A0A077Z410_TRITR Loading...

Membrane magnesium transporter

Part of the endoplasmic reticulum membrane protein complex (EMC) that enables the energy-independent insertion into endoplasmic reticulum membranes of newly synthesized membrane proteins. May be involved in Mg(2+) transport.

AlphaFold DB , UniProt , Accession A0A077Z410, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 115 aa.

						>A0A077Z410_TRITR|A0A077Z410
MRRKPVAKNCLLLGVIVLIHCTYSGASHRSYLRILKRDYRFLPADIIVECLVALVIIIISASAVGGDFVPIRIDVQMSSKSLANLFDGVSFFVFNHRGRVIASALEENFTSPSLQ
					

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	53	Low	81.7	Confident	208 Å²	208	116.2 Å²	116.2	100%	1.025	55%	0.549	S	S	*	.				0	32.6	0	-146.9	166.1	162.7	0	0	114
2	R	59.9	Low	82.9	Confident	224 Å²	224	114.6 Å²	114.6	85%	0.845	55%	0.546	S	S	*	.			trans	-110.1	15.7	-178.6	-165.6	178.3	145.8	-166	-6.1	113.5	P5	R2-P5 VanDerWaalsContact O-CD 3.29Å; R2-P5 WeakPolarHBondContact O-CD 3.48Å; R2-P5 WeakPolarHBondContact O-CG 3.41Å
3	R	64.7	Low	83.9	Confident	219 Å²	219	114.2 Å²	114.2	83%	0.826	55%	0.548	S	S	*	.			trans	-79.6	-19.7	-176	-67.1	-171.8	179.8	-172.5	0.8	114.1	V6 A7	R3-V6 PolarHBondContact O-N 3.21Å; R3-V6 VanDerWaalsContact O-N 3.09Å; R3-A7 PolarHBondContact O-N 3.13Å; R3-A7 VanDerWaalsContact O-N 3.11Å
4	K	73.8	Confident	84.8	Confident	132 Å²	132	106.1 Å²	106.1	57%	0.574	51%	0.51	S	S	*	.	H	α-helix	trans	-52.6	-45.8	-177.4	-58.8	-170.1	179.3	-172.2	0	114.7	V6 K8	K4-V6 VanDerWaalsContact C-N 3.34Å; K4-V6 PolarHBondContact O-N 3.46Å; K4-K8 PolarHBondContact O-N 3.14Å; K4-K8 VanDerWaalsContact O-N 3.12Å
5	P	86.4	Confident	85.7	Confident	67 Å²	67	103.3 Å²	103.3	44%	0.435	50%	0.501	S	S	.	.	H	α-helix	trans	-65.7	-36.2	178.4	25.2	-35.5	0	0	0	112.6	R2 K8 N9	R2-P5 VanDerWaalsContact O-CD 3.29Å; R2-P5 WeakPolarHBondContact O-CD 3.48Å; R2-P5 WeakPolarHBondContact O-CG 3.41Å; P5-K8 PolarHBondContact O-N 2.95Å; P5-N9 WeakPolarHBondContact O-CB 3.35Å; P5-N9 PolarHBondContact O-N 3.09Å; P5-N9 PolarHBondContact O-ND2 3.18Å; P5-N9 PolarHBondContact O-OD1 3.23Å
6	V	90.7	Very high	86.4	Confident	100 Å²	100	103.6 Å²	103.6	61%	0.606	51%	0.505	S	S	*	.	H	α-helix	trans	-66.9	-46.1	-179.3	-177.8	0	0	0	0	110.6	R3 K4 K8 N9 C10	R3-V6 PolarHBondContact O-N 3.21Å; R3-V6 VanDerWaalsContact O-N 3.09Å; K4-V6 VanDerWaalsContact C-N 3.34Å; K4-V6 PolarHBondContact O-N 3.46Å; V6-K8 VanDerWaalsContact C-N 3.33Å; V6-K8 PolarHBondContact O-N 3.35Å; V6-N9 PolarHBondContact O-N 3.27Å; V6-C10 WeakPolarHBondContact O-CB 3.48Å; V6-C10 PolarHBondContact O-N 3.27Å
7	A	91.5	Very high	87	Confident	13 Å²	13	100.4 Å²	100.4	11%	0.107	49%	0.493	C	S	.	.	H	α-helix	trans	-61.3	-42	177.2	0	0	0	0	0	111.8	R3 C10 L11 A63 V64	R3-A7 PolarHBondContact O-N 3.13Å; R3-A7 VanDerWaalsContact O-N 3.11Å; A7-C10 PolarHBondContact O-N 3.14Å; A7-L11 WeakPolarHBondContact O-CB 3.35Å; A7-L11 PolarHBondContact O-N 3.06Å; A7-A63 HydrophobicContact CB-CB 3.78Å; A7-V64 HydrophobicContact CB-CG2 3.91Å
8	K	93	Very high	87.6	Confident	129 Å²	129	98.1 Å²	98.1	56%	0.561	48%	0.482	S	S	*	.	H	α-helix	trans	-63	-44.2	175.6	-174.3	179.5	177.3	-178	0	112.1	K4 P5 V6 L11 L12	K4-K8 PolarHBondContact O-N 3.14Å; K4-K8 VanDerWaalsContact O-N 3.12Å; P5-K8 PolarHBondContact O-N 2.95Å; V6-K8 VanDerWaalsContact C-N 3.33Å; V6-K8 PolarHBondContact O-N 3.35Å; K8-L11 WeakPolarHBondContact O-CB 3.48Å; K8-L11 PolarHBondContact O-N 3.36Å; K8-L12 WeakPolarHBondContact O-CG 3.35Å; K8-L12 PolarHBondContact O-N 3.47Å
9	N	95	Very high	88.1	Confident	93 Å²	93	98.4 Å²	98.4	50%	0.497	49%	0.485	S	S	.	.	H	α-helix	trans	-64.8	-41.2	177.9	-67.4	-12.2	0	0	0	111.4	P5 V6 L11 L12 L13	P5-N9 WeakPolarHBondContact O-CB 3.35Å; P5-N9 PolarHBondContact O-N 3.09Å; P5-N9 PolarHBondContact O-ND2 3.18Å; P5-N9 PolarHBondContact O-OD1 3.23Å; V6-N9 PolarHBondContact O-N 3.27Å; N9-L11 VanDerWaalsContact C-N 3.33Å; N9-L11 PolarHBondContact O-N 2.89Å; N9-L12 PolarHBondContact O-N 3.17Å; N9-L13 WeakPolarHBondContact O-CG 3.5Å; N9-L13 PolarHBondContact O-N 3.49Å
10	C	94.8	Very high	88.5	Confident	50 Å²	50	98.5 Å²	98.5	34%	0.338	48%	0.484	S	S	.	.	H	α-helix	trans	-61.7	-41.6	175	-163.9	0	0	0	0	111.7	V6 A7 L13 G14 S60	V6-C10 WeakPolarHBondContact O-CB 3.48Å; V6-C10 PolarHBondContact O-N 3.27Å; A7-C10 PolarHBondContact O-N 3.14Å; C10-L13 PolarHBondContact O-N 3.24Å; C10-G14 PolarHBondContact O-N 3.34Å; C10-S60 WeakPolarHBondContact CB-OG 3.47Å; C10-S60 PolarHBondContact SG-OG 2.88Å
11	L	95.8	Very high	88.9	Confident	43 Å²	43	94.1 Å²	94.1	23%	0.225	46%	0.463	C	S	.	.	H	α-helix	trans	-61.7	-46	174.6	-177.9	62.5	0	0	0	111.7	A7 K8 N9 L13 G14 V15 I57 A61 V64	A7-L11 WeakPolarHBondContact O-CB 3.35Å; A7-L11 PolarHBondContact O-N 3.06Å; K8-L11 WeakPolarHBondContact O-CB 3.48Å; K8-L11 PolarHBondContact O-N 3.36Å; N9-L11 VanDerWaalsContact C-N 3.33Å; N9-L11 PolarHBondContact O-N 2.89Å; L11-L13 PolarHBondContact O-N 2.9Å; L11-G14 PolarHBondContact O-N 3.28Å; L11-V15 WeakPolarHBondContact O-CG2 3.38Å; L11-V15 PolarHBondContact O-N 3.02Å; L11-I57 HydrophobicContact CD1-CB 4.49Å; L11-I57 HydrophobicContact CD1-CG1 4.5Å; L11-I57 HydrophobicContact CD1-CG2 4.03Å; L11-A61 HydrophobicContact CD1-CB 4.24Å; L11-V64 HydrophobicContact CD2-CG2 4.34Å
12	L	96.3	Very high	90.9	Very high	97 Å²	97	88.3 Å²	88.3	51%	0.508	44%	0.439	S	S	.	.	H	α-helix	trans	-60.7	-44.8	176.7	-72	169.9	0	0	0	111.7	K8 N9 V15 I16	K8-L12 WeakPolarHBondContact O-CG 3.35Å; K8-L12 PolarHBondContact O-N 3.47Å; N9-L12 PolarHBondContact O-N 3.17Å; L12-V15 PolarHBondContact O-N 2.99Å; L12-I16 WeakPolarHBondContact O-CG1 3.42Å; L12-I16 PolarHBondContact O-N 3.33Å
13	L	96.3	Very high	92.7	Very high	110 Å²	110	85.2 Å²	85.2	58%	0.576	43%	0.429	S	S	*	.	H	α-helix	trans	-61.5	-44.9	175.6	-71	171.2	0	0	0	111.6	N9 C10 L11 V15 I16 V17	N9-L13 WeakPolarHBondContact O-CG 3.5Å; N9-L13 PolarHBondContact O-N 3.49Å; C10-L13 PolarHBondContact O-N 3.24Å; L11-L13 PolarHBondContact O-N 2.9Å; L13-V15 VanDerWaalsContact C-N 3.31Å; L13-V15 PolarHBondContact O-N 3.41Å; L13-I16 PolarHBondContact O-N 2.88Å; L13-I16 VanDerWaalsContact O-N 3.16Å; L13-V17 WeakPolarHBondContact O-CG2 3.33Å; L13-V17 PolarHBondContact O-N 2.95Å
14	G	96.5	Very high	94.2	Very high	1 Å²	1	76.2 Å²	76.2	1%	0.01	40%	0.4	C	S	.	.	H	α-helix	trans	-58.5	-41	176	0	0	0	0	0	112.8	C10 L11 V17 L18	C10-G14 PolarHBondContact O-N 3.34Å; L11-G14 PolarHBondContact O-N 3.28Å; G14-V17 PolarHBondContact O-N 3.49Å; G14-L18 WeakPolarHBondContact O-CB 3.46Å; G14-L18 PolarHBondContact O-N 3.44Å
15	V	97.4	Very high	95.2	Very high	64 Å²	64	70.7 Å²	70.7	39%	0.388	38%	0.38	S	S	.	.	H	α-helix	trans	-65.4	-41.3	175.2	172.3	0	0	0	0	111.6	L11 L12 L13 L18 I19 I57	L11-V15 WeakPolarHBondContact O-CG2 3.38Å; L11-V15 PolarHBondContact O-N 3.02Å; L12-V15 PolarHBondContact O-N 2.99Å; L13-V15 VanDerWaalsContact C-N 3.31Å; L13-V15 PolarHBondContact O-N 3.41Å; V15-L18 PolarHBondContact O-N 3.42Å; V15-I19 HydrophobicContact CG1-CD1 4.02Å; V15-I19 WeakPolarHBondContact O-CG1 3.36Å; V15-I19 PolarHBondContact O-N 2.87Å; V15-I57 HydrophobicContact CG2-CD1 4.37Å
16	I	97.8	Very high	95.6	Very high	108 Å²	108	70 Å²	70	55%	0.554	38%	0.38	S	S	*	.	H	α-helix	trans	-62.4	-44.6	176.4	-68.4	164.7	0	0	0	110.8	L12 L13 L18 I19 H20	L12-I16 WeakPolarHBondContact O-CG1 3.42Å; L12-I16 PolarHBondContact O-N 3.33Å; L13-I16 PolarHBondContact O-N 2.88Å; L13-I16 VanDerWaalsContact O-N 3.16Å; I16-L18 VanDerWaalsContact C-N 3.33Å; I16-L18 PolarHBondContact O-N 3.32Å; I16-I19 PolarHBondContact O-N 2.92Å; I16-H20 PolarHBondContact O-N 2.89Å
17	V	96.7	Very high	95.7	Very high	49 Å²	49	67.5 Å²	67.5	30%	0.297	37%	0.367	S	S	.	.	H	α-helix	trans	-64.2	-39.2	176.3	179.4	0	0	0	0	110.8	L13 G14 I19 H20 C21 E49 A53	L13-V17 WeakPolarHBondContact O-CG2 3.33Å; L13-V17 PolarHBondContact O-N 2.95Å; G14-V17 PolarHBondContact O-N 3.49Å; V17-I19 PolarHBondContact O-N 3.44Å; V17-H20 WeakPolarHBondContact O-CB 3.48Å; V17-H20 PolarHBondContact O-N 3.36Å; V17-C21 WeakPolarHBondContact O-CB 3.33Å; V17-C21 PolarHBondContact O-N 3.19Å; V17-E49 HydrophobicContact CG1-CG 3.81Å; V17-A53 HydrophobicContact CB-CB 4.17Å; V17-A53 HydrophobicContact CG1-CB 3.84Å
18	L	96.7	Very high	95.9	Very high	59 Å²	59	69 Å²	69	31%	0.309	37%	0.371	S	S	.	.	H	α-helix	trans	-63	-42.4	175.4	-173.2	64.3	0	0	0	111.6	G14 V15 I16 H20 C21 T22 A53 I57	G14-L18 WeakPolarHBondContact O-CB 3.46Å; G14-L18 PolarHBondContact O-N 3.44Å; V15-L18 PolarHBondContact O-N 3.42Å; I16-L18 VanDerWaalsContact C-N 3.33Å; I16-L18 PolarHBondContact O-N 3.32Å; L18-H20 VanDerWaalsContact C-N 3.34Å; L18-H20 PolarHBondContact O-N 3.03Å; L18-C21 WeakPolarHBondContact O-CB 3.34Å; L18-C21 PolarHBondContact O-N 2.96Å; L18-T22 WeakPolarHBondContact O-CG2 3.49Å; L18-T22 PolarHBondContact O-N 2.98Å; L18-A53 HydrophobicContact CB-CB 4.22Å; L18-A53 HydrophobicContact CD1-CB 4.42Å; L18-I57 HydrophobicContact CB-CD1 4.08Å; L18-I57 HydrophobicContact CD2-CD1 3.77Å; L18-I57 HydrophobicContact CG-CD1 4.5Å
19	I	97.6	Very high	95.8	Very high	104 Å²	104	70.4 Å²	70.4	53%	0.533	37%	0.373	S	S	.	.	H	α-helix	trans	-60.5	-45.4	173.8	-69	166.1	0	0	0	110.3	V15 I16 V17 C21 T22 Y23	V15-I19 HydrophobicContact CG1-CD1 4.02Å; V15-I19 WeakPolarHBondContact O-CG1 3.36Å; V15-I19 PolarHBondContact O-N 2.87Å; I16-I19 PolarHBondContact O-N 2.92Å; V17-I19 PolarHBondContact O-N 3.44Å; I19-C21 PolarHBondContact O-N 3.2Å; I19-T22 PolarHBondContact O-N 3.49Å; I19-T22 PolarHBondContact O-OG1 3.15Å; I19-Y23 PolarHBondContact O-N 2.72Å
20	H	96.6	Very high	95.7	Very high	100 Å²	100	68.7 Å²	68.7	46%	0.463	37%	0.368	S	S	.	.	H	α-helix	trans	-57.6	-48.4	176.3	-177.9	-95.1	0	0	0	111.8	I16 V17 L18 T22 Y23 S24 E49	I16-H20 PolarHBondContact O-N 2.89Å; V17-H20 WeakPolarHBondContact O-CB 3.48Å; V17-H20 PolarHBondContact O-N 3.36Å; L18-H20 VanDerWaalsContact C-N 3.34Å; L18-H20 PolarHBondContact O-N 3.03Å; H20-T22 VanDerWaalsContact C-N 3.34Å; H20-T22 PolarHBondContact O-N 3.1Å; H20-Y23 WeakPolarHBondContact O-CB 3.44Å; H20-Y23 PolarHBondContact O-N 3.27Å; H20-Y23 VanDerWaalsContact O-N 3.16Å; H20-S24 PolarHBondContact O-N 2.9Å; H20-S24 PolarHBondContact O-OG 3.34Å; H20-E49 IonicContact CE1-OE1 3.62Å; H20-E49 IonicContact CE1-OE2 3.64Å; H20-E49 IonicContact CG-OE1 3.97Å; H20-E49 IonicContact ND1-OE1 2.71Å; H20-E49 PolarHBondContact ND1-OE1 3.33Å; H20-E49 IonicContact ND1-OE2 3.96Å; H20-E49 PolarHBondContact ND1-OE2 3.07Å
21	C	96.1	Very high	95.7	Very high	7 Å²	7	72.9 Å²	72.9	5%	0.047	38%	0.378	C	S	.	.	H	α-helix	trans	-56.6	-45.1	174.9	173.1	0	0	0	0	112.3	V17 L18 I19 Y23 S24 G25 I46 E49 C50	V17-C21 WeakPolarHBondContact O-CB 3.33Å; V17-C21 PolarHBondContact O-N 3.19Å; L18-C21 WeakPolarHBondContact O-CB 3.34Å; L18-C21 PolarHBondContact O-N 2.96Å; I19-C21 PolarHBondContact O-N 3.2Å; C21-Y23 VanDerWaalsContact C-N 3.33Å; C21-Y23 PolarHBondContact O-N 2.92Å; C21-S24 PolarHBondContact O-N 3.37Å; C21-G25 PolarHBondContact O-N 3.16Å; C21-I46 PolarHBondContact SG-O 3.34Å; C21-E49 HydrophobicContact CB-CG 4.26Å; C21-C50 WeakPolarHBondContact SG-CB 3.47Å
22	T	95.8	Very high	95.5	Very high	86 Å²	86	71.8 Å²	71.8	53%	0.528	37%	0.372	S	S	.	.	H	α-helix	trans	-64.4	-38.8	178.5	61.7	0	0	0	0	112.1	L18 I19 H20 G25 A26	L18-T22 WeakPolarHBondContact O-CG2 3.49Å; L18-T22 PolarHBondContact O-N 2.98Å; I19-T22 PolarHBondContact O-N 3.49Å; I19-T22 PolarHBondContact O-OG1 3.15Å; H20-T22 VanDerWaalsContact C-N 3.34Å; H20-T22 PolarHBondContact O-N 3.1Å; T22-G25 PolarHBondContact O-N 2.95Å; T22-A26 WeakPolarHBondContact O-CB 3.47Å; T22-A26 PolarHBondContact O-N 2.97Å
23	Y	97	Very high	95.3	Very high	159 Å²	159	75.8 Å²	75.8	62%	0.624	38%	0.381	S	S	*	.	H	α-helix	trans	-65	-44.4	175.9	179.8	-96.4	0	0	0	111.8	I19 H20 C21 G25 A26 S27	I19-Y23 PolarHBondContact O-N 2.72Å; H20-Y23 WeakPolarHBondContact O-CB 3.44Å; H20-Y23 PolarHBondContact O-N 3.27Å; H20-Y23 VanDerWaalsContact O-N 3.16Å; C21-Y23 VanDerWaalsContact C-N 3.33Å; C21-Y23 PolarHBondContact O-N 2.92Å; Y23-G25 PolarHBondContact O-N 3.46Å; Y23-A26 PolarHBondContact O-N 3.19Å; Y23-S27 WeakPolarHBondContact O-CB 3.42Å; Y23-S27 PolarHBondContact O-N 3.48Å; Y23-S27 PolarHBondContact O-OG 3.23Å
24	S	95.7	Very high	95.2	Very high	30 Å²	30	77.1 Å²	77.1	21%	0.21	39%	0.387	C	S	.	.	H	α-helix	trans	-60.4	-44.2	175.4	-65.7	0	0	0	0	111.7	H20 C21 S27 H28	H20-S24 PolarHBondContact O-N 2.9Å; H20-S24 PolarHBondContact O-OG 3.34Å; C21-S24 PolarHBondContact O-N 3.37Å; S24-S27 PolarHBondContact O-N 2.91Å; S24-H28 WeakPolarHBondContact O-CB 3.31Å; S24-H28 PolarHBondContact O-N 3.5Å
25	G	95	Very high	95.1	Very high	16 Å²	16	81.5 Å²	81.5	17%	0.165	41%	0.41	C	S	.	.	H	α-helix	trans	-63	-43.5	175.5	0	0	0	0	0	113.1	C21 T22 Y23 H28 R29	C21-G25 PolarHBondContact O-N 3.16Å; T22-G25 PolarHBondContact O-N 2.95Å; Y23-G25 PolarHBondContact O-N 3.46Å; G25-H28 PolarHBondContact O-N 3.37Å; G25-R29 WeakPolarHBondContact O-CB 3.35Å; G25-R29 PolarHBondContact O-N 3.2Å
26	A	94.8	Very high	94.7	Very high	53 Å²	53	87.9 Å²	87.9	44%	0.438	43%	0.432	S	S	.	.	H	α-helix	trans	-65.6	-41	177.5	0	0	0	0	0	112.3	T22 Y23 R29 S30	T22-A26 WeakPolarHBondContact O-CB 3.47Å; T22-A26 PolarHBondContact O-N 2.97Å; Y23-A26 PolarHBondContact O-N 3.19Å; A26-R29 PolarHBondContact O-N 3.47Å; A26-S30 WeakPolarHBondContact O-CB 3.48Å; A26-S30 PolarHBondContact O-N 3.42Å; A26-S30 PolarHBondContact O-OG 3.42Å
27	S	94.4	Very high	94.2	Very high	46 Å²	46	90.6 Å²	90.6	32%	0.322	44%	0.435	S	S	.	.	H	α-helix	trans	-64.7	-46	176.4	-62	0	0	0	0	111.2	Y23 S24 R29 S30 Y31	Y23-S27 WeakPolarHBondContact O-CB 3.42Å; Y23-S27 PolarHBondContact O-N 3.48Å; Y23-S27 PolarHBondContact O-OG 3.23Å; S24-S27 PolarHBondContact O-N 2.91Å; S27-R29 VanDerWaalsContact C-N 3.33Å; S27-R29 PolarHBondContact O-N 3.34Å; S27-S30 PolarHBondContact O-N 3.45Å; S27-Y31 WeakPolarHBondContact O-CB 3.32Å; S27-Y31 PolarHBondContact O-N 3.39Å
28	H	93.9	Very high	93.7	Very high	44 Å²	44	93.3 Å²	93.3	20%	0.204	45%	0.448	C	S	.	.	H	α-helix	trans	-59.7	-42.5	175.6	178.5	-101.5	0	0	0	112.1	S24 G25 S30 Y31 L32 P43 I46	S24-H28 WeakPolarHBondContact O-CB 3.31Å; S24-H28 PolarHBondContact O-N 3.5Å; G25-H28 PolarHBondContact O-N 3.37Å; H28-S30 VanDerWaalsContact C-N 3.34Å; H28-S30 PolarHBondContact O-N 2.86Å; H28-Y31 PolarHBondContact O-N 3.49Å; H28-L32 WeakPolarHBondContact CE1-CD1 3.3Å; H28-L32 PolarHBondContact O-N 3.26Å; H28-P43 VanDerWaalsContact CE1-CD 3.42Å; H28-P43 WeakPolarHBondContact CE1-CD 3.43Å; H28-I46 HydrophobicContact CB-CD1 4.31Å
29	R	92	Very high	93	Very high	159 Å²	159	96.6 Å²	96.6	60%	0.6	46%	0.457	S	S	*	.	H	α-helix	trans	-64.8	-38.1	176.6	-167.3	-180	-176.2	-164.7	2	112.2	G25 A26 S27 R33	G25-R29 WeakPolarHBondContact O-CB 3.35Å; G25-R29 PolarHBondContact O-N 3.2Å; A26-R29 PolarHBondContact O-N 3.47Å; S27-R29 VanDerWaalsContact C-N 3.33Å; S27-R29 PolarHBondContact O-N 3.34Å; R29-R33 PolarHBondContact O-N 3.39Å
30	S	93.2	Very high	92.3	Very high	57 Å²	57	98.6 Å²	98.6	40%	0.399	46%	0.458	S	S	.	.	H	α-helix	trans	-68.1	-40.4	176.8	-59.2	0	0	0	0	111.6	A26 S27 H28 R33 I34	A26-S30 WeakPolarHBondContact O-CB 3.48Å; A26-S30 PolarHBondContact O-N 3.42Å; A26-S30 PolarHBondContact O-OG 3.42Å; S27-S30 PolarHBondContact O-N 3.45Å; H28-S30 VanDerWaalsContact C-N 3.34Å; H28-S30 PolarHBondContact O-N 2.86Å; S30-R33 WeakPolarHBondContact O-CB 3.32Å; S30-R33 PolarHBondContact O-N 2.88Å; S30-I34 WeakPolarHBondContact O-CG1 3.33Å; S30-I34 PolarHBondContact O-N 3.43Å
31	Y	93.3	Very high	91.8	Very high	139 Å²	139	102.2 Å²	102.2	55%	0.545	47%	0.473	S	S	.	.	H	α-helix	trans	-60.6	-46.8	175.4	177.4	-109.6	0	0	0	112.5	S27 H28 R33 I34 L35	S27-Y31 WeakPolarHBondContact O-CB 3.32Å; S27-Y31 PolarHBondContact O-N 3.39Å; H28-Y31 PolarHBondContact O-N 3.49Å; Y31-R33 VanDerWaalsContact C-N 3.28Å; Y31-R33 PolarHBondContact O-N 2.89Å; Y31-I34 PolarHBondContact O-N 2.87Å; Y31-L35 HydrophobicContact CD1-CD1 3.97Å; Y31-L35 HydrophobicContact CE1-CD1 3.34Å; Y31-L35 HydrophobicContact CE1-CG 4.35Å; Y31-L35 HydrophobicContact CE2-CD1 4Å; Y31-L35 HydrophobicContact CE2-CG 4.29Å; Y31-L35 PolarHBondContact O-N 3.49Å; Y31-L35 VanDerWaalsContact O-N 3.09Å
32	L	93	Very high	91.4	Very high	19 Å²	19	104.3 Å²	104.3	10%	0.099	48%	0.483	C	S	.	.	H	α-helix	trans	-62.8	-33.8	177.2	-72.8	175.9	0	0	0	113	H28 L35 K36 R37 Y39	H28-L32 WeakPolarHBondContact CE1-CD1 3.3Å; H28-L32 PolarHBondContact O-N 3.26Å; L32-L35 PolarHBondContact O-N 3.16Å; L32-K36 PolarHBondContact O-N 3Å; L32-K36 VanDerWaalsContact O-N 3.14Å; L32-R37 HydrophobicContact CD2-CB 4.14Å; L32-R37 HydrophobicContact CD2-CG 4.36Å; L32-R37 PolarHBondContact O-N 3.28Å; L32-Y39 HydrophobicContact CD1-CD2 3.85Å
33	R	91.7	Very high	91.2	Very high	181 Å²	181	102.4 Å²	102.4	68%	0.683	47%	0.472	S	S	*	.	H	α-helix	trans	-62.5	-43	175.1	-173.5	-174.4	-65.6	159	-1.1	111.4	R29 S30 Y31 L35 K36	R29-R33 PolarHBondContact O-N 3.39Å; S30-R33 WeakPolarHBondContact O-CB 3.32Å; S30-R33 PolarHBondContact O-N 2.88Å; Y31-R33 VanDerWaalsContact C-N 3.28Å; Y31-R33 PolarHBondContact O-N 2.89Å; R33-L35 VanDerWaalsContact C-N 3.34Å; R33-K36 PolarHBondContact O-N 3.39Å
34	I	94.4	Very high	91	Very high	139 Å²	139	98.3 Å²	98.3	71%	0.713	47%	0.472	S	S	*	.	H	α-helix	trans	-65.5	-40.8	178.1	-63.7	165.6	0	0	0	110.4	S30 Y31 K36	S30-I34 WeakPolarHBondContact O-CG1 3.33Å; S30-I34 PolarHBondContact O-N 3.43Å; Y31-I34 PolarHBondContact O-N 2.87Å; I34-K36 PolarHBondContact O-N 2.93Å
35	L	93.5	Very high	91	Very high	92 Å²	92	102.8 Å²	102.8	48%	0.482	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-3.4	178.3	-69.4	-176.7	0	0	0	114.7	Y31 L32 R33 R37	Y31-L35 HydrophobicContact CD1-CD1 3.97Å; Y31-L35 HydrophobicContact CE1-CD1 3.34Å; Y31-L35 HydrophobicContact CE1-CG 4.35Å; Y31-L35 HydrophobicContact CE2-CD1 4Å; Y31-L35 HydrophobicContact CE2-CG 4.29Å; Y31-L35 PolarHBondContact O-N 3.49Å; Y31-L35 VanDerWaalsContact O-N 3.09Å; L32-L35 PolarHBondContact O-N 3.16Å; R33-L35 VanDerWaalsContact C-N 3.34Å; L35-R37 HydrophobicContact CB-CB 4.39Å; L35-R37 PolarHBondContact O-N 2.99Å; L35-R37 VanDerWaalsContact O-N 3.13Å
36	K	90.7	Very high	91	Very high	198 Å²	198	102.7 Å²	102.7	86%	0.861	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.9	33.1	-174.4	-57.7	-179.3	179.9	176.7	0	113	L32 R33 I34	L32-K36 PolarHBondContact O-N 3Å; L32-K36 VanDerWaalsContact O-N 3.14Å; R33-K36 PolarHBondContact O-N 3.39Å; I34-K36 PolarHBondContact O-N 2.93Å
37	R	87.2	Confident	91.1	Very high	165 Å²	165	103.9 Å²	103.9	62%	0.623	49%	0.487	S	S	*	.			trans	-100	141.8	179.5	-173.7	175	176.3	125.3	-5.2	109.7	L32 L35 Y39	L32-R37 HydrophobicContact CD2-CB 4.14Å; L32-R37 HydrophobicContact CD2-CG 4.36Å; L32-R37 PolarHBondContact O-N 3.28Å; L35-R37 HydrophobicContact CB-CB 4.39Å; L35-R37 PolarHBondContact O-N 2.99Å; L35-R37 VanDerWaalsContact O-N 3.13Å; R37-Y39 PolarHBondContact O-N 3.38Å
38	D	85.8	Confident	91.1	Very high	106 Å²	106	105.8 Å²	105.8	57%	0.567	50%	0.496	S	S	*	.			trans	-61.6	136.3	177.4	-53.3	-45.2	0	0	0	111.7	R40	D38-R40 HydrophobicContact CB-CG 4.39Å; D38-R40 PolarHBondContact O-N 2.91Å; D38-R40 VanDerWaalsContact O-N 3.14Å; D38-R40 IonicContact OD2-CZ 2.95Å; D38-R40 IonicContact OD2-NH1 3.42Å; D38-R40 PolarHBondContact OD2-NH1 3.43Å
39	Y	82.3	Confident	91.3	Very high	128 Å²	128	105.6 Å²	105.6	50%	0.502	50%	0.496	S	S	.	.			trans	-74.8	98.3	169.5	-178.9	-96.4	0	0	0	109	L32 R37 L42	L32-Y39 HydrophobicContact CD1-CD2 3.85Å; R37-Y39 PolarHBondContact O-N 3.38Å; Y39-L42 HydrophobicContact CE2-CD1 4.45Å
40	R	82.1	Confident	91.5	Very high	147 Å²	147	100.4 Å²	100.4	56%	0.555	48%	0.483	S	S	*	.			trans	-97.9	-51	177.6	-74.5	-169.2	-94.8	-86.1	2.8	112.9	D38	D38-R40 HydrophobicContact CB-CG 4.39Å; D38-R40 PolarHBondContact O-N 2.91Å; D38-R40 VanDerWaalsContact O-N 3.14Å; D38-R40 IonicContact OD2-CZ 2.95Å; D38-R40 IonicContact OD2-NH1 3.42Å; D38-R40 PolarHBondContact OD2-NH1 3.43Å
41	F	85.6	Confident	91.7	Very high	176 Å²	176	102.5 Å²	102.5	77%	0.772	49%	0.489	S	S	*	.			trans	-143.4	148.7	-176.4	-61.4	-75.7	0	0	0	110.9
42	L	87.9	Confident	91.9	Very high	50 Å²	50	99.5 Å²	99.5	26%	0.262	49%	0.485	S	S	.	.			trans	-80.1	141.6	169.4	-162.4	67.5	0	0	0	108.7	Y39 A44 I46 I47	Y39-L42 HydrophobicContact CE2-CD1 4.45Å; L42-A44 PolarHBondContact O-N 2.95Å; L42-I46 HydrophobicContact CD1-CD1 4.31Å; L42-I46 HydrophobicContact CD2-CB 4.18Å; L42-I46 HydrophobicContact CD2-CG2 3.74Å; L42-I46 HydrophobicContact CG-CB 4.23Å; L42-I46 HydrophobicContact CG-CD1 4.47Å; L42-I46 HydrophobicContact CG-CG2 4.24Å; L42-I47 HydrophobicContact CB-CD1 4.23Å; L42-I47 HydrophobicContact CB-CG1 4.2Å; L42-I47 HydrophobicContact CD2-CG1 4.1Å; L42-I47 HydrophobicContact CG-CG1 4.44Å
43	P	92.1	Very high	92.1	Very high	46 Å²	46	98.6 Å²	98.6	30%	0.299	48%	0.48	S	S	.	.			trans	-51.2	132.3	173.7	-27.9	34.2	0	0	0	111	H28 D45 I46 I47	H28-P43 VanDerWaalsContact CE1-CD 3.42Å; H28-P43 WeakPolarHBondContact CE1-CD 3.43Å; P43-D45 PolarHBondContact O-N 2.71Å; P43-D45 VanDerWaalsContact O-N 3.15Å; P43-I46 HydrophobicContact CB-CD1 4.28Å; P43-I46 HydrophobicContact CB-CG1 4.35Å; P43-I46 HydrophobicContact CG-CD1 4.06Å; P43-I46 PolarHBondContact O-N 2.89Å; P43-I46 VanDerWaalsContact O-N 3.1Å; P43-I47 PolarHBondContact O-N 2.96Å
44	A	93.2	Very high	92.3	Very high	73 Å²	73	94 Å²	94	60%	0.603	47%	0.469	S	S	*	.	H	α-helix	trans	-56.4	-33.1	-178	0	0	0	0	0	112.2	L42 I46 I47 V48	L42-A44 PolarHBondContact O-N 2.95Å; A44-I46 PolarHBondContact O-N 3.07Å; A44-I47 WeakPolarHBondContact O-CB 3.36Å; A44-I47 PolarHBondContact O-N 2.77Å; A44-V48 WeakPolarHBondContact O-CG2 3.28Å; A44-V48 PolarHBondContact O-N 2.94Å
45	D	94.6	Very high	92.5	Very high	125 Å²	125	91.3 Å²	91.3	67%	0.668	46%	0.459	S	S	*	.	H	α-helix	trans	-55.2	-50.7	175.4	-172.3	39.8	0	0	0	112.6	P43 I47 V48 E49	P43-D45 PolarHBondContact O-N 2.71Å; P43-D45 VanDerWaalsContact O-N 3.15Å; D45-I47 VanDerWaalsContact C-N 3.29Å; D45-I47 PolarHBondContact O-N 3.34Å; D45-V48 PolarHBondContact O-N 3.45Å; D45-E49 WeakPolarHBondContact O-CB 3.45Å; D45-E49 PolarHBondContact O-N 3.36Å
46	I	95.7	Very high	92.6	Very high	14 Å²	14	89.6 Å²	89.6	7%	0.072	45%	0.449	C	S	.	.	H	α-helix	trans	-63.4	-37.2	178.1	-59.6	174.3	0	0	0	110.9	C21 H28 L42 P43 A44 C50	C21-I46 PolarHBondContact SG-O 3.34Å; H28-I46 HydrophobicContact CB-CD1 4.31Å; L42-I46 HydrophobicContact CD1-CD1 4.31Å; L42-I46 HydrophobicContact CD2-CB 4.18Å; L42-I46 HydrophobicContact CD2-CG2 3.74Å; L42-I46 HydrophobicContact CG-CB 4.23Å; L42-I46 HydrophobicContact CG-CD1 4.47Å; L42-I46 HydrophobicContact CG-CG2 4.24Å; P43-I46 HydrophobicContact CB-CD1 4.28Å; P43-I46 HydrophobicContact CB-CG1 4.35Å; P43-I46 HydrophobicContact CG-CD1 4.06Å; P43-I46 PolarHBondContact O-N 2.89Å; P43-I46 VanDerWaalsContact O-N 3.1Å; A44-I46 PolarHBondContact O-N 3.07Å; I46-C50 WeakPolarHBondContact O-CB 3.33Å; I46-C50 PolarHBondContact O-N 3.34Å
47	I	95.7	Very high	92.9	Very high	78 Å²	78	81.7 Å²	81.7	40%	0.4	42%	0.416	S	S	.	.	H	α-helix	trans	-64.9	-46.7	177.4	-60.2	173.8	0	0	0	110.1	L42 P43 A44 D45 C50 L51	L42-I47 HydrophobicContact CB-CD1 4.23Å; L42-I47 HydrophobicContact CB-CG1 4.2Å; L42-I47 HydrophobicContact CD2-CG1 4.1Å; L42-I47 HydrophobicContact CG-CG1 4.44Å; P43-I47 PolarHBondContact O-N 2.96Å; A44-I47 WeakPolarHBondContact O-CB 3.36Å; A44-I47 PolarHBondContact O-N 2.77Å; D45-I47 VanDerWaalsContact C-N 3.29Å; D45-I47 PolarHBondContact O-N 3.34Å; I47-C50 WeakPolarHBondContact O-CB 3.4Å; I47-C50 PolarHBondContact O-N 3.46Å; I47-L51 HydrophobicContact CG2-CD1 4.23Å; I47-L51 WeakPolarHBondContact O-CG 3.36Å; I47-L51 PolarHBondContact O-N 3.26Å
48	V	96.3	Very high	93.3	Very high	85 Å²	85	78.7 Å²	78.7	52%	0.515	41%	0.412	S	S	.	.	H	α-helix	trans	-63.9	-44.6	178.9	172.6	0	0	0	0	110.7	A44 D45 C50 L51 V52	A44-V48 WeakPolarHBondContact O-CG2 3.28Å; A44-V48 PolarHBondContact O-N 2.94Å; D45-V48 PolarHBondContact O-N 3.45Å; V48-C50 VanDerWaalsContact C-N 3.34Å; V48-C50 PolarHBondContact O-N 3.31Å; V48-L51 PolarHBondContact O-N 2.98Å; V48-V52 HydrophobicContact CG1-CG2 4.35Å; V48-V52 VanDerWaalsContact O-CG2 3.3Å; V48-V52 WeakPolarHBondContact O-CG2 3.1Å; V48-V52 PolarHBondContact O-N 3.46Å
49	E	96.3	Very high	93.7	Very high	41 Å²	41	78.7 Å²	78.7	19%	0.192	41%	0.41	C	S	.	.	H	α-helix	trans	-58.4	-44.8	175.8	-172.3	-179	-171.2	0	0	111.7	V17 H20 C21 D45 L51 V52 A53	V17-E49 HydrophobicContact CG1-CG 3.81Å; H20-E49 IonicContact CE1-OE1 3.62Å; H20-E49 IonicContact CE1-OE2 3.64Å; H20-E49 IonicContact CG-OE1 3.97Å; H20-E49 IonicContact ND1-OE1 2.71Å; H20-E49 PolarHBondContact ND1-OE1 3.33Å; H20-E49 IonicContact ND1-OE2 3.96Å; H20-E49 PolarHBondContact ND1-OE2 3.07Å; C21-E49 HydrophobicContact CB-CG 4.26Å; D45-E49 WeakPolarHBondContact O-CB 3.45Å; D45-E49 PolarHBondContact O-N 3.36Å; E49-L51 PolarHBondContact O-N 3.3Å; E49-V52 PolarHBondContact O-N 3.01Å; E49-A53 WeakPolarHBondContact O-CB 3.29Å; E49-A53 PolarHBondContact O-N 3Å
50	C	96.7	Very high	94.3	Very high	49 Å²	49	72.8 Å²	72.8	33%	0.331	39%	0.388	S	S	.	.	H	α-helix	trans	-59.4	-47.1	176.3	-166.2	0	0	0	0	112.2	C21 I46 I47 V48 A53 L54	C21-C50 WeakPolarHBondContact SG-CB 3.47Å; I46-C50 WeakPolarHBondContact O-CB 3.33Å; I46-C50 PolarHBondContact O-N 3.34Å; I47-C50 WeakPolarHBondContact O-CB 3.4Å; I47-C50 PolarHBondContact O-N 3.46Å; V48-C50 VanDerWaalsContact C-N 3.34Å; V48-C50 PolarHBondContact O-N 3.31Å; C50-A53 PolarHBondContact O-N 3.29Å; C50-L54 VanDerWaalsContact O-CB 3.31Å; C50-L54 WeakPolarHBondContact O-CB 3.33Å; C50-L54 PolarHBondContact O-N 3.5Å
51	L	97.3	Very high	94.8	Very high	101 Å²	101	68 Å²	68	53%	0.529	38%	0.379	S	S	.	.	H	α-helix	trans	-64.6	-42.4	-179.9	-71.8	175.5	0	0	0	111.5	I47 V48 E49 L54 V55	I47-L51 HydrophobicContact CG2-CD1 4.23Å; I47-L51 WeakPolarHBondContact O-CG 3.36Å; I47-L51 PolarHBondContact O-N 3.26Å; V48-L51 PolarHBondContact O-N 2.98Å; E49-L51 PolarHBondContact O-N 3.3Å; L51-L54 PolarHBondContact O-N 3.49Å; L51-V55 WeakPolarHBondContact O-CG2 3.3Å; L51-V55 PolarHBondContact O-N 2.91Å
52	V	96.9	Very high	95.1	Very high	76 Å²	76	63.7 Å²	63.7	46%	0.461	37%	0.372	S	S	.	.	H	α-helix	trans	-63.4	-46.7	176.3	171.7	0	0	0	0	110.5	V48 E49 L54 V55 I56	V48-V52 HydrophobicContact CG1-CG2 4.35Å; V48-V52 VanDerWaalsContact O-CG2 3.3Å; V48-V52 WeakPolarHBondContact O-CG2 3.1Å; V48-V52 PolarHBondContact O-N 3.46Å; E49-V52 PolarHBondContact O-N 3.01Å; V52-L54 VanDerWaalsContact C-N 3.33Å; V52-L54 PolarHBondContact O-N 3.31Å; V52-V55 PolarHBondContact O-N 2.88Å; V52-I56 HydrophobicContact CG1-CD1 3.8Å; V52-I56 VanDerWaalsContact O-CG1 3.29Å; V52-I56 WeakPolarHBondContact O-CG1 3.43Å; V52-I56 PolarHBondContact O-N 3.38Å
53	A	97.3	Very high	95.3	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-59.3	-43.8	176.6	0	0	0	0	0	111.9	V17 L18 E49 C50 I56 I57	V17-A53 HydrophobicContact CB-CB 4.17Å; V17-A53 HydrophobicContact CG1-CB 3.84Å; L18-A53 HydrophobicContact CB-CB 4.22Å; L18-A53 HydrophobicContact CD1-CB 4.42Å; E49-A53 WeakPolarHBondContact O-CB 3.29Å; E49-A53 PolarHBondContact O-N 3Å; C50-A53 PolarHBondContact O-N 3.29Å; A53-I56 PolarHBondContact O-N 2.95Å; A53-I57 VanDerWaalsContact O-CG1 3.28Å; A53-I57 WeakPolarHBondContact O-CG1 3.48Å; A53-I57 PolarHBondContact O-N 3.13Å
54	L	97.1	Very high	95.2	Very high	86 Å²	86	65.5 Å²	65.5	45%	0.45	39%	0.39	S	S	.	.	H	α-helix	trans	-60.5	-48	177.7	179.3	63.3	0	0	0	111.8	C50 L51 V52 I56 I57 I58	C50-L54 VanDerWaalsContact O-CB 3.31Å; C50-L54 WeakPolarHBondContact O-CB 3.33Å; C50-L54 PolarHBondContact O-N 3.5Å; L51-L54 PolarHBondContact O-N 3.49Å; V52-L54 VanDerWaalsContact C-N 3.33Å; V52-L54 PolarHBondContact O-N 3.31Å; L54-I56 VanDerWaalsContact C-N 3.35Å; L54-I56 PolarHBondContact O-N 3.47Å; L54-I57 PolarHBondContact O-N 3.5Å; L54-I58 HydrophobicContact CD1-CD1 4.05Å; L54-I58 HydrophobicContact CD1-CG1 4.38Å; L54-I58 HydrophobicContact CG-CD1 3.95Å; L54-I58 WeakPolarHBondContact O-CG1 3.21Å; L54-I58 PolarHBondContact O-N 3.3Å
55	V	97.5	Very high	94.9	Very high	81 Å²	81	65.4 Å²	65.4	49%	0.491	40%	0.396	S	S	.	.	H	α-helix	trans	-61.1	-44.2	178.4	170.8	0	0	0	0	111	L51 V52 I57 I58 I59	L51-V55 WeakPolarHBondContact O-CG2 3.3Å; L51-V55 PolarHBondContact O-N 2.91Å; V52-V55 PolarHBondContact O-N 2.88Å; V55-I57 VanDerWaalsContact C-N 3.34Å; V55-I57 PolarHBondContact O-N 3.16Å; V55-I58 PolarHBondContact O-N 2.89Å; V55-I59 HydrophobicContact CG1-CD1 3.73Å; V55-I59 WeakPolarHBondContact O-CG1 3.35Å; V55-I59 PolarHBondContact O-N 3.38Å
56	I	96.1	Very high	94.4	Very high	56 Å²	56	61.2 Å²	61.2	29%	0.287	38%	0.382	S	S	.	.	H	α-helix	trans	-60	-44.7	176.9	-69.7	168	0	0	0	110.9	V52 A53 L54 S60	V52-I56 HydrophobicContact CG1-CD1 3.8Å; V52-I56 VanDerWaalsContact O-CG1 3.29Å; V52-I56 WeakPolarHBondContact O-CG1 3.43Å; V52-I56 PolarHBondContact O-N 3.38Å; A53-I56 PolarHBondContact O-N 2.95Å; L54-I56 VanDerWaalsContact C-N 3.35Å; L54-I56 PolarHBondContact O-N 3.47Å; I56-S60 WeakPolarHBondContact O-CB 3.42Å; I56-S60 PolarHBondContact O-N 3.48Å; I56-S60 PolarHBondContact O-OG 3.12Å
57	I	97.1	Very high	94	Very high	32 Å²	32	67 Å²	67	16%	0.164	41%	0.413	C	S	.	.	H	α-helix	trans	-63.4	-45.7	179.1	-71.6	167.6	0	0	0	110.7	L11 V15 L18 A53 L54 V55 I59 S60 A61	L11-I57 HydrophobicContact CD1-CB 4.49Å; L11-I57 HydrophobicContact CD1-CG1 4.5Å; L11-I57 HydrophobicContact CD1-CG2 4.03Å; V15-I57 HydrophobicContact CG2-CD1 4.37Å; L18-I57 HydrophobicContact CB-CD1 4.08Å; L18-I57 HydrophobicContact CD2-CD1 3.77Å; L18-I57 HydrophobicContact CG-CD1 4.5Å; A53-I57 VanDerWaalsContact O-CG1 3.28Å; A53-I57 WeakPolarHBondContact O-CG1 3.48Å; A53-I57 PolarHBondContact O-N 3.13Å; L54-I57 PolarHBondContact O-N 3.5Å; V55-I57 VanDerWaalsContact C-N 3.34Å; V55-I57 PolarHBondContact O-N 3.16Å; I57-I59 PolarHBondContact O-N 3Å; I57-S60 PolarHBondContact O-N 3.42Å; I57-A61 WeakPolarHBondContact O-CB 3.34Å; I57-A61 PolarHBondContact O-N 3.16Å
58	I	96.6	Very high	93.6	Very high	102 Å²	102	73.3 Å²	73.3	52%	0.523	44%	0.438	S	S	.	.	H	α-helix	trans	-60.1	-47.8	179.9	-69	167	0	0	0	111	L54 V55 S62	L54-I58 HydrophobicContact CD1-CD1 4.05Å; L54-I58 HydrophobicContact CD1-CG1 4.38Å; L54-I58 HydrophobicContact CG-CD1 3.95Å; L54-I58 WeakPolarHBondContact O-CG1 3.21Å; L54-I58 PolarHBondContact O-N 3.3Å; V55-I58 PolarHBondContact O-N 2.89Å; I58-S62 WeakPolarHBondContact O-CB 3.4Å; I58-S62 PolarHBondContact O-N 2.68Å; I58-S62 PolarHBondContact O-OG 3.13Å
59	I	94.3	Very high	93.2	Very high	106 Å²	106	74 Å²	74	54%	0.544	44%	0.443	S	S	.	.	H	α-helix	trans	-65.7	-42.8	179.8	-65	169.4	0	0	0	110.7	V55 I57 S62 A63	V55-I59 HydrophobicContact CG1-CD1 3.73Å; V55-I59 WeakPolarHBondContact O-CG1 3.35Å; V55-I59 PolarHBondContact O-N 3.38Å; I57-I59 PolarHBondContact O-N 3Å; I59-S62 PolarHBondContact O-OG 3.42Å; I59-A63 WeakPolarHBondContact O-CB 3Å; I59-A63 PolarHBondContact O-N 3.44Å; I59-A63 VanDerWaalsContact O-N 3.16Å
60	S	93.6	Very high	92.8	Very high	5 Å²	5	75 Å²	75	4%	0.035	45%	0.453	C	S	.	.	H	α-helix	trans	-72.1	-39.5	-178	-53.2	0	0	0	0	112.1	C10 I56 I57 A63 V64	C10-S60 WeakPolarHBondContact CB-OG 3.47Å; C10-S60 PolarHBondContact SG-OG 2.88Å; I56-S60 WeakPolarHBondContact O-CB 3.42Å; I56-S60 PolarHBondContact O-N 3.48Å; I56-S60 PolarHBondContact O-OG 3.12Å; I57-S60 PolarHBondContact O-N 3.42Å; S60-A63 PolarHBondContact O-N 3.39Å; S60-V64 VanDerWaalsContact O-CG2 3.3Å; S60-V64 WeakPolarHBondContact O-CG2 3.29Å; S60-V64 PolarHBondContact O-N 2.89Å
61	A	93.3	Very high	92.5	Very high	45 Å²	45	81 Å²	81	37%	0.372	48%	0.48	S	S	.	.	H	α-helix	trans	-65.4	-43.5	177.9	0	0	0	0	0	111.6	L11 I57 A63 V64 G65	L11-A61 HydrophobicContact CD1-CB 4.24Å; I57-A61 WeakPolarHBondContact O-CB 3.34Å; I57-A61 PolarHBondContact O-N 3.16Å; A61-A63 VanDerWaalsContact C-N 3.3Å; A61-A63 PolarHBondContact O-N 3.44Å; A61-V64 PolarHBondContact O-N 3.37Å; A61-V64 VanDerWaalsContact O-N 3.16Å; A61-G65 PolarHBondContact O-N 3.27Å; A61-G65 VanDerWaalsContact O-N 3.13Å
62	S	92.3	Very high	92.2	Very high	87 Å²	87	84.1 Å²	84.1	61%	0.608	48%	0.484	S	S	*	.	H	α-helix	trans	-62	-37.5	174.4	54.2	0	0	0	0	112.1	I58 I59 V64 G65	I58-S62 WeakPolarHBondContact O-CB 3.4Å; I58-S62 PolarHBondContact O-N 2.68Å; I58-S62 PolarHBondContact O-OG 3.13Å; I59-S62 PolarHBondContact O-OG 3.42Å; S62-V64 PolarHBondContact O-N 2.93Å; S62-G65 PolarHBondContact O-N 2.94Å
63	A	90.8	Very high	91.7	Very high	61 Å²	61	86.6 Å²	86.6	50%	0.504	49%	0.494	S	S	.	.	H	α-helix	trans	-70.9	-26	175	0	0	0	0	0	114.1	A7 I59 S60 A61	A7-A63 HydrophobicContact CB-CB 3.78Å; I59-A63 WeakPolarHBondContact O-CB 3Å; I59-A63 PolarHBondContact O-N 3.44Å; I59-A63 VanDerWaalsContact O-N 3.16Å; S60-A63 PolarHBondContact O-N 3.39Å; A61-A63 VanDerWaalsContact C-N 3.3Å; A61-A63 PolarHBondContact O-N 3.44Å
64	V	90.5	Very high	91.2	Very high	72 Å²	72	91.3 Å²	91.3	44%	0.436	52%	0.519	S	S	.	.	H	α-helix	trans	-79.4	-27.1	176.8	170.3	0	0	0	0	112.2	A7 L11 S60 A61 S62 G66	A7-V64 HydrophobicContact CB-CG2 3.91Å; L11-V64 HydrophobicContact CD2-CG2 4.34Å; S60-V64 VanDerWaalsContact O-CG2 3.3Å; S60-V64 WeakPolarHBondContact O-CG2 3.29Å; S60-V64 PolarHBondContact O-N 2.89Å; A61-V64 PolarHBondContact O-N 3.37Å; A61-V64 VanDerWaalsContact O-N 3.16Å; S62-V64 PolarHBondContact O-N 2.93Å; V64-G66 PolarHBondContact O-N 3.11Å
65	G	86.5	Confident	90.6	Very high	72 Å²	72	90.4 Å²	90.4	74%	0.742	52%	0.517	S	S	*	.	S	Bend	trans	-58	-12	-177	0	0	0	0	0	116.1	A61 S62	A61-G65 PolarHBondContact O-N 3.27Å; A61-G65 VanDerWaalsContact O-N 3.13Å; S62-G65 PolarHBondContact O-N 2.94Å
66	G	84.7	Confident	90	Very high	36 Å²	36	91.2 Å²	91.2	37%	0.371	52%	0.515	S	S	.	.			trans	88.2	172.2	179.2	0	0	0	0	0	112.7	V64	V64-G66 PolarHBondContact O-N 3.11Å
67	D	87.1	Confident	89.3	Confident	135 Å²	135	91.9 Å²	91.9	72%	0.722	52%	0.518	S	S	*	.	P	Polyproline II helix	trans	-83.3	140.3	-180	-58.3	-57.1	0	0	0	109.9	V69	D67-V69 PolarHBondContact O-N 3.48Å
68	F	88	Confident	88.6	Confident	211 Å²	211	95.5 Å²	95.5	93%	0.925	55%	0.546	S	S	*	.	P	Polyproline II helix	trans	-67.8	131.6	174.2	-64.1	-76.8	0	0	0	110.5
69	V	87.3	Confident	87.9	Confident	100 Å²	100	95.4 Å²	95.4	61%	0.606	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-93.8	138.4	174.4	179	0	0	0	0	108.7	D67 I71	D67-V69 PolarHBondContact O-N 3.48Å; V69-I71 PolarHBondContact O-N 3.36Å
70	P	88.7	Confident	87.4	Confident	63 Å²	63	96.2 Å²	96.2	41%	0.409	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-60.6	137.7	177.7	25.1	-35.4	0	0	0	111.5	R72 V75	P70-R72 VanDerWaalsContact C-N 3.3Å; P70-V75 HydrophobicContact CG-CG1 4.17Å
71	I	89.5	Confident	86.8	Confident	174 Å²	174	99.3 Å²	99.3	89%	0.892	58%	0.576	S	S	*	*	S	Bend	trans	-70.3	-30.5	177.1	-60.3	170.4	0	0	0	111.1	V69 I73	V69-I71 PolarHBondContact O-N 3.36Å; I71-I73 PolarHBondContact O-N 3.09Å
72	R	91.1	Very high	86.3	Confident	167 Å²	167	103 Å²	103	63%	0.63	59%	0.589	S	S	*	*			trans	-73.8	124.5	-176.7	-52.8	-171.6	-68	-86.5	-1.5	111.1	P70 D74 V75	P70-R72 VanDerWaalsContact C-N 3.3Å; R72-D74 WeakPolarHBondContact CB-OD1 3.19Å; R72-V75 HydrophobicContact CB-CG2 4.41Å
73	I	85.9	Confident	85.7	Confident	128 Å²	128	102 Å²	102	66%	0.656	59%	0.585	S	S	*	*	H	α-helix	trans	-75.1	-26.1	-174.2	-160	156.4	0	0	0	113.1	I71 V75 Q76 M77	I71-I73 PolarHBondContact O-N 3.09Å; I73-V75 VanDerWaalsContact C-N 3.35Å; I73-V75 PolarHBondContact O-N 2.78Å; I73-Q76 PolarHBondContact O-N 2.78Å; I73-M77 WeakPolarHBondContact O-CB 3.29Å; I73-M77 PolarHBondContact O-N 3.49Å
74	D	87.1	Confident	85.2	Confident	99 Å²	99	104.5 Å²	104.5	53%	0.529	59%	0.59	S	S	.	*	H	α-helix	trans	-59.4	-44.9	175.8	62.7	-30.6	0	0	0	111.5	R72 Q76 M77 S78	R72-D74 WeakPolarHBondContact CB-OD1 3.19Å; D74-Q76 VanDerWaalsContact C-N 3.35Å; D74-Q76 PolarHBondContact O-N 3.24Å; D74-M77 PolarHBondContact O-N 2.92Å; D74-S78 VanDerWaalsContact O-CB 3.29Å; D74-S78 WeakPolarHBondContact O-CB 3.5Å; D74-S78 PolarHBondContact O-N 3.42Å
75	V	84.9	Confident	84.5	Confident	66 Å²	66	106.5 Å²	106.5	40%	0.4	60%	0.598	S	S	.	*	H	α-helix	trans	-64.2	-41.7	176.5	-179.7	0	0	0	0	110.6	P70 R72 I73	P70-V75 HydrophobicContact CG-CG1 4.17Å; R72-V75 HydrophobicContact CB-CG2 4.41Å; I73-V75 VanDerWaalsContact C-N 3.35Å; I73-V75 PolarHBondContact O-N 2.78Å
76	Q	84.1	Confident	84.1	Confident	98 Å²	98	110 Å²	110	46%	0.458	59%	0.593	S	S	.	*	H	α-helix	trans	-70	-40.3	179.2	-166	177.2	33.6	0	0	111.9	I73 D74 S79	I73-Q76 PolarHBondContact O-N 2.78Å; D74-Q76 VanDerWaalsContact C-N 3.35Å; D74-Q76 PolarHBondContact O-N 3.24Å; Q76-S79 PolarHBondContact O-OG 3.49Å
77	M	82.4	Confident	83.9	Confident	71 Å²	71	112.5 Å²	112.5	35%	0.35	60%	0.598	S	S	.	*	H	α-helix	trans	-76.5	-29.1	-176.6	-164.2	66.6	-155.8	0	0	112.6	I73 D74 S79 K80 L85	I73-M77 WeakPolarHBondContact O-CB 3.29Å; I73-M77 PolarHBondContact O-N 3.49Å; D74-M77 PolarHBondContact O-N 2.92Å; M77-S79 PolarHBondContact O-N 3.07Å; M77-S79 VanDerWaalsContact O-N 3.13Å; M77-K80 HydrophobicContact CE-CB 3.92Å; M77-K80 HydrophobicContact CE-CD 4.06Å; M77-K80 PolarHBondContact O-N 2.92Å; M77-K80 HydrophobicContact SD-CB 4.32Å; M77-K80 HydrophobicContact SD-CD 3.83Å; M77-K80 HydrophobicContact SD-CG 4.47Å; M77-L85 HydrophobicContact CE-CB 4.41Å; M77-L85 HydrophobicContact CE-CD1 3.88Å; M77-L85 HydrophobicContact CE-CD2 4.28Å; M77-L85 HydrophobicContact CE-CG 4.42Å
78	S	82.3	Confident	83.5	Confident	107 Å²	107	107.7 Å²	107.7	75%	0.748	58%	0.58	S	S	*	*	H	α-helix	trans	-56.8	-27.9	176	-178.6	0	0	0	0	113.1	D74 K80	D74-S78 VanDerWaalsContact O-CB 3.29Å; D74-S78 WeakPolarHBondContact O-CB 3.5Å; D74-S78 PolarHBondContact O-N 3.42Å; S78-K80 VanDerWaalsContact C-N 3.34Å
79	S	82.2	Confident	83.2	Confident	101 Å²	101	102.1 Å²	102.1	71%	0.706	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-14.7	175.7	71.1	0	0	0	0	114.7	Q76 M77	Q76-S79 PolarHBondContact O-OG 3.49Å; M77-S79 PolarHBondContact O-N 3.07Å; M77-S79 VanDerWaalsContact O-N 3.13Å
80	K	82.9	Confident	83.2	Confident	123 Å²	123	102.8 Å²	102.8	54%	0.535	57%	0.572	S	S	.	*	S	Bend	trans	-92.8	129	-176.5	-66.9	-171.2	177.6	-175.4	0	110.5	M77 S78	M77-K80 HydrophobicContact CE-CB 3.92Å; M77-K80 HydrophobicContact CE-CD 4.06Å; M77-K80 PolarHBondContact O-N 2.92Å; M77-K80 HydrophobicContact SD-CB 4.32Å; M77-K80 HydrophobicContact SD-CD 3.83Å; M77-K80 HydrophobicContact SD-CG 4.47Å; S78-K80 VanDerWaalsContact C-N 3.34Å
81	S	82.4	Confident	83.1	Confident	70 Å²	70	108.1 Å²	108.1	49%	0.49	59%	0.589	S	S	.	*			trans	-64.9	143	173.1	179.3	0	0	0	0	110.9	A83 N84	S81-A83 PolarHBondContact O-N 3.13Å; S81-A83 PolarHBondContact OG-N 3.18Å; S81-N84 WeakPolarHBondContact O-CB 3.42Å; S81-N84 PolarHBondContact O-N 3.3Å
82	L	81.2	Confident	83	Confident	123 Å²	123	104.9 Å²	104.9	64%	0.644	57%	0.568	S	S	*	*	H	α-helix	trans	-54.3	-35.5	173.3	-172.1	151.5	0	0	0	111.1	N84 L85 F86	L82-N84 PolarHBondContact O-N 2.77Å; L82-L85 WeakPolarHBondContact O-CB 3.42Å; L82-L85 PolarHBondContact O-N 3.43Å; L82-F86 HydrophobicContact CD1-CE2 4.18Å; L82-F86 HydrophobicContact CD2-CD2 3.26Å; L82-F86 HydrophobicContact CD2-CE2 3.3Å; L82-F86 HydrophobicContact CG-CD2 3.81Å; L82-F86 HydrophobicContact CG-CE2 3.55Å; L82-F86 VanDerWaalsContact O-CD2 3.27Å; L82-F86 WeakPolarHBondContact O-CD2 3.37Å; L82-F86 PolarHBondContact O-N 2.78Å
83	A	79.3	Confident	82.8	Confident	64 Å²	64	101.8 Å²	101.8	53%	0.529	57%	0.568	S	S	.	*	H	α-helix	trans	-56.2	-36.7	175.8	0	0	0	0	0	113.2	S81 L85 F86 D87	S81-A83 PolarHBondContact O-N 3.13Å; S81-A83 PolarHBondContact OG-N 3.18Å; A83-L85 VanDerWaalsContact C-N 3.31Å; A83-L85 PolarHBondContact O-N 2.81Å; A83-F86 PolarHBondContact O-N 3.21Å; A83-D87 PolarHBondContact O-N 3.46Å
84	N	80.4	Confident	82.8	Confident	114 Å²	114	103.2 Å²	103.2	61%	0.61	57%	0.57	S	S	*	*	H	α-helix	trans	-74.8	-23	179	-63.2	-8.9	0	0	0	112.5	S81 L82	S81-N84 WeakPolarHBondContact O-CB 3.42Å; S81-N84 PolarHBondContact O-N 3.3Å; L82-N84 PolarHBondContact O-N 2.77Å
85	L	77	Confident	82.9	Confident	114 Å²	114	104.6 Å²	104.6	60%	0.597	58%	0.577	S	S	*	*	H	α-helix	trans	-77.8	-32.5	177	-172.3	64.2	0	0	0	111.4	M77 L82 A83	M77-L85 HydrophobicContact CE-CB 4.41Å; M77-L85 HydrophobicContact CE-CD1 3.88Å; M77-L85 HydrophobicContact CE-CD2 4.28Å; M77-L85 HydrophobicContact CE-CG 4.42Å; L82-L85 WeakPolarHBondContact O-CB 3.42Å; L82-L85 PolarHBondContact O-N 3.43Å; A83-L85 VanDerWaalsContact C-N 3.31Å; A83-L85 PolarHBondContact O-N 2.81Å
86	F	78.8	Confident	83.1	Confident	147 Å²	147	106.8 Å²	106.8	65%	0.645	58%	0.583	S	S	*	*	S	Bend	trans	-93.1	5.6	178.2	-69.6	-77	0	0	0	113.8	L82 A83 G88	L82-F86 HydrophobicContact CD1-CE2 4.18Å; L82-F86 HydrophobicContact CD2-CD2 3.26Å; L82-F86 HydrophobicContact CD2-CE2 3.3Å; L82-F86 HydrophobicContact CG-CD2 3.81Å; L82-F86 HydrophobicContact CG-CE2 3.55Å; L82-F86 VanDerWaalsContact O-CD2 3.27Å; L82-F86 WeakPolarHBondContact O-CD2 3.37Å; L82-F86 PolarHBondContact O-N 2.78Å; A83-F86 PolarHBondContact O-N 3.21Å; F86-G88 PolarHBondContact O-N 3.22Å
87	D	78.5	Confident	83.5	Confident	88 Å²	88	112.1 Å²	112.1	47%	0.471	60%	0.599	S	S	.	*			trans	-71.5	74.3	167	-157.1	39	0	0	0	107.9	A83 V89 F92	A83-D87 PolarHBondContact O-N 3.46Å; D87-V89 PolarHBondContact O-N 3.48Å; D87-F92 WeakPolarHBondContact OD1-CE1 3.44Å; D87-F92 WeakPolarHBondContact OD1-CZ 3.32Å
88	G	80	Confident	83.9	Confident	33 Å²	33	109.9 Å²	109.9	34%	0.34	59%	0.594	S	S	.	*			trans	-72.2	74.1	-180	0	0	0	0	0	109.2	F86 S90 F91 F92	F86-G88 PolarHBondContact O-N 3.22Å; G88-S90 PolarHBondContact O-N 2.99Å; G88-F91 CarbonylContact O-C 3.5Å; G88-F91 WeakPolarHBondContact O-CA 3.08Å; G88-F91 PolarHBondContact O-N 3.22Å; G88-F92 PolarHBondContact O-N 3.32Å
89	V	82.3	Confident	84.2	Confident	94 Å²	94	112.7 Å²	112.7	57%	0.57	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-53.2	-34.3	-174.5	178.3	0	0	0	0	111.9	D87 F91 F92	D87-V89 PolarHBondContact O-N 3.48Å; V89-F91 PolarHBondContact O-N 2.98Å; V89-F92 HydrophobicContact CB-CD2 4.3Å; V89-F92 HydrophobicContact CB-CE2 3.93Å; V89-F92 HydrophobicContact CG1-CD2 4.09Å; V89-F92 HydrophobicContact CG1-CE2 3.88Å; V89-F92 HydrophobicContact CG2-CE2 3.84Å; V89-F92 HydrophobicContact CG2-CZ 4.26Å; V89-F92 WeakPolarHBondContact O-CD2 3.27Å
90	S	87.1	Confident	84.5	Confident	114 Å²	114	112.7 Å²	112.7	80%	0.797	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-68.5	-15.5	176.2	-54.4	0	0	0	0	114.7	G88	G88-S90 PolarHBondContact O-N 2.99Å
91	F	86.5	Confident	84.9	Confident	175 Å²	175	111.8 Å²	111.8	77%	0.768	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-121.6	22	-175.5	-58.7	-74.6	0	0	0	112.8	G88 V89 V93	G88-F91 CarbonylContact O-C 3.5Å; G88-F91 WeakPolarHBondContact O-CA 3.08Å; G88-F91 PolarHBondContact O-N 3.22Å; V89-F91 PolarHBondContact O-N 2.98Å; F91-V93 PolarHBondContact O-N 3.21Å
92	F	86.3	Confident	85.2	Confident	106 Å²	106	111.1 Å²	111.1	47%	0.465	58%	0.582	S	S	.	*			trans	-61.6	123.1	176.4	-81.5	-47.8	0	0	0	111.4	D87 G88 V89 F94	D87-F92 WeakPolarHBondContact OD1-CE1 3.44Å; D87-F92 WeakPolarHBondContact OD1-CZ 3.32Å; G88-F92 PolarHBondContact O-N 3.32Å; V89-F92 HydrophobicContact CB-CD2 4.3Å; V89-F92 HydrophobicContact CB-CE2 3.93Å; V89-F92 HydrophobicContact CG1-CD2 4.09Å; V89-F92 HydrophobicContact CG1-CE2 3.88Å; V89-F92 HydrophobicContact CG2-CE2 3.84Å; V89-F92 HydrophobicContact CG2-CZ 4.26Å; V89-F92 WeakPolarHBondContact O-CD2 3.27Å; F92-F94 HydrophobicContact CB-CZ 4.39Å
93	V	86.8	Confident	85.5	Confident	103 Å²	103	108 Å²	108	62%	0.624	57%	0.57	S	S	*	*			trans	-105.6	115.9	171	176.8	0	0	0	0	108	F91 N95	F91-V93 PolarHBondContact O-N 3.21Å; V93-N95 HydrophobicContact CG1-CB 3.93Å; V93-N95 PolarHBondContact O-N 3.28Å
94	F	86.1	Confident	85.9	Confident	158 Å²	158	107 Å²	107	69%	0.693	56%	0.562	S	S	*	*	S	Bend	trans	-78.3	1.5	179.8	-61.7	-76.3	0	0	0	114	F92 H96	F92-F94 HydrophobicContact CB-CZ 4.39Å; F94-H96 VanDerWaalsContact C-N 3.32Å; F94-H96 PolarHBondContact O-N 3.48Å
95	N	89.4	Confident	86.2	Confident	128 Å²	128	106.1 Å²	106.1	68%	0.684	56%	0.557	S	S	*	*			trans	-89	64.2	174.4	-68.6	-26.3	0	0	0	111.1	V93 R99	V93-N95 HydrophobicContact CG1-CB 3.93Å; V93-N95 PolarHBondContact O-N 3.28Å; N95-R99 PolarHBondContact OD1-NH1 2.85Å
96	H	89.8	Confident	86.5	Confident	112 Å²	112	106.9 Å²	106.9	52%	0.519	56%	0.558	S	S	.	*	S	Bend	trans	-124.1	167.5	173.8	67.3	97	0	0	0	111.2	F94 G98 R99	F94-H96 VanDerWaalsContact C-N 3.32Å; F94-H96 PolarHBondContact O-N 3.48Å; H96-G98 WeakPolarHBondContact ND1-CA 3.47Å; H96-G98 PolarHBondContact ND1-N 3.2Å; H96-G98 PolarHBondContact O-N 3.09Å; H96-R99 WeakPolarHBondContact O-CB 3.35Å; H96-R99 PolarHBondContact O-N 3.05Å
97	R	91.3	Very high	86.6	Confident	210 Å²	210	106.5 Å²	106.5	79%	0.792	56%	0.558	S	S	*	*	H	α-helix	trans	-50.8	-26	-179.4	68.4	179.4	-179.2	-173	-0.5	114.5	R99 V100 I101	R97-R99 PolarHBondContact O-N 3.32Å; R97-V100 PolarHBondContact O-N 2.92Å; R97-I101 HydrophobicContact CB-CD1 4.45Å; R97-I101 HydrophobicContact CG-CD1 4.25Å; R97-I101 WeakPolarHBondContact O-CG1 3.44Å; R97-I101 PolarHBondContact O-N 3.29Å; R97-I101 VanDerWaalsContact O-N 3.08Å
98	G	90.8	Very high	86.6	Confident	24 Å²	24	107.9 Å²	107.9	25%	0.247	57%	0.565	C	S	.	*	H	α-helix	trans	-63	-28.9	179.3	0	0	0	0	0	112.7	H96 A102	H96-G98 WeakPolarHBondContact ND1-CA 3.47Å; H96-G98 PolarHBondContact ND1-N 3.2Å; H96-G98 PolarHBondContact O-N 3.09Å; G98-A102 WeakPolarHBondContact O-CB 3.14Å; G98-A102 PolarHBondContact O-N 3.24Å
99	R	88.2	Confident	86.1	Confident	166 Å²	166	114 Å²	114	63%	0.626	58%	0.582	S	S	*	*	H	α-helix	trans	-62.3	-46.3	174.3	-177.6	178.7	174.6	-170.2	-3.1	112.2	N95 H96 R97 S103	N95-R99 PolarHBondContact OD1-NH1 2.85Å; H96-R99 WeakPolarHBondContact O-CB 3.35Å; H96-R99 PolarHBondContact O-N 3.05Å; R97-R99 PolarHBondContact O-N 3.32Å; R99-S103 PolarHBondContact O-N 2.96Å; R99-S103 PolarHBondContact O-OG 3.4Å
100	V	89.6	Confident	85.5	Confident	101 Å²	101	113.9 Å²	113.9	61%	0.612	58%	0.582	S	S	*	*	H	α-helix	trans	-71.3	-39.6	-179.8	-179.8	0	0	0	0	111.1	R97 S103 A104	R97-V100 PolarHBondContact O-N 2.92Å; V100-S103 WeakPolarHBondContact CA-OG 3.32Å; V100-S103 PolarHBondContact O-N 2.91Å; V100-S103 PolarHBondContact O-OG 2.94Å; V100-A104 WeakPolarHBondContact O-CB 3.45Å; V100-A104 PolarHBondContact O-N 3.28Å
101	I	90.7	Very high	84.1	Confident	104 Å²	104	112.1 Å²	112.1	53%	0.533	57%	0.57	S	S	.	*	H	α-helix	trans	-65.9	-41.6	177.1	-64.6	166.8	0	0	0	110.4	R97 A104 L105	R97-I101 HydrophobicContact CB-CD1 4.45Å; R97-I101 HydrophobicContact CG-CD1 4.25Å; R97-I101 WeakPolarHBondContact O-CG1 3.44Å; R97-I101 PolarHBondContact O-N 3.29Å; R97-I101 VanDerWaalsContact O-N 3.08Å; I101-A104 PolarHBondContact O-N 3.29Å; I101-L105 VanDerWaalsContact O-CB 3.32Å; I101-L105 WeakPolarHBondContact O-CB 3.32Å; I101-L105 PolarHBondContact O-N 3.47Å
102	A	89	Confident	82.7	Confident	55 Å²	55	108.3 Å²	108.3	46%	0.455	56%	0.563	S	S	.	*	H	α-helix	trans	-63.4	-44.8	176.8	0	0	0	0	0	111.7	G98 L105 E106	G98-A102 WeakPolarHBondContact O-CB 3.14Å; G98-A102 PolarHBondContact O-N 3.24Å; A102-L105 PolarHBondContact O-N 3.08Å; A102-E106 PolarHBondContact O-N 2.95Å
103	S	87.1	Confident	81.1	Confident	57 Å²	57	108.8 Å²	108.8	40%	0.399	58%	0.579	S	S	.	*	H	α-helix	trans	-64.3	-42.4	176.7	60.6	0	0	0	0	112.4	R99 V100 L105 E106 E107	R99-S103 PolarHBondContact O-N 2.96Å; R99-S103 PolarHBondContact O-OG 3.4Å; V100-S103 WeakPolarHBondContact CA-OG 3.32Å; V100-S103 PolarHBondContact O-N 2.91Å; V100-S103 PolarHBondContact O-OG 2.94Å; S103-L105 VanDerWaalsContact C-N 3.29Å; S103-L105 PolarHBondContact O-N 3.01Å; S103-E106 PolarHBondContact O-N 3.47Å; S103-E107 PolarHBondContact O-N 3.1Å; S103-E107 VanDerWaalsContact O-N 3.1Å
104	A	87.6	Confident	79.4	Confident	43 Å²	43	111.8 Å²	111.8	36%	0.355	59%	0.591	S	S	.	*	H	α-helix	trans	-66.2	-31.5	177.4	0	0	0	0	0	112.8	V100 I101 N108	V100-A104 WeakPolarHBondContact O-CB 3.45Å; V100-A104 PolarHBondContact O-N 3.28Å; I101-A104 PolarHBondContact O-N 3.29Å; A104-N108 PolarHBondContact O-N 3.42Å; A104-N108 PolarHBondContact O-ND2 3.19Å
105	L	86.7	Confident	77.2	Confident	96 Å²	96	117.4 Å²	117.4	50%	0.503	62%	0.619	S	S	.	*	H	α-helix	trans	-71.4	-41.5	175.1	-174.7	64.7	0	0	0	111.3	I101 A102 S103 E107 N108 F109	I101-L105 VanDerWaalsContact O-CB 3.32Å; I101-L105 WeakPolarHBondContact O-CB 3.32Å; I101-L105 PolarHBondContact O-N 3.47Å; A102-L105 PolarHBondContact O-N 3.08Å; S103-L105 VanDerWaalsContact C-N 3.29Å; S103-L105 PolarHBondContact O-N 3.01Å; L105-E107 VanDerWaalsContact C-N 3.33Å; L105-E107 PolarHBondContact O-N 3.45Å; L105-N108 PolarHBondContact O-N 3.18Å; L105-F109 HydrophobicContact CD1-CD2 4.03Å; L105-F109 HydrophobicContact CD1-CE2 3.37Å; L105-F109 HydrophobicContact CD1-CZ 4.15Å; L105-F109 HydrophobicContact CD2-CE2 4.06Å; L105-F109 HydrophobicContact CG-CD2 3.86Å; L105-F109 HydrophobicContact CG-CE2 3.49Å; L105-F109 VanDerWaalsContact CG-CE2 3.49Å; L105-F109 WeakPolarHBondContact O-CD2 3.16Å; L105-F109 PolarHBondContact O-N 3.47Å
106	E	84.1	Confident	76.6	Confident	131 Å²	131	116.9 Å²	116.9	61%	0.612	62%	0.616	S	S	*	*	H	α-helix	trans	-64.2	-36.9	178.2	-171.1	150.4	-164.6	0	0	112.3	A102 S103 N108 F109 T110	A102-E106 PolarHBondContact O-N 2.95Å; S103-E106 PolarHBondContact O-N 3.47Å; E106-N108 PolarHBondContact O-N 3.32Å; E106-F109 PolarHBondContact O-N 2.96Å; E106-T110 HydrophobicContact CG-CG2 4.43Å; E106-T110 WeakPolarHBondContact O-CB 3.48Å; E106-T110 PolarHBondContact O-N 3.45Å; E106-T110 PolarHBondContact O-OG1 3.15Å
107	E	80.6	Confident	75.9	Confident	138 Å²	138	117.1 Å²	117.1	65%	0.645	62%	0.621	S	S	*	*	H	α-helix	trans	-61.2	-40.2	171.8	-73.3	175.5	-172.2	0	0	112.6	S103 L105 F109 T110 S111	S103-E107 PolarHBondContact O-N 3.1Å; S103-E107 VanDerWaalsContact O-N 3.1Å; L105-E107 VanDerWaalsContact C-N 3.33Å; L105-E107 PolarHBondContact O-N 3.45Å; E107-F109 VanDerWaalsContact C-N 3.32Å; E107-F109 PolarHBondContact O-N 3.42Å; E107-T110 WeakPolarHBondContact CA-OG1 3.44Å; E107-T110 PolarHBondContact O-N 3.22Å; E107-T110 PolarHBondContact O-OG1 3.45Å; E107-S111 PolarHBondContact O-N 2.87Å; E107-S111 PolarHBondContact O-OG 2.68Å
108	N	77.8	Confident	75	Confident	118 Å²	118	111.9 Å²	111.9	63%	0.631	61%	0.612	S	S	*	*	H	α-helix	trans	-69	-27.6	178	-80.2	-65.2	0	0	0	113.5	A104 L105 E106 S111	A104-N108 PolarHBondContact O-N 3.42Å; A104-N108 PolarHBondContact O-ND2 3.19Å; L105-N108 PolarHBondContact O-N 3.18Å; E106-N108 PolarHBondContact O-N 3.32Å; N108-S111 PolarHBondContact O-OG 3.47Å
109	F	71.5	Confident	74.1	Confident	160 Å²	160	117.1 Å²	117.1	70%	0.702	63%	0.633	S	S	*	*	H	α-helix	trans	-88.9	-26.2	177.2	-72.6	-64.5	0	0	0	113.3	L105 E106 E107	L105-F109 HydrophobicContact CD1-CD2 4.03Å; L105-F109 HydrophobicContact CD1-CE2 3.37Å; L105-F109 HydrophobicContact CD1-CZ 4.15Å; L105-F109 HydrophobicContact CD2-CE2 4.06Å; L105-F109 HydrophobicContact CG-CD2 3.86Å; L105-F109 HydrophobicContact CG-CE2 3.49Å; L105-F109 VanDerWaalsContact CG-CE2 3.49Å; L105-F109 WeakPolarHBondContact O-CD2 3.16Å; L105-F109 PolarHBondContact O-N 3.47Å; E106-F109 PolarHBondContact O-N 2.96Å; E107-F109 VanDerWaalsContact C-N 3.32Å; E107-F109 PolarHBondContact O-N 3.42Å
110	T	68	Low	73.2	Confident	92 Å²	92	114.1 Å²	114.1	56%	0.564	63%	0.634	S	S	*	*	H	α-helix	trans	-87.7	-7	178.4	47.6	0	0	0	0	113.6	E106 E107 P112	E106-T110 HydrophobicContact CG-CG2 4.43Å; E106-T110 WeakPolarHBondContact O-CB 3.48Å; E106-T110 PolarHBondContact O-N 3.45Å; E106-T110 PolarHBondContact O-OG1 3.15Å; E107-T110 WeakPolarHBondContact CA-OG1 3.44Å; E107-T110 PolarHBondContact O-N 3.22Å; E107-T110 PolarHBondContact O-OG1 3.45Å; T110-P112 WeakPolarHBondContact O-CD 3.48Å; T110-P112 WeakPolarHBondContact O-CG 2.95Å
111	S	57.4	Low	72.1	Confident	78 Å²	78	114.9 Å²	114.9	55%	0.545	64%	0.635	S	S	.	*			trans	-78.1	95.9	162.2	56.2	0	0	0	0	110	E107 N108	E107-S111 PolarHBondContact O-N 2.87Å; E107-S111 PolarHBondContact O-OG 2.68Å; N108-S111 PolarHBondContact O-OG 3.47Å
112	P	57.6	Low	70.8	Confident	94 Å²	94	115.7 Å²	115.7	61%	0.61	64%	0.642	S	S	*	*			trans	-93.3	117.7	179.7	17.4	6.6	0	0	0	106.9	T110 L114	T110-P112 WeakPolarHBondContact O-CD 3.48Å; T110-P112 WeakPolarHBondContact O-CG 2.95Å; P112-L114 PolarHBondContact O-N 3.16Å; P112-L114 VanDerWaalsContact O-N 3.16Å
113	S	53.1	Low	69.4	Low	116 Å²	116	120.4 Å²	120.4	81%	0.811	66%	0.657	S	S	*	*			trans	46.5	61.9	149.6	60.1	0	0	0	0	116.4
114	L	52	Low	67.9	Low	167 Å²	167	125.7 Å²	125.7	87%	0.874	68%	0.678	S	S	*	*			trans	-122	98.8	160.4	-79.9	175.3	0	0	0	109.2	P112	P112-L114 PolarHBondContact O-N 3.16Å; P112-L114 VanDerWaalsContact O-N 3.16Å
115	Q	38.9	Very low	66.2	Low	275 Å²	275	133.2 Å²	133.2	100%	1.285	71%	0.708	S	S	*	*			trans	90.6	0	175.4	-58.8	-168.8	-30.1	0	0	117.5

Retrieved 115 of 115 residues in 30.3 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).