 S94	V27-Q32 HydrophobicContact CB-CB 3.81Å; V27-Q32 HydrophobicContact CG2-CB 3.89Å; V27-T36 HydrophobicContact CG1-CG2 4.15Å; V27-T36 HydrophobicContact CG2-CG2 3.61Å; V27-M93 CarbonylContact O-C 3.58Å; V27-M93 VanDerWaalsContact O-CA 3.27Å; V27-M93 WeakPolarHBondContact O-CA 3.49Å; V27-M93 WeakPolarHBondContact O-CB 3.4Å; V27-S94 PolarHBondContact N-O 3.12Å; V27-S94 PolarHBondContact O-N 3.3Å
28	L	98	Very high	97.6	Very high	39 Å²	39	67.9 Å²	67.9	20%	0.204	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	145.4	-177.8	-58.1	179.1	0	0	0	110.9	Y26 K86 F88 V90 M93	Y26-L28 HydrophobicContact CD2-CD2 3.7Å; Y26-L28 HydrophobicContact CD2-CG 3.95Å; Y26-L28 HydrophobicContact CE2-CD1 4.07Å; Y26-L28 HydrophobicContact CE2-CD2 3.86Å; Y26-L28 HydrophobicContact CE2-CG 3.87Å; L28-K86 HydrophobicContact CD1-CD 4.15Å; L28-K86 HydrophobicContact CD1-CG 3.8Å; L28-F88 HydrophobicContact CD1-CE2 3.94Å; L28-F88 HydrophobicContact CD1-CZ 3.81Å; L28-V90 HydrophobicContact CD1-CG2 4.08Å; L28-V90 HydrophobicContact CD2-CG1 3.95Å; L28-V90 HydrophobicContact CD2-CG2 4.35Å; L28-M93 HydrophobicContact CD2-CB 3.62Å; L28-M93 HydrophobicContact CD2-CE 4.16Å
29	G	97.4	Very high	97.6	Very high	27 Å²	27	68.2 Å²	68.2	28%	0.278	32%	0.323	S	S	.	.	S	Bend	trans	84.5	165	173.2	0	0	0	0	0	114.3	T33 M92	G29-T33 VanDerWaalsContact O-CB 3.29Å; G29-T33 WeakPolarHBondContact O-CB 3.31Å; G29-T33 PolarHBondContact O-N 3.23Å; G29-T33 PolarHBondContact O-OG1 3.05Å; G29-M92 PolarHBondContact N-O 3.07Å
30	Y	97.9	Very high	97.6	Very high	62 Å²	62	67.5 Å²	67.5	24%	0.243	33%	0.333	C	S	.	.	H	α-helix	trans	-63.3	-51.3	-168.6	166.3	-95.8	0	0	0	114	Q32 T33 L34 R55 E58 I59 M92	Y30-Q32 VanDerWaalsContact C-N 3.31Å; Y30-Q32 PolarHBondContact O-N 3.39Å; Y30-T33 PolarHBondContact O-N 3.2Å; Y30-L34 WeakPolarHBondContact O-CB 3.21Å; Y30-L34 PolarHBondContact O-N 2.8Å; Y30-R55 HydrophobicContact CD2-CB 4.36Å; Y30-R55 HydrophobicContact CD2-CG 4.37Å; Y30-R55 HydrophobicContact CE2-CB 4.49Å; Y30-R55 HydrophobicContact CE2-CG 4.4Å; Y30-E58 WeakPolarHBondContact CE2-OE2 3.19Å; Y30-E58 VanDerWaalsContact CZ-OE2 3.29Å; Y30-E58 PolarHBondContact OH-OE1 2.96Å; Y30-E58 PolarHBondContact OH-OE2 2.87Å; Y30-I59 HydrophobicContact CD2-CD1 3.86Å; Y30-I59 HydrophobicContact CD2-CG1 3.89Å; Y30-I59 HydrophobicContact CE2-CD1 3.98Å; Y30-I59 HydrophobicContact CE2-CG1 4.04Å; Y30-M92 WeakPolarHBondContact CA-SD 3.43Å; Y30-M92 HydrophobicContact CD2-CE 4.12Å; Y30-M92 HydrophobicContact CD2-SD 3.96Å; Y30-M92 HydrophobicContact CG-SD 4.34Å
31	R	97.6	Very high	97.6	Very high	212 Å²	212	74.1 Å²	74.1	80%	0.8	36%	0.362	S	S	*	.	H	α-helix	trans	-60.4	-40.7	-176.3	-66.5	-176.3	-179.5	-178.1	0	112.5	K35	R31-K35 WeakPolarHBondContact O-CB 3.41Å; R31-K35 PolarHBondContact O-N 3.24Å; R31-K35 VanDerWaalsContact O-N 3.12Å
32	Q	98.2	Very high	97.7	Very high	93 Å²	93	72.1 Å²	72.1	44%	0.435	35%	0.353	S	S	.	.	H	α-helix	trans	-74.6	-41.1	179.5	-64.4	-62.9	-20	0	0	111.7	V27 Y30 L34 K35 T36	V27-Q32 HydrophobicContact CB-CB 3.81Å; V27-Q32 HydrophobicContact CG2-CB 3.89Å; Y30-Q32 VanDerWaalsContact C-N 3.31Å; Y30-Q32 PolarHBondContact O-N 3.39Å; Q32-L34 VanDerWaalsContact C-N 3.33Å; Q32-L34 PolarHBondContact O-N 2.93Å; Q32-K35 WeakPolarHBondContact O-CB 3.41Å; Q32-K35 PolarHBondContact O-N 3.02Å; Q32-K35 VanDerWaalsContact O-N 3.09Å; Q32-T36 PolarHBondContact O-N 3.44Å; Q32-T36 PolarHBondContact O-OG1 3.44Å
33	T	98.5	Very high	97.7	Very high	0 Å²	0	68 Å²	68	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-57.6	-45.7	173.8	-59.3	0	0	0	0	110.9	G29 Y30 K35 T36 L37 V45 I59 M92	G29-T33 VanDerWaalsContact O-CB 3.29Å; G29-T33 WeakPolarHBondContact O-CB 3.31Å; G29-T33 PolarHBondContact O-N 3.23Å; G29-T33 PolarHBondContact O-OG1 3.05Å; Y30-T33 PolarHBondContact O-N 3.2Å; T33-K35 VanDerWaalsContact C-N 3.3Å; T33-K35 PolarHBondContact O-N 3.06Å; T33-T36 PolarHBondContact O-N 2.83Å; T33-T36 PolarHBondContact O-OG1 3.31Å; T33-L37 HydrophobicContact CG2-CD1 4.18Å; T33-L37 WeakPolarHBondContact O-CB 3.44Å; T33-L37 WeakPolarHBondContact O-CG 3.4Å; T33-L37 PolarHBondContact O-N 3.32Å; T33-V45 HydrophobicContact CG2-CG1 3.88Å; T33-V45 HydrophobicContact CG2-CG2 4.1Å; T33-I59 HydrophobicContact CG2-CD1 4.05Å; T33-I59 HydrophobicContact CG2-CG2 4.23Å; T33-M92 HydrophobicContact CG2-SD 4.37Å
34	L	98.2	Very high	97.7	Very high	17 Å²	17	65.8 Å²	65.8	9%	0.089	32%	0.319	C	S	.	.	H	α-helix	trans	-64.2	-34.6	176	-177	60.9	0	0	0	112.4	Y30 Q32 R38 I59 Y62	Y30-L34 WeakPolarHBondContact O-CB 3.21Å; Y30-L34 PolarHBondContact O-N 2.8Å; Q32-L34 VanDerWaalsContact C-N 3.33Å; Q32-L34 PolarHBondContact O-N 2.93Å; L34-R38 HydrophobicContact CD1-CG 4.34Å; L34-R38 WeakPolarHBondContact O-CB 3.21Å; L34-R38 WeakPolarHBondContact O-CG 3.35Å; L34-R38 PolarHBondContact O-N 3.26Å; L34-I59 HydrophobicContact CB-CD1 4.22Å; L34-Y62 HydrophobicContact CD1-CD1 3.96Å; L34-Y62 HydrophobicContact CD1-CD2 3.33Å; L34-Y62 HydrophobicContact CD1-CE1 4.15Å; L34-Y62 HydrophobicContact CD1-CE2 3.58Å; L34-Y62 HydrophobicContact CD1-CG 3.56Å
35	K	98.4	Very high	97.7	Very high	127 Å²	127	65 Å²	65	55%	0.552	31%	0.311	S	S	*	.	H	α-helix	trans	-67.3	-41.8	175.7	-173.9	-179.1	179.8	-179.3	0	111.8	R31 Q32 T33 S39	R31-K35 WeakPolarHBondContact O-CB 3.41Å; R31-K35 PolarHBondContact O-N 3.24Å; R31-K35 VanDerWaalsContact O-N 3.12Å; Q32-K35 WeakPolarHBondContact O-CB 3.41Å; Q32-K35 PolarHBondContact O-N 3.02Å; Q32-K35 VanDerWaalsContact O-N 3.09Å; T33-K35 VanDerWaalsContact C-N 3.3Å; T33-K35 PolarHBondContact O-N 3.06Å; K35-S39 WeakPolarHBondContact O-CB 3.4Å; K35-S39 PolarHBondContact O-N 3.47Å; K35-S39 VanDerWaalsContact O-N 3.12Å; K35-S39 PolarHBondContact O-OG 2.96Å
36	T	98.4	Very high	97.6	Very high	11 Å²	11	58.6 Å²	58.6	7%	0.067	28%	0.283	C	S	.	.	H	α-helix	trans	-70.3	-36.1	178.5	54.6	0	0	0	0	112	V27 Q32 T33 S39 G40 K41 A42 S94 T96	V27-T36 HydrophobicContact CG1-CG2 4.15Å; V27-T36 HydrophobicContact CG2-CG2 3.61Å; Q32-T36 PolarHBondContact O-N 3.44Å; Q32-T36 PolarHBondContact O-OG1 3.44Å; T33-T36 PolarHBondContact O-N 2.83Å; T33-T36 PolarHBondContact O-OG1 3.31Å; T36-S39 PolarHBondContact O-N 3.21Å; T36-S39 PolarHBondContact O-OG 3.01Å; T36-G40 PolarHBondContact O-N 2.81Å; T36-K41 PolarHBondContact O-N 3Å; T36-A42 PolarHBondContact O-N 3.03Å; T36-S94 VanDerWaalsContact OG1-CB 3.24Å; T36-S94 WeakPolarHBondContact OG1-CB 3.43Å; T36-S94 PolarHBondContact OG1-OG 3.09Å; T36-T96 HydrophobicContact CG2-CG2 3.69Å
37	L	98.1	Very high	97.6	Very high	5 Å²	5	55.8 Å²	55.8	3%	0.026	27%	0.273	C	S	.	.	H	α-helix	trans	-61.1	-53.4	171.5	-75.7	170.3	0	0	0	111.9	T33 S39 G40 A42 V45 I59 A63 A66 T68	T33-L37 HydrophobicContact CG2-CD1 4.18Å; T33-L37 WeakPolarHBondContact O-CB 3.44Å; T33-L37 WeakPolarHBondContact O-CG 3.4Å; T33-L37 PolarHBondContact O-N 3.32Å; L37-S39 PolarHBondContact O-N 2.9Å; L37-G40 PolarHBondContact O-N 2.94Å; L37-A42 HydrophobicContact CD2-CB 3.81Å; L37-A42 HydrophobicContact CG-CB 4.13Å; L37-V45 HydrophobicContact CD1-CG2 4.25Å; L37-V45 HydrophobicContact CD2-CG2 3.98Å; L37-V45 HydrophobicContact CG-CG2 4.26Å; L37-I59 HydrophobicContact CD1-CD1 4.12Å; L37-I59 HydrophobicContact CD1-CG2 4.09Å; L37-A63 HydrophobicContact CD2-CB 3.96Å; L37-A66 HydrophobicContact CD2-CB 4Å; L37-T68 HydrophobicContact CD2-CG2 4.23Å
38	R	97.5	Very high	97.6	Very high	172 Å²	172	54.2 Å²	54.2	65%	0.649	26%	0.263	S	S	*	.	H	α-helix	trans	-62.7	-24.2	179.7	-73.4	-172.9	-64.3	167.3	-2.1	114.3	L34 Y62	L34-R38 HydrophobicContact CD1-CG 4.34Å; L34-R38 WeakPolarHBondContact O-CB 3.21Å; L34-R38 WeakPolarHBondContact O-CG 3.35Å; L34-R38 PolarHBondContact O-N 3.26Å; R38-Y62 HydrophobicContact CG-CD1 4.26Å; R38-Y62 HydrophobicContact CG-CE1 4.21Å
39	S	97.1	Very high	97.5	Very high	64 Å²	64	56.2 Å²	56.2	45%	0.448	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	3.9	177	56	0	0	0	0	113.8	K35 T36 L37 K41	K35-S39 WeakPolarHBondContact O-CB 3.4Å; K35-S39 PolarHBondContact O-N 3.47Å; K35-S39 VanDerWaalsContact O-N 3.12Å; K35-S39 PolarHBondContact O-OG 2.96Å; T36-S39 PolarHBondContact O-N 3.21Å; T36-S39 PolarHBondContact O-OG 3.01Å; L37-S39 PolarHBondContact O-N 2.9Å; S39-K41 PolarHBondContact O-N 3.22Å
40	G	95.3	Very high	97.4	Very high	59 Å²	59	58.4 Å²	58.4	61%	0.608	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.7	14.6	-179.2	0	0	0	0	0	114.6	T36 L37	T36-G40 PolarHBondContact O-N 2.81Å; L37-G40 PolarHBondContact O-N 2.94Å
41	K	97.4	Very high	97.4	Very high	139 Å²	139	55.5 Å²	55.5	60%	0.604	27%	0.268	S	S	*	.			trans	-88	-18.2	-178.4	-66.9	-176.2	179.4	-177.5	0	113.2	T36 S39 K43 T96	T36-K41 PolarHBondContact O-N 3Å; S39-K41 PolarHBondContact O-N 3.22Å; K41-K43 PolarHBondContact O-N 2.91Å; K41-T96 HydrophobicContact CB-CG2 4.28Å; K41-T96 WeakPolarHBondContact O-CA 3.31Å; K41-T96 WeakPolarHBondContact O-CB 3.41Å; K41-T96 WeakPolarHBondContact O-CG2 3.29Å
42	A	97.7	Very high	97.4	Very high	7 Å²	7	47.9 Å²	47.9	6%	0.058	25%	0.246	C	C	.	.			trans	-73.4	124.5	179.5	0	0	0	0	0	110.5	T36 L37 T68 S94	T36-A42 PolarHBondContact O-N 3.03Å; L37-A42 HydrophobicContact CD2-CB 3.81Å; L37-A42 HydrophobicContact CG-CB 4.13Å; A42-T68 HydrophobicContact CB-CG2 3.96Å; A42-T68 WeakPolarHBondContact O-CG2 3.49Å; A42-T68 PolarHBondContact O-OG1 2.76Å; A42-S94 WeakPolarHBondContact CB-OG 3.45Å
43	K	96.3	Very high	97.4	Very high	101 Å²	101	47.8 Å²	47.8	44%	0.439	25%	0.253	S	S	.	.	S	Bend	trans	-101.7	-29.5	175	-56	-178.4	177.1	174.7	0	112.8	K41 I95 T96 D97 I104	K41-K43 PolarHBondContact O-N 2.91Å; K43-I95 PolarHBondContact N-O 2.86Å; K43-T96 WeakPolarHBondContact CD-O 3.37Å; K43-T96 WeakPolarHBondContact CE-O 3.45Å; K43-D97 IonicContact NZ-OD1 3.97Å; K43-I104 HydrophobicContact CB-CD1 3.42Å; K43-I104 VanDerWaalsContact CB-CD1 3.42Å; K43-I104 HydrophobicContact CB-CG1 4.27Å; K43-I104 HydrophobicContact CD-CD1 3.58Å; K43-I104 HydrophobicContact CG-CD1 4.15Å
44	L	97.2	Very high	97.3	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	142.3	171.6	176.8	63.2	0	0	0	109.8	I46 G69 H71 S94 I95 I103 I104 V107	L44-I46 HydrophobicContact CD2-CD1 4.26Å; L44-I46 HydrophobicContact CD2-CG1 4.19Å; L44-I46 HydrophobicContact CG-CG1 4.24Å; L44-G69 WeakPolarHBondContact CD1-O 3.18Å; L44-H71 HydrophobicContact CD1-CB 4.19Å; L44-S94 CarbonylContact O-C 3.57Å; L44-S94 WeakPolarHBondContact O-CA 3.23Å; L44-I95 HydrophobicContact CB-CB 4.28Å; L44-I95 HydrophobicContact CB-CD1 4.47Å; L44-I95 HydrophobicContact CD2-CD1 4.07Å; L44-I95 PolarHBondContact N-O 2.98Å; L44-I95 PolarHBondContact O-N 3.15Å; L44-I103 HydrophobicContact CD2-CD1 4.32Å; L44-I103 HydrophobicContact CD2-CG1 3.79Å; L44-I103 HydrophobicContact CD2-CG2 4.31Å; L44-I104 HydrophobicContact CB-CG1 4.27Å; L44-V107 HydrophobicContact CD1-CB 4.05Å; L44-V107 HydrophobicContact CD1-CG1 4.21Å; L44-V107 HydrophobicContact CD1-CG2 3.49Å; L44-V107 VanDerWaalsContact CD1-CG2 3.49Å; L44-V107 HydrophobicContact CD2-CG2 4.3Å
45	V	97.7	Very high	97.3	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	136.6	169	177.7	0	0	0	0	109.5	T33 L37 L47 I59 T68 G69 V70 H71 M93	T33-V45 HydrophobicContact CG2-CG1 3.88Å; T33-V45 HydrophobicContact CG2-CG2 4.1Å; L37-V45 HydrophobicContact CD1-CG2 4.25Å; L37-V45 HydrophobicContact CD2-CG2 3.98Å; L37-V45 HydrophobicContact CG-CG2 4.26Å; V45-L47 HydrophobicContact CG1-CD2 3.83Å; V45-L47 HydrophobicContact CG1-CG 4.26Å; V45-I59 HydrophobicContact CG1-CG2 3.71Å; V45-T68 HydrophobicContact CG2-CG2 4.13Å; V45-G69 PolarHBondContact N-O 3.12Å; V45-V70 HydrophobicContact CB-CG2 4.43Å; V45-V70 CarbonylContact O-C 3.55Å; V45-V70 WeakPolarHBondContact O-CA 3.24Å; V45-H71 PolarHBondContact O-N 2.88Å; V45-M93 WeakPolarHBondContact CA-O 3.34Å
46	I	96.8	Very high	97.2	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	128.3	176.6	-62	167.2	0	0	0	108.6	L17 L44 H71 Y73 L80 M92 M93 I95 I103	L17-I46 HydrophobicContact CD1-CD1 4.31Å; L17-I46 HydrophobicContact CD2-CD1 3.54Å; L17-I46 HydrophobicContact CG-CD1 4.16Å; L44-I46 HydrophobicContact CD2-CD1 4.26Å; L44-I46 HydrophobicContact CD2-CG1 4.19Å; L44-I46 HydrophobicContact CG-CG1 4.24Å; I46-H71 WeakPolarHBondContact CA-O 2.84Å; I46-H71 HydrophobicContact CG1-CB 4.24Å; I46-Y73 HydrophobicContact CG2-CG 4.44Å; I46-L80 HydrophobicContact CG2-CD1 3.98Å; I46-L80 HydrophobicContact CG2-CD2 4.25Å; I46-M92 CarbonylContact O-C 3.47Å; I46-M92 WeakPolarHBondContact O-CA 3.36Å; I46-M92 WeakPolarHBondContact O-CB 3.38Å; I46-M93 HydrophobicContact CB-CG 3.82Å; I46-M93 HydrophobicContact CB-SD 4.5Å; I46-M93 HydrophobicContact CD1-CG 4.36Å; I46-M93 HydrophobicContact CD1-SD 4.17Å; I46-M93 HydrophobicContact CG1-CG 4.49Å; I46-M93 PolarHBondContact N-O 3.44Å; I46-M93 PolarHBondContact O-N 2.88Å; I46-I95 HydrophobicContact CD1-CD1 3.92Å; I46-I103 HydrophobicContact CD1-CD1 4.07Å
47	L	97.5	Very high	97.2	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	128.6	-177.7	-58.6	-177	0	0	0	110.5	V45 R56 I59 E60 V70 H71 Y73 M92	V45-L47 HydrophobicContact CG1-CD2 3.83Å; V45-L47 HydrophobicContact CG1-CG 4.26Å; L47-R56 HydrophobicContact CD1-CG 3.97Å; L47-I59 HydrophobicContact CD2-CG2 3.99Å; L47-E60 HydrophobicContact CD1-CG 4.21Å; L47-V70 HydrophobicContact CD1-CG1 3.71Å; L47-V70 HydrophobicContact CG-CG1 3.97Å; L47-H71 PolarHBondContact N-O 2.8Å; L47-Y73 VanDerWaalsContact O-CB 3.27Å; L47-Y73 WeakPolarHBondContact O-CB 3.48Å; L47-Y73 PolarHBondContact O-N 2.88Å; L47-M92 HydrophobicContact CD2-CB 3.49Å; L47-M92 VanDerWaalsContact CD2-CB 3.49Å; L47-M92 HydrophobicContact CD2-CE 4.26Å; L47-M92 HydrophobicContact CD2-CG 4.49Å; L47-M92 HydrophobicContact CD2-SD 4.31Å
48	A	97.7	Very high	97.2	Very high	1 Å²	1	61.8 Å²	61.8	1%	0.008	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	149.5	170	0	0	0	0	0	111	N50 T51 N77 L80 C91	A48-N50 PolarHBondContact O-N 3.2Å; A48-T51 PolarHBondContact N-OG1 3.32Å; A48-T51 WeakPolarHBondContact O-CB 3.42Å; A48-T51 PolarHBondContact O-N 3.02Å; A48-T51 PolarHBondContact O-OG1 2.83Å; A48-N77 HydrophobicContact CB-CB 4.2Å; A48-L80 HydrophobicContact CB-CD2 4.1Å; A48-C91 VanDerWaalsContact CB-O 3.31Å; A48-C91 WeakPolarHBondContact CB-O 3.34Å; A48-C91 PolarHBondContact N-O 2.76Å
49	N	96.1	Very high	97.2	Very high	82 Å²	82	53.6 Å²	53.6	44%	0.439	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-27.1	-177	68.4	7.9	0	0	0	113.3	R56 G75 N76	N49-R56 PolarHBondContact O-NH2 2.99Å; N49-G75 VanDerWaalsContact CG-C 3.41Å; N49-G75 PolarHBondContact N-O 3.01Å; N49-G75 PolarHBondContact OD1-O 3.43Å; N49-N76 VanDerWaalsContact OD1-CA 3.27Å; N49-N76 WeakPolarHBondContact OD1-CA 3.36Å; N49-N76 PolarHBondContact OD1-N 3.03Å
50	N	96.9	Very high	97.3	Very high	72 Å²	72	53.3 Å²	53.3	39%	0.385	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	17	179	70.1	-20.8	0	0	0	113.4	A48 N77	A48-N50 PolarHBondContact O-N 3.2Å; N50-N77 PolarHBondContact ND2-OD1 3.44Å; N50-N77 VanDerWaalsContact ND2-OD1 3.1Å; N50-N77 PolarHBondContact OD1-N 3.3Å
51	T	97.8	Very high	97.4	Very high	2 Å²	2	56.4 Å²	56.4	1%	0.012	28%	0.278	C	S	.	.			trans	-59	129.8	171.4	-60.5	0	0	0	0	110	A48 R55 R56 C91 M92	A48-T51 PolarHBondContact N-OG1 3.32Å; A48-T51 WeakPolarHBondContact O-CB 3.42Å; A48-T51 PolarHBondContact O-N 3.02Å; A48-T51 PolarHBondContact O-OG1 2.83Å; T51-R55 HydrophobicContact CG2-CB 4.28Å; T51-R56 HydrophobicContact CG2-CB 4.05Å; T51-R56 PolarHBondContact O-NH2 3.18Å; T51-C91 PolarHBondContact OG1-O 2.81Å; T51-C91 VanDerWaalsContact OG1-O 3.06Å; T51-M92 HydrophobicContact CG2-CE 3.67Å
52	P	97.2	Very high	97.4	Very high	51 Å²	51	53.2 Å²	53.2	33%	0.331	26%	0.263	S	S	.	.			trans	-53.9	135.6	179.2	-28	35	0	0	0	111.9	L54 R55 R56	P52-L54 VanDerWaalsContact C-N 3.3Å; P52-L54 PolarHBondContact O-N 2.83Å; P52-R55 PolarHBondContact O-N 3.49Å; P52-R56 PolarHBondContact O-N 2.93Å
53	P	97.3	Very high	97.4	Very high	91 Å²	91	52.9 Å²	52.9	59%	0.591	26%	0.26	S	S	*	.	H	α-helix	trans	-51.4	-45.5	-173.6	-29.5	35	0	0	0	113.8	R55 R56 S57	P53-R55 PolarHBondContact O-N 3.35Å; P53-R56 WeakPolarHBondContact O-CB 3.4Å; P53-R56 PolarHBondContact O-N 3.3Å; P53-S57 PolarHBondContact O-N 3.44Å; P53-S57 PolarHBondContact O-OG 2.89Å
54	L	97	Very high	97.4	Very high	145 Å²	145	53.8 Å²	53.8	76%	0.759	27%	0.267	S	S	*	.	H	α-helix	trans	-58.1	-44.8	178.5	-176.9	63.2	0	0	0	112.6	P52 E58	P52-L54 VanDerWaalsContact C-N 3.3Å; P52-L54 PolarHBondContact O-N 2.83Å; L54-E58 WeakPolarHBondContact O-CB 3.45Å; L54-E58 PolarHBondContact O-N 2.94Å; L54-E58 VanDerWaalsContact O-N 3.09Å
55	R	97.4	Very high	97.3	Very high	119 Å²	119	58.3 Å²	58.3	45%	0.449	29%	0.291	S	S	.	.	H	α-helix	trans	-72.3	-33.7	179.1	-66.8	-174.2	-173.6	152.8	3.6	112.2	Y30 T51 P52 P53 I59 M92	Y30-R55 HydrophobicContact CD2-CB 4.36Å; Y30-R55 HydrophobicContact CD2-CG 4.37Å; Y30-R55 HydrophobicContact CE2-CB 4.49Å; Y30-R55 HydrophobicContact CE2-CG 4.4Å; T51-R55 HydrophobicContact CG2-CB 4.28Å; P52-R55 PolarHBondContact O-N 3.49Å; P53-R55 PolarHBondContact O-N 3.35Å; R55-I59 WeakPolarHBondContact O-CB 3.49Å; R55-I59 VanDerWaalsContact O-CG1 3.25Å; R55-I59 WeakPolarHBondContact O-CG1 3.35Å; R55-I59 PolarHBondContact O-N 2.82Å; R55-I59 VanDerWaalsContact O-N 3.1Å; R55-M92 HydrophobicContact CB-CE 4.24Å
56	R	97.7	Very high	97.2	Very high	61 Å²	61	60 Å²	60	23%	0.23	30%	0.304	C	S	.	.	H	α-helix	trans	-61.7	-57	175.5	177.4	-173.5	-58.1	124.1	-2.8	109.7	L47 N49 T51 P52 P53 E58 I59 E60	L47-R56 HydrophobicContact CD1-CG 3.97Å; N49-R56 PolarHBondContact O-NH2 2.99Å; T51-R56 HydrophobicContact CG2-CB 4.05Å; T51-R56 PolarHBondContact O-NH2 3.18Å; P52-R56 PolarHBondContact O-N 2.93Å; P53-R56 WeakPolarHBondContact O-CB 3.4Å; P53-R56 PolarHBondContact O-N 3.3Å; R56-E58 VanDerWaalsContact C-N 3.3Å; R56-E58 PolarHBondContact O-N 3.35Å; R56-I59 PolarHBondContact O-N 3.35Å; R56-E60 WeakPolarHBondContact CD-OE1 3.36Å; R56-E60 HydrophobicContact CG-CG 4.45Å; R56-E60 WeakPolarHBondContact CG-OE1 3.33Å; R56-E60 WeakPolarHBondContact O-CB 3.46Å; R56-E60 WeakPolarHBondContact O-CG 3.45Å; R56-E60 PolarHBondContact O-N 3.38Å
57	S	98	Very high	97.1	Very high	69 Å²	69	68.7 Å²	68.7	48%	0.483	34%	0.342	S	S	.	.	H	α-helix	trans	-61.3	-38.8	-178.1	-58.5	0	0	0	0	112.5	P53 Y61	P53-S57 PolarHBondContact O-N 3.44Å; P53-S57 PolarHBondContact O-OG 2.89Å; S57-Y61 WeakPolarHBondContact O-CB 3.01Å; S57-Y61 PolarHBondContact O-N 3.26Å
58	E	97.9	Very high	97.1	Very high	60 Å²	60	69.3 Å²	69.3	28%	0.28	35%	0.346	S	S	.	.	H	α-helix	trans	-62.3	-48.1	175.3	-174.7	-178.8	-170.3	0	0	112	Y30 L54 R56 Y61 Y62	Y30-E58 WeakPolarHBondContact CE2-OE2 3.19Å; Y30-E58 VanDerWaalsContact CZ-OE2 3.29Å; Y30-E58 PolarHBondContact OH-OE1 2.96Å; Y30-E58 PolarHBondContact OH-OE2 2.87Å; L54-E58 WeakPolarHBondContact O-CB 3.45Å; L54-E58 PolarHBondContact O-N 2.94Å; L54-E58 VanDerWaalsContact O-N 3.09Å; R56-E58 VanDerWaalsContact C-N 3.3Å; R56-E58 PolarHBondContact O-N 3.35Å; E58-Y61 WeakPolarHBondContact O-CB 3.38Å; E58-Y61 PolarHBondContact O-N 2.99Å; E58-Y62 HydrophobicContact CG-CD2 3.89Å; E58-Y62 HydrophobicContact CG-CE2 3.75Å; E58-Y62 WeakPolarHBondContact O-CD2 3.49Å; E58-Y62 PolarHBondContact O-N 3.38Å
59	I	98.2	Very high	96.9	Very high	0 Å²	0	69.9 Å²	69.9	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-67.7	-38.4	-179.7	-69.4	-69.4	0	0	0	111.8	Y30 T33 L34 L37 V45 L47 R55 R56 Y61 Y62 A63 M92	Y30-I59 HydrophobicContact CD2-CD1 3.86Å; Y30-I59 HydrophobicContact CD2-CG1 3.89Å; Y30-I59 HydrophobicContact CE2-CD1 3.98Å; Y30-I59 HydrophobicContact CE2-CG1 4.04Å; T33-I59 HydrophobicContact CG2-CD1 4.05Å; T33-I59 HydrophobicContact CG2-CG2 4.23Å; L34-I59 HydrophobicContact CB-CD1 4.22Å; L37-I59 HydrophobicContact CD1-CD1 4.12Å; L37-I59 HydrophobicContact CD1-CG2 4.09Å; V45-I59 HydrophobicContact CG1-CG2 3.71Å; L47-I59 HydrophobicContact CD2-CG2 3.99Å; R55-I59 WeakPolarHBondContact O-CB 3.49Å; R55-I59 VanDerWaalsContact O-CG1 3.25Å; R55-I59 WeakPolarHBondContact O-CG1 3.35Å; R55-I59 PolarHBondContact O-N 2.82Å; R55-I59 VanDerWaalsContact O-N 3.1Å; R56-I59 PolarHBondContact O-N 3.35Å; I59-Y61 VanDerWaalsContact C-N 3.32Å; I59-Y61 PolarHBondContact O-N 2.96Å; I59-Y62 PolarHBondContact O-N 2.9Å; I59-A63 WeakPolarHBondContact O-CB 3.43Å; I59-A63 PolarHBondContact O-N 2.82Å; I59-M92 HydrophobicContact CD1-SD 4.12Å; I59-M92 HydrophobicContact CG1-CE 4.21Å; I59-M92 HydrophobicContact CG1-SD 3.77Å
60	E	97.4	Very high	96.9	Very high	58 Å²	58	67.6 Å²	67.6	27%	0.271	34%	0.341	S	S	.	.	H	α-helix	trans	-60.4	-42.2	173.1	-75.8	165.4	-175	0	0	111.8	L47 R56 A63 M64 V70 H72	L47-E60 HydrophobicContact CD1-CG 4.21Å; R56-E60 WeakPolarHBondContact CD-OE1 3.36Å; R56-E60 HydrophobicContact CG-CG 4.45Å; R56-E60 WeakPolarHBondContact CG-OE1 3.33Å; R56-E60 WeakPolarHBondContact O-CB 3.46Å; R56-E60 WeakPolarHBondContact O-CG 3.45Å; R56-E60 PolarHBondContact O-N 3.38Å; E60-A63 PolarHBondContact O-N 3.1Å; E60-M64 WeakPolarHBondContact O-CB 3.33Å; E60-M64 PolarHBondContact O-N 3.01Å; E60-V70 HydrophobicContact CG-CG1 4.3Å; E60-H72 IonicContact OE1-CE1 2.99Å; E60-H72 PolarHBondContact OE1-CE1 3.43Å; E60-H72 IonicContact OE1-NE2 3.63Å
61	Y	98.1	Very high	96.8	Very high	125 Å²	125	66.6 Å²	66.6	49%	0.49	33%	0.334	S	S	.	.	H	α-helix	trans	-61.2	-50.2	174.9	171.7	-106.9	0	0	0	111.9	S57 E58 I59 A63 M64 L65	S57-Y61 WeakPolarHBondContact O-CB 3.01Å; S57-Y61 PolarHBondContact O-N 3.26Å; E58-Y61 WeakPolarHBondContact O-CB 3.38Å; E58-Y61 PolarHBondContact O-N 2.99Å; I59-Y61 VanDerWaalsContact C-N 3.32Å; I59-Y61 PolarHBondContact O-N 2.96Å; Y61-A63 VanDerWaalsContact C-N 3.33Å; Y61-A63 PolarHBondContact O-N 3.29Å; Y61-M64 HydrophobicContact CD2-CE 4.07Å; Y61-M64 HydrophobicContact CE2-CE 4.25Å; Y61-M64 WeakPolarHBondContact O-CB 3.47Å; Y61-M64 PolarHBondContact O-N 3.5Å; Y61-L65 HydrophobicContact CD1-CD1 4.21Å; Y61-L65 HydrophobicContact CE1-CD1 3.59Å; Y61-L65 HydrophobicContact CE1-CG 4.42Å; Y61-L65 HydrophobicContact CE2-CD1 4.2Å; Y61-L65 HydrophobicContact CE2-CD2 4.41Å; Y61-L65 HydrophobicContact CE2-CG 4.28Å; Y61-L65 WeakPolarHBondContact O-CG 3.46Å; Y61-L65 PolarHBondContact O-N 3.17Å
62	Y	98.2	Very high	96.7	Very high	72 Å²	72	71.7 Å²	71.7	28%	0.282	36%	0.357	S	S	.	.	H	α-helix	trans	-66.2	-33.6	177.4	-79.9	-76.3	0	0	0	113.1	L34 R38 E58 I59 L65 A66	L34-Y62 HydrophobicContact CD1-CD1 3.96Å; L34-Y62 HydrophobicContact CD1-CD2 3.33Å; L34-Y62 HydrophobicContact CD1-CE1 4.15Å; L34-Y62 HydrophobicContact CD1-CE2 3.58Å; L34-Y62 HydrophobicContact CD1-CG 3.56Å; R38-Y62 HydrophobicContact CG-CD1 4.26Å; R38-Y62 HydrophobicContact CG-CE1 4.21Å; E58-Y62 HydrophobicContact CG-CD2 3.89Å; E58-Y62 HydrophobicContact CG-CE2 3.75Å; E58-Y62 WeakPolarHBondContact O-CD2 3.49Å; E58-Y62 PolarHBondContact O-N 3.38Å; I59-Y62 PolarHBondContact O-N 2.9Å; Y62-L65 HydrophobicContact CD1-CD1 4.5Å; Y62-L65 PolarHBondContact O-N 3Å; Y62-A66 VanDerWaalsContact O-CB 3.31Å; Y62-A66 WeakPolarHBondContact O-CB 3.27Å; Y62-A66 PolarHBondContact O-N 3.25Å
63	A	97.2	Very high	96.6	Very high	0 Å²	0	70 Å²	70	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-64.6	-42.1	173.7	0	0	0	0	0	111.6	L37 I59 E60 Y61 A66 K67 T68 V70	L37-A63 HydrophobicContact CD2-CB 3.96Å; I59-A63 WeakPolarHBondContact O-CB 3.43Å; I59-A63 PolarHBondContact O-N 2.82Å; E60-A63 PolarHBondContact O-N 3.1Å; Y61-A63 VanDerWaalsContact C-N 3.33Å; Y61-A63 PolarHBondContact O-N 3.29Å; A63-A66 CarbonylContact O-C 3.5Å; A63-A66 PolarHBondContact O-N 3.39Å; A63-K67 PolarHBondContact O-N 3.47Å; A63-T68 PolarHBondContact O-N 3.38Å; A63-V70 HydrophobicContact CB-CG2 3.32Å
64	M	96	Very high	96.3	Very high	119 Å²	119	70.7 Å²	70.7	59%	0.586	34%	0.344	S	S	*	.	H	α-helix	trans	-59.8	-48.7	173.2	179.3	-86.2	-75.4	0	0	111.5	E60 Y61 A66 K67	E60-M64 WeakPolarHBondContact O-CB 3.33Å; E60-M64 PolarHBondContact O-N 3.01Å; Y61-M64 HydrophobicContact CD2-CE 4.07Å; Y61-M64 HydrophobicContact CE2-CE 4.25Å; Y61-M64 WeakPolarHBondContact O-CB 3.47Å; Y61-M64 PolarHBondContact O-N 3.5Å; M64-A66 VanDerWaalsContact C-N 3.27Å; M64-A66 PolarHBondContact O-N 3.01Å; M64-K67 PolarHBondContact O-N 3.29Å
65	L	96	Very high	96.2	Very high	97 Å²	97	63.9 Å²	63.9	51%	0.508	31%	0.308	S	S	.	.	H	α-helix	trans	-59.6	-37.6	176.6	-67.5	-179.5	0	0	0	112.7	Y61 Y62 K67	Y61-L65 HydrophobicContact CD1-CD1 4.21Å; Y61-L65 HydrophobicContact CE1-CD1 3.59Å; Y61-L65 HydrophobicContact CE1-CG 4.42Å; Y61-L65 HydrophobicContact CE2-CD1 4.2Å; Y61-L65 HydrophobicContact CE2-CD2 4.41Å; Y61-L65 HydrophobicContact CE2-CG 4.28Å; Y61-L65 WeakPolarHBondContact O-CG 3.46Å; Y61-L65 PolarHBondContact O-N 3.17Å; Y62-L65 HydrophobicContact CD1-CD1 4.5Å; Y62-L65 PolarHBondContact O-N 3Å; L65-K67 VanDerWaalsContact C-N 3.25Å; L65-K67 PolarHBondContact O-N 2.93Å
66	A	95.5	Very high	96.2	Very high	34 Å²	34	60.3 Å²	60.3	28%	0.281	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-0.1	177.9	0	0	0	0	0	113.8	L37 Y62 A63 M64 T68	L37-A66 HydrophobicContact CD2-CB 4Å; Y62-A66 VanDerWaalsContact O-CB 3.31Å; Y62-A66 WeakPolarHBondContact O-CB 3.27Å; Y62-A66 PolarHBondContact O-N 3.25Å; A63-A66 CarbonylContact O-C 3.5Å; A63-A66 PolarHBondContact O-N 3.39Å; M64-A66 VanDerWaalsContact C-N 3.27Å; M64-A66 PolarHBondContact O-N 3.01Å; A66-T68 WeakPolarHBondContact CB-OG1 3.27Å; A66-T68 PolarHBondContact O-N 2.91Å; A66-T68 PolarHBondContact O-OG1 3.3Å
67	K	94.9	Very high	96.2	Very high	183 Å²	183	58.6 Å²	58.6	80%	0.796	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	32.2	-171.6	-55.8	-178.9	-179.9	-177.8	0	112.8	A63 M64 L65	A63-K67 PolarHBondContact O-N 3.47Å; M64-K67 PolarHBondContact O-N 3.29Å; L65-K67 VanDerWaalsContact C-N 3.25Å; L65-K67 PolarHBondContact O-N 2.93Å
68	T	95.8	Very high	96.2	Very high	14 Å²	14	59.4 Å²	59.4	9%	0.086	29%	0.291	C	S	.	.			trans	-96	132.7	-179.6	-54	0	0	0	0	109.8	L37 A42 V45 A63 A66	L37-T68 HydrophobicContact CD2-CG2 4.23Å; A42-T68 HydrophobicContact CB-CG2 3.96Å; A42-T68 WeakPolarHBondContact O-CG2 3.49Å; A42-T68 PolarHBondContact O-OG1 2.76Å; V45-T68 HydrophobicContact CG2-CG2 4.13Å; A63-T68 PolarHBondContact O-N 3.38Å; A66-T68 WeakPolarHBondContact CB-OG1 3.27Å; A66-T68 PolarHBondContact O-N 2.91Å; A66-T68 PolarHBondContact O-OG1 3.3Å
69	G	94.5	Very high	96.2	Very high	13 Å²	13	61 Å²	61	13%	0.134	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	148	173.8	0	0	0	0	0	112.5	L44 V45	L44-G69 WeakPolarHBondContact CD1-O 3.18Å; V45-G69 PolarHBondContact N-O 3.12Å
70	V	96.1	Very high	96.1	Very high	35 Å²	35	61 Å²	61	21%	0.212	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	127.2	171.7	-176.8	0	0	0	0	108.9	V45 L47 E60 A63	V45-V70 HydrophobicContact CB-CG2 4.43Å; V45-V70 CarbonylContact O-C 3.55Å; V45-V70 WeakPolarHBondContact O-CA 3.24Å; L47-V70 HydrophobicContact CD1-CG1 3.71Å; L47-V70 HydrophobicContact CG-CG1 3.97Å; E60-V70 HydrophobicContact CG-CG1 4.3Å; A63-V70 HydrophobicContact CB-CG2 3.32Å
71	H	94.8	Very high	96.1	Very high	50 Å²	50	58.2 Å²	58.2	23%	0.231	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	121	174.2	177.7	-80.4	0	0	0	110.3	L44 V45 I46 L47 Y73 V107	L44-H71 HydrophobicContact CD1-CB 4.19Å; V45-H71 PolarHBondContact O-N 2.88Å; I46-H71 WeakPolarHBondContact CA-O 2.84Å; I46-H71 HydrophobicContact CG1-CB 4.24Å; L47-H71 PolarHBondContact N-O 2.8Å; H71-Y73 PolarHBondContact O-N 2.9Å; H71-V107 HydrophobicContact CB-CG2 4.29Å
72	H	94.8	Very high	96	Very high	109 Å²	109	56.9 Å²	56.9	51%	0.505	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	108.6	173.4	-63	-92.7	0	0	0	109.7	E60 N74	E60-H72 IonicContact OE1-CE1 2.99Å; E60-H72 PolarHBondContact OE1-CE1 3.43Å; E60-H72 IonicContact OE1-NE2 3.63Å; H72-N74 PolarHBondContact O-N 2.98Å
73	Y	95	Very high	95.8	Very high	15 Å²	15	54.6 Å²	54.6	6%	0.059	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	128.7	177.5	-173.4	-111.3	0	0	0	110.3	I13 N14 I46 L47 H71 G75 E79 L80	I13-Y73 HydrophobicContact CG2-CD2 4.01Å; I13-Y73 HydrophobicContact CG2-CE2 3.88Å; N14-Y73 PolarHBondContact ND2-OH 2.93Å; N14-Y73 WeakPolarHBondContact OD1-CE2 3.19Å; N14-Y73 PolarHBondContact OD1-OH 3.4Å; I46-Y73 HydrophobicContact CG2-CG 4.44Å; L47-Y73 VanDerWaalsContact O-CB 3.27Å; L47-Y73 WeakPolarHBondContact O-CB 3.48Å; L47-Y73 PolarHBondContact O-N 2.88Å; H71-Y73 PolarHBondContact O-N 2.9Å; Y73-G75 WeakPolarHBondContact CD1-O 3.48Å; Y73-G75 PolarHBondContact O-N 3.26Å; Y73-E79 HydrophobicContact CE1-CB 4.06Å; Y73-L80 HydrophobicContact CD1-CB 3.85Å; Y73-L80 HydrophobicContact CD1-CD1 4.19Å; Y73-L80 HydrophobicContact CD1-CG 4.47Å; Y73-L80 HydrophobicContact CD2-CD1 4.22Å; Y73-L80 HydrophobicContact CE1-CB 3.93Å; Y73-L80 HydrophobicContact CE1-CD1 4.43Å; Y73-L80 HydrophobicContact CE2-CD1 4.47Å; Y73-L80 HydrophobicContact CG-CD1 4.09Å
74	N	92.9	Very high	95.7	Very high	107 Å²	107	54.6 Å²	54.6	57%	0.572	29%	0.287	S	S	*	.	S	Bend	trans	-80.1	60.6	176.3	-172.2	31	0	0	0	110.7	A10 H72	A10-N74 HydrophobicContact CB-CB 4.47Å; H72-N74 PolarHBondContact O-N 2.98Å
75	G	94.6	Very high	95.6	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.01	29%	0.287	C	S	.	.	S	Bend	trans	-177.7	163.5	-179.4	0	0	0	0	0	112.2	N49 Y73 E79	N49-G75 VanDerWaalsContact CG-C 3.41Å; N49-G75 PolarHBondContact N-O 3.01Å; N49-G75 PolarHBondContact OD1-O 3.43Å; Y73-G75 WeakPolarHBondContact CD1-O 3.48Å; Y73-G75 PolarHBondContact O-N 3.26Å; G75-E79 VanDerWaalsContact C-OE2 3.29Å; G75-E79 WeakPolarHBondContact CA-OE2 3.36Å
76	N	97.3	Very high	95.7	Very high	45 Å²	45	49.7 Å²	49.7	24%	0.241	28%	0.275	C	S	.	.			trans	-81.8	176.7	-178.6	70	36.2	0	0	0	111.9	N49 I78 E79 L80	N49-N76 VanDerWaalsContact OD1-CA 3.27Å; N49-N76 WeakPolarHBondContact OD1-CA 3.36Å; N49-N76 PolarHBondContact OD1-N 3.03Å; N76-I78 VanDerWaalsContact C-N 3.25Å; N76-I78 PolarHBondContact O-N 2.83Å; N76-I78 WeakPolarHBondContact OD1-CA 3.21Å; N76-I78 VanDerWaalsContact OD1-CB 3.3Å; N76-I78 WeakPolarHBondContact OD1-CB 3.37Å; N76-I78 PolarHBondContact OD1-N 2.85Å; N76-E79 PolarHBondContact N-OE2 3.38Å; N76-E79 PolarHBondContact O-N 3.26Å; N76-E79 PolarHBondContact OD1-N 3.12Å; N76-L80 PolarHBondContact O-N 3.39Å
77	N	97.7	Very high	95.7	Very high	25 Å²	25	59.8 Å²	59.8	13%	0.134	31%	0.307	C	S	.	.	H	α-helix	trans	-65.6	-20.3	-180	62.6	-9.2	0	0	0	115.3	A48 N50 G81 R89 V90 C91	A48-N77 HydrophobicContact CB-CB 4.2Å; N50-N77 PolarHBondContact ND2-OD1 3.44Å; N50-N77 VanDerWaalsContact ND2-OD1 3.1Å; N50-N77 PolarHBondContact OD1-N 3.3Å; N77-G81 PolarHBondContact O-N 3.2Å; N77-R89 HydrophobicContact CB-CB 4.4Å; N77-R89 CarbonylContact O-C 3.59Å; N77-R89 WeakPolarHBondContact O-CA 3.5Å; N77-V90 WeakPolarHBondContact CA-O 3.21Å; N77-V90 WeakPolarHBondContact CB-O 3.33Å; N77-V90 PolarHBondContact O-N 2.9Å; N77-C91 HydrophobicContact CB-CB 4.42Å; N77-C91 PolarHBondContact ND2-SG 3.47Å
78	I	97.9	Very high	95.8	Very high	86 Å²	86	56.8 Å²	56.8	44%	0.441	29%	0.294	S	S	.	.	H	α-helix	trans	-73.6	-51.3	171.6	-62	167	0	0	0	108.3	N76 L80 G81 T82 R89	N76-I78 VanDerWaalsContact C-N 3.25Å; N76-I78 PolarHBondContact O-N 2.83Å; N76-I78 WeakPolarHBondContact OD1-CA 3.21Å; N76-I78 VanDerWaalsContact OD1-CB 3.3Å; N76-I78 WeakPolarHBondContact OD1-CB 3.37Å; N76-I78 PolarHBondContact OD1-N 2.85Å; I78-L80 VanDerWaalsContact C-N 3.35Å; I78-L80 PolarHBondContact O-N 3.31Å; I78-G81 WeakPolarHBondContact O-CA 3.48Å; I78-G81 PolarHBondContact O-N 3.37Å; I78-T82 PolarHBondContact O-N 3.19Å; I78-T82 PolarHBondContact O-OG1 3.35Å; I78-R89 HydrophobicContact CG1-CG 3.91Å
79	E	96.6	Very high	95.9	Very high	93 Å²	93	64.7 Å²	64.7	44%	0.435	32%	0.322	S	S	.	.	H	α-helix	trans	-61.2	-41	-179.7	-67.2	165.1	170.3	0	0	112.1	Y73 G75 N76 G81 T82 A83	Y73-E79 HydrophobicContact CE1-CB 4.06Å; G75-E79 VanDerWaalsContact C-OE2 3.29Å; G75-E79 WeakPolarHBondContact CA-OE2 3.36Å; N76-E79 PolarHBondContact N-OE2 3.38Å; N76-E79 PolarHBondContact O-N 3.26Å; N76-E79 PolarHBondContact OD1-N 3.12Å; E79-G81 VanDerWaalsContact C-N 3.33Å; E79-T82 PolarHBondContact O-N 3.03Å; E79-A83 WeakPolarHBondContact O-CB 3.33Å; E79-A83 PolarHBondContact O-N 3.09Å
80	L	96.6	Very high	96	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-65.4	-37.9	173.9	-177.5	58.1	0	0	0	111.5	L17 I46 A48 Y73 N76 I78 A83 C84 V90 M93	L17-L80 HydrophobicContact CD1-CD1 4.18Å; I46-L80 HydrophobicContact CG2-CD1 3.98Å; I46-L80 HydrophobicContact CG2-CD2 4.25Å; A48-L80 HydrophobicContact CB-CD2 4.1Å; Y73-L80 HydrophobicContact CD1-CB 3.85Å; Y73-L80 HydrophobicContact CD1-CD1 4.19Å; Y73-L80 HydrophobicContact CD1-CG 4.47Å; Y73-L80 HydrophobicContact CD2-CD1 4.22Å; Y73-L80 HydrophobicContact CE1-CB 3.93Å; Y73-L80 HydrophobicContact CE1-CD1 4.43Å; Y73-L80 HydrophobicContact CE2-CD1 4.47Å; Y73-L80 HydrophobicContact CG-CD1 4.09Å; N76-L80 PolarHBondContact O-N 3.39Å; I78-L80 VanDerWaalsContact C-N 3.35Å; I78-L80 PolarHBondContact O-N 3.31Å; L80-A83 PolarHBondContact O-N 2.94Å; L80-C84 PolarHBondContact O-N 3.13Å; L80-C84 PolarHBondContact O-SG 2.94Å; L80-V90 HydrophobicContact CD2-CG1 4.11Å; L80-V90 WeakPolarHBondContact CD2-O 3.47Å; L80-V90 HydrophobicContact CG-CB 4.38Å; L80-V90 HydrophobicContact CG-CG1 4.14Å; L80-M93 HydrophobicContact CD1-SD 4.35Å
81	G	97.2	Very high	96.1	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-60.1	-48.5	173.9	0	0	0	0	0	111.6	N77 I78 E79 C84 G85 K86	N77-G81 PolarHBondContact O-N 3.2Å; I78-G81 WeakPolarHBondContact O-CA 3.48Å; I78-G81 PolarHBondContact O-N 3.37Å; E79-G81 VanDerWaalsContact C-N 3.33Å; G81-C84 CarbonylContact O-C 3.5Å; G81-C84 WeakPolarHBondContact O-CB 3.25Å; G81-C84 PolarHBondContact O-N 2.82Å; G81-C84 VanDerWaalsContact O-N 3.13Å; G81-G85 PolarHBondContact O-N 3.02Å; G81-K86 CarbonylContact C-O 3.5Å; G81-K86 WeakPolarHBondContact O-CB 3.37Å; G81-K86 PolarHBondContact O-N 2.93Å
82	T	96.5	Very high	96.2	Very high	97 Å²	97	62 Å²	62	60%	0.595	31%	0.308	S	S	*	.	H	α-helix	trans	-61.3	-43.6	175.6	-55.5	0	0	0	0	112	I78 E79 C84 G85	I78-T82 PolarHBondContact O-N 3.19Å; I78-T82 PolarHBondContact O-OG1 3.35Å; E79-T82 PolarHBondContact O-N 3.03Å; T82-C84 PolarHBondContact O-N 3.18Å; T82-G85 WeakPolarHBondContact O-CA 3.47Å; T82-G85 PolarHBondContact O-N 3.1Å
83	A	94.7	Very high	96.4	Very high	24 Å²	24	56.8 Å²	56.8	20%	0.198	28%	0.284	C	S	.	.	H	α-helix	trans	-61.2	-29	175.5	0	0	0	0	0	112.8	N14 L17 E79 L80 G85	N14-A83 WeakPolarHBondContact OD1-CB 3.12Å; L17-A83 HydrophobicContact CD1-CB 4.31Å; E79-A83 WeakPolarHBondContact O-CB 3.33Å; E79-A83 PolarHBondContact O-N 3.09Å; L80-A83 PolarHBondContact O-N 2.94Å; A83-G85 VanDerWaalsContact C-N 3.29Å
84	C	94.8	Very high	96.5	Very high	0 Å²	0	56 Å²	56	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	3.5	173.3	-62	0	0	0	0	114	I21 L80 G81 T82 K86 M93	I21-C84 HydrophobicContact CD1-CB 4.12Å; L80-C84 PolarHBondContact O-N 3.13Å; L80-C84 PolarHBondContact O-SG 2.94Å; G81-C84 CarbonylContact O-C 3.5Å; G81-C84 WeakPolarHBondContact O-CB 3.25Å; G81-C84 PolarHBondContact O-N 2.82Å; G81-C84 VanDerWaalsContact O-N 3.13Å; T82-C84 PolarHBondContact O-N 3.18Å; C84-K86 VanDerWaalsContact C-N 3.34Å; C84-K86 HydrophobicContact CB-CG 3.96Å; C84-K86 WeakPolarHBondContact O-CE 3.42Å; C84-M93 PolarHBondContact SG-SD 3.26Å
85	G	94.4	Very high	96.8	Very high	58 Å²	58	51 Å²	51	60%	0.598	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.3	30.5	-174.6	0	0	0	0	0	113.6	G81 T82 A83	G81-G85 PolarHBondContact O-N 3.02Å; T82-G85 WeakPolarHBondContact O-CA 3.47Å; T82-G85 PolarHBondContact O-N 3.1Å; A83-G85 VanDerWaalsContact C-N 3.29Å
86	K	96.6	Very high	96.9	Very high	55 Å²	55	52.4 Å²	52.4	24%	0.239	26%	0.263	C	S	.	.			trans	-109.1	142.3	-179.4	-52.6	-54.1	173.7	-162.7	0	111.3	Y26 L28 G81 C84 F88 V90	Y26-K86 WeakPolarHBondContact OH-CE 3.43Å; Y26-K86 PolarHBondContact OH-NZ 2.75Å; L28-K86 HydrophobicContact CD1-CD 4.15Å; L28-K86 HydrophobicContact CD1-CG 3.8Å; G81-K86 CarbonylContact C-O 3.5Å; G81-K86 WeakPolarHBondContact O-CB 3.37Å; G81-K86 PolarHBondContact O-N 2.93Å; C84-K86 VanDerWaalsContact C-N 3.34Å; C84-K86 HydrophobicContact CB-CG 3.96Å; C84-K86 WeakPolarHBondContact O-CE 3.42Å; K86-F88 HydrophobicContact CB-CD1 4.02Å; K86-F88 HydrophobicContact CB-CD2 4.36Å; K86-F88 HydrophobicContact CB-CE1 3.84Å; K86-F88 HydrophobicContact CB-CE2 4.18Å; K86-F88 HydrophobicContact CB-CG 4.28Å; K86-F88 HydrophobicContact CB-CZ 3.92Å; K86-F88 HydrophobicContact CD-CE1 3.92Å; K86-F88 HydrophobicContact CD-CZ 3.88Å; K86-F88 HydrophobicContact CG-CE1 4.02Å; K86-F88 HydrophobicContact CG-CE2 4.19Å; K86-F88 HydrophobicContact CG-CZ 3.74Å; K86-F88 PolarHBondContact O-N 3.06Å; K86-V90 HydrophobicContact CG-CG2 4.49Å
87	Y	95.8	Very high	96.9	Very high	245 Å²	245	52.9 Å²	52.9	96%	0.961	27%	0.265	S	S	*	.	S	Bend	trans	-82.3	-1	172	-60.9	-70.9	0	0	0	113.4
88	F	97.4	Very high	96.8	Very high	120 Å²	120	53.8 Å²	53.8	53%	0.526	27%	0.269	S	S	.	.	S	Bend	trans	-118	158.8	179.4	60	-97.5	0	0	0	111.3	L28 K86 V90	L28-F88 HydrophobicContact CD1-CE2 3.94Å; L28-F88 HydrophobicContact CD1-CZ 3.81Å; K86-F88 HydrophobicContact CB-CD1 4.02Å; K86-F88 HydrophobicContact CB-CD2 4.36Å; K86-F88 HydrophobicContact CB-CE1 3.84Å; K86-F88 HydrophobicContact CB-CE2 4.18Å; K86-F88 HydrophobicContact CB-CG 4.28Å; K86-F88 HydrophobicContact CB-CZ 3.92Å; K86-F88 HydrophobicContact CD-CE1 3.92Å; K86-F88 HydrophobicContact CD-CZ 3.88Å; K86-F88 HydrophobicContact CG-CE1 4.02Å; K86-F88 HydrophobicContact CG-CE2 4.19Å; K86-F88 HydrophobicContact CG-CZ 3.74Å; K86-F88 PolarHBondContact O-N 3.06Å; F88-V90 HydrophobicContact CD2-CG2 4.08Å; F88-V90 HydrophobicContact CE2-CG2 3.8Å
89	R	97.7	Very high	96.7	Very high	180 Å²	180	51 Å²	51	68%	0.679	26%	0.26	S	S	*	.			trans	-69.9	135.3	-178.2	-56.6	-179	-176	161.7	-0.5	111.3	N77 I78	N77-R89 HydrophobicContact CB-CB 4.4Å; N77-R89 CarbonylContact O-C 3.59Å; N77-R89 WeakPolarHBondContact O-CA 3.5Å; I78-R89 HydrophobicContact CG1-CG 3.91Å
90	V	97.8	Very high	96.6	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.024	27%	0.274	C	S	.	.			trans	-122.8	108	176.4	176.1	0	0	0	0	108.6	L28 N77 L80 K86 F88 M92	L28-V90 HydrophobicContact CD1-CG2 4.08Å; L28-V90 HydrophobicContact CD2-CG1 3.95Å; L28-V90 HydrophobicContact CD2-CG2 4.35Å; N77-V90 WeakPolarHBondContact CA-O 3.21Å; N77-V90 WeakPolarHBondContact CB-O 3.33Å; N77-V90 PolarHBondContact O-N 2.9Å; L80-V90 HydrophobicContact CD2-CG1 4.11Å; L80-V90 WeakPolarHBondContact CD2-O 3.47Å; L80-V90 HydrophobicContact CG-CB 4.38Å; L80-V90 HydrophobicContact CG-CG1 4.14Å; K86-V90 HydrophobicContact CG-CG2 4.49Å; F88-V90 HydrophobicContact CD2-CG2 4.08Å; F88-V90 HydrophobicContact CE2-CG2 3.8Å; V90-M92 VanDerWaalsContact CG1-O 3.31Å; V90-M92 WeakPolarHBondContact CG1-O 3.47Å
91	C	97.2	Very high	96.5	Very high	36 Å²	36	53 Å²	53	24%	0.243	27%	0.274	C	S	.	.	S	Bend	trans	-75.4	-29.6	174.6	-70	0	0	0	0	112.8	A48 T51 N77	A48-C91 VanDerWaalsContact CB-O 3.31Å; A48-C91 WeakPolarHBondContact CB-O 3.34Å; A48-C91 PolarHBondContact N-O 2.76Å; T51-C91 PolarHBondContact OG1-O 2.81Å; T51-C91 VanDerWaalsContact OG1-O 3.06Å; N77-C91 HydrophobicContact CB-CB 4.42Å; N77-C91 PolarHBondContact ND2-SG 3.47Å
92	M	97.9	Very high	96.3	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.005	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	158.5	-178.8	61.9	-172.9	70.9	0	0	111.4	G29 Y30 T33 I46 L47 T51 R55 I59 V90	G29-M92 PolarHBondContact N-O 3.07Å; Y30-M92 WeakPolarHBondContact CA-SD 3.43Å; Y30-M92 HydrophobicContact CD2-CE 4.12Å; Y30-M92 HydrophobicContact CD2-SD 3.96Å; Y30-M92 HydrophobicContact CG-SD 4.34Å; T33-M92 HydrophobicContact CG2-SD 4.37Å; I46-M92 CarbonylContact O-C 3.47Å; I46-M92 WeakPolarHBondContact O-CA 3.36Å; I46-M92 WeakPolarHBondContact O-CB 3.38Å; L47-M92 HydrophobicContact CD2-CB 3.49Å; L47-M92 VanDerWaalsContact CD2-CB 3.49Å; L47-M92 HydrophobicContact CD2-CE 4.26Å; L47-M92 HydrophobicContact CD2-CG 4.49Å; L47-M92 HydrophobicContact CD2-SD 4.31Å; T51-M92 HydrophobicContact CG2-CE 3.67Å; R55-M92 HydrophobicContact CB-CE 4.24Å; I59-M92 HydrophobicContact CD1-SD 4.12Å; I59-M92 HydrophobicContact CG1-CE 4.21Å; I59-M92 HydrophobicContact CG1-SD 3.77Å; V90-M92 VanDerWaalsContact CG1-O 3.31Å; V90-M92 WeakPolarHBondContact CG1-O 3.47Å
93	M	97.9	Very high	96.1	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	156.7	173.1	65.2	-177.7	-57.1	0	0	111.3	L17 Y26 V27 L28 V45 I46 L80 C84 I95	L17-M93 HydrophobicContact CD2-CE 4.04Å; L17-M93 HydrophobicContact CD2-SD 3.69Å; Y26-M93 HydrophobicContact CD2-CE 3.81Å; Y26-M93 HydrophobicContact CG-CE 3.9Å; V27-M93 CarbonylContact O-C 3.58Å; V27-M93 VanDerWaalsContact O-CA 3.27Å; V27-M93 WeakPolarHBondContact O-CA 3.49Å; V27-M93 WeakPolarHBondContact O-CB 3.4Å; L28-M93 HydrophobicContact CD2-CB 3.62Å; L28-M93 HydrophobicContact CD2-CE 4.16Å; V45-M93 WeakPolarHBondContact CA-O 3.34Å; I46-M93 HydrophobicContact CB-CG 3.82Å; I46-M93 HydrophobicContact CB-SD 4.5Å; I46-M93 HydrophobicContact CD1-CG 4.36Å; I46-M93 HydrophobicContact CD1-SD 4.17Å; I46-M93 HydrophobicContact CG1-CG 4.49Å; I46-M93 PolarHBondContact N-O 3.44Å; I46-M93 PolarHBondContact O-N 2.88Å; L80-M93 HydrophobicContact CD1-SD 4.35Å; C84-M93 PolarHBondContact SG-SD 3.26Å; M93-I95 HydrophobicContact CE-CG1 4.3Å
94	S	98	Very high	95.9	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	129.6	169.1	169.2	0	0	0	0	109.4	Y26 V27 T36 A42 L44	Y26-S94 CarbonylContact C-O 3.57Å; Y26-S94 WeakPolarHBondContact CA-O 3.27Å; Y26-S94 WeakPolarHBondContact CB-O 3.31Å; V27-S94 PolarHBondContact N-O 3.12Å; V27-S94 PolarHBondContact O-N 3.3Å; T36-S94 VanDerWaalsContact OG1-CB 3.24Å; T36-S94 WeakPolarHBondContact OG1-CB 3.43Å; T36-S94 PolarHBondContact OG1-OG 3.09Å; A42-S94 WeakPolarHBondContact CB-OG 3.45Å; L44-S94 CarbonylContact O-C 3.57Å; L44-S94 WeakPolarHBondContact O-CA 3.23Å
95	I	97.8	Very high	95.1	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	121.7	170.8	-57.4	-179.5	0	0	0	107.2	L17 V20 K43 L44 I46 M93 D97 I103	L17-I95 HydrophobicContact CD2-CD1 4.35Å; V20-I95 HydrophobicContact CG1-CD1 4.24Å; V20-I95 HydrophobicContact CG1-CG1 4.29Å; V20-I95 HydrophobicContact CG1-CG2 3.99Å; V20-I95 HydrophobicContact CG2-CD1 4.18Å; K43-I95 PolarHBondContact N-O 2.86Å; L44-I95 HydrophobicContact CB-CB 4.28Å; L44-I95 HydrophobicContact CB-CD1 4.47Å; L44-I95 HydrophobicContact CD2-CD1 4.07Å; L44-I95 PolarHBondContact N-O 2.98Å; L44-I95 PolarHBondContact O-N 3.15Å; I46-I95 HydrophobicContact CD1-CD1 3.92Å; M93-I95 HydrophobicContact CE-CG1 4.3Å; I95-D97 WeakPolarHBondContact CG2-O 3.21Å; I95-I103 HydrophobicContact CD1-CD1 3.71Å; I95-I103 HydrophobicContact CD1-CG1 4.38Å; I95-I103 HydrophobicContact CD1-CG2 3.79Å
96	T	97.5	Very high	93.4	Very high	32 Å²	32	62.5 Å²	62.5	20%	0.196	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-21.2	177.2	56.7	0	0	0	0	111.6	K25 T36 K41 K43	K25-T96 WeakPolarHBondContact CB-OG1 3.3Å; K25-T96 PolarHBondContact O-N 3.18Å; K25-T96 PolarHBondContact O-OG1 3.42Å; T36-T96 HydrophobicContact CG2-CG2 3.69Å; K41-T96 HydrophobicContact CB-CG2 4.28Å; K41-T96 WeakPolarHBondContact O-CA 3.31Å; K41-T96 WeakPolarHBondContact O-CB 3.41Å; K41-T96 WeakPolarHBondContact O-CG2 3.29Å; K43-T96 WeakPolarHBondContact CD-O 3.37Å; K43-T96 WeakPolarHBondContact CE-O 3.45Å
97	D	97.2	Very high	91.7	Very high	54 Å²	54	61 Å²	61	29%	0.289	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	129.7	171.1	-162.2	-12.1	0	0	0	110.3	G24 K25 K43 I95 G99	G24-D97 WeakPolarHBondContact CA-O 3.4Å; K25-D97 HydrophobicContact CB-CB 3.68Å; K25-D97 HydrophobicContact CD-CB 4.18Å; K25-D97 HydrophobicContact CG-CB 3.99Å; K25-D97 PolarHBondContact N-O 2.87Å; K25-D97 PolarHBondContact O-N 2.86Å; K43-D97 IonicContact NZ-OD1 3.97Å; I95-D97 WeakPolarHBondContact CG2-O 3.21Å; D97-G99 VanDerWaalsContact C-N 3.32Å; D97-G99 PolarHBondContact OD1-N 2.71Å
98	Q	95.3	Very high	89.6	Confident	45 Å²	45	54 Å²	54	21%	0.21	27%	0.271	C	S	.	.			trans	-77.7	-18.8	-179.7	56.3	176.7	71.7	0	0	113	D100 S101 I103 I104	Q98-D100 PolarHBondContact O-N 2.95Å; Q98-S101 WeakPolarHBondContact CB-O 3.42Å; Q98-S101 VanDerWaalsContact CD-O 3.25Å; Q98-S101 PolarHBondContact NE2-O 2.88Å; Q98-S101 VanDerWaalsContact O-CB 3.22Å; Q98-S101 WeakPolarHBondContact O-CB 3.34Å; Q98-S101 PolarHBondContact O-N 3.24Å; Q98-I103 HydrophobicContact CB-CG2 4.26Å; Q98-I104 HydrophobicContact CB-CD1 3.64Å; Q98-I104 HydrophobicContact CB-CG1 4.09Å; Q98-I104 HydrophobicContact CG-CD1 3.97Å
99	G	96.5	Very high	87.3	Confident	26 Å²	26	51.7 Å²	51.7	27%	0.268	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	-128.3	-168.1	0	0	0	0	0	110.5	D97 S101	D97-G99 VanDerWaalsContact C-N 3.32Å; D97-G99 PolarHBondContact OD1-N 2.71Å; G99-S101 VanDerWaalsContact C-N 3.26Å; G99-S101 PolarHBondContact O-N 3.01Å
100	D	94.6	Very high	85	Confident	134 Å²	134	51.2 Å²	51.2	72%	0.717	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-0.3	-178.9	-56.6	-36.5	0	0	0	113.7	S23 Q98	S23-D100 PolarHBondContact OG-N 2.82Å; Q98-D100 PolarHBondContact O-N 2.95Å
101	S	94.3	Very high	82.4	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.014	32%	0.316	C	S	.	.			trans	-82.7	142.8	-176.7	-168.2	0	0	0	0	112.5	R16 V20 Q98 G99 I103	R16-S101 PolarHBondContact O-OG 2.92Å; V20-S101 VanDerWaalsContact CG2-CB 3.47Å; Q98-S101 WeakPolarHBondContact CB-O 3.42Å; Q98-S101 VanDerWaalsContact CD-O 3.25Å; Q98-S101 PolarHBondContact NE2-O 2.88Å; Q98-S101 VanDerWaalsContact O-CB 3.22Å; Q98-S101 WeakPolarHBondContact O-CB 3.34Å; Q98-S101 PolarHBondContact O-N 3.24Å; G99-S101 VanDerWaalsContact C-N 3.26Å; G99-S101 PolarHBondContact O-N 3.01Å; S101-I103 PolarHBondContact O-N 3.3Å; S101-I103 WeakPolarHBondContact OG-CB 3.34Å; S101-I103 PolarHBondContact OG-N 3.4Å
102	D	91.6	Very high	79.3	Confident	66 Å²	66	55.1 Å²	55.1	35%	0.353	33%	0.326	S	S	.	.			trans	-85.6	10.7	172	71.5	-32.7	0	0	0	113.1	R16 I104 R105	R16-D102 WeakPolarHBondContact CD-OD1 3.42Å; R16-D102 VanDerWaalsContact CG-OD1 3.25Å; R16-D102 WeakPolarHBondContact CG-OD1 3.45Å; R16-D102 IonicContact CZ-OD1 3.49Å; R16-D102 IonicContact CZ-OD2 3.8Å; R16-D102 IonicContact NE-OD1 3.29Å; R16-D102 PolarHBondContact NE-OD1 3.25Å; R16-D102 IonicContact NE-OD2 2.85Å; R16-D102 PolarHBondContact NE-OD2 3.24Å; R16-D102 IonicContact NH2-OD1 2.9Å; R16-D102 IonicContact NH2-OD2 3.93Å; R16-D102 PolarHBondContact NH2-OD2 3.03Å; D102-I104 VanDerWaalsContact C-N 3.26Å; D102-I104 PolarHBondContact O-N 2.82Å; D102-I104 VanDerWaalsContact O-N 3.09Å; D102-R105 PolarHBondContact O-N 3.18Å; D102-R105 VanDerWaalsContact O-N 3.1Å
103	I	93	Very high	76	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-55.1	-34.2	-168.6	-157.8	164.5	0	0	0	114.9	I13 R16 L17 V20 L44 I46 I95 Q98 S101 T106	I13-I103 HydrophobicContact CD1-CD1 3.6Å; I13-I103 HydrophobicContact CD1-CG1 3.63Å; R16-I103 HydrophobicContact CB-CB 4.01Å; R16-I103 HydrophobicContact CB-CD1 3.91Å; R16-I103 HydrophobicContact CB-CG1 3.94Å; L17-I103 HydrophobicContact CD2-CD1 3.88Å; L17-I103 HydrophobicContact CG-CD1 3.91Å; V20-I103 HydrophobicContact CG2-CB 4.49Å; V20-I103 HydrophobicContact CG2-CD1 4.42Å; V20-I103 HydrophobicContact CG2-CG2 3.83Å; L44-I103 HydrophobicContact CD2-CD1 4.32Å; L44-I103 HydrophobicContact CD2-CG1 3.79Å; L44-I103 HydrophobicContact CD2-CG2 4.31Å; I46-I103 HydrophobicContact CD1-CD1 4.07Å; I95-I103 HydrophobicContact CD1-CD1 3.71Å; I95-I103 HydrophobicContact CD1-CG1 4.38Å; I95-I103 HydrophobicContact CD1-CG2 3.79Å; Q98-I103 HydrophobicContact CB-CG2 4.26Å; S101-I103 PolarHBondContact O-N 3.3Å; S101-I103 WeakPolarHBondContact OG-CB 3.34Å; S101-I103 PolarHBondContact OG-N 3.4Å; I103-T106 PolarHBondContact O-OG1 3.19Å
104	I	89.7	Confident	73	Confident	37 Å²	37	73 Å²	73	19%	0.19	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-76.4	-31.5	-175.8	-61.1	173	0	0	0	111.3	K43 L44 Q98 D102 T106 V107	K43-I104 HydrophobicContact CB-CD1 3.42Å; K43-I104 VanDerWaalsContact CB-CD1 3.42Å; K43-I104 HydrophobicContact CB-CG1 4.27Å; K43-I104 HydrophobicContact CD-CD1 3.58Å; K43-I104 HydrophobicContact CG-CD1 4.15Å; L44-I104 HydrophobicContact CB-CG1 4.27Å; Q98-I104 HydrophobicContact CB-CD1 3.64Å; Q98-I104 HydrophobicContact CB-CG1 4.09Å; Q98-I104 HydrophobicContact CG-CD1 3.97Å; D102-I104 VanDerWaalsContact C-N 3.26Å; D102-I104 PolarHBondContact O-N 2.82Å; D102-I104 VanDerWaalsContact O-N 3.09Å; I104-T106 PolarHBondContact O-N 2.89Å; I104-T106 VanDerWaalsContact O-N 3.11Å; I104-V107 PolarHBondContact O-N 3.49Å
105	R	78.5	Confident	69.7	Low	209 Å²	209	81.9 Å²	81.9	79%	0.789	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-64.9	-21.7	-173.2	-64.1	-174.5	178.5	-164.3	0.8	113.6	D102	D102-R105 PolarHBondContact O-N 3.18Å; D102-R105 VanDerWaalsContact O-N 3.1Å
106	T	60.1	Low	68.3	Low	67 Å²	67	86 Å²	86	41%	0.411	50%	0.495	S	S	.	.	G	3₁₀ helix	trans	-94.9	-7	-170.4	60.6	0	0	0	0	114.9	R16 I103 I104	R16-T106 PolarHBondContact NH1-OG1 2.87Å; I103-T106 PolarHBondContact O-OG1 3.19Å; I104-T106 PolarHBondContact O-N 2.89Å; I104-T106 VanDerWaalsContact O-N 3.11Å
107	V	60.5	Low	66.7	Low	23 Å²	23	88.8 Å²	88.8	14%	0.139	51%	0.511	C	S	.	.	S	Bend	trans	-95.2	119.5	176.9	-174.4	0	0	0	0	107.4	L44 H71 I104 S109	L44-V107 HydrophobicContact CD1-CB 4.05Å; L44-V107 HydrophobicContact CD1-CG1 4.21Å; L44-V107 HydrophobicContact CD1-CG2 3.49Å; L44-V107 VanDerWaalsContact CD1-CG2 3.49Å; L44-V107 HydrophobicContact CD2-CG2 4.3Å; H71-V107 HydrophobicContact CB-CG2 4.29Å; I104-V107 PolarHBondContact O-N 3.49Å; V107-S109 PolarHBondContact O-N 3Å
108	P	51.2	Low	65.1	Low	99 Å²	99	90.8 Å²	90.8	64%	0.643	52%	0.524	S	S	*	.			trans	-55.8	108.4	173.3	-19	29.8	0	0	0	107.8	I110	P108-I110 PolarHBondContact O-N 2.57Å; P108-I110 VanDerWaalsContact O-N 3.15Å
109	S	50	Low	63.3	Low	70 Å²	70	93.5 Å²	93.5	49%	0.49	54%	0.542	S	S	.	.			trans	-64.8	113.6	160.1	48.1	0	0	0	0	104.8	V107 G111 G112	V107-S109 PolarHBondContact O-N 3Å; S109-G111 PolarHBondContact O-N 2.91Å; S109-G112 PolarHBondContact O-N 3.1Å
110	I	48.6	Very low	61.2	Low	171 Å²	171	97.7 Å²	97.7	88%	0.877	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	93.1	174.5	-59.9	169.4	0	0	0	105.6	P108	P108-I110 PolarHBondContact O-N 2.57Å; P108-I110 VanDerWaalsContact O-N 3.15Å
111	G	42	Very low	59	Low	77 Å²	77	95.3 Å²	95.3	79%	0.794	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	146.7	-4.1	-172.9	0	0	0	0	0	116.5	S109	S109-G111 PolarHBondContact O-N 2.91Å
112	G	32.3	Very low	56.4	Low	45 Å²	45	101.9 Å²	101.9	46%	0.464	59%	0.587	S	S	.	*			trans	-93.5	101	169.1	0	0	0	0	0	111.2	S109 Q114	S109-G112 PolarHBondContact O-N 3.1Å; G112-Q114 PolarHBondContact O-N 3.46Å
113	E	29.1	Very low	53.7	Low	191 Å²	191	104.7 Å²	104.7	89%	0.893	61%	0.605	S	S	*	*			trans	-50.4	106.5	160.3	-66.2	172.5	147.2	0	0	108.3
114	Q	34.5	Very low	50.5	Low	184 Å²	184	113.4 Å²	113.4	86%	0.86	66%	0.655	S	S	*	*			trans	-94.7	97.3	166.4	-72.8	-179.9	50.8	0	0	106.1	G112	G112-Q114 PolarHBondContact O-N 3.46Å
115	S	29.3	Very low	46.9	Very low	188 Å²	188	120.4 Å²	120.4	100%	1.315	70%	0.698	S	S	*	*			trans	-71.9	0	159.7	-57.8	0	0	0	0	110.1

Retrieved 115 of 115 residues in 89.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).