A0A077ZGB6_TRITR Loading...

Ank 2 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZGB6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 248 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.4	Very low	36.5	Very low	238 Å²	238	126 Å²	126	100%	1.172	66%	0.66	S	S	*	*				0	120.6	0	-89.5	164.9	178.3	0	0	108.3
2	R	30.3	Very low	37	Very low	247 Å²	247	127.3 Å²	127.3	93%	0.932	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-66.3	132.8	165.2	-88.6	-177.6	-175.8	179	0.7	107.5
3	L	32.7	Very low	37.4	Very low	55 Å²	55	124.2 Å²	124.2	29%	0.288	66%	0.66	S	S	.	*	P	Polyproline II helix	trans	-59.7	143.7	169.3	-79.7	161.3	0	0	0	109.3	E5 N15 Y44	L3-E5 PolarHBondContact O-N 3.02Å; L3-N15 WeakPolarHBondContact CD1-OD1 3.48Å; L3-Y44 HydrophobicContact CD1-CE2 4Å; L3-Y44 HydrophobicContact CD2-CD2 3.48Å; L3-Y44 VanDerWaalsContact CD2-CD2 3.48Å; L3-Y44 HydrophobicContact CD2-CE2 3.27Å; L3-Y44 HydrophobicContact CG-CE2 4.18Å
4	P	32.8	Very low	38.1	Very low	95 Å²	95	119.1 Å²	119.1	62%	0.617	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-58.4	126.3	163.4	1.8	8.8	0	0	0	107.4	V6	P4-V6 VanDerWaalsContact C-N 3.25Å; P4-V6 PolarHBondContact O-N 3.14Å
5	E	36.2	Very low	38.3	Very low	148 Å²	148	118.2 Å²	118.2	69%	0.692	63%	0.628	S	S	*	*			trans	-69.2	86.5	172.9	-69.7	178	166.7	0	0	108.5	L3 H7	L3-E5 PolarHBondContact O-N 3.02Å; E5-H7 VanDerWaalsContact C-N 3.26Å; E5-H7 PolarHBondContact O-N 2.89Å; E5-H7 PolarHBondContact O-ND1 2.7Å; E5-H7 IonicContact OE2-CE1 2.68Å; E5-H7 PolarHBondContact OE2-CE1 2.83Å
6	V	38.8	Very low	38.3	Very low	69 Å²	69	118 Å²	118	42%	0.418	63%	0.633	S	S	.	*			trans	-74.1	90.5	168.1	-165.6	0	0	0	0	106.8	P4 V8 Q40	P4-V6 VanDerWaalsContact C-N 3.25Å; P4-V6 PolarHBondContact O-N 3.14Å; V6-V8 VanDerWaalsContact C-N 3.31Å; V6-V8 HydrophobicContact CG1-CG2 3.93Å; V6-V8 PolarHBondContact O-N 3.08Å; V6-Q40 HydrophobicContact CG2-CG 4.29Å
7	H	39.6	Very low	38.3	Very low	149 Å²	149	115.4 Å²	115.4	69%	0.69	62%	0.618	S	S	*	*			trans	-69.6	90.7	170.3	-77.8	79	0	0	0	108.3	E5	E5-H7 VanDerWaalsContact C-N 3.26Å; E5-H7 PolarHBondContact O-N 2.89Å; E5-H7 PolarHBondContact O-ND1 2.7Å; E5-H7 IonicContact OE2-CE1 2.68Å; E5-H7 PolarHBondContact OE2-CE1 2.83Å
8	V	41.7	Very low	38.7	Very low	39 Å²	39	114.4 Å²	114.4	24%	0.236	61%	0.613	C	S	.	*			trans	-84.9	118.7	168	-162.7	0	0	0	0	107.5	V6 G10 L11 T37	V6-V8 VanDerWaalsContact C-N 3.31Å; V6-V8 HydrophobicContact CG1-CG2 3.93Å; V6-V8 PolarHBondContact O-N 3.08Å; V8-G10 PolarHBondContact O-N 3.14Å; V8-L11 PolarHBondContact O-N 3.07Å; V8-L11 VanDerWaalsContact O-N 3.13Å; V8-T37 HydrophobicContact CB-CG2 4.33Å; V8-T37 HydrophobicContact CG1-CG2 3.69Å; V8-T37 HydrophobicContact CG2-CG2 3.61Å
9	N	36.8	Very low	39.2	Very low	167 Å²	167	114.5 Å²	114.5	89%	0.893	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-36.5	96.9	180	-69.7	-36.3	0	0	0	113.3
10	G	41.3	Very low	39.8	Very low	75 Å²	75	112.4 Å²	112.4	77%	0.773	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	93.1	-2.8	169.6	0	0	0	0	0	117.5	V8	V8-G10 PolarHBondContact O-N 3.14Å
11	L	39.9	Very low	40.7	Very low	104 Å²	104	107.6 Å²	107.6	55%	0.545	59%	0.593	S	S	.	*			trans	-117.1	76.1	175.8	-79.7	161	0	0	0	111	V8 L13	V8-L11 PolarHBondContact O-N 3.07Å; V8-L11 VanDerWaalsContact O-N 3.13Å; L11-L13 PolarHBondContact O-N 3.26Å
12	T	42.5	Very low	42	Very low	141 Å²	141	97.8 Å²	97.8	87%	0.865	54%	0.543	S	S	*	.			trans	-68.8	60.7	168.1	19.9	0	0	0	0	111.8
13	L	42.8	Very low	43.9	Very low	88 Å²	88	87.8 Å²	87.8	46%	0.461	51%	0.508	S	S	.	.			trans	-138.4	21.9	-171.4	-106.5	155.8	0	0	0	115.9	L11 L17	L11-L13 PolarHBondContact O-N 3.26Å; L13-L17 HydrophobicContact CD2-CD1 3.14Å; L13-L17 HydrophobicContact CD2-CG 4.12Å
14	L	46.4	Very low	46	Very low	52 Å²	52	91.2 Å²	91.2	27%	0.272	53%	0.526	S	S	.	.	S	Bend	trans	-99.9	-4.6	179	-78.4	165.7	0	0	0	115.7	L41	L14-L41 HydrophobicContact CD2-CD2 3.62Å
15	N	41.3	Very low	48.1	Very low	106 Å²	106	88.1 Å²	88.1	57%	0.567	51%	0.507	S	S	*	.	S	Bend	trans	-120.4	13.6	-170	-92.4	-16.3	0	0	0	117	L3	L3-N15 WeakPolarHBondContact CD1-OD1 3.48Å
16	T	38.2	Very low	50.4	Low	115 Å²	115	81.1 Å²	81.1	71%	0.706	47%	0.474	S	S	*	.	S	Bend	trans	-139.4	1.2	-177	48.2	0	0	0	0	117.9
17	L	39.3	Very low	52.4	Low	74 Å²	74	78.2 Å²	78.2	39%	0.387	46%	0.456	S	S	.	.			trans	-121.7	117.9	-167.3	-61.3	178.6	0	0	0	112.8	L13 W22	L13-L17 HydrophobicContact CD2-CD1 3.14Å; L13-L17 HydrophobicContact CD2-CG 4.12Å; L17-W22 PolarHBondContact O-NE1 3.3Å; L17-W22 VanDerWaalsContact O-NE1 3.08Å
18	D	43.9	Very low	54.5	Low	97 Å²	97	72.6 Å²	72.6	52%	0.519	44%	0.436	S	S	.	.			trans	10.4	177.6	143.1	61.5	22.5	0	0	0	121.1	C20 G21	D18-C20 PolarHBondContact O-N 2.85Å; D18-C20 PolarHBondContact OD1-N 3.48Å; D18-C20 PolarHBondContact OD1-SG 2.97Å; D18-G21 PolarHBondContact O-N 3.1Å; D18-G21 PolarHBondContact OD1-N 3.5Å; D18-G21 VanDerWaalsContact OD1-N 3.16Å
19	S	49.9	Very low	56.5	Low	116 Å²	116	70.9 Å²	70.9	81%	0.811	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-9.5	-178.8	41.9	0	0	0	0	115
20	C	50.9	Low	58.7	Low	73 Å²	73	63 Å²	63	49%	0.493	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	-16.2	-177.2	53.3	0	0	0	0	114.9	D18 W22 L24	D18-C20 PolarHBondContact O-N 2.85Å; D18-C20 PolarHBondContact OD1-N 3.48Å; D18-C20 PolarHBondContact OD1-SG 2.97Å; C20-W22 PolarHBondContact O-N 3.35Å; C20-L24 PolarHBondContact O-N 2.93Å
21	G	57.9	Low	60.7	Low	12 Å²	12	61.7 Å²	61.7	12%	0.124	36%	0.358	C	S	.	.	H	α-helix	trans	-65.3	-35.1	-179.3	0	0	0	0	0	114.7	D18 L24 S25	D18-G21 PolarHBondContact O-N 3.1Å; D18-G21 PolarHBondContact OD1-N 3.5Å; D18-G21 VanDerWaalsContact OD1-N 3.16Å; G21-L24 PolarHBondContact O-N 3.27Å; G21-S25 PolarHBondContact O-N 2.98Å; G21-S25 PolarHBondContact O-OG 3.21Å
22	W	59.1	Low	62.6	Low	32 Å²	32	60 Å²	60	12%	0.121	35%	0.35	C	S	.	.	H	α-helix	trans	-71	-38.7	-177.1	-58.2	76.7	0	0	0	112.2	L17 C20 L24 S25 L26 L41 Y44 M45 K50	L17-W22 PolarHBondContact O-NE1 3.3Å; L17-W22 VanDerWaalsContact O-NE1 3.08Å; C20-W22 PolarHBondContact O-N 3.35Å; W22-L24 VanDerWaalsContact C-N 3.32Å; W22-S25 PolarHBondContact O-N 3.17Å; W22-L26 WeakPolarHBondContact O-CB 3.28Å; W22-L26 PolarHBondContact O-N 3.23Å; W22-L41 HydrophobicContact CE3-CD2 4.37Å; W22-Y44 AromaticContact CD2-CE1 3.99Å; W22-Y44 HydrophobicContact CD2-CE1 3.99Å; W22-Y44 AromaticContact CE3-CD1 3.57Å; W22-Y44 HydrophobicContact CE3-CD1 3.57Å; W22-Y44 AromaticContact CE3-CE1 3.33Å; W22-Y44 HydrophobicContact CE3-CE1 3.33Å; W22-Y44 AromaticContact CH2-CD1 3.84Å; W22-Y44 HydrophobicContact CH2-CD1 3.84Å; W22-Y44 AromaticContact CH2-CE1 3.07Å; W22-Y44 HydrophobicContact CH2-CE1 3.07Å; W22-Y44 AromaticContact CH2-CE2 3.98Å; W22-Y44 HydrophobicContact CH2-CE2 3.98Å; W22-Y44 AromaticContact CH2-CZ 3.07Å; W22-Y44 WeakPolarHBondContact CH2-OH 3.48Å; W22-Y44 AromaticContact CZ2-CE1 3.7Å; W22-Y44 HydrophobicContact CZ2-CE1 3.7Å; W22-Y44 AromaticContact CZ2-CZ 3.71Å; W22-Y44 WeakPolarHBondContact CZ2-OH 3.44Å; W22-Y44 AromaticContact CZ3-CD1 3.15Å; W22-Y44 HydrophobicContact CZ3-CD1 3.15Å; W22-Y44 HydrophobicContact CZ3-CD2 4.46Å; W22-Y44 AromaticContact CZ3-CE1 2.85Å; W22-Y44 HydrophobicContact CZ3-CE1 2.85Å; W22-Y44 HydrophobicContact CZ3-CE2 4.21Å; W22-Y44 AromaticContact CZ3-CG 3.95Å; W22-Y44 HydrophobicContact CZ3-CG 3.95Å; W22-Y44 AromaticContact CZ3-CZ 3.38Å; W22-M45 HydrophobicContact CB-CE 3.91Å; W22-M45 WeakPolarHBondContact O-CE 3.37Å; W22-K50 HydrophobicContact CD2-CD 4.45Å; W22-K50 HydrophobicContact CG-CD 4.32Å
23	D	70.3	Confident	64.4	Low	37 Å²	37	53.4 Å²	53.4	20%	0.198	31%	0.309	C	S	.	.	H	α-helix	trans	-61.2	-50	174.9	-56.8	-25.9	0	0	0	107.8	S25 L26 H27 S54	D23-S25 VanDerWaalsContact C-N 3.34Å; D23-S25 PolarHBondContact O-N 3.29Å; D23-L26 PolarHBondContact O-N 3.39Å; D23-L26 VanDerWaalsContact O-N 3.14Å; D23-H27 PolarHBondContact O-N 2.97Å; D23-H27 PolarHBondContact O-ND1 3.36Å; D23-S54 WeakPolarHBondContact OD1-CB 3.42Å; D23-S54 PolarHBondContact OD1-OG 2.92Å; D23-S54 WeakPolarHBondContact OD2-CB 3.47Å
24	L	75.8	Confident	66.3	Low	127 Å²	127	53 Å²	53	67%	0.665	31%	0.305	S	S	*	.	H	α-helix	trans	-58.1	-43.9	178.5	-174.3	61.7	0	0	0	112.8	C20 G21 W22 H27 A28	C20-L24 PolarHBondContact O-N 2.93Å; G21-L24 PolarHBondContact O-N 3.27Å; W22-L24 VanDerWaalsContact C-N 3.32Å; L24-H27 PolarHBondContact O-N 3.09Å; L24-A28 VanDerWaalsContact O-CB 3.3Å; L24-A28 WeakPolarHBondContact O-CB 3.28Å; L24-A28 PolarHBondContact O-N 3.04Å
25	S	77.6	Confident	68.1	Low	30 Å²	30	52.7 Å²	52.7	21%	0.21	30%	0.302	C	S	.	.	H	α-helix	trans	-63.6	-40.7	176.7	-60.8	0	0	0	0	112.8	G21 W22 D23 A28 S29	G21-S25 PolarHBondContact O-N 2.98Å; G21-S25 PolarHBondContact O-OG 3.21Å; W22-S25 PolarHBondContact O-N 3.17Å; D23-S25 VanDerWaalsContact C-N 3.34Å; D23-S25 PolarHBondContact O-N 3.29Å; S25-A28 PolarHBondContact O-N 3.48Å; S25-S29 PolarHBondContact O-N 3.43Å; S25-S29 PolarHBondContact O-OG 3.37Å
26	L	83.8	Confident	70.1	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-66	-40	176.4	-174.7	77.1	0	0	0	111.8	W22 D23 S29 A30 L38 L41 L42 M45 A63 L86	W22-L26 WeakPolarHBondContact O-CB 3.28Å; W22-L26 PolarHBondContact O-N 3.23Å; D23-L26 PolarHBondContact O-N 3.39Å; D23-L26 VanDerWaalsContact O-N 3.14Å; L26-S29 PolarHBondContact O-OG 2.9Å; L26-A30 WeakPolarHBondContact O-CB 3.46Å; L26-A30 PolarHBondContact O-N 2.83Å; L26-L38 HydrophobicContact CD1-CD1 3.66Å; L26-L38 HydrophobicContact CG-CD1 4.48Å; L26-L41 HydrophobicContact CD1-CB 4.23Å; L26-L42 HydrophobicContact CD1-CD2 3.97Å; L26-L42 HydrophobicContact CD1-CG 4.3Å; L26-M45 HydrophobicContact CB-CE 3.73Å; L26-M45 HydrophobicContact CD1-CE 4.23Å; L26-M45 HydrophobicContact CD1-SD 4.05Å; L26-M45 HydrophobicContact CD2-CE 3.93Å; L26-M45 HydrophobicContact CD2-SD 3.88Å; L26-M45 HydrophobicContact CG-CE 4.18Å; L26-M45 HydrophobicContact CG-SD 4.39Å; L26-A63 HydrophobicContact CD2-CB 3.85Å; L26-A63 HydrophobicContact CG-CB 3.82Å; L26-L86 HydrophobicContact CD1-CD2 4.26Å; L26-L86 HydrophobicContact CD2-CD2 4.39Å; L26-L86 HydrophobicContact CG-CD2 4.44Å
27	H	82.1	Confident	72.2	Confident	8 Å²	8	49.8 Å²	49.8	4%	0.037	28%	0.279	C	S	.	.	H	α-helix	trans	-67.7	-42.6	176.8	-69.4	60.1	0	0	0	110.3	D23 L24 A30 I31 S54 W61 A63 W66	D23-H27 PolarHBondContact O-N 2.97Å; D23-H27 PolarHBondContact O-ND1 3.36Å; L24-H27 PolarHBondContact O-N 3.09Å; H27-A30 PolarHBondContact O-N 2.85Å; H27-I31 WeakPolarHBondContact O-CD1 3.44Å; H27-I31 WeakPolarHBondContact O-CG1 3.33Å; H27-I31 PolarHBondContact O-N 3.39Å; H27-S54 PolarHBondContact CE1-O 2.9Å; H27-S54 PolarHBondContact NE2-O 3.32Å; H27-W61 PolarHBondContact NE2-O 3.04Å; H27-A63 PolarHBondContact NE2-N 2.91Å; H27-W66 AromaticContact CD2-CD1 3.36Å; H27-W66 AromaticContact CD2-NE1 3.57Å
28	A	82.5	Confident	74.5	Confident	32 Å²	32	46.3 Å²	46.3	26%	0.264	26%	0.26	S	S	.	.	H	α-helix	trans	-63.7	-45.1	177.9	0	0	0	0	0	112.4	L24 S25 A30 I31 D32	L24-A28 VanDerWaalsContact O-CB 3.3Å; L24-A28 WeakPolarHBondContact O-CB 3.28Å; L24-A28 PolarHBondContact O-N 3.04Å; S25-A28 PolarHBondContact O-N 3.48Å; A28-A30 VanDerWaalsContact C-N 3.27Å; A28-A30 PolarHBondContact O-N 3.26Å; A28-I31 PolarHBondContact O-N 2.89Å; A28-I31 VanDerWaalsContact O-N 3.16Å; A28-D32 PolarHBondContact O-N 3.38Å
29	S	83.7	Confident	76.5	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.021	25%	0.25	C	C	.	.	H	α-helix	trans	-62	-36.8	177.2	61.7	0	0	0	0	112.1	S25 L26 G33 H34 T37 L38	S25-S29 PolarHBondContact O-N 3.43Å; S25-S29 PolarHBondContact O-OG 3.37Å; L26-S29 PolarHBondContact O-OG 2.9Å; S29-G33 PolarHBondContact O-N 3.02Å; S29-H34 PolarHBondContact O-N 3.17Å; S29-T37 VanDerWaalsContact CB-OG1 3.26Å; S29-T37 WeakPolarHBondContact CB-OG1 3.45Å; S29-L38 VanDerWaalsContact OG-CD1 3.24Å; S29-L38 WeakPolarHBondContact OG-CD1 3.36Å
30	A	84.6	Confident	78.1	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-68.4	-36.5	174.2	0	0	0	0	0	113.6	L26 H27 A28 A63 A67 L86	L26-A30 WeakPolarHBondContact O-CB 3.46Å; L26-A30 PolarHBondContact O-N 2.83Å; H27-A30 PolarHBondContact O-N 2.85Å; A28-A30 VanDerWaalsContact C-N 3.27Å; A28-A30 PolarHBondContact O-N 3.26Å; A30-A63 HydrophobicContact CB-CB 4.08Å; A30-A67 HydrophobicContact CB-CB 4.19Å; A30-L86 HydrophobicContact CB-CD1 4.08Å
31	I	81.6	Confident	79.6	Confident	48 Å²	48	40 Å²	40	25%	0.246	21%	0.21	C	C	.	.	H	α-helix	trans	-68.7	-50.3	176.6	-70.3	163.4	0	0	0	110.7	H27 A28 G33 W66 Q79	H27-I31 WeakPolarHBondContact O-CD1 3.44Å; H27-I31 WeakPolarHBondContact O-CG1 3.33Å; H27-I31 PolarHBondContact O-N 3.39Å; A28-I31 PolarHBondContact O-N 2.89Å; A28-I31 VanDerWaalsContact O-N 3.16Å; I31-G33 VanDerWaalsContact C-N 3.32Å; I31-G33 PolarHBondContact O-N 3.17Å; I31-W66 HydrophobicContact CD1-CB 4.18Å; I31-W66 HydrophobicContact CD1-CD2 3.7Å; I31-W66 HydrophobicContact CD1-CE3 3.66Å; I31-W66 HydrophobicContact CD1-CG 3.95Å; I31-W66 HydrophobicContact CD1-CZ3 4.33Å; I31-W66 HydrophobicContact CG1-CB 3.58Å; I31-W66 HydrophobicContact CG1-CD2 3.99Å; I31-W66 HydrophobicContact CG1-CE3 3.86Å; I31-W66 HydrophobicContact CG1-CG 3.91Å; I31-Q79 PolarHBondContact O-NE2 2.9Å
32	D	80.6	Confident	80.9	Confident	70 Å²	70	40 Å²	40	37%	0.374	21%	0.206	S	C	.	.	H	α-helix	trans	-80.5	-17.3	-172.8	-69.8	-26.1	0	0	0	112.6	A28 N75	A28-D32 PolarHBondContact O-N 3.38Å; D32-N75 PolarHBondContact O-ND2 3.35Å
33	G	79.4	Confident	82.1	Confident	2 Å²	2	42.9 Å²	42.9	2%	0.021	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	33.8	-177.9	0	0	0	0	0	112.7	S29 I31 E35 L78	S29-G33 PolarHBondContact O-N 3.02Å; I31-G33 VanDerWaalsContact C-N 3.32Å; I31-G33 PolarHBondContact O-N 3.17Å; G33-E35 PolarHBondContact O-N 3.36Å; G33-E35 VanDerWaalsContact O-N 3.13Å; G33-L78 WeakPolarHBondContact O-CB 3.47Å
34	H	83	Confident	82.6	Confident	80 Å²	80	42 Å²	42	37%	0.37	22%	0.218	S	C	.	.			trans	-85.9	77.8	-179.5	-68.5	-42.9	0	0	0	111	S29 E36 T37 L38	S29-H34 PolarHBondContact O-N 3.17Å; H34-E36 PolarHBondContact O-N 3.41Å; H34-T37 HydrophobicContact CB-CG2 4Å; H34-T37 WeakPolarHBondContact CB-OG1 3.25Å; H34-T37 PolarHBondContact O-N 3.43Å; H34-T37 VanDerWaalsContact O-N 3.14Å; H34-T37 PolarHBondContact O-OG1 3.47Å; H34-L38 WeakPolarHBondContact O-CB 3.34Å; H34-L38 PolarHBondContact O-N 3.47Å
35	E	84.8	Confident	82.9	Confident	44 Å²	44	36 Å²	36	21%	0.206	19%	0.187	C	C	.	.	H	α-helix	trans	-50.6	-51.1	-175.9	-178.4	177.7	-174.4	0	0	112.5	G33 T37 L38 D39 V81 R85	G33-E35 PolarHBondContact O-N 3.36Å; G33-E35 VanDerWaalsContact O-N 3.13Å; E35-T37 VanDerWaalsContact C-N 3.29Å; E35-T37 PolarHBondContact O-N 3.13Å; E35-L38 WeakPolarHBondContact O-CB 3.2Å; E35-L38 PolarHBondContact O-N 3.35Å; E35-L38 VanDerWaalsContact O-N 3.12Å; E35-D39 PolarHBondContact O-N 3.07Å; E35-V81 VanDerWaalsContact CD-CG1 3.43Å; E35-V81 HydrophobicContact CG-CG1 4.06Å; E35-V81 WeakPolarHBondContact OE1-CG1 3.3Å; E35-R85 IonicContact OE1-CZ 3.37Å; E35-R85 IonicContact OE1-NE 3.01Å; E35-R85 PolarHBondContact OE1-NE 2.92Å; E35-R85 IonicContact OE1-NH2 3.96Å; E35-R85 PolarHBondContact OE1-NH2 3.3Å
36	E	82.6	Confident	83.1	Confident	140 Å²	140	38.3 Å²	38.3	65%	0.654	21%	0.207	S	C	*	.	H	α-helix	trans	-63.8	-38.3	-176.5	-64.2	84.7	175.2	0	0	111.8	H34 L38 D39 Q40	H34-E36 PolarHBondContact O-N 3.41Å; E36-L38 VanDerWaalsContact C-N 3.34Å; E36-D39 PolarHBondContact O-N 2.87Å; E36-Q40 VanDerWaalsContact O-CG 3.28Å; E36-Q40 WeakPolarHBondContact O-CG 3.38Å; E36-Q40 PolarHBondContact O-N 3.38Å; E36-Q40 VanDerWaalsContact O-N 3.1Å
37	T	83.8	Confident	83	Confident	21 Å²	21	45.1 Å²	45.1	13%	0.129	24%	0.239	C	C	.	.	H	α-helix	trans	-69.7	-37	177.7	71.4	0	0	0	0	111.3	V8 S29 H34 E35 Q40 L41	V8-T37 HydrophobicContact CB-CG2 4.33Å; V8-T37 HydrophobicContact CG1-CG2 3.69Å; V8-T37 HydrophobicContact CG2-CG2 3.61Å; S29-T37 VanDerWaalsContact CB-OG1 3.26Å; S29-T37 WeakPolarHBondContact CB-OG1 3.45Å; H34-T37 HydrophobicContact CB-CG2 4Å; H34-T37 WeakPolarHBondContact CB-OG1 3.25Å; H34-T37 PolarHBondContact O-N 3.43Å; H34-T37 VanDerWaalsContact O-N 3.14Å; H34-T37 PolarHBondContact O-OG1 3.47Å; E35-T37 VanDerWaalsContact C-N 3.29Å; E35-T37 PolarHBondContact O-N 3.13Å; T37-Q40 PolarHBondContact O-N 2.62Å; T37-L41 WeakPolarHBondContact O-CB 3.28Å; T37-L41 WeakPolarHBondContact O-CG 3.26Å; T37-L41 PolarHBondContact O-N 2.9Å
38	L	86	Confident	82.8	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.1	-47.1	175.8	-176.6	77.7	0	0	0	110.3	L26 S29 H34 E35 E36 Q40 L41 L42 C82 R85 L86	L26-L38 HydrophobicContact CD1-CD1 3.66Å; L26-L38 HydrophobicContact CG-CD1 4.48Å; S29-L38 VanDerWaalsContact OG-CD1 3.24Å; S29-L38 WeakPolarHBondContact OG-CD1 3.36Å; H34-L38 WeakPolarHBondContact O-CB 3.34Å; H34-L38 PolarHBondContact O-N 3.47Å; E35-L38 WeakPolarHBondContact O-CB 3.2Å; E35-L38 PolarHBondContact O-N 3.35Å; E35-L38 VanDerWaalsContact O-N 3.12Å; E36-L38 VanDerWaalsContact C-N 3.34Å; L38-Q40 VanDerWaalsContact C-N 3.35Å; L38-Q40 PolarHBondContact O-N 2.96Å; L38-L41 WeakPolarHBondContact O-CB 3.41Å; L38-L41 PolarHBondContact O-N 3.43Å; L38-L41 VanDerWaalsContact O-N 3.15Å; L38-L42 HydrophobicContact CD1-CD1 4.44Å; L38-L42 HydrophobicContact CD2-CD1 4.23Å; L38-L42 HydrophobicContact CG-CD1 3.85Å; L38-L42 HydrophobicContact CG-CG 4.3Å; L38-L42 WeakPolarHBondContact O-CB 3.47Å; L38-L42 VanDerWaalsContact O-CG 3.29Å; L38-L42 WeakPolarHBondContact O-CG 3.27Å; L38-L42 PolarHBondContact O-N 2.98Å; L38-C82 VanDerWaalsContact CD2-CA 3.47Å; L38-C82 HydrophobicContact CD2-CB 3.61Å; L38-C82 WeakPolarHBondContact CD2-O 3.37Å; L38-R85 HydrophobicContact CD2-CB 3.96Å; L38-L86 HydrophobicContact CD1-CD2 4.2Å; L38-L86 HydrophobicContact CD1-CG 4.34Å; L38-L86 HydrophobicContact CD2-CG 4.36Å
39	D	85.8	Confident	82.5	Confident	56 Å²	56	52.9 Å²	52.9	30%	0.299	28%	0.28	S	S	.	.	H	α-helix	trans	-61.4	-42.9	179.2	-78	-9.7	0	0	0	111.7	E35 E36 L41 L42 L43 R85	E35-D39 PolarHBondContact O-N 3.07Å; E36-D39 PolarHBondContact O-N 2.87Å; D39-L41 VanDerWaalsContact C-N 3.33Å; D39-L41 PolarHBondContact O-N 3.23Å; D39-L42 PolarHBondContact O-N 3.38Å; D39-L43 WeakPolarHBondContact O-CB 3.39Å; D39-L43 PolarHBondContact O-N 3.32Å; D39-R85 IonicContact OD1-NE 3.61Å
40	Q	83.6	Confident	82	Confident	89 Å²	89	56 Å²	56	42%	0.416	29%	0.293	S	S	.	.	H	α-helix	trans	-63.5	-39.7	175.1	-67.6	-59.8	-36.6	0	0	112.1	V6 E36 T37 L38 Y44	V6-Q40 HydrophobicContact CG2-CG 4.29Å; E36-Q40 VanDerWaalsContact O-CG 3.28Å; E36-Q40 WeakPolarHBondContact O-CG 3.38Å; E36-Q40 PolarHBondContact O-N 3.38Å; E36-Q40 VanDerWaalsContact O-N 3.1Å; T37-Q40 PolarHBondContact O-N 2.62Å; L38-Q40 VanDerWaalsContact C-N 3.35Å; L38-Q40 PolarHBondContact O-N 2.96Å; Q40-Y44 VanDerWaalsContact O-CB 3.28Å; Q40-Y44 WeakPolarHBondContact O-CB 3.47Å; Q40-Y44 PolarHBondContact O-N 3.39Å
41	L	83.5	Confident	81.7	Confident	9 Å²	9	63 Å²	63	5%	0.047	33%	0.325	C	S	.	.	H	α-helix	trans	-66.2	-45.2	176.3	-75.4	169.3	0	0	0	111.8	L14 W22 L26 T37 L38 D39 Y44 M45	L14-L41 HydrophobicContact CD2-CD2 3.62Å; W22-L41 HydrophobicContact CE3-CD2 4.37Å; L26-L41 HydrophobicContact CD1-CB 4.23Å; T37-L41 WeakPolarHBondContact O-CB 3.28Å; T37-L41 WeakPolarHBondContact O-CG 3.26Å; T37-L41 PolarHBondContact O-N 2.9Å; L38-L41 WeakPolarHBondContact O-CB 3.41Å; L38-L41 PolarHBondContact O-N 3.43Å; L38-L41 VanDerWaalsContact O-N 3.15Å; D39-L41 VanDerWaalsContact C-N 3.33Å; D39-L41 PolarHBondContact O-N 3.23Å; L41-Y44 PolarHBondContact O-N 3.36Å; L41-M45 WeakPolarHBondContact O-CB 3.47Å; L41-M45 WeakPolarHBondContact O-CG 3.46Å; L41-M45 PolarHBondContact O-N 3.22Å
42	L	85.2	Confident	81.7	Confident	11 Å²	11	61.7 Å²	61.7	6%	0.058	32%	0.32	C	S	.	.	H	α-helix	trans	-63.4	-44.8	178.8	-72.2	172.4	0	0	0	111.4	L26 L38 D39 Y44 M45 A46 T52 R85 L86	L26-L42 HydrophobicContact CD1-CD2 3.97Å; L26-L42 HydrophobicContact CD1-CG 4.3Å; L38-L42 HydrophobicContact CD1-CD1 4.44Å; L38-L42 HydrophobicContact CD2-CD1 4.23Å; L38-L42 HydrophobicContact CG-CD1 3.85Å; L38-L42 HydrophobicContact CG-CG 4.3Å; L38-L42 WeakPolarHBondContact O-CB 3.47Å; L38-L42 VanDerWaalsContact O-CG 3.29Å; L38-L42 WeakPolarHBondContact O-CG 3.27Å; L38-L42 PolarHBondContact O-N 2.98Å; D39-L42 PolarHBondContact O-N 3.38Å; L42-Y44 PolarHBondContact O-N 3.28Å; L42-M45 PolarHBondContact O-N 3.36Å; L42-A46 WeakPolarHBondContact O-CB 3.42Å; L42-A46 PolarHBondContact O-N 2.79Å; L42-T52 HydrophobicContact CD2-CG2 3.83Å; L42-R85 HydrophobicContact CD1-CB 4.11Å; L42-L86 HydrophobicContact CD2-CD2 4.11Å
43	L	84.3	Confident	81.8	Confident	93 Å²	93	62.6 Å²	62.6	49%	0.487	32%	0.322	S	S	.	.	H	α-helix	trans	-59.2	-48.3	175.1	-177.9	63.6	0	0	0	111	D39 M45 A46 E47	D39-L43 WeakPolarHBondContact O-CB 3.39Å; D39-L43 PolarHBondContact O-N 3.32Å; L43-M45 PolarHBondContact O-N 3.1Å; L43-A46 PolarHBondContact O-N 3.35Å; L43-E47 WeakPolarHBondContact O-CG 3.36Å; L43-E47 PolarHBondContact O-N 3.16Å
44	Y	80.8	Confident	82	Confident	19 Å²	19	63.7 Å²	63.7	8%	0.075	33%	0.33	C	S	.	.	H	α-helix	trans	-63.8	-39.6	178.5	177.1	-86.9	0	0	0	113	L3 W22 Q40 L41 L42 E47 R48 K50	L3-Y44 HydrophobicContact CD1-CE2 4Å; L3-Y44 HydrophobicContact CD2-CD2 3.48Å; L3-Y44 VanDerWaalsContact CD2-CD2 3.48Å; L3-Y44 HydrophobicContact CD2-CE2 3.27Å; L3-Y44 HydrophobicContact CG-CE2 4.18Å; W22-Y44 AromaticContact CD2-CE1 3.99Å; W22-Y44 HydrophobicContact CD2-CE1 3.99Å; W22-Y44 AromaticContact CE3-CD1 3.57Å; W22-Y44 HydrophobicContact CE3-CD1 3.57Å; W22-Y44 AromaticContact CE3-CE1 3.33Å; W22-Y44 HydrophobicContact CE3-CE1 3.33Å; W22-Y44 AromaticContact CH2-CD1 3.84Å; W22-Y44 HydrophobicContact CH2-CD1 3.84Å; W22-Y44 AromaticContact CH2-CE1 3.07Å; W22-Y44 HydrophobicContact CH2-CE1 3.07Å; W22-Y44 AromaticContact CH2-CE2 3.98Å; W22-Y44 HydrophobicContact CH2-CE2 3.98Å; W22-Y44 AromaticContact CH2-CZ 3.07Å; W22-Y44 WeakPolarHBondContact CH2-OH 3.48Å; W22-Y44 AromaticContact CZ2-CE1 3.7Å; W22-Y44 HydrophobicContact CZ2-CE1 3.7Å; W22-Y44 AromaticContact CZ2-CZ 3.71Å; W22-Y44 WeakPolarHBondContact CZ2-OH 3.44Å; W22-Y44 AromaticContact CZ3-CD1 3.15Å; W22-Y44 HydrophobicContact CZ3-CD1 3.15Å; W22-Y44 HydrophobicContact CZ3-CD2 4.46Å; W22-Y44 AromaticContact CZ3-CE1 2.85Å; W22-Y44 HydrophobicContact CZ3-CE1 2.85Å; W22-Y44 HydrophobicContact CZ3-CE2 4.21Å; W22-Y44 AromaticContact CZ3-CG 3.95Å; W22-Y44 HydrophobicContact CZ3-CG 3.95Å; W22-Y44 AromaticContact CZ3-CZ 3.38Å; Q40-Y44 VanDerWaalsContact O-CB 3.28Å; Q40-Y44 WeakPolarHBondContact O-CB 3.47Å; Q40-Y44 PolarHBondContact O-N 3.39Å; L41-Y44 PolarHBondContact O-N 3.36Å; L42-Y44 PolarHBondContact O-N 3.28Å; Y44-E47 PolarHBondContact O-N 3.37Å; Y44-R48 HydrophobicContact CE1-CG 4.29Å; Y44-R48 HydrophobicContact CE2-CG 4.4Å; Y44-R48 VanDerWaalsContact CE2-CZ 3.43Å; Y44-R48 PolarHBondContact O-N 3.44Å; Y44-R48 PolarHBondContact OH-NE 3.39Å; Y44-R48 PolarHBondContact OH-NH1 3.27Å; Y44-R48 PolarHBondContact OH-NH2 3.19Å; Y44-K50 HydrophobicContact CE1-CD 4.49Å
45	M	80.9	Confident	82	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-63.9	-43.1	176.5	-76	179.8	173.4	0	0	111.1	W22 L26 L41 L42 L43 R48 G49 K50 T52	W22-M45 HydrophobicContact CB-CE 3.91Å; W22-M45 WeakPolarHBondContact O-CE 3.37Å; L26-M45 HydrophobicContact CB-CE 3.73Å; L26-M45 HydrophobicContact CD1-CE 4.23Å; L26-M45 HydrophobicContact CD1-SD 4.05Å; L26-M45 HydrophobicContact CD2-CE 3.93Å; L26-M45 HydrophobicContact CD2-SD 3.88Å; L26-M45 HydrophobicContact CG-CE 4.18Å; L26-M45 HydrophobicContact CG-SD 4.39Å; L41-M45 WeakPolarHBondContact O-CB 3.47Å; L41-M45 WeakPolarHBondContact O-CG 3.46Å; L41-M45 PolarHBondContact O-N 3.22Å; L42-M45 PolarHBondContact O-N 3.36Å; L43-M45 PolarHBondContact O-N 3.1Å; M45-R48 PolarHBondContact O-N 3.26Å; M45-G49 PolarHBondContact O-N 2.63Å; M45-K50 HydrophobicContact CB-CB 4.09Å; M45-K50 HydrophobicContact CG-CB 4.06Å; M45-K50 PolarHBondContact O-N 3.36Å; M45-T52 HydrophobicContact SD-CG2 4.28Å
46	A	81.9	Confident	81.9	Confident	78 Å²	78	63.5 Å²	63.5	65%	0.645	33%	0.33	S	S	*	.	H	α-helix	trans	-61.5	-45.5	175.8	0	0	0	0	0	111.9	L42 L43 R48 G49	L42-A46 WeakPolarHBondContact O-CB 3.42Å; L42-A46 PolarHBondContact O-N 2.79Å; L43-A46 PolarHBondContact O-N 3.35Å; A46-R48 PolarHBondContact O-N 3.05Å; A46-G49 PolarHBondContact O-N 3.39Å
47	E	82.7	Confident	81.5	Confident	144 Å²	144	68.2 Å²	68.2	67%	0.673	34%	0.342	S	S	*	.	H	α-helix	trans	-62.2	-30.4	178.2	-74.9	-179.9	176.8	0	0	113.5	L43 Y44	L43-E47 WeakPolarHBondContact O-CG 3.36Å; L43-E47 PolarHBondContact O-N 3.16Å; Y44-E47 PolarHBondContact O-N 3.37Å
48	R	78.3	Confident	81	Confident	142 Å²	142	75.5 Å²	75.5	54%	0.536	37%	0.368	S	S	.	.	H	α-helix	trans	-102	2.3	-177.5	-64.6	-156.5	178.6	-170.9	7.6	114.4	Y44 M45 A46 K50	Y44-R48 HydrophobicContact CE1-CG 4.29Å; Y44-R48 HydrophobicContact CE2-CG 4.4Å; Y44-R48 VanDerWaalsContact CE2-CZ 3.43Å; Y44-R48 PolarHBondContact O-N 3.44Å; Y44-R48 PolarHBondContact OH-NE 3.39Å; Y44-R48 PolarHBondContact OH-NH1 3.27Å; Y44-R48 PolarHBondContact OH-NH2 3.19Å; M45-R48 PolarHBondContact O-N 3.26Å; A46-R48 PolarHBondContact O-N 3.05Å; R48-K50 HydrophobicContact CB-CG 4.19Å; R48-K50 PolarHBondContact O-N 3.49Å
49	G	75.2	Confident	80.7	Confident	60 Å²	60	76.7 Å²	76.7	62%	0.619	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	31.8	-177	0	0	0	0	0	113.3	M45 A46	M45-G49 PolarHBondContact O-N 2.63Å; A46-G49 PolarHBondContact O-N 3.39Å
50	K	74.6	Confident	80.6	Confident	69 Å²	69	74.2 Å²	74.2	30%	0.3	36%	0.362	S	S	.	.			trans	-80.8	149.9	174.5	-66.9	-169.6	174.5	-162.6	0	110.5	W22 Y44 M45 R48	W22-K50 HydrophobicContact CD2-CD 4.45Å; W22-K50 HydrophobicContact CG-CD 4.32Å; Y44-K50 HydrophobicContact CE1-CD 4.49Å; M45-K50 HydrophobicContact CB-CB 4.09Å; M45-K50 HydrophobicContact CG-CB 4.06Å; M45-K50 PolarHBondContact O-N 3.36Å; R48-K50 HydrophobicContact CB-CG 4.19Å; R48-K50 PolarHBondContact O-N 3.49Å
51	H	77.8	Confident	80.8	Confident	146 Å²	146	71.2 Å²	71.2	68%	0.676	35%	0.347	S	S	*	.			trans	-79.8	124.6	-179.1	-57.6	-65.2	0	0	0	111	E53 S54	H51-E53 VanDerWaalsContact C-N 3.26Å; H51-S54 PolarHBondContact O-OG 3.47Å; H51-S54 VanDerWaalsContact O-OG 3.07Å
52	T	81.2	Confident	81.2	Confident	22 Å²	22	70.9 Å²	70.9	14%	0.135	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-14.4	172.4	47	0	0	0	0	112.7	L42 M45 S54 C90	L42-T52 HydrophobicContact CD2-CG2 3.83Å; M45-T52 HydrophobicContact SD-CG2 4.28Å; T52-S54 VanDerWaalsContact C-N 3.32Å; T52-C90 WeakPolarHBondContact OG1-CB 3.43Å; T52-C90 PolarHBondContact OG1-SG 3.09Å; T52-C90 VanDerWaalsContact OG1-SG 3.34Å
53	E	83.1	Confident	81.4	Confident	88 Å²	88	70.3 Å²	70.3	41%	0.411	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	9.8	-177.8	-54.9	-176.2	146.3	0	0	113.2	H51 Q55 T62 C90 G92 L93	H51-E53 VanDerWaalsContact C-N 3.26Å; E53-Q55 PolarHBondContact O-N 3.02Å; E53-T62 WeakPolarHBondContact O-CG2 3.42Å; E53-C90 VanDerWaalsContact CD-SG 3.58Å; E53-C90 WeakPolarHBondContact CG-SG 3.33Å; E53-C90 PolarHBondContact OE1-SG 3.28Å; E53-G92 VanDerWaalsContact OE1-CA 3.3Å; E53-G92 WeakPolarHBondContact OE1-CA 3.48Å; E53-L93 HydrophobicContact CB-CD2 4.17Å; E53-L93 HydrophobicContact CG-CD2 3.89Å; E53-L93 HydrophobicContact CG-CG 4.13Å
54	S	83.3	Confident	81.8	Confident	26 Å²	26	65.9 Å²	65.9	18%	0.182	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-54.1	130.4	179.4	-60.9	0	0	0	0	111	D23 H27 H51 T52	D23-S54 WeakPolarHBondContact OD1-CB 3.42Å; D23-S54 PolarHBondContact OD1-OG 2.92Å; D23-S54 WeakPolarHBondContact OD2-CB 3.47Å; H27-S54 PolarHBondContact CE1-O 2.9Å; H27-S54 PolarHBondContact NE2-O 3.32Å; H51-S54 PolarHBondContact O-OG 3.47Å; H51-S54 VanDerWaalsContact O-OG 3.07Å; T52-S54 VanDerWaalsContact C-N 3.32Å
55	Q	83.5	Confident	82.3	Confident	84 Å²	84	65 Å²	65	39%	0.393	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-96.2	141.4	177.6	-66.5	-173	-17.3	0	0	110.1	E53 G60 W61 T62 S97	E53-Q55 PolarHBondContact O-N 3.02Å; Q55-G60 VanDerWaalsContact CG-O 3.29Å; Q55-G60 WeakPolarHBondContact CG-O 3.36Å; Q55-G60 PolarHBondContact NE2-O 3.44Å; Q55-W61 CarbonylContact C-O 3.52Å; Q55-W61 WeakPolarHBondContact CA-O 3.4Å; Q55-T62 HydrophobicContact CG-CG2 3.86Å; Q55-S97 PolarHBondContact NE2-O 2.64Å
56	N	81.1	Confident	82.7	Confident	36 Å²	36	67.9 Å²	67.9	19%	0.193	33%	0.327	C	S	.	.	P	Polyproline II helix	trans	-70	160.8	171.7	75.5	15.7	0	0	0	111.7	Y58 N59 G60 W61 W66	N56-Y58 PolarHBondContact O-N 3.49Å; N56-Y58 PolarHBondContact OD1-N 3.03Å; N56-N59 PolarHBondContact ND2-OD1 2.68Å; N56-N59 PolarHBondContact OD1-N 3.39Å; N56-N59 PolarHBondContact OD1-OD1 3.44Å; N56-G60 WeakPolarHBondContact O-CA 3.08Å; N56-G60 PolarHBondContact O-N 3.08Å; N56-G60 PolarHBondContact OD1-N 3.2Å; N56-W61 PolarHBondContact N-O 2.8Å; N56-W61 PolarHBondContact OD1-N 3.31Å; N56-W61 VanDerWaalsContact OD1-N 3.14Å; N56-W66 PolarHBondContact ND2-NE1 2.84Å
57	W	75	Confident	83.1	Confident	238 Å²	238	64.1 Å²	64.1	90%	0.902	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-21	-176.7	66.1	-91.2	0	0	0	114.2
58	Y	73.4	Confident	83.6	Confident	175 Å²	175	57.3 Å²	57.3	69%	0.686	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-48.6	-169.4	177	-97.4	0	0	0	112.9	N56	N56-Y58 PolarHBondContact O-N 3.49Å; N56-Y58 PolarHBondContact OD1-N 3.03Å
59	N	79.4	Confident	84.2	Confident	25 Å²	25	55.3 Å²	55.3	13%	0.134	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	7.5	-177.7	60.8	-1.8	0	0	0	113	N56 W61 S98	N56-N59 PolarHBondContact ND2-OD1 2.68Å; N56-N59 PolarHBondContact OD1-N 3.39Å; N56-N59 PolarHBondContact OD1-OD1 3.44Å; N59-W61 HydrophobicContact CB-CG 4.44Å; N59-W61 VanDerWaalsContact CG-CD1 3.44Å; N59-W61 VanDerWaalsContact CG-CG 3.42Å; N59-W61 PolarHBondContact ND2-NE1 3.47Å; N59-W61 PolarHBondContact O-N 2.89Å; N59-W61 VanDerWaalsContact OD1-CB 3.28Å; N59-W61 WeakPolarHBondContact OD1-CB 3.43Å; N59-W61 PolarHBondContact OD1-N 3.14Å; N59-S98 VanDerWaalsContact O-CB 3.3Å; N59-S98 WeakPolarHBondContact O-CB 3.49Å
60	G	84.4	Confident	84.5	Confident	4 Å²	4	53.3 Å²	53.3	4%	0.041	23%	0.234	C	C	.	.			trans	69	20.2	179.6	0	0	0	0	0	113.5	Q55 N56 S98	Q55-G60 VanDerWaalsContact CG-O 3.29Å; Q55-G60 WeakPolarHBondContact CG-O 3.36Å; Q55-G60 PolarHBondContact NE2-O 3.44Å; N56-G60 WeakPolarHBondContact O-CA 3.08Å; N56-G60 PolarHBondContact O-N 3.08Å; N56-G60 PolarHBondContact OD1-N 3.2Å; G60-S98 WeakPolarHBondContact O-CA 3.38Å
61	W	88.4	Confident	84.1	Confident	26 Å²	26	50.5 Å²	50.5	10%	0.098	22%	0.224	C	C	.	.			trans	-80.9	139.8	-177.6	-77.6	15.7	0	0	0	111.2	H27 Q55 N56 N59 H65 W66 Y69	H27-W61 PolarHBondContact NE2-O 3.04Å; Q55-W61 CarbonylContact C-O 3.52Å; Q55-W61 WeakPolarHBondContact CA-O 3.4Å; N56-W61 PolarHBondContact N-O 2.8Å; N56-W61 PolarHBondContact OD1-N 3.31Å; N56-W61 VanDerWaalsContact OD1-N 3.14Å; N59-W61 HydrophobicContact CB-CG 4.44Å; N59-W61 VanDerWaalsContact CG-CD1 3.44Å; N59-W61 VanDerWaalsContact CG-CG 3.42Å; N59-W61 PolarHBondContact ND2-NE1 3.47Å; N59-W61 PolarHBondContact O-N 2.89Å; N59-W61 VanDerWaalsContact OD1-CB 3.28Å; N59-W61 WeakPolarHBondContact OD1-CB 3.43Å; N59-W61 PolarHBondContact OD1-N 3.14Å; W61-H65 HydrophobicContact CB-CB 3.69Å; W61-H65 AromaticContact CD1-CD2 3.93Å; W61-H65 HydrophobicContact CD2-CB 3.82Å; W61-H65 HydrophobicContact CE3-CB 4.07Å; W61-H65 HydrophobicContact CG-CB 3.66Å; W61-H65 AromaticContact CG-CG 3.98Å; W61-W66 AromaticContact CE3-CD2 3.58Å; W61-W66 HydrophobicContact CE3-CD2 3.58Å; W61-W66 AromaticContact CE3-CE2 3.48Å; W61-W66 VanDerWaalsContact CE3-CE2 3.48Å; W61-W66 AromaticContact CE3-CE3 3.92Å; W61-W66 HydrophobicContact CE3-CE3 3.92Å; W61-W66 HydrophobicContact CE3-CG 4.03Å; W61-W66 HydrophobicContact CE3-CH2 4.1Å; W61-W66 AromaticContact CE3-CZ2 3.76Å; W61-W66 HydrophobicContact CE3-CZ2 3.76Å; W61-W66 HydrophobicContact CE3-CZ3 4.17Å; W61-W66 AromaticContact CE3-NE1 3.8Å; W61-W66 AromaticContact CZ3-CD2 4Å; W61-W66 HydrophobicContact CZ3-CD2 4Å; W61-W66 AromaticContact CZ3-CE3 3.83Å; W61-W66 HydrophobicContact CZ3-CE3 3.83Å; W61-W66 HydrophobicContact CZ3-CH2 4.08Å; W61-W66 HydrophobicContact CZ3-CZ2 4.22Å; W61-W66 AromaticContact CZ3-CZ3 3.88Å; W61-W66 HydrophobicContact CZ3-CZ3 3.88Å; W61-Y69 AromaticContact CH2-CD2 3.92Å; W61-Y69 HydrophobicContact CH2-CD2 3.92Å; W61-Y69 HydrophobicContact CH2-CE2 4.38Å; W61-Y69 HydrophobicContact CH2-CG 4.03Å; W61-Y69 HydrophobicContact CZ3-CD1 4.37Å; W61-Y69 HydrophobicContact CZ3-CD2 4.38Å; W61-Y69 HydrophobicContact CZ3-CG 4.01Å
62	T	91.2	Very high	83.3	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.006	22%	0.218	C	C	.	.			trans	-88.4	170.2	168.5	65.7	0	0	0	0	110.8	E53 Q55 A64 H65 W66 L93 S96	E53-T62 WeakPolarHBondContact O-CG2 3.42Å; Q55-T62 HydrophobicContact CG-CG2 3.86Å; T62-A64 PolarHBondContact O-N 2.81Å; T62-A64 VanDerWaalsContact O-N 3.17Å; T62-A64 PolarHBondContact OG1-N 3.16Å; T62-H65 PolarHBondContact N-ND1 3.17Å; T62-H65 WeakPolarHBondContact O-CB 3.45Å; T62-H65 PolarHBondContact O-N 2.89Å; T62-H65 PolarHBondContact OG1-ND1 3.09Å; T62-W66 PolarHBondContact O-N 3.44Å; T62-L93 HydrophobicContact CG2-CD2 4.05Å; T62-S96 PolarHBondContact OG1-OG 2.97Å
63	A	89.6	Confident	82.8	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-54.9	-33.6	173	0	0	0	0	0	112.7	L26 H27 A30 W66 A67 L86	L26-A63 HydrophobicContact CD2-CB 3.85Å; L26-A63 HydrophobicContact CG-CB 3.82Å; H27-A63 PolarHBondContact NE2-N 2.91Å; A30-A63 HydrophobicContact CB-CB 4.08Å; A63-W66 PolarHBondContact O-N 2.8Å; A63-A67 PolarHBondContact O-N 3.37Å; A63-L86 HydrophobicContact CB-CD1 3.84Å; A63-L86 HydrophobicContact CB-CD2 3.91Å
64	A	92.5	Very high	82.4	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-66	-36.2	176	0	0	0	0	0	113	T62 W66 A68 L83 L93 P105	T62-A64 PolarHBondContact O-N 2.81Å; T62-A64 VanDerWaalsContact O-N 3.17Å; T62-A64 PolarHBondContact OG1-N 3.16Å; A64-W66 VanDerWaalsContact C-N 3.33Å; A64-W66 PolarHBondContact O-N 2.82Å; A64-A68 WeakPolarHBondContact O-CB 3.16Å; A64-A68 PolarHBondContact O-N 2.76Å; A64-L83 HydrophobicContact CB-CD1 3.86Å; A64-L93 HydrophobicContact CB-CB 3.99Å; A64-L93 HydrophobicContact CB-CD1 4.3Å; A64-L93 HydrophobicContact CB-CD2 4.22Å; A64-L93 HydrophobicContact CB-CG 4.42Å; A64-P105 HydrophobicContact CB-CG 4.07Å
65	H	91.7	Very high	82	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62	-43.1	174.8	-72.5	79.3	0	0	0	111.4	W61 T62 A68 Y69 S96 I103 C108	W61-H65 HydrophobicContact CB-CB 3.69Å; W61-H65 AromaticContact CD1-CD2 3.93Å; W61-H65 HydrophobicContact CD2-CB 3.82Å; W61-H65 HydrophobicContact CE3-CB 4.07Å; W61-H65 HydrophobicContact CG-CB 3.66Å; W61-H65 AromaticContact CG-CG 3.98Å; T62-H65 PolarHBondContact N-ND1 3.17Å; T62-H65 WeakPolarHBondContact O-CB 3.45Å; T62-H65 PolarHBondContact O-N 2.89Å; T62-H65 PolarHBondContact OG1-ND1 3.09Å; H65-A68 PolarHBondContact O-N 3.35Å; H65-Y69 WeakPolarHBondContact O-CB 3.32Å; H65-Y69 PolarHBondContact O-N 2.88Å; H65-S96 PolarHBondContact CE1-O 3.33Å; H65-S96 PolarHBondContact CE1-OG 2.88Å; H65-S96 VanDerWaalsContact CE1-OG 3.26Å; H65-I103 PolarHBondContact NE2-O 3.4Å; H65-C108 WeakPolarHBondContact O-CB 3.29Å
66	W	89.2	Confident	81.8	Confident	61 Å²	61	54.6 Å²	54.6	23%	0.231	25%	0.253	C	S	.	.	H	α-helix	trans	-69.7	-46.1	179.2	-73	100.6	0	0	0	112.4	H27 I31 N56 W61 T62 A63 A64 A68 Y69 C70	H27-W66 AromaticContact CD2-CD1 3.36Å; H27-W66 AromaticContact CD2-NE1 3.57Å; I31-W66 HydrophobicContact CD1-CB 4.18Å; I31-W66 HydrophobicContact CD1-CD2 3.7Å; I31-W66 HydrophobicContact CD1-CE3 3.66Å; I31-W66 HydrophobicContact CD1-CG 3.95Å; I31-W66 HydrophobicContact CD1-CZ3 4.33Å; I31-W66 HydrophobicContact CG1-CB 3.58Å; I31-W66 HydrophobicContact CG1-CD2 3.99Å; I31-W66 HydrophobicContact CG1-CE3 3.86Å; I31-W66 HydrophobicContact CG1-CG 3.91Å; N56-W66 PolarHBondContact ND2-NE1 2.84Å; W61-W66 AromaticContact CE3-CD2 3.58Å; W61-W66 HydrophobicContact CE3-CD2 3.58Å; W61-W66 AromaticContact CE3-CE2 3.48Å; W61-W66 VanDerWaalsContact CE3-CE2 3.48Å; W61-W66 AromaticContact CE3-CE3 3.92Å; W61-W66 HydrophobicContact CE3-CE3 3.92Å; W61-W66 HydrophobicContact CE3-CG 4.03Å; W61-W66 HydrophobicContact CE3-CH2 4.1Å; W61-W66 AromaticContact CE3-CZ2 3.76Å; W61-W66 HydrophobicContact CE3-CZ2 3.76Å; W61-W66 HydrophobicContact CE3-CZ3 4.17Å; W61-W66 AromaticContact CE3-NE1 3.8Å; W61-W66 AromaticContact CZ3-CD2 4Å; W61-W66 HydrophobicContact CZ3-CD2 4Å; W61-W66 AromaticContact CZ3-CE3 3.83Å; W61-W66 HydrophobicContact CZ3-CE3 3.83Å; W61-W66 HydrophobicContact CZ3-CH2 4.08Å; W61-W66 HydrophobicContact CZ3-CZ2 4.22Å; W61-W66 AromaticContact CZ3-CZ3 3.88Å; W61-W66 HydrophobicContact CZ3-CZ3 3.88Å; T62-W66 PolarHBondContact O-N 3.44Å; A63-W66 PolarHBondContact O-N 2.8Å; A64-W66 VanDerWaalsContact C-N 3.33Å; A64-W66 PolarHBondContact O-N 2.82Å; W66-A68 PolarHBondContact O-N 3.25Å; W66-Y69 PolarHBondContact O-N 2.8Å; W66-Y69 VanDerWaalsContact O-N 3.13Å; W66-C70 PolarHBondContact O-N 2.74Å; W66-C70 VanDerWaalsContact O-N 3.12Å; W66-C70 PolarHBondContact O-SG 2.91Å; W66-C70 VanDerWaalsContact O-SG 3.4Å
67	A	90.6	Very high	82	Confident	0 Å²	0	58 Å²	58	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-57.2	-39.7	174.4	0	0	0	0	0	111.7	A30 A63 L83 L86	A30-A67 HydrophobicContact CB-CB 4.19Å; A63-A67 PolarHBondContact O-N 3.37Å; A67-L83 HydrophobicContact CB-CB 3.89Å; A67-L83 HydrophobicContact CB-CD1 4.21Å; A67-L86 HydrophobicContact CB-CD1 4.29Å
68	A	92	Very high	82.5	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-69.3	-39.2	176.2	0	0	0	0	0	112.8	A64 H65 W66 L83 P105 C108 S109 A114 L121	A64-A68 WeakPolarHBondContact O-CB 3.16Å; A64-A68 PolarHBondContact O-N 2.76Å; H65-A68 PolarHBondContact O-N 3.35Å; W66-A68 PolarHBondContact O-N 3.25Å; A68-L83 HydrophobicContact CB-CD2 4.44Å; A68-P105 HydrophobicContact CB-CB 4.16Å; A68-P105 VanDerWaalsContact CB-O 3.25Å; A68-P105 WeakPolarHBondContact CB-O 3.26Å; A68-C108 HydrophobicContact CB-CB 3.96Å; A68-S109 VanDerWaalsContact O-CA 3.28Å; A68-S109 WeakPolarHBondContact O-CA 3.23Å; A68-A114 WeakPolarHBondContact O-CB 3.29Å; A68-L121 HydrophobicContact CB-CD1 4.11Å
69	Y	90.3	Very high	83	Confident	101 Å²	101	42 Å²	42	40%	0.396	21%	0.214	S	C	.	.	H	α-helix	trans	-69.1	-36.8	-178.1	-179.5	-100.7	0	0	0	113.6	W61 H65 W66 G71 I111 G112	W61-Y69 AromaticContact CH2-CD2 3.92Å; W61-Y69 HydrophobicContact CH2-CD2 3.92Å; W61-Y69 HydrophobicContact CH2-CE2 4.38Å; W61-Y69 HydrophobicContact CH2-CG 4.03Å; W61-Y69 HydrophobicContact CZ3-CD1 4.37Å; W61-Y69 HydrophobicContact CZ3-CD2 4.38Å; W61-Y69 HydrophobicContact CZ3-CG 4.01Å; H65-Y69 WeakPolarHBondContact O-CB 3.32Å; H65-Y69 PolarHBondContact O-N 2.88Å; W66-Y69 PolarHBondContact O-N 2.8Å; W66-Y69 VanDerWaalsContact O-N 3.13Å; Y69-G71 VanDerWaalsContact C-N 3.34Å; Y69-G71 PolarHBondContact O-N 3.47Å; Y69-I111 HydrophobicContact CD2-CG2 4.24Å; Y69-I111 HydrophobicContact CE2-CB 4.49Å; Y69-I111 HydrophobicContact CE2-CG2 3.74Å; Y69-G112 WeakPolarHBondContact O-CA 3.39Å
70	C	81.9	Confident	83.4	Confident	18 Å²	18	41.3 Å²	41.3	12%	0.122	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-3.1	-166.4	-66.5	0	0	0	0	115.7	W66 R72 S73 Q79	W66-C70 PolarHBondContact O-N 2.74Å; W66-C70 VanDerWaalsContact O-N 3.12Å; W66-C70 PolarHBondContact O-SG 2.91Å; W66-C70 VanDerWaalsContact O-SG 3.4Å; C70-R72 PolarHBondContact O-N 3.21Å; C70-S73 WeakPolarHBondContact O-CB 3.45Å; C70-S73 PolarHBondContact O-N 3.04Å; C70-S73 PolarHBondContact O-OG 3.3Å; C70-Q79 HydrophobicContact CB-CG 4.44Å; C70-Q79 PolarHBondContact O-OE1 3.46Å
71	G	66.1	Low	83.7	Confident	9 Å²	9	43.5 Å²	43.5	9%	0.093	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	12.4	-168	0	0	0	0	0	118.5	Y69 H76 Q79 A114	Y69-G71 VanDerWaalsContact C-N 3.34Å; Y69-G71 PolarHBondContact O-N 3.47Å; G71-H76 WeakPolarHBondContact O-CB 3.41Å; G71-Q79 VanDerWaalsContact CA-OE1 3.29Å; G71-A114 VanDerWaalsContact CA-CB 3.5Å
72	R	62.2	Low	83.7	Confident	148 Å²	148	42.2 Å²	42.2	56%	0.558	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-7.5	162.8	-93	178.3	-136.6	148	15.2	113.7	C70 I111 G112 I145	C70-R72 PolarHBondContact O-N 3.21Å; R72-I111 PolarHBondContact NH2-O 3.13Å; R72-G112 VanDerWaalsContact CD-O 3.26Å; R72-G112 WeakPolarHBondContact CD-O 3.18Å; R72-G112 WeakPolarHBondContact CG-O 3.23Å; R72-G112 VanDerWaalsContact CZ-C 3.5Å; R72-G112 VanDerWaalsContact CZ-O 3.26Å; R72-G112 PolarHBondContact NE-O 2.9Å; R72-G112 PolarHBondContact NH2-O 3.22Å; R72-I145 VanDerWaalsContact NH2-CD1 3.35Å
73	S	69.3	Low	83.7	Confident	55 Å²	55	42.2 Å²	42.2	39%	0.385	22%	0.219	S	C	.	.	S	Bend	trans	-72.5	164.8	-176.1	-53.4	0	0	0	0	110.9	C70 N75 H76	C70-S73 WeakPolarHBondContact O-CB 3.45Å; C70-S73 PolarHBondContact O-N 3.04Å; C70-S73 PolarHBondContact O-OG 3.3Å; S73-N75 PolarHBondContact O-N 3.09Å; S73-H76 WeakPolarHBondContact O-CB 3.41Å; S73-H76 PolarHBondContact O-N 3.33Å; S73-H76 PolarHBondContact O-ND1 3.3Å
74	S	75	Confident	83.8	Confident	112 Å²	112	43.2 Å²	43.2	78%	0.783	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50	-25	171.2	52.6	0	0	0	0	112.9
75	N	76.2	Confident	83.7	Confident	59 Å²	59	48.1 Å²	48.1	32%	0.316	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.3	18.5	-175	-54.4	-5.6	0	0	0	113.4	D32 S73 L77 L78 Q79	D32-N75 PolarHBondContact O-ND2 3.35Å; S73-N75 PolarHBondContact O-N 3.09Å; N75-L77 PolarHBondContact O-N 3.13Å; N75-L77 VanDerWaalsContact O-N 3.14Å; N75-L78 HydrophobicContact CB-CB 4.46Å; N75-L78 HydrophobicContact CB-CD1 4.37Å; N75-L78 WeakPolarHBondContact O-CB 3.42Å; N75-L78 PolarHBondContact O-N 3.34Å; N75-Q79 PolarHBondContact O-N 3.22Å
76	H	79.5	Confident	83.7	Confident	78 Å²	78	48.1 Å²	48.1	36%	0.361	25%	0.245	S	C	.	.	H	α-helix	trans	-53.2	-35.3	-175.9	66	-77	0	0	0	114.8	G71 S73 A80	G71-H76 WeakPolarHBondContact O-CB 3.41Å; S73-H76 WeakPolarHBondContact O-CB 3.41Å; S73-H76 PolarHBondContact O-N 3.33Å; S73-H76 PolarHBondContact O-ND1 3.3Å; H76-A80 PolarHBondContact O-N 2.97Å
77	L	84.6	Confident	83.9	Confident	108 Å²	108	45.4 Å²	45.4	57%	0.565	24%	0.235	S	C	*	.	H	α-helix	trans	-64.1	-48	174	-67.7	173.4	0	0	0	111.4	N75 Q79 A80 V81 L116	N75-L77 PolarHBondContact O-N 3.13Å; N75-L77 VanDerWaalsContact O-N 3.14Å; L77-Q79 VanDerWaalsContact C-N 3.3Å; L77-Q79 PolarHBondContact O-N 3.4Å; L77-A80 PolarHBondContact O-N 3.48Å; L77-V81 WeakPolarHBondContact O-CG2 3.37Å; L77-V81 PolarHBondContact O-N 3.42Å; L77-L116 HydrophobicContact CD2-CD1 3.57Å
78	L	84.5	Confident	83.9	Confident	73 Å²	73	50.3 Å²	50.3	38%	0.382	26%	0.261	S	S	.	.	H	α-helix	trans	-65.2	-36.2	179.7	-65.3	172	0	0	0	111.5	G33 N75 V81 C82	G33-L78 WeakPolarHBondContact O-CB 3.47Å; N75-L78 HydrophobicContact CB-CB 4.46Å; N75-L78 HydrophobicContact CB-CD1 4.37Å; N75-L78 WeakPolarHBondContact O-CB 3.42Å; N75-L78 PolarHBondContact O-N 3.34Å; L78-V81 PolarHBondContact O-N 3.45Å; L78-C82 WeakPolarHBondContact O-CB 3.35Å; L78-C82 PolarHBondContact O-N 2.96Å; L78-C82 PolarHBondContact O-SG 2.86Å
79	Q	83.8	Confident	83.8	Confident	3 Å²	3	53.5 Å²	53.5	1%	0.014	28%	0.283	C	S	.	.	H	α-helix	trans	-67.1	-37.9	175.3	-71.1	160.5	-14	0	0	112.1	I31 C70 G71 N75 L77 V81 C82 L83	I31-Q79 PolarHBondContact O-NE2 2.9Å; C70-Q79 HydrophobicContact CB-CG 4.44Å; C70-Q79 PolarHBondContact O-OE1 3.46Å; G71-Q79 VanDerWaalsContact CA-OE1 3.29Å; N75-Q79 PolarHBondContact O-N 3.22Å; L77-Q79 VanDerWaalsContact C-N 3.3Å; L77-Q79 PolarHBondContact O-N 3.4Å; Q79-V81 VanDerWaalsContact C-N 3.34Å; Q79-C82 PolarHBondContact O-N 3.34Å; Q79-L83 WeakPolarHBondContact O-CB 3.33Å; Q79-L83 PolarHBondContact O-N 3.47Å
80	A	88.5	Confident	83.7	Confident	11 Å²	11	49.6 Å²	49.6	9%	0.091	27%	0.271	C	S	.	.	H	α-helix	trans	-66.2	-36.6	173.4	0	0	0	0	0	112.1	H76 L77 S84 L116	H76-A80 PolarHBondContact O-N 2.97Å; L77-A80 PolarHBondContact O-N 3.48Å; A80-S84 WeakPolarHBondContact O-CB 3.48Å; A80-S84 PolarHBondContact O-N 3.37Å; A80-S84 PolarHBondContact O-OG 2.91Å; A80-L116 HydrophobicContact CB-CB 3.75Å; A80-L116 HydrophobicContact CB-CD1 4.4Å
81	V	89.9	Confident	84.2	Confident	50 Å²	50	53.3 Å²	53.3	30%	0.303	30%	0.295	S	S	.	.	H	α-helix	trans	-65.5	-47	171.6	176	0	0	0	0	110.5	E35 L77 L78 Q79 L83 S84 R85	E35-V81 VanDerWaalsContact CD-CG1 3.43Å; E35-V81 HydrophobicContact CG-CG1 4.06Å; E35-V81 WeakPolarHBondContact OE1-CG1 3.3Å; L77-V81 WeakPolarHBondContact O-CG2 3.37Å; L77-V81 PolarHBondContact O-N 3.42Å; L78-V81 PolarHBondContact O-N 3.45Å; Q79-V81 VanDerWaalsContact C-N 3.34Å; V81-L83 VanDerWaalsContact C-N 3.33Å; V81-L83 PolarHBondContact O-N 2.84Å; V81-S84 WeakPolarHBondContact O-CA 3.25Å; V81-S84 VanDerWaalsContact O-CB 3.27Å; V81-S84 WeakPolarHBondContact O-CB 3.11Å; V81-S84 PolarHBondContact O-N 3.28Å; V81-R85 HydrophobicContact CG1-CG 4.39Å; V81-R85 WeakPolarHBondContact O-CG 3.05Å; V81-R85 PolarHBondContact O-N 3.18Å
82	C	89.2	Confident	85.4	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-58.3	-45.1	176.9	-71.1	0	0	0	0	111.9	L38 L78 Q79 S84 R85 L86	L38-C82 VanDerWaalsContact CD2-CA 3.47Å; L38-C82 HydrophobicContact CD2-CB 3.61Å; L38-C82 WeakPolarHBondContact CD2-O 3.37Å; L78-C82 WeakPolarHBondContact O-CB 3.35Å; L78-C82 PolarHBondContact O-N 2.96Å; L78-C82 PolarHBondContact O-SG 2.86Å; Q79-C82 PolarHBondContact O-N 3.34Å; C82-S84 VanDerWaalsContact C-N 3.33Å; C82-S84 PolarHBondContact O-N 3.36Å; C82-R85 PolarHBondContact O-N 3.39Å; C82-L86 WeakPolarHBondContact O-CB 3.5Å; C82-L86 VanDerWaalsContact O-CG 3.29Å; C82-L86 WeakPolarHBondContact O-CG 3.41Å; C82-L86 PolarHBondContact O-N 3.48Å
83	L	91.6	Very high	86.8	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-59.7	-45.1	173.5	-177.6	62.5	0	0	0	111.1	A64 A67 A68 Q79 V81 R85 L86 L87 C117 L121	A64-L83 HydrophobicContact CB-CD1 3.86Å; A67-L83 HydrophobicContact CB-CB 3.89Å; A67-L83 HydrophobicContact CB-CD1 4.21Å; A68-L83 HydrophobicContact CB-CD2 4.44Å; Q79-L83 WeakPolarHBondContact O-CB 3.33Å; Q79-L83 PolarHBondContact O-N 3.47Å; V81-L83 VanDerWaalsContact C-N 3.33Å; V81-L83 PolarHBondContact O-N 2.84Å; L83-R85 PolarHBondContact O-N 3.32Å; L83-L86 WeakPolarHBondContact O-CB 3.37Å; L83-L86 PolarHBondContact O-N 3.09Å; L83-L87 HydrophobicContact CD1-CD1 4.31Å; L83-L87 HydrophobicContact CD1-CD2 4.4Å; L83-L87 HydrophobicContact CD1-CG 4.18Å; L83-L87 HydrophobicContact CG-CD1 4.15Å; L83-L87 HydrophobicContact CG-CG 4.36Å; L83-L87 VanDerWaalsContact O-CG 3.28Å; L83-L87 WeakPolarHBondContact O-CG 3.17Å; L83-L87 PolarHBondContact O-N 3.48Å; L83-C117 HydrophobicContact CD2-CB 3.47Å; L83-C117 VanDerWaalsContact CD2-CB 3.47Å; L83-L121 HydrophobicContact CD1-CD2 4.45Å; L83-L121 HydrophobicContact CD2-CD1 4.1Å; L83-L121 HydrophobicContact CD2-CD2 4.48Å; L83-L121 HydrophobicContact CD2-CG 3.97Å
84	S	91.7	Very high	87.9	Confident	22 Å²	22	45.3 Å²	45.3	15%	0.154	26%	0.264	C	S	.	.	H	α-helix	trans	-56.6	-49.3	177.1	-63.3	0	0	0	0	111.9	A80 V81 C82 L86 L87 D88 R120	A80-S84 WeakPolarHBondContact O-CB 3.48Å; A80-S84 PolarHBondContact O-N 3.37Å; A80-S84 PolarHBondContact O-OG 2.91Å; V81-S84 WeakPolarHBondContact O-CA 3.25Å; V81-S84 VanDerWaalsContact O-CB 3.27Å; V81-S84 WeakPolarHBondContact O-CB 3.11Å; V81-S84 PolarHBondContact O-N 3.28Å; C82-S84 VanDerWaalsContact C-N 3.33Å; C82-S84 PolarHBondContact O-N 3.36Å; S84-L86 VanDerWaalsContact C-N 3.33Å; S84-L86 PolarHBondContact O-N 3.23Å; S84-L87 PolarHBondContact O-N 3.24Å; S84-D88 WeakPolarHBondContact O-CB 3.47Å; S84-D88 PolarHBondContact O-N 3.36Å; S84-R120 VanDerWaalsContact CB-CZ 3.44Å; S84-R120 PolarHBondContact O-NH2 3.38Å; S84-R120 PolarHBondContact OG-NH1 3.26Å
85	R	90.3	Very high	88.7	Confident	102 Å²	102	43.9 Å²	43.9	39%	0.385	26%	0.255	S	S	.	.	H	α-helix	trans	-60.6	-40.8	177.2	-63	-66.2	-176.7	-161.5	1.2	112.7	E35 L38 D39 L42 V81 C82 L83 S89	E35-R85 IonicContact OE1-CZ 3.37Å; E35-R85 IonicContact OE1-NE 3.01Å; E35-R85 PolarHBondContact OE1-NE 2.92Å; E35-R85 IonicContact OE1-NH2 3.96Å; E35-R85 PolarHBondContact OE1-NH2 3.3Å; L38-R85 HydrophobicContact CD2-CB 3.96Å; D39-R85 IonicContact OD1-NE 3.61Å; L42-R85 HydrophobicContact CD1-CB 4.11Å; V81-R85 HydrophobicContact CG1-CG 4.39Å; V81-R85 WeakPolarHBondContact O-CG 3.05Å; V81-R85 PolarHBondContact O-N 3.18Å; C82-R85 PolarHBondContact O-N 3.39Å; L83-R85 PolarHBondContact O-N 3.32Å; R85-S89 WeakPolarHBondContact O-CB 3.47Å; R85-S89 PolarHBondContact O-N 3.16Å; R85-S89 PolarHBondContact O-OG 3.44Å
86	L	91.7	Very high	89.4	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.9	-48.4	176.4	-77.1	165.9	0	0	0	111.3	L26 A30 L38 L42 A63 A67 C82 L83 S84 S89 C90 L93	L26-L86 HydrophobicContact CD1-CD2 4.26Å; L26-L86 HydrophobicContact CD2-CD2 4.39Å; L26-L86 HydrophobicContact CG-CD2 4.44Å; A30-L86 HydrophobicContact CB-CD1 4.08Å; L38-L86 HydrophobicContact CD1-CD2 4.2Å; L38-L86 HydrophobicContact CD1-CG 4.34Å; L38-L86 HydrophobicContact CD2-CG 4.36Å; L42-L86 HydrophobicContact CD2-CD2 4.11Å; A63-L86 HydrophobicContact CB-CD1 3.84Å; A63-L86 HydrophobicContact CB-CD2 3.91Å; A67-L86 HydrophobicContact CB-CD1 4.29Å; C82-L86 WeakPolarHBondContact O-CB 3.5Å; C82-L86 VanDerWaalsContact O-CG 3.29Å; C82-L86 WeakPolarHBondContact O-CG 3.41Å; C82-L86 PolarHBondContact O-N 3.48Å; L83-L86 WeakPolarHBondContact O-CB 3.37Å; L83-L86 PolarHBondContact O-N 3.09Å; S84-L86 VanDerWaalsContact C-N 3.33Å; S84-L86 PolarHBondContact O-N 3.23Å; L86-S89 PolarHBondContact O-N 2.96Å; L86-C90 PolarHBondContact O-N 3.29Å; L86-L93 HydrophobicContact CB-CD1 3.96Å; L86-L93 HydrophobicContact CD2-CD1 4.3Å
87	L	92.4	Very high	90	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-67.4	-37.3	179.6	-62.5	-177.8	0	0	0	112.2	L83 S84 S89 C90 P91 L93 V94 R120 L121	L83-L87 HydrophobicContact CD1-CD1 4.31Å; L83-L87 HydrophobicContact CD1-CD2 4.4Å; L83-L87 HydrophobicContact CD1-CG 4.18Å; L83-L87 HydrophobicContact CG-CD1 4.15Å; L83-L87 HydrophobicContact CG-CG 4.36Å; L83-L87 VanDerWaalsContact O-CG 3.28Å; L83-L87 WeakPolarHBondContact O-CG 3.17Å; L83-L87 PolarHBondContact O-N 3.48Å; S84-L87 PolarHBondContact O-N 3.24Å; L87-S89 VanDerWaalsContact C-N 3.31Å; L87-S89 PolarHBondContact O-N 3.38Å; L87-C90 CarbonylContact O-C 3.22Å; L87-C90 VanDerWaalsContact O-C 3.22Å; L87-C90 PolarHBondContact O-N 2.66Å; L87-P91 WeakPolarHBondContact O-CA 3.26Å; L87-L93 HydrophobicContact CD2-CB 3.76Å; L87-V94 HydrophobicContact CD1-CG2 4.2Å; L87-V94 HydrophobicContact CD2-CB 4.48Å; L87-V94 HydrophobicContact CD2-CG2 3.62Å; L87-V94 HydrophobicContact CG-CG2 4.33Å; L87-R120 HydrophobicContact CD1-CG 4.06Å; L87-L121 HydrophobicContact CD1-CD2 3.9Å; L87-L121 HydrophobicContact CD2-CD2 4.37Å
88	D	91	Very high	90.2	Very high	103 Å²	103	35.3 Å²	35.3	55%	0.551	22%	0.217	S	C	*	.	H	α-helix	trans	-65.5	-36.3	175.5	-70	-26.2	0	0	0	111.8	S84 R120	S84-D88 WeakPolarHBondContact O-CB 3.47Å; S84-D88 PolarHBondContact O-N 3.36Å; D88-R120 IonicContact OD1-CZ 3.1Å; D88-R120 IonicContact OD1-NH2 3.24Å; D88-R120 PolarHBondContact OD1-NH2 3Å; D88-R120 IonicContact OD2-NH2 3.57Å; D88-R120 PolarHBondContact OD2-NH2 3.08Å
89	S	89.7	Confident	90.1	Very high	67 Å²	67	39.9 Å²	39.9	47%	0.469	23%	0.234	S	C	.	.	H	α-helix	trans	-76	-32.9	176.7	-57.3	0	0	0	0	112.5	R85 L86 L87	R85-S89 WeakPolarHBondContact O-CB 3.47Å; R85-S89 PolarHBondContact O-N 3.16Å; R85-S89 PolarHBondContact O-OG 3.44Å; L86-S89 PolarHBondContact O-N 2.96Å; L87-S89 VanDerWaalsContact C-N 3.31Å; L87-S89 PolarHBondContact O-N 3.38Å
90	C	89.7	Confident	90	Very high	19 Å²	19	42.6 Å²	42.6	13%	0.128	26%	0.263	C	S	.	.			trans	-149	93.8	-176.5	-169	0	0	0	0	111.6	T52 E53 L86 L87 G92 L93	T52-C90 WeakPolarHBondContact OG1-CB 3.43Å; T52-C90 PolarHBondContact OG1-SG 3.09Å; T52-C90 VanDerWaalsContact OG1-SG 3.34Å; E53-C90 VanDerWaalsContact CD-SG 3.58Å; E53-C90 WeakPolarHBondContact CG-SG 3.33Å; E53-C90 PolarHBondContact OE1-SG 3.28Å; L86-C90 PolarHBondContact O-N 3.29Å; L87-C90 CarbonylContact O-C 3.22Å; L87-C90 VanDerWaalsContact O-C 3.22Å; L87-C90 PolarHBondContact O-N 2.66Å; C90-G92 PolarHBondContact O-N 3.42Å; C90-L93 HydrophobicContact CB-CD1 3.96Å; C90-L93 HydrophobicContact CB-CG 4.13Å; C90-L93 WeakPolarHBondContact O-CB 3.48Å; C90-L93 PolarHBondContact O-N 3.06Å; C90-L93 VanDerWaalsContact O-N 3.16Å
91	P	90.6	Very high	89.9	Confident	96 Å²	96	48.8 Å²	48.8	62%	0.623	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-61.9	-23.7	-179.3	-26.7	35.5	0	0	0	114.4	L87 L93 V94	L87-P91 WeakPolarHBondContact O-CA 3.26Å; P91-L93 PolarHBondContact O-N 3.4Å; P91-V94 WeakPolarHBondContact O-CB 3.5Å; P91-V94 VanDerWaalsContact O-CG2 3.27Å; P91-V94 WeakPolarHBondContact O-CG2 3.35Å; P91-V94 PolarHBondContact O-N 3.25Å
92	G	91.3	Very high	90.1	Very high	32 Å²	32	49.6 Å²	49.6	33%	0.33	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-63.4	-20.3	177.2	0	0	0	0	0	113.8	E53 C90 V94 S95 S96	E53-G92 VanDerWaalsContact OE1-CA 3.3Å; E53-G92 WeakPolarHBondContact OE1-CA 3.48Å; C90-G92 PolarHBondContact O-N 3.42Å; G92-V94 PolarHBondContact O-N 2.8Å; G92-S95 PolarHBondContact O-N 2.76Å; G92-S96 PolarHBondContact O-N 2.99Å
93	L	92	Very high	90.3	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-61.6	-27.5	174.7	-73.7	173.3	0	0	0	113	E53 T62 A64 L86 L87 C90 P91 S95 S96 P105	E53-L93 HydrophobicContact CB-CD2 4.17Å; E53-L93 HydrophobicContact CG-CD2 3.89Å; E53-L93 HydrophobicContact CG-CG 4.13Å; T62-L93 HydrophobicContact CG2-CD2 4.05Å; A64-L93 HydrophobicContact CB-CB 3.99Å; A64-L93 HydrophobicContact CB-CD1 4.3Å; A64-L93 HydrophobicContact CB-CD2 4.22Å; A64-L93 HydrophobicContact CB-CG 4.42Å; L86-L93 HydrophobicContact CB-CD1 3.96Å; L86-L93 HydrophobicContact CD2-CD1 4.3Å; L87-L93 HydrophobicContact CD2-CB 3.76Å; C90-L93 HydrophobicContact CB-CD1 3.96Å; C90-L93 HydrophobicContact CB-CG 4.13Å; C90-L93 WeakPolarHBondContact O-CB 3.48Å; C90-L93 PolarHBondContact O-N 3.06Å; C90-L93 VanDerWaalsContact O-N 3.16Å; P91-L93 PolarHBondContact O-N 3.4Å; L93-S95 VanDerWaalsContact C-N 3.29Å; L93-S95 PolarHBondContact O-N 3.12Å; L93-S96 WeakPolarHBondContact O-CB 3.3Å; L93-S96 PolarHBondContact O-N 2.88Å; L93-S96 PolarHBondContact O-OG 3.39Å; L93-P105 WeakPolarHBondContact O-CG 3.28Å
94	V	93	Very high	90.5	Very high	11 Å²	11	52 Å²	52	7%	0.067	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-56.4	-44	-179.2	177.6	0	0	0	0	111.5	L87 P91 G92 A126	L87-V94 HydrophobicContact CD1-CG2 4.2Å; L87-V94 HydrophobicContact CD2-CB 4.48Å; L87-V94 HydrophobicContact CD2-CG2 3.62Å; L87-V94 HydrophobicContact CG-CG2 4.33Å; P91-V94 WeakPolarHBondContact O-CB 3.5Å; P91-V94 VanDerWaalsContact O-CG2 3.27Å; P91-V94 WeakPolarHBondContact O-CG2 3.35Å; P91-V94 PolarHBondContact O-N 3.25Å; G92-V94 PolarHBondContact O-N 2.8Å; V94-A126 VanDerWaalsContact CG1-CA 3.47Å; V94-A126 HydrophobicContact CG1-CB 3.7Å; V94-A126 VanDerWaalsContact CG1-N 3.27Å
95	S	91.2	Very high	90.6	Very high	83 Å²	83	50.9 Å²	50.9	58%	0.58	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-103.5	10.7	-178	56.3	0	0	0	0	113.1	G92 L93 S97 H104	G92-S95 PolarHBondContact O-N 2.76Å; L93-S95 VanDerWaalsContact C-N 3.29Å; L93-S95 PolarHBondContact O-N 3.12Å; S95-S97 PolarHBondContact O-N 3.26Å; S95-H104 PolarHBondContact O-CD2 3.01Å
96	S	91.7	Very high	90.9	Very high	15 Å²	15	46 Å²	46	11%	0.105	27%	0.273	C	S	.	.			trans	-59.8	136.1	177.4	62.9	0	0	0	0	110.7	T62 H65 G92 L93 H104 P105	T62-S96 PolarHBondContact OG1-OG 2.97Å; H65-S96 PolarHBondContact CE1-O 3.33Å; H65-S96 PolarHBondContact CE1-OG 2.88Å; H65-S96 VanDerWaalsContact CE1-OG 3.26Å; G92-S96 PolarHBondContact O-N 2.99Å; L93-S96 WeakPolarHBondContact O-CB 3.3Å; L93-S96 PolarHBondContact O-N 2.88Å; L93-S96 PolarHBondContact O-OG 3.39Å; S96-H104 WeakPolarHBondContact O-CA 3.4Å; S96-P105 VanDerWaalsContact O-CD 3.24Å; S96-P105 WeakPolarHBondContact O-CD 3.49Å
97	S	91.7	Very high	91.1	Very high	46 Å²	46	46 Å²	46	32%	0.322	27%	0.273	S	S	.	.			trans	-120.4	138.5	179.8	73	0	0	0	0	112	Q55 S95 N102 I103	Q55-S97 PolarHBondContact NE2-O 2.64Å; S95-S97 PolarHBondContact O-N 3.26Å; S97-N102 WeakPolarHBondContact CB-OD1 3.07Å; S97-N102 PolarHBondContact OG-OD1 3.33Å; S97-I103 CarbonylContact C-O 3.59Å; S97-I103 VanDerWaalsContact CA-O 3.29Å; S97-I103 WeakPolarHBondContact CA-O 3.44Å
98	S	88.6	Confident	91.1	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.021	27%	0.272	C	S	.	.			trans	-69.2	140.1	179.4	72.3	0	0	0	0	112.1	N59 G60 G100 Y101 N102 I103	N59-S98 VanDerWaalsContact O-CB 3.3Å; N59-S98 WeakPolarHBondContact O-CB 3.49Å; G60-S98 WeakPolarHBondContact O-CA 3.38Å; S98-G100 PolarHBondContact O-N 3.12Å; S98-Y101 PolarHBondContact O-N 2.85Å; S98-N102 PolarHBondContact O-N 3.14Å; S98-N102 VanDerWaalsContact O-N 3.09Å; S98-N102 PolarHBondContact OG-N 3.34Å; S98-I103 PolarHBondContact N-O 2.71Å; S98-I103 WeakPolarHBondContact OG-CB 3.43Å; S98-I103 PolarHBondContact OG-N 2.8Å
99	F	81.6	Confident	91.3	Very high	169 Å²	169	40.9 Å²	40.9	74%	0.741	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	130.4	174.2	-176.7	-101.6	0	0	0	112.3	Y101	F99-Y101 PolarHBondContact O-N 3.06Å
100	G	81.7	Confident	91.5	Very high	60 Å²	60	37.7 Å²	37.7	62%	0.619	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.6	-28.6	174.5	0	0	0	0	0	116.4	S98	S98-G100 PolarHBondContact O-N 3.12Å
101	Y	88.2	Confident	91.7	Very high	141 Å²	141	39.2 Å²	39.2	55%	0.553	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.1	-9.2	-176.8	-60.8	-78.2	0	0	0	115	S98 F99 I103 A133	S98-Y101 PolarHBondContact O-N 2.85Å; F99-Y101 PolarHBondContact O-N 3.06Å; Y101-I103 PolarHBondContact O-N 3.46Å; Y101-A133 VanDerWaalsContact O-CB 3.32Å; Y101-A133 WeakPolarHBondContact O-CB 3.38Å; Y101-A133 PolarHBondContact O-N 3.47Å
102	N	92.4	Very high	91.6	Very high	67 Å²	67	34.8 Å²	34.8	36%	0.358	20%	0.201	S	C	.	.			trans	50	30.8	-177	-157.3	39.6	0	0	0	113.8	S97 S98 H104 R131	S97-N102 WeakPolarHBondContact CB-OD1 3.07Å; S97-N102 PolarHBondContact OG-OD1 3.33Å; S98-N102 PolarHBondContact O-N 3.14Å; S98-N102 VanDerWaalsContact O-N 3.09Å; S98-N102 PolarHBondContact OG-N 3.34Å; N102-H104 PolarHBondContact O-CE1 2.95Å; N102-H104 VanDerWaalsContact O-CE1 3.3Å; N102-H104 PolarHBondContact O-ND1 3.48Å; N102-R131 PolarHBondContact ND2-O 3.13Å
103	I	94.1	Very high	91.6	Very high	24 Å²	24	33.8 Å²	33.8	12%	0.123	19%	0.191	C	C	.	.			trans	-76.4	133.9	176.2	-64.5	-175.3	0	0	0	107	H65 S97 S98 Y101 H107 D132	H65-I103 PolarHBondContact NE2-O 3.4Å; S97-I103 CarbonylContact C-O 3.59Å; S97-I103 VanDerWaalsContact CA-O 3.29Å; S97-I103 WeakPolarHBondContact CA-O 3.44Å; S98-I103 PolarHBondContact N-O 2.71Å; S98-I103 WeakPolarHBondContact OG-CB 3.43Å; S98-I103 PolarHBondContact OG-N 2.8Å; Y101-I103 PolarHBondContact O-N 3.46Å; I103-H107 HydrophobicContact CG2-CB 3.82Å; I103-D132 HydrophobicContact CG1-CB 4.23Å
104	H	95.4	Very high	91.5	Very high	26 Å²	26	34 Å²	34	12%	0.12	19%	0.192	C	C	.	.			trans	-107.7	161.4	176.5	-59.9	69.1	0	0	0	109.3	S95 S96 N102 L106 H107 C108	S95-H104 PolarHBondContact O-CD2 3.01Å; S96-H104 WeakPolarHBondContact O-CA 3.4Å; N102-H104 PolarHBondContact O-CE1 2.95Å; N102-H104 VanDerWaalsContact O-CE1 3.3Å; N102-H104 PolarHBondContact O-ND1 3.48Å; H104-L106 PolarHBondContact O-N 3.36Å; H104-H107 AromaticContact CG-ND1 3.91Å; H104-H107 PolarHBondContact N-ND1 3.49Å; H104-H107 VanDerWaalsContact N-ND1 3.16Å; H104-H107 AromaticContact ND1-CE1 3.6Å; H104-H107 AromaticContact ND1-ND1 3.59Å; H104-H107 WeakPolarHBondContact O-CA 3.45Å; H104-H107 WeakPolarHBondContact O-CB 3.07Å; H104-H107 PolarHBondContact O-N 2.76Å; H104-C108 PolarHBondContact O-N 3.44Å
105	P	94.5	Very high	91.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-53.1	-31.8	174.7	-28.7	36.2	0	0	0	113.2	A64 A68 L93 S96 H107 C108 S109 L121	A64-P105 HydrophobicContact CB-CG 4.07Å; A68-P105 HydrophobicContact CB-CB 4.16Å; A68-P105 VanDerWaalsContact CB-O 3.25Å; A68-P105 WeakPolarHBondContact CB-O 3.26Å; L93-P105 WeakPolarHBondContact O-CG 3.28Å; S96-P105 VanDerWaalsContact O-CD 3.24Å; S96-P105 WeakPolarHBondContact O-CD 3.49Å; P105-H107 VanDerWaalsContact C-N 3.34Å; P105-H107 PolarHBondContact O-N 2.75Å; P105-C108 CarbonylContact O-C 3.59Å; P105-C108 WeakPolarHBondContact O-CA 3.41Å; P105-C108 WeakPolarHBondContact O-CB 3.45Å; P105-C108 PolarHBondContact O-N 3.32Å; P105-C108 VanDerWaalsContact O-N 3.13Å; P105-S109 PolarHBondContact O-N 3.5Å; P105-L121 HydrophobicContact CB-CD1 3.82Å; P105-L121 HydrophobicContact CB-CD2 3.77Å; P105-L121 HydrophobicContact CB-CG 4.48Å
106	L	96.1	Very high	91.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.7	-36.8	175.3	-171.5	69.1	0	0	0	112.9	H104 S109 A110 L118 L121 L122 A126 D127 A138 L154	H104-L106 PolarHBondContact O-N 3.36Å; L106-S109 PolarHBondContact O-OG 3.46Å; L106-A110 PolarHBondContact O-N 2.91Å; L106-A110 VanDerWaalsContact O-N 3.17Å; L106-L118 HydrophobicContact CD1-CD1 4.21Å; L106-L118 HydrophobicContact CD1-CG 4.02Å; L106-L121 HydrophobicContact CD1-CB 4.16Å; L106-L122 HydrophobicContact CD1-CD1 4.47Å; L106-L122 HydrophobicContact CD1-CD2 3.85Å; L106-L122 HydrophobicContact CD1-CG 3.84Å; L106-L122 HydrophobicContact CD2-CD2 3.97Å; L106-A126 HydrophobicContact CB-CB 4.3Å; L106-A126 HydrophobicContact CD1-CB 4.43Å; L106-A126 HydrophobicContact CD2-CB 4.21Å; L106-D127 WeakPolarHBondContact CD2-O 3.37Å; L106-A138 HydrophobicContact CD2-CB 4.09Å; L106-A138 HydrophobicContact CG-CB 3.92Å; L106-L154 HydrophobicContact CD1-CD2 4.42Å; L106-L154 HydrophobicContact CD2-CD2 4.34Å
107	H	95.8	Very high	91.4	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66.8	-40.7	172.2	-64.1	98.2	0	0	0	110.7	I103 H104 P105 A110 I111 S130 E136	I103-H107 HydrophobicContact CG2-CB 3.82Å; H104-H107 AromaticContact CG-ND1 3.91Å; H104-H107 PolarHBondContact N-ND1 3.49Å; H104-H107 VanDerWaalsContact N-ND1 3.16Å; H104-H107 AromaticContact ND1-CE1 3.6Å; H104-H107 AromaticContact ND1-ND1 3.59Å; H104-H107 WeakPolarHBondContact O-CA 3.45Å; H104-H107 WeakPolarHBondContact O-CB 3.07Å; H104-H107 PolarHBondContact O-N 2.76Å; P105-H107 VanDerWaalsContact C-N 3.34Å; P105-H107 PolarHBondContact O-N 2.75Å; H107-A110 PolarHBondContact O-N 3.39Å; H107-I111 VanDerWaalsContact O-CG1 3.25Å; H107-I111 WeakPolarHBondContact O-CG1 3.34Å; H107-I111 PolarHBondContact O-N 3.43Å; H107-S130 PolarHBondContact CE1-OG 2.69Å; H107-S130 PolarHBondContact NE2-O 3.31Å; H107-E136 PolarHBondContact NE2-O 3.41Å; H107-E136 VanDerWaalsContact NE2-O 3.09Å
108	C	93.8	Very high	91.5	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.1	-41.8	176.8	-70.3	0	0	0	0	112.3	H65 A68 H104 P105 A110 I111 G112	H65-C108 WeakPolarHBondContact O-CB 3.29Å; A68-C108 HydrophobicContact CB-CB 3.96Å; H104-C108 PolarHBondContact O-N 3.44Å; P105-C108 CarbonylContact O-C 3.59Å; P105-C108 WeakPolarHBondContact O-CA 3.41Å; P105-C108 WeakPolarHBondContact O-CB 3.45Å; P105-C108 PolarHBondContact O-N 3.32Å; P105-C108 VanDerWaalsContact O-N 3.13Å; C108-A110 VanDerWaalsContact C-N 3.35Å; C108-A110 PolarHBondContact O-N 2.93Å; C108-I111 PolarHBondContact O-N 3.21Å; C108-G112 WeakPolarHBondContact O-CA 3.38Å; C108-G112 PolarHBondContact O-N 3.06Å
109	S	94.3	Very high	91.7	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-64.9	-39.1	176.5	64.8	0	0	0	0	112.2	A68 P105 L106 G112 G113 A114	A68-S109 VanDerWaalsContact O-CA 3.28Å; A68-S109 WeakPolarHBondContact O-CA 3.23Å; P105-S109 PolarHBondContact O-N 3.5Å; L106-S109 PolarHBondContact O-OG 3.46Å; S109-G112 PolarHBondContact O-N 3.44Å; S109-G113 PolarHBondContact O-N 2.9Å; S109-A114 PolarHBondContact O-N 2.87Å
110	A	94.5	Very high	92.2	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-64.2	-44	174	0	0	0	0	0	112.1	L106 H107 C108 G113 A138 K141 A142 I145	L106-A110 PolarHBondContact O-N 2.91Å; L106-A110 VanDerWaalsContact O-N 3.17Å; H107-A110 PolarHBondContact O-N 3.39Å; C108-A110 VanDerWaalsContact C-N 3.35Å; C108-A110 PolarHBondContact O-N 2.93Å; A110-G113 PolarHBondContact O-N 2.85Å; A110-A138 HydrophobicContact CB-CB 4.07Å; A110-A138 WeakPolarHBondContact CB-O 3.14Å; A110-K141 HydrophobicContact CB-CB 3.84Å; A110-A142 HydrophobicContact CB-CB 4.43Å; A110-I145 WeakPolarHBondContact O-CD1 3.47Å
111	I	92.6	Very high	92.8	Very high	51 Å²	51	26.2 Å²	26.2	26%	0.262	13%	0.127	S	C	.	.	H	α-helix	trans	-67.2	-38.5	176.3	-63.7	166.7	0	0	0	111.3	Y69 R72 H107 C108 G113 K141 I145	Y69-I111 HydrophobicContact CD2-CG2 4.24Å; Y69-I111 HydrophobicContact CE2-CB 4.49Å; Y69-I111 HydrophobicContact CE2-CG2 3.74Å; R72-I111 PolarHBondContact NH2-O 3.13Å; H107-I111 VanDerWaalsContact O-CG1 3.25Å; H107-I111 WeakPolarHBondContact O-CG1 3.34Å; H107-I111 PolarHBondContact O-N 3.43Å; C108-I111 PolarHBondContact O-N 3.21Å; I111-G113 VanDerWaalsContact C-N 3.31Å; I111-G113 PolarHBondContact O-N 3.13Å; I111-K141 HydrophobicContact CD1-CD 3.97Å; I111-K141 HydrophobicContact CD1-CG 4.2Å; I111-K141 HydrophobicContact CG1-CB 3.76Å; I111-K141 HydrophobicContact CG1-CD 3.9Å; I111-K141 HydrophobicContact CG1-CG 3.83Å; I111-I145 VanDerWaalsContact CA-CD1 3.41Å; I111-I145 WeakPolarHBondContact O-CD1 3.36Å
112	G	89.8	Confident	93.1	Very high	3 Å²	3	20 Å²	20	3%	0.031	10%	0.103	C	C	.	.	H	α-helix	trans	-74.7	-17.3	-179.1	0	0	0	0	0	113.9	Y69 R72 C108 S109	Y69-G112 WeakPolarHBondContact O-CA 3.39Å; R72-G112 VanDerWaalsContact CD-O 3.26Å; R72-G112 WeakPolarHBondContact CD-O 3.18Å; R72-G112 WeakPolarHBondContact CG-O 3.23Å; R72-G112 VanDerWaalsContact CZ-C 3.5Å; R72-G112 VanDerWaalsContact CZ-O 3.26Å; R72-G112 PolarHBondContact NE-O 2.9Å; R72-G112 PolarHBondContact NH2-O 3.22Å; C108-G112 WeakPolarHBondContact O-CA 3.38Å; C108-G112 PolarHBondContact O-N 3.06Å; S109-G112 PolarHBondContact O-N 3.44Å
113	G	90.1	Very high	93.1	Very high	11 Å²	11	21.4 Å²	21.4	11%	0.113	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.4	19	-172.2	0	0	0	0	0	113.6	S109 A110 I111 L115	S109-G113 PolarHBondContact O-N 2.9Å; A110-G113 PolarHBondContact O-N 2.85Å; I111-G113 VanDerWaalsContact C-N 3.31Å; I111-G113 PolarHBondContact O-N 3.13Å; G113-L115 PolarHBondContact O-N 3.21Å; G113-L115 VanDerWaalsContact O-N 3.13Å
114	A	90.3	Very high	93.1	Very high	3 Å²	3	22.3 Å²	22.3	3%	0.025	12%	0.122	C	C	.	.			trans	-86.6	80.3	-169.4	0	0	0	0	0	110.6	A68 G71 S109 L116 C117 L118	A68-A114 WeakPolarHBondContact O-CB 3.29Å; G71-A114 VanDerWaalsContact CA-CB 3.5Å; S109-A114 PolarHBondContact O-N 2.87Å; A114-L116 PolarHBondContact O-N 3.17Å; A114-C117 HydrophobicContact CB-CB 3.73Å; A114-C117 PolarHBondContact O-N 2.93Å; A114-C117 VanDerWaalsContact O-N 3.17Å; A114-L118 WeakPolarHBondContact O-CB 3.25Å; A114-L118 PolarHBondContact O-N 3.46Å
115	L	90.9	Very high	92.9	Very high	49 Å²	49	24 Å²	24	26%	0.257	15%	0.147	S	C	.	.	H	α-helix	trans	-55.6	-47.9	-175.2	-175.3	66	0	0	0	112.8	G113 C117 L118 D119 E149 L150 R153	G113-L115 PolarHBondContact O-N 3.21Å; G113-L115 VanDerWaalsContact O-N 3.13Å; L115-C117 VanDerWaalsContact C-N 3.31Å; L115-C117 PolarHBondContact O-N 2.87Å; L115-L118 WeakPolarHBondContact O-CB 3.47Å; L115-L118 PolarHBondContact O-N 3.09Å; L115-D119 PolarHBondContact O-N 3.05Å; L115-E149 HydrophobicContact CD1-CG 3.83Å; L115-E149 HydrophobicContact CD2-CG 3.59Å; L115-E149 HydrophobicContact CG-CG 4.37Å; L115-L150 HydrophobicContact CB-CD2 4.2Å; L115-L150 HydrophobicContact CD1-CD2 3.79Å; L115-R153 HydrophobicContact CD1-CG 3.81Å
116	L	91.1	Very high	92.9	Very high	79 Å²	79	24.5 Å²	24.5	41%	0.414	15%	0.152	S	C	.	.	H	α-helix	trans	-63.6	-37.7	179.6	-62	177.1	0	0	0	112.4	L77 A80 A114 R120	L77-L116 HydrophobicContact CD2-CD1 3.57Å; A80-L116 HydrophobicContact CB-CB 3.75Å; A80-L116 HydrophobicContact CB-CD1 4.4Å; A114-L116 PolarHBondContact O-N 3.17Å; L116-R120 WeakPolarHBondContact O-CB 3.5Å; L116-R120 PolarHBondContact O-N 3.17Å
117	C	91.8	Very high	92.8	Very high	1 Å²	1	29 Å²	29	1%	0.007	18%	0.175	C	C	.	.	H	α-helix	trans	-68.8	-39.5	175.8	-64.5	0	0	0	0	111.4	L83 A114 L115 R120 L121	L83-C117 HydrophobicContact CD2-CB 3.47Å; L83-C117 VanDerWaalsContact CD2-CB 3.47Å; A114-C117 HydrophobicContact CB-CB 3.73Å; A114-C117 PolarHBondContact O-N 2.93Å; A114-C117 VanDerWaalsContact O-N 3.17Å; L115-C117 VanDerWaalsContact C-N 3.31Å; L115-C117 PolarHBondContact O-N 2.87Å; C117-R120 PolarHBondContact O-N 3.13Å; C117-L121 WeakPolarHBondContact O-CB 3.29Å; C117-L121 WeakPolarHBondContact O-CD1 3.4Å; C117-L121 VanDerWaalsContact O-CG 3.24Å; C117-L121 WeakPolarHBondContact O-CG 3.24Å; C117-L121 PolarHBondContact O-N 3.11Å
118	L	94.2	Very high	92.7	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.5	-50.2	175.5	-178.6	135.3	0	0	0	111	L106 A114 L115 R120 L121 L122 L150 R153 L154	L106-L118 HydrophobicContact CD1-CD1 4.21Å; L106-L118 HydrophobicContact CD1-CG 4.02Å; A114-L118 WeakPolarHBondContact O-CB 3.25Å; A114-L118 PolarHBondContact O-N 3.46Å; L115-L118 WeakPolarHBondContact O-CB 3.47Å; L115-L118 PolarHBondContact O-N 3.09Å; L118-R120 VanDerWaalsContact C-N 3.34Å; L118-R120 PolarHBondContact O-N 3.01Å; L118-L121 PolarHBondContact O-N 2.96Å; L118-L122 HydrophobicContact CD2-CD1 3.45Å; L118-L122 VanDerWaalsContact CD2-CD1 3.45Å; L118-L122 HydrophobicContact CG-CD1 3.96Å; L118-L122 WeakPolarHBondContact O-CG 3.41Å; L118-L122 PolarHBondContact O-N 2.98Å; L118-L150 HydrophobicContact CB-CD2 4.02Å; L118-L150 HydrophobicContact CD1-CD2 3.77Å; L118-L150 HydrophobicContact CD2-CD2 4.32Å; L118-L150 HydrophobicContact CG-CD2 4.25Å; L118-R153 HydrophobicContact CD2-CB 3.7Å; L118-R153 HydrophobicContact CD2-CG 4.46Å; L118-L154 HydrophobicContact CD1-CD1 4.15Å; L118-L154 HydrophobicContact CD1-CD2 4.02Å; L118-L154 HydrophobicContact CD1-CG 3.94Å; L118-L154 HydrophobicContact CD2-CG 4.48Å
119	D	92.2	Very high	92.8	Very high	29 Å²	29	31.9 Å²	31.9	16%	0.155	19%	0.192	C	C	.	.	H	α-helix	trans	-58.9	-45.9	177.6	-78	-4.4	0	0	0	110.8	L115 L121 L122 V123 R153	L115-D119 PolarHBondContact O-N 3.05Å; D119-L121 PolarHBondContact O-N 3.31Å; D119-L122 PolarHBondContact O-N 2.92Å; D119-V123 WeakPolarHBondContact O-CB 3.49Å; D119-V123 VanDerWaalsContact O-CG2 3.3Å; D119-V123 WeakPolarHBondContact O-CG2 3.1Å; D119-V123 PolarHBondContact O-N 2.92Å; D119-R153 VanDerWaalsContact OD1-CD 3.26Å; D119-R153 WeakPolarHBondContact OD1-CD 3.27Å; D119-R153 WeakPolarHBondContact OD1-CG 3.3Å; D119-R153 IonicContact OD1-NE 3.07Å; D119-R153 PolarHBondContact OD1-NE 3.45Å; D119-R153 VanDerWaalsContact OD1-NE 3.1Å; D119-R153 IonicContact OD2-CZ 2.92Å; D119-R153 IonicContact OD2-NE 2.68Å; D119-R153 PolarHBondContact OD2-NE 2.98Å; D119-R153 VanDerWaalsContact OD2-NE 3.07Å; D119-R153 IonicContact OD2-NH2 3.38Å; D119-R153 PolarHBondContact OD2-NH2 2.76Å
120	R	92.8	Very high	92.9	Very high	66 Å²	66	32.4 Å²	32.4	25%	0.249	20%	0.195	C	C	.	.	H	α-helix	trans	-60.9	-42.9	177.9	179.1	57.1	-178.5	-117.9	2.8	112.4	S84 L87 D88 L116 C117 L118 S124	S84-R120 VanDerWaalsContact CB-CZ 3.44Å; S84-R120 PolarHBondContact O-NH2 3.38Å; S84-R120 PolarHBondContact OG-NH1 3.26Å; L87-R120 HydrophobicContact CD1-CG 4.06Å; D88-R120 IonicContact OD1-CZ 3.1Å; D88-R120 IonicContact OD1-NH2 3.24Å; D88-R120 PolarHBondContact OD1-NH2 3Å; D88-R120 IonicContact OD2-NH2 3.57Å; D88-R120 PolarHBondContact OD2-NH2 3.08Å; L116-R120 WeakPolarHBondContact O-CB 3.5Å; L116-R120 PolarHBondContact O-N 3.17Å; C117-R120 PolarHBondContact O-N 3.13Å; L118-R120 VanDerWaalsContact C-N 3.34Å; L118-R120 PolarHBondContact O-N 3.01Å; R120-S124 PolarHBondContact NE-OG 3.46Å; R120-S124 VanDerWaalsContact O-CB 3.26Å; R120-S124 WeakPolarHBondContact O-CB 3.43Å; R120-S124 PolarHBondContact O-N 2.83Å; R120-S124 PolarHBondContact O-OG 3.43Å
121	L	94.5	Very high	92.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-64.2	-45	178.8	-77	163.1	0	0	0	111.8	A68 L83 L87 P105 L106 C117 L118 D119 S124 G125 A126	A68-L121 HydrophobicContact CB-CD1 4.11Å; L83-L121 HydrophobicContact CD1-CD2 4.45Å; L83-L121 HydrophobicContact CD2-CD1 4.1Å; L83-L121 HydrophobicContact CD2-CD2 4.48Å; L83-L121 HydrophobicContact CD2-CG 3.97Å; L87-L121 HydrophobicContact CD1-CD2 3.9Å; L87-L121 HydrophobicContact CD2-CD2 4.37Å; P105-L121 HydrophobicContact CB-CD1 3.82Å; P105-L121 HydrophobicContact CB-CD2 3.77Å; P105-L121 HydrophobicContact CB-CG 4.48Å; L106-L121 HydrophobicContact CD1-CB 4.16Å; C117-L121 WeakPolarHBondContact O-CB 3.29Å; C117-L121 WeakPolarHBondContact O-CD1 3.4Å; C117-L121 VanDerWaalsContact O-CG 3.24Å; C117-L121 WeakPolarHBondContact O-CG 3.24Å; C117-L121 PolarHBondContact O-N 3.11Å; L118-L121 PolarHBondContact O-N 2.96Å; D119-L121 PolarHBondContact O-N 3.31Å; L121-S124 CarbonylContact O-C 3.5Å; L121-S124 PolarHBondContact O-N 3.41Å; L121-S124 VanDerWaalsContact O-N 3.17Å; L121-G125 PolarHBondContact O-N 3.45Å; L121-A126 HydrophobicContact CB-CB 4.01Å; L121-A126 WeakPolarHBondContact O-CB 3.29Å; L121-A126 PolarHBondContact O-N 2.9Å
122	L	93.8	Very high	93	Very high	11 Å²	11	36.3 Å²	36.3	6%	0.058	21%	0.208	C	C	.	.	H	α-helix	trans	-64.3	-43.9	178.6	-69.3	169.3	0	0	0	111.7	L106 L118 D119 S124 G125 A128 L154 F157	L106-L122 HydrophobicContact CD1-CD1 4.47Å; L106-L122 HydrophobicContact CD1-CD2 3.85Å; L106-L122 HydrophobicContact CD1-CG 3.84Å; L106-L122 HydrophobicContact CD2-CD2 3.97Å; L118-L122 HydrophobicContact CD2-CD1 3.45Å; L118-L122 VanDerWaalsContact CD2-CD1 3.45Å; L118-L122 HydrophobicContact CG-CD1 3.96Å; L118-L122 WeakPolarHBondContact O-CG 3.41Å; L118-L122 PolarHBondContact O-N 2.98Å; D119-L122 PolarHBondContact O-N 2.92Å; L122-S124 PolarHBondContact O-N 3.14Å; L122-G125 PolarHBondContact O-N 3.49Å; L122-A128 HydrophobicContact CD2-CB 3.95Å; L122-L154 HydrophobicContact CD1-CD2 4.25Å; L122-L154 HydrophobicContact CD2-CD2 4.41Å; L122-F157 HydrophobicContact CB-CD1 3.67Å; L122-F157 HydrophobicContact CB-CD2 3.99Å; L122-F157 HydrophobicContact CB-CE1 3.66Å; L122-F157 HydrophobicContact CB-CE2 3.99Å; L122-F157 HydrophobicContact CB-CG 3.81Å; L122-F157 HydrophobicContact CB-CZ 3.83Å; L122-F157 HydrophobicContact CD1-CB 4.02Å; L122-F157 HydrophobicContact CD1-CD1 4.49Å; L122-F157 HydrophobicContact CD1-CD2 3.49Å; L122-F157 VanDerWaalsContact CD1-CD2 3.49Å; L122-F157 HydrophobicContact CD1-CE2 3.98Å; L122-F157 HydrophobicContact CD1-CG 3.77Å; L122-F157 HydrophobicContact CD2-CB 4.09Å; L122-F157 HydrophobicContact CD2-CG 4.29Å; L122-F157 HydrophobicContact CG-CB 4.44Å; L122-F157 HydrophobicContact CG-CD1 4.46Å; L122-F157 HydrophobicContact CG-CD2 4.28Å; L122-F157 HydrophobicContact CG-CG 4.17Å
123	V	92.8	Very high	93.2	Very high	96 Å²	96	38.7 Å²	38.7	58%	0.582	23%	0.227	S	C	*	.	H	α-helix	trans	-62.8	-31.9	173.7	171.8	0	0	0	0	111.8	D119 G125 F157 M232	D119-V123 WeakPolarHBondContact O-CB 3.49Å; D119-V123 VanDerWaalsContact O-CG2 3.3Å; D119-V123 WeakPolarHBondContact O-CG2 3.1Å; D119-V123 PolarHBondContact O-N 2.92Å; V123-G125 PolarHBondContact O-N 2.94Å; V123-F157 HydrophobicContact CG2-CE1 4.3Å; V123-F157 HydrophobicContact CG2-CZ 3.93Å; V123-M232 HydrophobicContact CG2-CE 4.14Å
124	S	92.9	Very high	93.4	Very high	43 Å²	43	42.9 Å²	42.9	30%	0.301	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	5.6	177.5	-53	0	0	0	0	113.1	R120 L121 L122	R120-S124 PolarHBondContact NE-OG 3.46Å; R120-S124 VanDerWaalsContact O-CB 3.26Å; R120-S124 WeakPolarHBondContact O-CB 3.43Å; R120-S124 PolarHBondContact O-N 2.83Å; R120-S124 PolarHBondContact O-OG 3.43Å; L121-S124 CarbonylContact O-C 3.5Å; L121-S124 PolarHBondContact O-N 3.41Å; L121-S124 VanDerWaalsContact O-N 3.17Å; L122-S124 PolarHBondContact O-N 3.14Å
125	G	92.3	Very high	93.6	Very high	62 Å²	62	43.3 Å²	43.3	64%	0.639	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.8	20.8	174.7	0	0	0	0	0	115.2	L121 L122 V123 D127	L121-G125 PolarHBondContact O-N 3.45Å; L122-G125 PolarHBondContact O-N 3.49Å; V123-G125 PolarHBondContact O-N 2.94Å; G125-D127 PolarHBondContact O-N 3.4Å
126	A	94.2	Very high	93.9	Very high	11 Å²	11	41.2 Å²	41.2	9%	0.091	24%	0.24	C	C	.	.			trans	-62.6	133.1	171.9	0	0	0	0	0	110.7	V94 L106 L121 A128	V94-A126 VanDerWaalsContact CG1-CA 3.47Å; V94-A126 HydrophobicContact CG1-CB 3.7Å; V94-A126 VanDerWaalsContact CG1-N 3.27Å; L106-A126 HydrophobicContact CB-CB 4.3Å; L106-A126 HydrophobicContact CD1-CB 4.43Å; L106-A126 HydrophobicContact CD2-CB 4.21Å; L121-A126 HydrophobicContact CB-CB 4.01Å; L121-A126 WeakPolarHBondContact O-CB 3.29Å; L121-A126 PolarHBondContact O-N 2.9Å; A126-A128 PolarHBondContact O-N 2.8Å; A126-A128 VanDerWaalsContact O-N 3.14Å
127	D	94.4	Very high	94.2	Very high	94 Å²	94	37.5 Å²	37.5	50%	0.503	22%	0.221	S	C	.	.			trans	-71.4	108.9	176.8	179.6	13	0	0	0	110.6	L106 G125 N129 S130	L106-D127 WeakPolarHBondContact CD2-O 3.37Å; G125-D127 PolarHBondContact O-N 3.4Å; D127-N129 PolarHBondContact O-N 2.85Å; D127-N129 VanDerWaalsContact O-N 3.12Å; D127-N129 WeakPolarHBondContact OD1-CA 3.36Å; D127-N129 WeakPolarHBondContact OD1-CB 3.38Å; D127-N129 PolarHBondContact OD1-N 2.93Å; D127-S130 VanDerWaalsContact O-CB 3.3Å; D127-S130 WeakPolarHBondContact O-CB 3.44Å; D127-S130 PolarHBondContact O-N 2.8Å; D127-S130 PolarHBondContact O-OG 3.12Å; D127-S130 PolarHBondContact OD2-N 2.94Å
128	A	94.2	Very high	94.4	Very high	6 Å²	6	37.5 Å²	37.5	5%	0.05	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.2	176.3	0	0	0	0	0	113.3	L122 A126 C159	L122-A128 HydrophobicContact CD2-CB 3.95Å; A126-A128 PolarHBondContact O-N 2.8Å; A126-A128 VanDerWaalsContact O-N 3.14Å; A128-C159 HydrophobicContact CB-CB 4.1Å; A128-C159 PolarHBondContact O-SG 3.47Å
129	N	95.1	Very high	94.5	Very high	55 Å²	55	37.5 Å²	37.5	29%	0.294	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103	4.7	179.8	-61.4	-53.2	0	0	0	113.4	D127 G158 C159 D160	D127-N129 PolarHBondContact O-N 2.85Å; D127-N129 VanDerWaalsContact O-N 3.12Å; D127-N129 WeakPolarHBondContact OD1-CA 3.36Å; D127-N129 WeakPolarHBondContact OD1-CB 3.38Å; D127-N129 PolarHBondContact OD1-N 2.93Å; N129-G158 PolarHBondContact ND2-O 3.01Å; N129-C159 WeakPolarHBondContact OD1-CA 3.48Å; N129-D160 WeakPolarHBondContact OD1-CB 2.98Å; N129-D160 PolarHBondContact OD1-N 3.2Å
130	S	95.4	Very high	94.7	Very high	11 Å²	11	36.2 Å²	36.2	8%	0.077	21%	0.214	C	C	.	.			trans	-55.9	141.3	174.5	57	0	0	0	0	110.8	H107 D127 T137	H107-S130 PolarHBondContact CE1-OG 2.69Å; H107-S130 PolarHBondContact NE2-O 3.31Å; D127-S130 VanDerWaalsContact O-CB 3.3Å; D127-S130 WeakPolarHBondContact O-CB 3.44Å; D127-S130 PolarHBondContact O-N 2.8Å; D127-S130 PolarHBondContact O-OG 3.12Å; D127-S130 PolarHBondContact OD2-N 2.94Å; S130-T137 WeakPolarHBondContact O-CA 3.28Å
131	R	95.7	Very high	94.9	Very high	121 Å²	121	33.6 Å²	33.6	46%	0.457	20%	0.204	S	C	.	.			trans	-119.3	131.8	-177	-62.6	-178.7	-176.8	175	-3.7	110.5	N102 E136 T137 T163	N102-R131 PolarHBondContact ND2-O 3.13Å; R131-E136 WeakPolarHBondContact CA-O 3.37Å; R131-T137 HydrophobicContact CG-CG2 4.17Å; R131-T163 VanDerWaalsContact NE-CG2 3.27Å; R131-T163 VanDerWaalsContact NH2-CG2 3.33Å; R131-T163 PolarHBondContact NH2-OG1 3.32Å
132	D	95.1	Very high	94.9	Very high	11 Å²	11	33.6 Å²	33.6	6%	0.059	20%	0.204	C	C	.	.			trans	-75.8	-177.8	170.2	79	0.2	0	0	0	112.2	I103 L134 G135 E136 K141	I103-D132 HydrophobicContact CG1-CB 4.23Å; D132-L134 PolarHBondContact O-N 2.94Å; D132-L134 VanDerWaalsContact O-N 3.17Å; D132-L134 WeakPolarHBondContact OD1-CA 3.16Å; D132-L134 WeakPolarHBondContact OD1-CB 3.45Å; D132-L134 PolarHBondContact OD1-N 2.94Å; D132-G135 WeakPolarHBondContact O-CA 3.36Å; D132-G135 PolarHBondContact O-N 2.94Å; D132-G135 PolarHBondContact OD1-N 3.27Å; D132-E136 PolarHBondContact N-O 3.48Å; D132-E136 WeakPolarHBondContact OD1-CB 3.08Å; D132-E136 PolarHBondContact OD1-N 3.35Å; D132-K141 WeakPolarHBondContact OD2-CE 3.42Å; D132-K141 IonicContact OD2-NZ 3.91Å; D132-K141 PolarHBondContact OD2-NZ 3.32Å
133	A	94.1	Very high	95	Very high	54 Å²	54	33.1 Å²	33.1	45%	0.446	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-16.1	179.8	0	0	0	0	0	114.1	Y101 G135	Y101-A133 VanDerWaalsContact O-CB 3.32Å; Y101-A133 WeakPolarHBondContact O-CB 3.38Å; Y101-A133 PolarHBondContact O-N 3.47Å; A133-G135 VanDerWaalsContact C-N 3.29Å
134	L	94.4	Very high	95.1	Very high	98 Å²	98	32.5 Å²	32.5	51%	0.513	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	5	172.4	-59.6	177.6	0	0	0	111.7	D132 E136 N165 V166	D132-L134 PolarHBondContact O-N 2.94Å; D132-L134 VanDerWaalsContact O-N 3.17Å; D132-L134 WeakPolarHBondContact OD1-CA 3.16Å; D132-L134 WeakPolarHBondContact OD1-CB 3.45Å; D132-L134 PolarHBondContact OD1-N 2.94Å; L134-E136 HydrophobicContact CB-CG 3.91Å; L134-E136 PolarHBondContact O-N 3.13Å; L134-N165 WeakPolarHBondContact O-CB 3.18Å; L134-V166 VanDerWaalsContact C-CG2 3.44Å; L134-V166 WeakPolarHBondContact O-CB 3.4Å; L134-V166 VanDerWaalsContact O-CG2 3.28Å; L134-V166 WeakPolarHBondContact O-CG2 3.41Å; L134-V166 PolarHBondContact O-N 2.87Å
135	G	94.8	Very high	95.1	Very high	12 Å²	12	33.1 Å²	33.1	12%	0.124	19%	0.188	C	C	.	.	S	Bend	trans	70.9	13.1	-173.4	0	0	0	0	0	113	D132 A133	D132-G135 WeakPolarHBondContact O-CA 3.36Å; D132-G135 PolarHBondContact O-N 2.94Å; D132-G135 PolarHBondContact OD1-N 3.27Å; A133-G135 VanDerWaalsContact C-N 3.29Å
136	E	96.3	Very high	95.2	Very high	6 Å²	6	31.3 Å²	31.3	3%	0.028	17%	0.17	C	C	.	.			trans	-86.6	134.1	-176.4	-64.2	-165.7	148.4	0	0	110.7	H107 R131 D132 L134 H140 K141 R144 N165	H107-E136 PolarHBondContact NE2-O 3.41Å; H107-E136 VanDerWaalsContact NE2-O 3.09Å; R131-E136 WeakPolarHBondContact CA-O 3.37Å; D132-E136 PolarHBondContact N-O 3.48Å; D132-E136 WeakPolarHBondContact OD1-CB 3.08Å; D132-E136 PolarHBondContact OD1-N 3.35Å; L134-E136 HydrophobicContact CB-CG 3.91Å; L134-E136 PolarHBondContact O-N 3.13Å; E136-H140 HydrophobicContact CB-CB 3.84Å; E136-H140 HydrophobicContact CG-CB 4.14Å; E136-K141 WeakPolarHBondContact OE2-CE 3.21Å; E136-K141 IonicContact OE2-NZ 2.64Å; E136-K141 PolarHBondContact OE2-NZ 3.39Å; E136-R144 VanDerWaalsContact CD-NH2 3.26Å; E136-R144 IonicContact OE1-CZ 3.66Å; E136-R144 IonicContact OE1-NH1 3.82Å; E136-R144 IonicContact OE1-NH2 2.63Å; E136-R144 PolarHBondContact OE1-NH2 3.34Å; E136-R144 IonicContact OE2-CZ 3.4Å; E136-R144 IonicContact OE2-NH1 2.79Å; E136-R144 PolarHBondContact OE2-NH1 2.73Å; E136-R144 IonicContact OE2-NH2 3.1Å; E136-R144 PolarHBondContact OE2-NH2 3.21Å; E136-R144 VanDerWaalsContact OE2-NH2 3.1Å; E136-N165 HydrophobicContact CG-CB 3.64Å; E136-N165 PolarHBondContact OE1-ND2 3.18Å; E136-N165 VanDerWaalsContact OE1-ND2 3.09Å
137	T	96.8	Very high	95	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.006	18%	0.177	C	C	.	.			trans	-85	169.2	168.1	64.9	0	0	0	0	111.2	S130 R131 A139 H140 K141 T163	S130-T137 WeakPolarHBondContact O-CA 3.28Å; R131-T137 HydrophobicContact CG-CG2 4.17Å; T137-A139 PolarHBondContact O-N 3.48Å; T137-A139 VanDerWaalsContact O-N 3.16Å; T137-A139 PolarHBondContact OG1-N 3.46Å; T137-H140 PolarHBondContact N-ND1 3.2Å; T137-H140 VanDerWaalsContact N-ND1 3.17Å; T137-H140 WeakPolarHBondContact O-CB 3.42Å; T137-H140 PolarHBondContact O-N 3.49Å; T137-H140 PolarHBondContact OG1-ND1 3.49Å; T137-K141 PolarHBondContact O-N 2.96Å; T137-T163 HydrophobicContact CG2-CG2 3.68Å
138	A	96.4	Very high	94.9	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-53.9	-33	170.7	0	0	0	0	0	112.4	L106 A110 H140 K141 A142 L154	L106-A138 HydrophobicContact CD2-CB 4.09Å; L106-A138 HydrophobicContact CG-CB 3.92Å; A110-A138 HydrophobicContact CB-CB 4.07Å; A110-A138 WeakPolarHBondContact CB-O 3.14Å; A138-H140 PolarHBondContact O-N 3.01Å; A138-K141 WeakPolarHBondContact O-CB 3.37Å; A138-K141 PolarHBondContact O-N 3.19Å; A138-A142 PolarHBondContact O-N 3.17Å; A138-L154 HydrophobicContact CB-CD1 3.78Å; A138-L154 HydrophobicContact CB-CD2 3.72Å; A138-L154 HydrophobicContact CB-CG 4.44Å
139	A	96.3	Very high	94.8	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.008	16%	0.156	C	C	.	.	H	α-helix	trans	-65.9	-37.5	176.9	0	0	0	0	0	112.5	T137 K141 A142 A143 L154 L161 A171	T137-A139 PolarHBondContact O-N 3.48Å; T137-A139 VanDerWaalsContact O-N 3.16Å; T137-A139 PolarHBondContact OG1-N 3.46Å; A139-K141 VanDerWaalsContact C-N 3.31Å; A139-K141 PolarHBondContact O-N 2.87Å; A139-A142 PolarHBondContact O-N 3.17Å; A139-A143 WeakPolarHBondContact O-CB 3.06Å; A139-A143 PolarHBondContact O-N 3.38Å; A139-L154 HydrophobicContact CB-CD1 4.22Å; A139-L161 HydrophobicContact CB-CD2 4.23Å; A139-A171 HydrophobicContact CB-CB 4.09Å
140	H	97.1	Very high	94.6	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-62	-40.5	173.1	-68.8	81.6	0	0	0	111.5	E136 T137 A138 R144 T163 Y169 A171	E136-H140 HydrophobicContact CB-CB 3.84Å; E136-H140 HydrophobicContact CG-CB 4.14Å; T137-H140 PolarHBondContact N-ND1 3.2Å; T137-H140 VanDerWaalsContact N-ND1 3.17Å; T137-H140 WeakPolarHBondContact O-CB 3.42Å; T137-H140 PolarHBondContact O-N 3.49Å; T137-H140 PolarHBondContact OG1-ND1 3.49Å; A138-H140 PolarHBondContact O-N 3.01Å; H140-R144 PolarHBondContact O-N 2.89Å; H140-T163 PolarHBondContact CE1-O 2.86Å; H140-T163 PolarHBondContact NE2-O 3.37Å; H140-Y169 PolarHBondContact NE2-O 2.97Å; H140-A171 PolarHBondContact NE2-N 3.38Å
141	K	95.5	Very high	94.6	Very high	12 Å²	12	26.2 Å²	26.2	5%	0.052	14%	0.139	C	C	.	.	H	α-helix	trans	-66.7	-45.8	177.4	-56.4	-56.1	-173.8	-174	0	111.3	A110 I111 D132 E136 T137 A138 A139 R144 I145	A110-K141 HydrophobicContact CB-CB 3.84Å; I111-K141 HydrophobicContact CD1-CD 3.97Å; I111-K141 HydrophobicContact CD1-CG 4.2Å; I111-K141 HydrophobicContact CG1-CB 3.76Å; I111-K141 HydrophobicContact CG1-CD 3.9Å; I111-K141 HydrophobicContact CG1-CG 3.83Å; D132-K141 WeakPolarHBondContact OD2-CE 3.42Å; D132-K141 IonicContact OD2-NZ 3.91Å; D132-K141 PolarHBondContact OD2-NZ 3.32Å; E136-K141 WeakPolarHBondContact OE2-CE 3.21Å; E136-K141 IonicContact OE2-NZ 2.64Å; E136-K141 PolarHBondContact OE2-NZ 3.39Å; T137-K141 PolarHBondContact O-N 2.96Å; A138-K141 WeakPolarHBondContact O-CB 3.37Å; A138-K141 PolarHBondContact O-N 3.19Å; A139-K141 VanDerWaalsContact C-N 3.31Å; A139-K141 PolarHBondContact O-N 2.87Å; K141-R144 WeakPolarHBondContact O-CB 3.46Å; K141-R144 PolarHBondContact O-N 3.01Å; K141-I145 PolarHBondContact O-N 2.98Å
142	A	95.4	Very high	94.4	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-62.9	-42.2	176.9	0	0	0	0	0	112	A110 A138 A139 R144 I145 G146 N147 L150 I151 L154	A110-A142 HydrophobicContact CB-CB 4.43Å; A138-A142 PolarHBondContact O-N 3.17Å; A139-A142 PolarHBondContact O-N 3.17Å; A142-R144 VanDerWaalsContact C-N 3.31Å; A142-R144 PolarHBondContact O-N 2.81Å; A142-I145 PolarHBondContact O-N 3.41Å; A142-I145 VanDerWaalsContact O-N 3.16Å; A142-G146 PolarHBondContact O-N 3.47Å; A142-N147 PolarHBondContact O-N 3.43Å; A142-L150 HydrophobicContact CB-CB 3.84Å; A142-L150 HydrophobicContact CB-CD1 4.39Å; A142-I151 HydrophobicContact CB-CG1 3.73Å; A142-L154 HydrophobicContact CB-CD1 4.3Å
143	A	96	Very high	94.2	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-59.9	-37.1	174.5	0	0	0	0	0	112.9	A139 I145 G146 I151 A171 V174 A175 H180 L187	A139-A143 WeakPolarHBondContact O-CB 3.06Å; A139-A143 PolarHBondContact O-N 3.38Å; A143-I145 VanDerWaalsContact C-N 3.3Å; A143-I145 PolarHBondContact O-N 3.24Å; A143-G146 PolarHBondContact O-N 2.91Å; A143-I151 HydrophobicContact CB-CD1 4.37Å; A143-A171 HydrophobicContact CB-CB 4.28Å; A143-A171 VanDerWaalsContact CB-O 3.25Å; A143-A171 WeakPolarHBondContact CB-O 3.46Å; A143-V174 HydrophobicContact CB-CB 4.32Å; A143-V174 HydrophobicContact CB-CG1 4.26Å; A143-A175 HydrophobicContact CB-CB 4.04Å; A143-H180 PolarHBondContact O-CD2 3.08Å; A143-H180 VanDerWaalsContact O-CD2 3.27Å; A143-L187 HydrophobicContact CB-CD1 4.1Å
144	R	95.1	Very high	94.2	Very high	84 Å²	84	20.1 Å²	20.1	32%	0.317	10%	0.103	S	C	.	.	H	α-helix	trans	-64	-36.6	176.2	-179.4	173.3	-65	128.8	6.5	112.7	E136 H140 K141 A142 V174 K178 H180	E136-R144 VanDerWaalsContact CD-NH2 3.26Å; E136-R144 IonicContact OE1-CZ 3.66Å; E136-R144 IonicContact OE1-NH1 3.82Å; E136-R144 IonicContact OE1-NH2 2.63Å; E136-R144 PolarHBondContact OE1-NH2 3.34Å; E136-R144 IonicContact OE2-CZ 3.4Å; E136-R144 IonicContact OE2-NH1 2.79Å; E136-R144 PolarHBondContact OE2-NH1 2.73Å; E136-R144 IonicContact OE2-NH2 3.1Å; E136-R144 PolarHBondContact OE2-NH2 3.21Å; E136-R144 VanDerWaalsContact OE2-NH2 3.1Å; H140-R144 PolarHBondContact O-N 2.89Å; K141-R144 WeakPolarHBondContact O-CB 3.46Å; K141-R144 PolarHBondContact O-N 3.01Å; A142-R144 VanDerWaalsContact C-N 3.31Å; A142-R144 PolarHBondContact O-N 2.81Å; R144-V174 HydrophobicContact CB-CG1 3.84Å; R144-K178 HydrophobicContact CG-CG 4.37Å; R144-H180 PolarHBondContact O-NE2 2.94Å
145	I	92.6	Very high	94.1	Very high	55 Å²	55	15.7 Å²	15.7	28%	0.282	8%	0.081	S	C	.	.	H	α-helix	trans	-81	-26.9	-179.8	-72	152.8	0	0	0	111.6	R72 A110 I111 K141 A142 A143 N147 H180	R72-I145 VanDerWaalsContact NH2-CD1 3.35Å; A110-I145 WeakPolarHBondContact O-CD1 3.47Å; I111-I145 VanDerWaalsContact CA-CD1 3.41Å; I111-I145 WeakPolarHBondContact O-CD1 3.36Å; K141-I145 PolarHBondContact O-N 2.98Å; A142-I145 PolarHBondContact O-N 3.41Å; A142-I145 VanDerWaalsContact O-N 3.16Å; A143-I145 VanDerWaalsContact C-N 3.3Å; A143-I145 PolarHBondContact O-N 3.24Å; I145-N147 HydrophobicContact CG2-CB 4.22Å; I145-H180 VanDerWaalsContact C-NE2 3.32Å; I145-H180 PolarHBondContact O-CE1 3.28Å; I145-H180 PolarHBondContact O-NE2 3.14Å
146	G	93.4	Very high	93.8	Very high	25 Å²	25	17.8 Å²	17.8	26%	0.258	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.4	28.9	-176.4	0	0	0	0	0	112.8	A142 A143 L148 H180 C183	A142-G146 PolarHBondContact O-N 3.47Å; A143-G146 PolarHBondContact O-N 2.91Å; G146-L148 PolarHBondContact O-N 2.96Å; G146-H180 WeakPolarHBondContact CA-CD2 3.4Å; G146-H180 PolarHBondContact N-CD2 2.93Å; G146-H180 PolarHBondContact N-NE2 2.97Å; G146-C183 PolarHBondContact O-SG 3.36Å
147	N	91.7	Very high	93.5	Very high	43 Å²	43	20.4 Å²	20.4	23%	0.23	11%	0.108	C	C	.	.			trans	-93.1	97.3	177.9	-169.5	-27.2	0	0	0	110.2	A142 I145 E149 L150 I151	A142-N147 PolarHBondContact O-N 3.43Å; I145-N147 HydrophobicContact CG2-CB 4.22Å; N147-E149 VanDerWaalsContact C-N 3.28Å; N147-E149 PolarHBondContact O-N 2.98Å; N147-E149 WeakPolarHBondContact OD1-CB 3.44Å; N147-E149 PolarHBondContact OD1-N 3.1Å; N147-E149 VanDerWaalsContact OD1-N 3.13Å; N147-L150 HydrophobicContact CB-CB 4.26Å; N147-L150 HydrophobicContact CB-CD1 3.92Å; N147-L150 HydrophobicContact CB-CG 4.14Å; N147-L150 PolarHBondContact O-N 3.07Å; N147-L150 PolarHBondContact OD1-N 3.41Å; N147-I151 WeakPolarHBondContact O-CG1 3.47Å; N147-I151 PolarHBondContact O-N 2.93Å
148	L	92.2	Very high	93.1	Very high	11 Å²	11	22.6 Å²	22.6	6%	0.058	13%	0.131	C	C	.	.	H	α-helix	trans	-60.5	-37.6	-179.9	-178.1	58.9	0	0	0	112.2	G146 L150 I151 S152 Y186 M203 V208 L211	G146-L148 PolarHBondContact O-N 2.96Å; L148-L150 PolarHBondContact O-N 3.24Å; L148-I151 PolarHBondContact O-N 3.27Å; L148-S152 PolarHBondContact O-N 3.2Å; L148-S152 PolarHBondContact O-OG 3.16Å; L148-Y186 VanDerWaalsContact CD1-CB 3.43Å; L148-Y186 HydrophobicContact CD1-CD1 3.8Å; L148-Y186 HydrophobicContact CD1-CD2 4.18Å; L148-Y186 HydrophobicContact CD1-CG 3.53Å; L148-M203 HydrophobicContact CD2-SD 4.36Å; L148-V208 HydrophobicContact CB-CG1 4.24Å; L148-V208 HydrophobicContact CD2-CG1 4.1Å; L148-V208 HydrophobicContact CD2-CG2 4.16Å; L148-V208 HydrophobicContact CG-CG2 4.42Å; L148-L211 HydrophobicContact CD2-CD1 3.77Å
149	E	91	Very high	93	Very high	15 Å²	15	22.6 Å²	22.6	7%	0.07	13%	0.131	C	C	.	.	H	α-helix	trans	-65.2	-39.2	-178.8	-166	67	-168.9	0	0	112.2	L115 N147 I151 S152 R153 Y202 S205 V208	L115-E149 HydrophobicContact CD1-CG 3.83Å; L115-E149 HydrophobicContact CD2-CG 3.59Å; L115-E149 HydrophobicContact CG-CG 4.37Å; N147-E149 VanDerWaalsContact C-N 3.28Å; N147-E149 PolarHBondContact O-N 2.98Å; N147-E149 WeakPolarHBondContact OD1-CB 3.44Å; N147-E149 PolarHBondContact OD1-N 3.1Å; N147-E149 VanDerWaalsContact OD1-N 3.13Å; E149-I151 VanDerWaalsContact C-N 3.34Å; E149-S152 PolarHBondContact O-OG 3.2Å; E149-R153 WeakPolarHBondContact O-CB 3.39Å; E149-R153 WeakPolarHBondContact O-CG 3.38Å; E149-R153 PolarHBondContact O-N 3.39Å; E149-R153 VanDerWaalsContact O-N 3.09Å; E149-Y202 PolarHBondContact OE1-OH 3.23Å; E149-S205 VanDerWaalsContact CD-N 3.27Å; E149-S205 PolarHBondContact OE1-N 3.18Å; E149-S205 WeakPolarHBondContact OE2-CA 3.24Å; E149-S205 PolarHBondContact OE2-N 3.18Å; E149-V208 WeakPolarHBondContact OE2-CG2 3.41Å
150	L	92.5	Very high	92.8	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-67	-38.3	174.6	-70.9	177.1	0	0	0	111.6	L115 L118 A142 N147 L148 L154	L115-L150 HydrophobicContact CB-CD2 4.2Å; L115-L150 HydrophobicContact CD1-CD2 3.79Å; L118-L150 HydrophobicContact CB-CD2 4.02Å; L118-L150 HydrophobicContact CD1-CD2 3.77Å; L118-L150 HydrophobicContact CD2-CD2 4.32Å; L118-L150 HydrophobicContact CG-CD2 4.25Å; A142-L150 HydrophobicContact CB-CB 3.84Å; A142-L150 HydrophobicContact CB-CD1 4.39Å; N147-L150 HydrophobicContact CB-CB 4.26Å; N147-L150 HydrophobicContact CB-CD1 3.92Å; N147-L150 HydrophobicContact CB-CG 4.14Å; N147-L150 PolarHBondContact O-N 3.07Å; N147-L150 PolarHBondContact OD1-N 3.41Å; L148-L150 PolarHBondContact O-N 3.24Å; L150-L154 WeakPolarHBondContact O-CB 3.42Å; L150-L154 WeakPolarHBondContact O-CD1 3.49Å; L150-L154 VanDerWaalsContact O-CG 3.29Å; L150-L154 WeakPolarHBondContact O-CG 3.3Å; L150-L154 PolarHBondContact O-N 3.16Å
151	I	94	Very high	92.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-66.3	-47.6	178.5	-64.3	164.9	0	0	0	109.8	A142 A143 N147 L148 E149 R153 L154 V155 C183 Y186 L187	A142-I151 HydrophobicContact CB-CG1 3.73Å; A143-I151 HydrophobicContact CB-CD1 4.37Å; N147-I151 WeakPolarHBondContact O-CG1 3.47Å; N147-I151 PolarHBondContact O-N 2.93Å; L148-I151 PolarHBondContact O-N 3.27Å; E149-I151 VanDerWaalsContact C-N 3.34Å; I151-R153 VanDerWaalsContact C-N 3.29Å; I151-R153 PolarHBondContact O-N 3.33Å; I151-L154 PolarHBondContact O-N 3.06Å; I151-V155 HydrophobicContact CG2-CG2 4.32Å; I151-V155 WeakPolarHBondContact O-CB 3.3Å; I151-V155 VanDerWaalsContact O-CG2 3.26Å; I151-V155 WeakPolarHBondContact O-CG2 3.34Å; I151-V155 PolarHBondContact O-N 2.78Å; I151-C183 HydrophobicContact CD1-CB 3.75Å; I151-Y186 HydrophobicContact CG2-CD1 3.85Å; I151-Y186 HydrophobicContact CG2-CE1 3.93Å; I151-L187 HydrophobicContact CD1-CD1 4.12Å; I151-L187 HydrophobicContact CD1-CG 4.47Å; I151-L187 HydrophobicContact CG2-CD2 3.46Å; I151-L187 VanDerWaalsContact CG2-CD2 3.46Å; I151-L187 HydrophobicContact CG2-CG 3.89Å
152	S	91.2	Very high	92.5	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-60.9	-40.2	180	68.7	0	0	0	0	111.3	L148 E149 V155 A156 Y186 Y202 M203	L148-S152 PolarHBondContact O-N 3.2Å; L148-S152 PolarHBondContact O-OG 3.16Å; E149-S152 PolarHBondContact O-OG 3.2Å; S152-V155 PolarHBondContact O-N 2.92Å; S152-A156 WeakPolarHBondContact O-CB 3.26Å; S152-A156 PolarHBondContact O-N 3.17Å; S152-Y186 WeakPolarHBondContact CA-OH 3.27Å; S152-Y202 WeakPolarHBondContact OG-CE2 3.39Å; S152-M203 PolarHBondContact OG-O 2.82Å
153	R	91.8	Very high	92.5	Very high	58 Å²	58	27.7 Å²	27.7	22%	0.219	16%	0.163	C	C	.	.	H	α-helix	trans	-61.6	-51.2	172.5	-80.9	-59.5	-157.7	-148.3	1.4	113.2	L115 L118 D119 E149 I151 V155 A156 F157 Y202	L115-R153 HydrophobicContact CD1-CG 3.81Å; L118-R153 HydrophobicContact CD2-CB 3.7Å; L118-R153 HydrophobicContact CD2-CG 4.46Å; D119-R153 VanDerWaalsContact OD1-CD 3.26Å; D119-R153 WeakPolarHBondContact OD1-CD 3.27Å; D119-R153 WeakPolarHBondContact OD1-CG 3.3Å; D119-R153 IonicContact OD1-NE 3.07Å; D119-R153 PolarHBondContact OD1-NE 3.45Å; D119-R153 VanDerWaalsContact OD1-NE 3.1Å; D119-R153 IonicContact OD2-CZ 2.92Å; D119-R153 IonicContact OD2-NE 2.68Å; D119-R153 PolarHBondContact OD2-NE 2.98Å; D119-R153 VanDerWaalsContact OD2-NE 3.07Å; D119-R153 IonicContact OD2-NH2 3.38Å; D119-R153 PolarHBondContact OD2-NH2 2.76Å; E149-R153 WeakPolarHBondContact O-CB 3.39Å; E149-R153 WeakPolarHBondContact O-CG 3.38Å; E149-R153 PolarHBondContact O-N 3.39Å; E149-R153 VanDerWaalsContact O-N 3.09Å; I151-R153 VanDerWaalsContact C-N 3.29Å; I151-R153 PolarHBondContact O-N 3.33Å; R153-V155 PolarHBondContact O-N 3.37Å; R153-A156 WeakPolarHBondContact O-CB 3.37Å; R153-A156 PolarHBondContact O-N 3.34Å; R153-A156 VanDerWaalsContact O-N 3.11Å; R153-F157 WeakPolarHBondContact O-CD2 3.27Å; R153-F157 PolarHBondContact O-N 2.83Å; R153-F157 VanDerWaalsContact O-N 3.08Å; R153-Y202 VanDerWaalsContact CD-CE2 3.48Å; R153-Y202 HydrophobicContact CG-CE2 3.84Å; R153-Y202 VanDerWaalsContact CZ-CZ 3.49Å; R153-Y202 PolarHBondContact NE-OH 3.35Å; R153-Y202 VanDerWaalsContact NH1-CE1 3.3Å; R153-Y202 PolarHBondContact NH1-OH 3.48Å
154	L	93.3	Very high	92.5	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-57.2	-41.6	179.1	-76.5	165.1	0	0	0	111.8	L106 L118 L122 A138 A139 A142 L150 I151 F157 G158 C159	L106-L154 HydrophobicContact CD1-CD2 4.42Å; L106-L154 HydrophobicContact CD2-CD2 4.34Å; L118-L154 HydrophobicContact CD1-CD1 4.15Å; L118-L154 HydrophobicContact CD1-CD2 4.02Å; L118-L154 HydrophobicContact CD1-CG 3.94Å; L118-L154 HydrophobicContact CD2-CG 4.48Å; L122-L154 HydrophobicContact CD1-CD2 4.25Å; L122-L154 HydrophobicContact CD2-CD2 4.41Å; A138-L154 HydrophobicContact CB-CD1 3.78Å; A138-L154 HydrophobicContact CB-CD2 3.72Å; A138-L154 HydrophobicContact CB-CG 4.44Å; A139-L154 HydrophobicContact CB-CD1 4.22Å; A142-L154 HydrophobicContact CB-CD1 4.3Å; L150-L154 WeakPolarHBondContact O-CB 3.42Å; L150-L154 WeakPolarHBondContact O-CD1 3.49Å; L150-L154 VanDerWaalsContact O-CG 3.29Å; L150-L154 WeakPolarHBondContact O-CG 3.3Å; L150-L154 PolarHBondContact O-N 3.16Å; I151-L154 PolarHBondContact O-N 3.06Å; L154-F157 CarbonylContact O-C 3.54Å; L154-F157 PolarHBondContact O-N 2.94Å; L154-G158 PolarHBondContact O-N 3.5Å; L154-C159 HydrophobicContact CB-CB 3.97Å; L154-C159 WeakPolarHBondContact O-CB 3.45Å; L154-C159 PolarHBondContact O-N 3.16Å
155	V	92	Very high	92.5	Very high	6 Å²	6	28 Å²	28	4%	0.036	17%	0.174	C	C	.	.	H	α-helix	trans	-66	-40.1	177.3	173.4	0	0	0	0	111.8	I151 S152 R153 F157 G158 L161 Y186 A190 P200	I151-V155 HydrophobicContact CG2-CG2 4.32Å; I151-V155 WeakPolarHBondContact O-CB 3.3Å; I151-V155 VanDerWaalsContact O-CG2 3.26Å; I151-V155 WeakPolarHBondContact O-CG2 3.34Å; I151-V155 PolarHBondContact O-N 2.78Å; S152-V155 PolarHBondContact O-N 2.92Å; R153-V155 PolarHBondContact O-N 3.37Å; V155-F157 PolarHBondContact O-N 3.04Å; V155-G158 PolarHBondContact O-N 3.11Å; V155-L161 HydrophobicContact CG2-CD1 3.79Å; V155-L161 HydrophobicContact CG2-CD2 3.81Å; V155-L161 HydrophobicContact CG2-CG 4.05Å; V155-Y186 HydrophobicContact CG2-CE1 4.3Å; V155-A190 HydrophobicContact CG1-CB 4.37Å; V155-P200 HydrophobicContact CG1-CB 3.5Å; V155-P200 VanDerWaalsContact CG1-CB 3.5Å; V155-P200 HydrophobicContact CG1-CG 3.38Å
156	A	89.5	Confident	92.7	Very high	56 Å²	56	30.9 Å²	30.9	46%	0.463	19%	0.194	S	C	.	.	H	α-helix	trans	-61.8	-30.7	174.8	0	0	0	0	0	112.8	S152 R153 G158 Y202	S152-A156 WeakPolarHBondContact O-CB 3.26Å; S152-A156 PolarHBondContact O-N 3.17Å; R153-A156 WeakPolarHBondContact O-CB 3.37Å; R153-A156 PolarHBondContact O-N 3.34Å; R153-A156 VanDerWaalsContact O-N 3.11Å; A156-G158 VanDerWaalsContact C-N 3.29Å; A156-G158 PolarHBondContact O-N 3.41Å; A156-Y202 HydrophobicContact CB-CD2 4.09Å; A156-Y202 HydrophobicContact CB-CG 4.42Å
157	F	89.8	Confident	92.8	Very high	60 Å²	60	33 Å²	33	26%	0.263	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	13.9	173.2	-80.4	-89.7	0	0	0	114	L122 V123 R153 L154 V155 M232	L122-F157 HydrophobicContact CB-CD1 3.67Å; L122-F157 HydrophobicContact CB-CD2 3.99Å; L122-F157 HydrophobicContact CB-CE1 3.66Å; L122-F157 HydrophobicContact CB-CE2 3.99Å; L122-F157 HydrophobicContact CB-CG 3.81Å; L122-F157 HydrophobicContact CB-CZ 3.83Å; L122-F157 HydrophobicContact CD1-CB 4.02Å; L122-F157 HydrophobicContact CD1-CD1 4.49Å; L122-F157 HydrophobicContact CD1-CD2 3.49Å; L122-F157 VanDerWaalsContact CD1-CD2 3.49Å; L122-F157 HydrophobicContact CD1-CE2 3.98Å; L122-F157 HydrophobicContact CD1-CG 3.77Å; L122-F157 HydrophobicContact CD2-CB 4.09Å; L122-F157 HydrophobicContact CD2-CG 4.29Å; L122-F157 HydrophobicContact CG-CB 4.44Å; L122-F157 HydrophobicContact CG-CD1 4.46Å; L122-F157 HydrophobicContact CG-CD2 4.28Å; L122-F157 HydrophobicContact CG-CG 4.17Å; V123-F157 HydrophobicContact CG2-CE1 4.3Å; V123-F157 HydrophobicContact CG2-CZ 3.93Å; R153-F157 WeakPolarHBondContact O-CD2 3.27Å; R153-F157 PolarHBondContact O-N 2.83Å; R153-F157 VanDerWaalsContact O-N 3.08Å; L154-F157 CarbonylContact O-C 3.54Å; L154-F157 PolarHBondContact O-N 2.94Å; V155-F157 PolarHBondContact O-N 3.04Å; F157-M232 HydrophobicContact CE1-CE 3.58Å; F157-M232 HydrophobicContact CZ-CE 3.73Å
158	G	88.7	Confident	93	Very high	47 Å²	47	33.2 Å²	33.2	49%	0.485	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	82	26.6	172.6	0	0	0	0	0	115.2	N129 L154 V155 A156 D160	N129-G158 PolarHBondContact ND2-O 3.01Å; L154-G158 PolarHBondContact O-N 3.5Å; V155-G158 PolarHBondContact O-N 3.11Å; A156-G158 VanDerWaalsContact C-N 3.29Å; A156-G158 PolarHBondContact O-N 3.41Å; G158-D160 PolarHBondContact O-N 2.99Å
159	C	92.9	Very high	93.2	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	24%	0.237	C	C	.	.			trans	-65.2	123.6	172.2	-170.8	0	0	0	0	111.3	A128 N129 L154 L161 Q194	A128-C159 HydrophobicContact CB-CB 4.1Å; A128-C159 PolarHBondContact O-SG 3.47Å; N129-C159 WeakPolarHBondContact OD1-CA 3.48Å; L154-C159 HydrophobicContact CB-CB 3.97Å; L154-C159 WeakPolarHBondContact O-CB 3.45Å; L154-C159 PolarHBondContact O-N 3.16Å; C159-L161 PolarHBondContact O-N 3.36Å; C159-Q194 PolarHBondContact O-NE2 3.14Å
160	D	93	Very high	93.5	Very high	53 Å²	53	37.3 Å²	37.3	28%	0.283	24%	0.237	S	C	.	.			trans	-73.4	110.6	176.5	169.6	32.3	0	0	0	111.1	N129 G158 S162 T163	N129-D160 WeakPolarHBondContact OD1-CB 2.98Å; N129-D160 PolarHBondContact OD1-N 3.2Å; G158-D160 PolarHBondContact O-N 2.99Å; D160-S162 VanDerWaalsContact C-N 3.28Å; D160-S162 VanDerWaalsContact CG-OG 3.25Å; D160-S162 PolarHBondContact O-N 3.44Å; D160-S162 VanDerWaalsContact OD1-CB 3.26Å; D160-S162 WeakPolarHBondContact OD1-CB 3.29Å; D160-S162 PolarHBondContact OD1-N 3.35Å; D160-S162 PolarHBondContact OD1-OG 2.62Å; D160-S162 PolarHBondContact OD2-OG 3.31Å; D160-S162 VanDerWaalsContact OD2-OG 3.13Å; D160-T163 PolarHBondContact OD2-N 3.38Å; D160-T163 PolarHBondContact OD2-OG1 3.14Å
161	L	93.9	Very high	93.7	Very high	5 Å²	5	37.4 Å²	37.4	3%	0.026	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-6.4	179.5	-58	179.4	0	0	0	113.2	A139 V155 C159 T163 L187 A190 Q191 Q194	A139-L161 HydrophobicContact CB-CD2 4.23Å; V155-L161 HydrophobicContact CG2-CD1 3.79Å; V155-L161 HydrophobicContact CG2-CD2 3.81Å; V155-L161 HydrophobicContact CG2-CG 4.05Å; C159-L161 PolarHBondContact O-N 3.36Å; L161-T163 VanDerWaalsContact C-N 3.32Å; L161-L187 HydrophobicContact CD1-CD2 3.9Å; L161-L187 HydrophobicContact CD2-CD2 3.57Å; L161-L187 HydrophobicContact CG-CD2 4.31Å; L161-A190 HydrophobicContact CD1-CB 3.44Å; L161-A190 VanDerWaalsContact CD1-CB 3.44Å; L161-Q191 HydrophobicContact CB-CB 4.24Å; L161-Q191 HydrophobicContact CB-CG 4.39Å; L161-Q191 HydrophobicContact CD1-CB 4.46Å; L161-Q194 VanDerWaalsContact CB-OE1 3.24Å
162	S	93.1	Very high	93.8	Very high	59 Å²	59	39.7 Å²	39.7	41%	0.413	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-14.5	175.3	78.5	0	0	0	0	113.2	D160 V164	D160-S162 VanDerWaalsContact C-N 3.28Å; D160-S162 VanDerWaalsContact CG-OG 3.25Å; D160-S162 PolarHBondContact O-N 3.44Å; D160-S162 VanDerWaalsContact OD1-CB 3.26Å; D160-S162 WeakPolarHBondContact OD1-CB 3.29Å; D160-S162 PolarHBondContact OD1-N 3.35Å; D160-S162 PolarHBondContact OD1-OG 2.62Å; D160-S162 PolarHBondContact OD2-OG 3.31Å; D160-S162 VanDerWaalsContact OD2-OG 3.13Å; S162-V164 PolarHBondContact O-N 2.86Å
163	T	94.2	Very high	94	Very high	5 Å²	5	42.2 Å²	42.2	3%	0.031	26%	0.262	C	S	.	.			trans	-60.9	130.2	178.1	-75.9	0	0	0	0	111.1	R131 T137 H140 D160 L161	R131-T163 VanDerWaalsContact NE-CG2 3.27Å; R131-T163 VanDerWaalsContact NH2-CG2 3.33Å; R131-T163 PolarHBondContact NH2-OG1 3.32Å; T137-T163 HydrophobicContact CG2-CG2 3.68Å; H140-T163 PolarHBondContact CE1-O 2.86Å; H140-T163 PolarHBondContact NE2-O 3.37Å; D160-T163 PolarHBondContact OD2-N 3.38Å; D160-T163 PolarHBondContact OD2-OG1 3.14Å; L161-T163 VanDerWaalsContact C-N 3.32Å
164	V	96.2	Very high	94.2	Very high	74 Å²	74	39.7 Å²	39.7	45%	0.448	25%	0.252	S	S	.	.			trans	-104.9	143.2	174.6	-64.7	0	0	0	0	110.9	S162 Y169 T170	S162-V164 PolarHBondContact O-N 2.86Å; V164-Y169 WeakPolarHBondContact CA-O 3.28Å; V164-T170 HydrophobicContact CG1-CG2 3.72Å
165	N	96.1	Very high	94.4	Very high	15 Å²	15	39.7 Å²	39.7	8%	0.08	25%	0.252	C	S	.	.			trans	-76.5	178.7	171.5	75.2	6.7	0	0	0	111.9	L134 E136 A167 G168 Y169	L134-N165 WeakPolarHBondContact O-CB 3.18Å; E136-N165 HydrophobicContact CG-CB 3.64Å; E136-N165 PolarHBondContact OE1-ND2 3.18Å; E136-N165 VanDerWaalsContact OE1-ND2 3.09Å; N165-A167 PolarHBondContact O-N 3.23Å; N165-A167 VanDerWaalsContact O-N 3.14Å; N165-A167 WeakPolarHBondContact OD1-CA 3.17Å; N165-A167 WeakPolarHBondContact OD1-CB 3.37Å; N165-A167 PolarHBondContact OD1-N 3.06Å; N165-G168 PolarHBondContact O-N 2.94Å; N165-G168 PolarHBondContact OD1-N 3.42Å; N165-Y169 PolarHBondContact N-O 3.35Å; N165-Y169 PolarHBondContact OD1-N 2.94Å; N165-Y169 PolarHBondContact OD1-O 2.99Å
166	V	96.1	Very high	94.6	Very high	117 Å²	117	42.9 Å²	42.9	71%	0.709	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-25.1	-179.6	168.8	0	0	0	0	112.9	L134 G168	L134-V166 VanDerWaalsContact C-CG2 3.44Å; L134-V166 WeakPolarHBondContact O-CB 3.4Å; L134-V166 VanDerWaalsContact O-CG2 3.28Å; L134-V166 WeakPolarHBondContact O-CG2 3.41Å; L134-V166 PolarHBondContact O-N 2.87Å; V166-G168 VanDerWaalsContact C-N 3.3Å
167	A	95.6	Very high	94.9	Very high	69 Å²	69	45.1 Å²	45.1	57%	0.57	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	1.1	175.7	0	0	0	0	0	113.4	N165 Y169	N165-A167 PolarHBondContact O-N 3.23Å; N165-A167 VanDerWaalsContact O-N 3.14Å; N165-A167 WeakPolarHBondContact OD1-CA 3.17Å; N165-A167 WeakPolarHBondContact OD1-CB 3.37Å; N165-A167 PolarHBondContact OD1-N 3.06Å; A167-Y169 HydrophobicContact CB-CD2 3.57Å; A167-Y169 HydrophobicContact CB-CE2 3.76Å
168	G	96	Very high	95.2	Very high	47 Å²	47	47.9 Å²	47.9	49%	0.485	29%	0.286	S	S	.	.	S	Bend	trans	81.5	15.6	179.6	0	0	0	0	0	114.4	N165 V166	N165-G168 PolarHBondContact O-N 2.94Å; N165-G168 PolarHBondContact OD1-N 3.42Å; V166-G168 VanDerWaalsContact C-N 3.3Å
169	Y	96.7	Very high	95.5	Very high	100 Å²	100	48.5 Å²	48.5	39%	0.392	29%	0.293	S	S	.	.			trans	-99.7	135.8	-179.7	-63.5	-59.8	0	0	0	111.3	H140 V164 N165 A167 D173 M177	H140-Y169 PolarHBondContact NE2-O 2.97Å; V164-Y169 WeakPolarHBondContact CA-O 3.28Å; N165-Y169 PolarHBondContact N-O 3.35Å; N165-Y169 PolarHBondContact OD1-N 2.94Å; N165-Y169 PolarHBondContact OD1-O 2.99Å; A167-Y169 HydrophobicContact CB-CD2 3.57Å; A167-Y169 HydrophobicContact CB-CE2 3.76Å; Y169-D173 HydrophobicContact CD1-CB 3.7Å; Y169-D173 HydrophobicContact CG-CB 4.21Å; Y169-M177 HydrophobicContact CD1-CE 3.62Å; Y169-M177 HydrophobicContact CD1-SD 4.21Å; Y169-M177 HydrophobicContact CD2-CE 3.62Å; Y169-M177 HydrophobicContact CD2-SD 4.42Å; Y169-M177 HydrophobicContact CE1-CE 3.89Å; Y169-M177 HydrophobicContact CE1-SD 3.86Å; Y169-M177 HydrophobicContact CE2-CE 3.9Å; Y169-M177 HydrophobicContact CE2-SD 4.09Å; Y169-M177 HydrophobicContact CG-CE 3.47Å; Y169-M177 VanDerWaalsContact CG-CE 3.47Å; Y169-M177 HydrophobicContact CG-SD 4.48Å
170	T	96.6	Very high	95.6	Very high	13 Å²	13	51.3 Å²	51.3	8%	0.08	31%	0.305	C	S	.	.			trans	-80	171.7	167.3	63.7	0	0	0	0	111.2	V164 F172 D173 V174	V164-T170 HydrophobicContact CG1-CG2 3.72Å; T170-F172 PolarHBondContact O-N 3.14Å; T170-F172 PolarHBondContact OG1-N 2.84Å; T170-D173 WeakPolarHBondContact CB-OD2 3.44Å; T170-D173 PolarHBondContact N-OD2 3.34Å; T170-D173 PolarHBondContact O-N 2.74Å; T170-D173 VanDerWaalsContact O-N 3.17Å; T170-D173 VanDerWaalsContact OG1-CG 3.28Å; T170-D173 PolarHBondContact OG1-N 3.02Å; T170-D173 PolarHBondContact OG1-OD2 2.94Å; T170-V174 WeakPolarHBondContact O-CG2 3.49Å; T170-V174 PolarHBondContact O-N 3.07Å
171	A	96	Very high	95.6	Very high	2 Å²	2	52.4 Å²	52.4	2%	0.017	32%	0.322	C	S	.	.	H	α-helix	trans	-57.3	-36.2	170.9	0	0	0	0	0	111.9	A139 H140 A143 V174 A175 L187	A139-A171 HydrophobicContact CB-CB 4.09Å; H140-A171 PolarHBondContact NE2-N 3.38Å; A143-A171 HydrophobicContact CB-CB 4.28Å; A143-A171 VanDerWaalsContact CB-O 3.25Å; A143-A171 WeakPolarHBondContact CB-O 3.46Å; A171-V174 PolarHBondContact O-N 3.27Å; A171-A175 PolarHBondContact O-N 2.9Å; A171-L187 HydrophobicContact CB-CD1 4.18Å; A171-L187 HydrophobicContact CB-CD2 4.11Å; A171-L187 WeakPolarHBondContact O-CD1 3.26Å
172	F	96.3	Very high	95.4	Very high	48 Å²	48	54.2 Å²	54.2	21%	0.211	34%	0.342	C	S	.	.	H	α-helix	trans	-61.5	-46.3	175.5	167.7	-99	0	0	0	111.8	T170 V174 A175 T176 A184 L187 Q188	T170-F172 PolarHBondContact O-N 3.14Å; T170-F172 PolarHBondContact OG1-N 2.84Å; F172-V174 VanDerWaalsContact C-N 3.31Å; F172-V174 PolarHBondContact O-N 3.33Å; F172-A175 PolarHBondContact O-N 3.24Å; F172-T176 WeakPolarHBondContact O-CB 3.16Å; F172-T176 PolarHBondContact O-N 3.49Å; F172-T176 PolarHBondContact O-OG1 3.34Å; F172-A184 HydrophobicContact CD2-CB 4.15Å; F172-A184 WeakPolarHBondContact CD2-O 3.29Å; F172-A184 HydrophobicContact CE2-CB 3.92Å; F172-A184 WeakPolarHBondContact CE2-O 3.46Å; F172-L187 HydrophobicContact CB-CB 4.09Å; F172-L187 HydrophobicContact CD2-CB 4.31Å; F172-Q188 HydrophobicContact CD2-CB 3.86Å; F172-Q188 HydrophobicContact CE2-CB 3.72Å; F172-Q188 HydrophobicContact CE2-CG 4.27Å
173	D	96.8	Very high	95.5	Very high	53 Å²	53	51.6 Å²	51.6	28%	0.283	32%	0.323	S	S	.	.	H	α-helix	trans	-63.6	-40.1	178.8	-59.2	-52	0	0	0	111	Y169 T170 T176 M177	Y169-D173 HydrophobicContact CD1-CB 3.7Å; Y169-D173 HydrophobicContact CG-CB 4.21Å; T170-D173 WeakPolarHBondContact CB-OD2 3.44Å; T170-D173 PolarHBondContact N-OD2 3.34Å; T170-D173 PolarHBondContact O-N 2.74Å; T170-D173 VanDerWaalsContact O-N 3.17Å; T170-D173 VanDerWaalsContact OG1-CG 3.28Å; T170-D173 PolarHBondContact OG1-N 3.02Å; T170-D173 PolarHBondContact OG1-OD2 2.94Å; D173-T176 PolarHBondContact O-N 2.65Å; D173-M177 HydrophobicContact CB-CE 4.4Å; D173-M177 WeakPolarHBondContact O-CB 3.04Å; D173-M177 WeakPolarHBondContact O-CE 3.38Å; D173-M177 VanDerWaalsContact O-CG 3.28Å; D173-M177 WeakPolarHBondContact O-CG 3.43Å; D173-M177 PolarHBondContact O-N 3.17Å
174	V	96.5	Very high	95.5	Very high	4 Å²	4	51.8 Å²	51.8	2%	0.024	33%	0.326	C	S	.	.	H	α-helix	trans	-62.5	-45.4	175.6	176.2	0	0	0	0	111.6	A143 R144 T170 A171 F172 T176 M177 K178	A143-V174 HydrophobicContact CB-CB 4.32Å; A143-V174 HydrophobicContact CB-CG1 4.26Å; R144-V174 HydrophobicContact CB-CG1 3.84Å; T170-V174 WeakPolarHBondContact O-CG2 3.49Å; T170-V174 PolarHBondContact O-N 3.07Å; A171-V174 PolarHBondContact O-N 3.27Å; F172-V174 VanDerWaalsContact C-N 3.31Å; F172-V174 PolarHBondContact O-N 3.33Å; V174-T176 VanDerWaalsContact C-N 3.33Å; V174-T176 PolarHBondContact O-N 2.96Å; V174-M177 HydrophobicContact CG2-CE 4.27Å; V174-M177 PolarHBondContact O-N 3.5Å; V174-K178 WeakPolarHBondContact O-CB 3.24Å; V174-K178 VanDerWaalsContact O-CG 3.28Å; V174-K178 WeakPolarHBondContact O-CG 3.26Å; V174-K178 PolarHBondContact O-N 3.37Å; V174-K178 VanDerWaalsContact O-N 3.1Å
175	A	96.2	Very high	95.3	Very high	0 Å²	0	51 Å²	51	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-61.3	-43.1	176.3	0	0	0	0	0	111.6	A143 A171 F172 K178 G179 H180 C183 A184 L187	A143-A175 HydrophobicContact CB-CB 4.04Å; A171-A175 PolarHBondContact O-N 2.9Å; F172-A175 PolarHBondContact O-N 3.24Å; A175-K178 PolarHBondContact O-N 2.92Å; A175-G179 PolarHBondContact O-N 2.75Å; A175-G179 VanDerWaalsContact O-N 3.14Å; A175-H180 PolarHBondContact O-N 3.45Å; A175-C183 HydrophobicContact CB-CB 4.04Å; A175-A184 HydrophobicContact CB-CB 4.11Å; A175-L187 HydrophobicContact CB-CD1 3.87Å
176	T	96.5	Very high	95.2	Very high	73 Å²	73	50.7 Å²	50.7	45%	0.448	32%	0.324	S	S	.	.	H	α-helix	trans	-64.3	-47.8	179.2	-58	0	0	0	0	111.5	F172 D173 V174 K178 G179	F172-T176 WeakPolarHBondContact O-CB 3.16Å; F172-T176 PolarHBondContact O-N 3.49Å; F172-T176 PolarHBondContact O-OG1 3.34Å; D173-T176 PolarHBondContact O-N 2.65Å; V174-T176 VanDerWaalsContact C-N 3.33Å; V174-T176 PolarHBondContact O-N 2.96Å; T176-K178 PolarHBondContact O-N 2.88Å; T176-G179 PolarHBondContact O-N 3.32Å; T176-G179 VanDerWaalsContact O-N 3.08Å
177	M	95.9	Very high	95.1	Very high	103 Å²	103	45.1 Å²	45.1	51%	0.507	29%	0.291	S	S	.	.	H	α-helix	trans	-62.8	-28	177.3	-74.8	-172.2	-70.7	0	0	113.1	Y169 D173 V174	Y169-M177 HydrophobicContact CD1-CE 3.62Å; Y169-M177 HydrophobicContact CD1-SD 4.21Å; Y169-M177 HydrophobicContact CD2-CE 3.62Å; Y169-M177 HydrophobicContact CD2-SD 4.42Å; Y169-M177 HydrophobicContact CE1-CE 3.89Å; Y169-M177 HydrophobicContact CE1-SD 3.86Å; Y169-M177 HydrophobicContact CE2-CE 3.9Å; Y169-M177 HydrophobicContact CE2-SD 4.09Å; Y169-M177 HydrophobicContact CG-CE 3.47Å; Y169-M177 VanDerWaalsContact CG-CE 3.47Å; Y169-M177 HydrophobicContact CG-SD 4.48Å; D173-M177 HydrophobicContact CB-CE 4.4Å; D173-M177 WeakPolarHBondContact O-CB 3.04Å; D173-M177 WeakPolarHBondContact O-CE 3.38Å; D173-M177 VanDerWaalsContact O-CG 3.28Å; D173-M177 WeakPolarHBondContact O-CG 3.43Å; D173-M177 PolarHBondContact O-N 3.17Å; V174-M177 HydrophobicContact CG2-CE 4.27Å; V174-M177 PolarHBondContact O-N 3.5Å
178	K	95.8	Very high	94.9	Very high	119 Å²	119	47.5 Å²	47.5	52%	0.517	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-2.4	177.2	-64	-61.8	176.1	-172	0	113.9	R144 V174 A175 T176	R144-K178 HydrophobicContact CG-CG 4.37Å; V174-K178 WeakPolarHBondContact O-CB 3.24Å; V174-K178 VanDerWaalsContact O-CG 3.28Å; V174-K178 WeakPolarHBondContact O-CG 3.26Å; V174-K178 PolarHBondContact O-N 3.37Å; V174-K178 VanDerWaalsContact O-N 3.1Å; A175-K178 PolarHBondContact O-N 2.92Å; T176-K178 PolarHBondContact O-N 2.88Å
179	G	94.6	Very high	94.7	Very high	60 Å²	60	49.9 Å²	49.9	62%	0.619	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.2	15.7	177.1	0	0	0	0	0	114.4	A175 T176 A181	A175-G179 PolarHBondContact O-N 2.75Å; A175-G179 VanDerWaalsContact O-N 3.14Å; T176-G179 PolarHBondContact O-N 3.32Å; T176-G179 VanDerWaalsContact O-N 3.08Å; G179-A181 VanDerWaalsContact C-N 3.34Å; G179-A181 PolarHBondContact O-N 3.03Å
180	H	95.6	Very high	94.4	Very high	58 Å²	58	45.2 Å²	45.2	27%	0.269	27%	0.27	S	S	.	.			trans	-86.3	73.3	-178.7	-63.7	-54.4	0	0	0	111	A143 R144 I145 G146 A175 G182 C183 A184	A143-H180 PolarHBondContact O-CD2 3.08Å; A143-H180 VanDerWaalsContact O-CD2 3.27Å; R144-H180 PolarHBondContact O-NE2 2.94Å; I145-H180 VanDerWaalsContact C-NE2 3.32Å; I145-H180 PolarHBondContact O-CE1 3.28Å; I145-H180 PolarHBondContact O-NE2 3.14Å; G146-H180 WeakPolarHBondContact CA-CD2 3.4Å; G146-H180 PolarHBondContact N-CD2 2.93Å; G146-H180 PolarHBondContact N-NE2 2.97Å; A175-H180 PolarHBondContact O-N 3.45Å; H180-G182 VanDerWaalsContact C-N 3.34Å; H180-G182 PolarHBondContact O-N 2.81Å; H180-C183 HydrophobicContact CB-CB 3.99Å; H180-C183 WeakPolarHBondContact O-CB 3.41Å; H180-C183 PolarHBondContact O-N 3.01Å; H180-C183 VanDerWaalsContact O-N 3.09Å; H180-A184 PolarHBondContact O-N 2.89Å
181	A	92.5	Very high	94.1	Very high	77 Å²	77	46.9 Å²	46.9	64%	0.636	28%	0.277	S	S	*	.	H	α-helix	trans	-54.7	-43	-172	0	0	0	0	0	113.9	G179 C183 A184 A185	G179-A181 VanDerWaalsContact C-N 3.34Å; G179-A181 PolarHBondContact O-N 3.03Å; A181-C183 PolarHBondContact O-N 2.97Å; A181-A184 PolarHBondContact O-N 3.13Å; A181-A185 WeakPolarHBondContact O-CB 3.42Å; A181-A185 PolarHBondContact O-N 3.43Å
182	G	91.2	Very high	93.8	Very high	42 Å²	42	51.9 Å²	51.9	43%	0.433	30%	0.3	S	S	.	.	H	α-helix	trans	-64.2	-39.7	177.7	0	0	0	0	0	113.2	H180 Y186	H180-G182 VanDerWaalsContact C-N 3.34Å; H180-G182 PolarHBondContact O-N 2.81Å; G182-Y186 PolarHBondContact O-N 3.31Å; G182-Y186 VanDerWaalsContact O-N 3.14Å
183	C	93.4	Very high	93.4	Very high	5 Å²	5	51.2 Å²	51.2	3%	0.034	30%	0.299	C	S	.	.	H	α-helix	trans	-67.6	-42	174.6	-67.5	0	0	0	0	111.7	G146 I151 A175 H180 A181 Y186 L187	G146-C183 PolarHBondContact O-SG 3.36Å; I151-C183 HydrophobicContact CD1-CB 3.75Å; A175-C183 HydrophobicContact CB-CB 4.04Å; H180-C183 HydrophobicContact CB-CB 3.99Å; H180-C183 WeakPolarHBondContact O-CB 3.41Å; H180-C183 PolarHBondContact O-N 3.01Å; H180-C183 VanDerWaalsContact O-N 3.09Å; A181-C183 PolarHBondContact O-N 2.97Å; C183-Y186 PolarHBondContact O-N 3.36Å; C183-L187 VanDerWaalsContact O-CB 3.29Å; C183-L187 WeakPolarHBondContact O-CB 3.2Å; C183-L187 WeakPolarHBondContact O-CD1 3.38Å; C183-L187 VanDerWaalsContact O-CG 3.23Å; C183-L187 WeakPolarHBondContact O-CG 3.37Å; C183-L187 PolarHBondContact O-N 3.47Å
184	A	94.6	Very high	93	Very high	9 Å²	9	51 Å²	51	7%	0.074	30%	0.296	C	S	.	.	H	α-helix	trans	-63.1	-44.9	177.8	0	0	0	0	0	111.4	F172 A175 H180 A181 Y186 L187 Q188	F172-A184 HydrophobicContact CD2-CB 4.15Å; F172-A184 WeakPolarHBondContact CD2-O 3.29Å; F172-A184 HydrophobicContact CE2-CB 3.92Å; F172-A184 WeakPolarHBondContact CE2-O 3.46Å; A175-A184 HydrophobicContact CB-CB 4.11Å; H180-A184 PolarHBondContact O-N 2.89Å; A181-A184 PolarHBondContact O-N 3.13Å; A184-Y186 PolarHBondContact O-N 3.05Å; A184-L187 PolarHBondContact O-N 2.9Å; A184-Q188 WeakPolarHBondContact O-CB 3.46Å; A184-Q188 PolarHBondContact O-N 2.77Å
185	A	93.3	Very high	92.5	Very high	56 Å²	56	57.8 Å²	57.8	46%	0.463	33%	0.329	S	S	.	.	H	α-helix	trans	-59.6	-47.7	177	0	0	0	0	0	111.9	A181 Q188 Q189	A181-A185 WeakPolarHBondContact O-CB 3.42Å; A181-A185 PolarHBondContact O-N 3.43Å; A185-Q188 PolarHBondContact O-N 2.94Å; A185-Q189 PolarHBondContact O-N 3.37Å; A185-Q189 VanDerWaalsContact O-N 3.08Å
186	Y	93.1	Very high	92	Very high	9 Å²	9	64 Å²	64	4%	0.035	36%	0.356	C	S	.	.	H	α-helix	trans	-62	-47.2	176.5	179.5	-95	0	0	0	112.2	L148 I151 S152 V155 G182 C183 A184 Q188 Q189 A190 P201 M203	L148-Y186 VanDerWaalsContact CD1-CB 3.43Å; L148-Y186 HydrophobicContact CD1-CD1 3.8Å; L148-Y186 HydrophobicContact CD1-CD2 4.18Å; L148-Y186 HydrophobicContact CD1-CG 3.53Å; I151-Y186 HydrophobicContact CG2-CD1 3.85Å; I151-Y186 HydrophobicContact CG2-CE1 3.93Å; S152-Y186 WeakPolarHBondContact CA-OH 3.27Å; V155-Y186 HydrophobicContact CG2-CE1 4.3Å; G182-Y186 PolarHBondContact O-N 3.31Å; G182-Y186 VanDerWaalsContact O-N 3.14Å; C183-Y186 PolarHBondContact O-N 3.36Å; A184-Y186 PolarHBondContact O-N 3.05Å; Y186-Q188 VanDerWaalsContact C-N 3.33Å; Y186-Q188 PolarHBondContact O-N 2.98Å; Y186-Q189 PolarHBondContact O-N 2.91Å; Y186-A190 HydrophobicContact CD1-CB 4.5Å; Y186-A190 HydrophobicContact CE1-CB 4.23Å; Y186-A190 VanDerWaalsContact O-CB 3.23Å; Y186-A190 WeakPolarHBondContact O-CB 3.42Å; Y186-A190 PolarHBondContact O-N 3.4Å; Y186-P201 WeakPolarHBondContact CE2-O 3.44Å; Y186-P201 PolarHBondContact OH-O 2.8Å; Y186-M203 HydrophobicContact CD2-CE 4.38Å; Y186-M203 HydrophobicContact CD2-CG 4.36Å; Y186-M203 HydrophobicContact CD2-SD 3.69Å; Y186-M203 HydrophobicContact CE2-CB 4.47Å; Y186-M203 HydrophobicContact CE2-CG 4.04Å; Y186-M203 HydrophobicContact CE2-SD 3.99Å
187	L	93.2	Very high	91.3	Very high	1 Å²	1	63.9 Å²	63.9	1%	0.005	37%	0.369	C	S	.	.	H	α-helix	trans	-61.2	-40.6	179.4	-77.7	166.4	0	0	0	112.1	A143 I151 L161 A171 F172 A175 C183 A184 A190 Q191	A143-L187 HydrophobicContact CB-CD1 4.1Å; I151-L187 HydrophobicContact CD1-CD1 4.12Å; I151-L187 HydrophobicContact CD1-CG 4.47Å; I151-L187 HydrophobicContact CG2-CD2 3.46Å; I151-L187 VanDerWaalsContact CG2-CD2 3.46Å; I151-L187 HydrophobicContact CG2-CG 3.89Å; L161-L187 HydrophobicContact CD1-CD2 3.9Å; L161-L187 HydrophobicContact CD2-CD2 3.57Å; L161-L187 HydrophobicContact CG-CD2 4.31Å; A171-L187 HydrophobicContact CB-CD1 4.18Å; A171-L187 HydrophobicContact CB-CD2 4.11Å; A171-L187 WeakPolarHBondContact O-CD1 3.26Å; F172-L187 HydrophobicContact CB-CB 4.09Å; F172-L187 HydrophobicContact CD2-CB 4.31Å; A175-L187 HydrophobicContact CB-CD1 3.87Å; C183-L187 VanDerWaalsContact O-CB 3.29Å; C183-L187 WeakPolarHBondContact O-CB 3.2Å; C183-L187 WeakPolarHBondContact O-CD1 3.38Å; C183-L187 VanDerWaalsContact O-CG 3.23Å; C183-L187 WeakPolarHBondContact O-CG 3.37Å; C183-L187 PolarHBondContact O-N 3.47Å; A184-L187 PolarHBondContact O-N 2.9Å; L187-A190 PolarHBondContact O-N 3.01Å; L187-Q191 WeakPolarHBondContact O-CB 3.45Å; L187-Q191 PolarHBondContact O-N 3.42Å
188	Q	92.9	Very high	90.6	Very high	119 Å²	119	63.5 Å²	63.5	56%	0.556	37%	0.369	S	S	*	.	H	α-helix	trans	-63.3	-45.5	176.5	-171	178.3	18.7	0	0	111.5	F172 A184 A185 Y186 H192	F172-Q188 HydrophobicContact CD2-CB 3.86Å; F172-Q188 HydrophobicContact CE2-CB 3.72Å; F172-Q188 HydrophobicContact CE2-CG 4.27Å; A184-Q188 WeakPolarHBondContact O-CB 3.46Å; A184-Q188 PolarHBondContact O-N 2.77Å; A185-Q188 PolarHBondContact O-N 2.94Å; Y186-Q188 VanDerWaalsContact C-N 3.33Å; Y186-Q188 PolarHBondContact O-N 2.98Å; Q188-H192 WeakPolarHBondContact O-CB 3.36Å; Q188-H192 PolarHBondContact O-N 2.89Å
189	Q	91	Very high	89.6	Confident	97 Å²	97	63.6 Å²	63.6	45%	0.453	38%	0.383	S	S	.	.	H	α-helix	trans	-63.7	-46.1	176.9	-175.3	179	9.7	0	0	111.1	A185 Y186 H192 L193	A185-Q189 PolarHBondContact O-N 3.37Å; A185-Q189 VanDerWaalsContact O-N 3.08Å; Y186-Q189 PolarHBondContact O-N 2.91Å; Q189-H192 PolarHBondContact O-N 3.12Å; Q189-L193 HydrophobicContact CG-CD1 4.32Å; Q189-L193 WeakPolarHBondContact O-CG 3.38Å; Q189-L193 PolarHBondContact O-N 3.48Å
190	A	91.3	Very high	88.4	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.008	36%	0.358	C	S	.	.	H	α-helix	trans	-64	-43.1	179.5	0	0	0	0	0	112	V155 L161 Y186 L187 H192 L193 Q194 P200	V155-A190 HydrophobicContact CG1-CB 4.37Å; L161-A190 HydrophobicContact CD1-CB 3.44Å; L161-A190 VanDerWaalsContact CD1-CB 3.44Å; Y186-A190 HydrophobicContact CD1-CB 4.5Å; Y186-A190 HydrophobicContact CE1-CB 4.23Å; Y186-A190 VanDerWaalsContact O-CB 3.23Å; Y186-A190 WeakPolarHBondContact O-CB 3.42Å; Y186-A190 PolarHBondContact O-N 3.4Å; L187-A190 PolarHBondContact O-N 3.01Å; A190-H192 PolarHBondContact O-N 2.9Å; A190-L193 PolarHBondContact O-N 2.68Å; A190-Q194 WeakPolarHBondContact O-CG 3.48Å; A190-Q194 PolarHBondContact O-N 3Å; A190-P200 HydrophobicContact CB-CB 3.55Å; A190-P200 HydrophobicContact CB-CG 3.63Å; A190-P200 WeakPolarHBondContact O-CG 3.08Å
191	Q	90	Very high	87.1	Confident	49 Å²	49	60.8 Å²	60.8	23%	0.229	36%	0.359	C	S	.	.	H	α-helix	trans	-62.8	-42	176.3	-171.3	179.1	16.4	0	0	111.5	L161 L187 L193 Q194 M195	L161-Q191 HydrophobicContact CB-CB 4.24Å; L161-Q191 HydrophobicContact CB-CG 4.39Å; L161-Q191 HydrophobicContact CD1-CB 4.46Å; L187-Q191 WeakPolarHBondContact O-CB 3.45Å; L187-Q191 PolarHBondContact O-N 3.42Å; Q191-L193 VanDerWaalsContact C-N 3.31Å; Q191-L193 PolarHBondContact O-N 2.86Å; Q191-Q194 PolarHBondContact O-N 3.13Å; Q191-M195 VanDerWaalsContact O-CG 3.27Å; Q191-M195 WeakPolarHBondContact O-CG 2.87Å; Q191-M195 PolarHBondContact O-N 2.85Å
192	H	88.7	Confident	86	Confident	106 Å²	106	60.6 Å²	60.6	49%	0.491	34%	0.343	S	S	.	.	H	α-helix	trans	-62.3	-37.4	174.8	-179.3	66.8	0	0	0	112.8	Q188 Q189 A190 K196	Q188-H192 WeakPolarHBondContact O-CB 3.36Å; Q188-H192 PolarHBondContact O-N 2.89Å; Q189-H192 PolarHBondContact O-N 3.12Å; A190-H192 PolarHBondContact O-N 2.9Å; H192-K196 VanDerWaalsContact CE1-CE 3.47Å; H192-K196 WeakPolarHBondContact CE1-CE 3.2Å; H192-K196 WeakPolarHBondContact NE2-CE 3.39Å; H192-K196 PolarHBondContact NE2-NZ 2.77Å; H192-K196 WeakPolarHBondContact O-CG 3.46Å; H192-K196 PolarHBondContact O-N 3.5Å
193	L	88.7	Confident	84.6	Confident	35 Å²	35	60.1 Å²	60.1	18%	0.183	33%	0.329	C	S	.	.	H	α-helix	trans	-69	-44.1	175	-69.6	171.1	0	0	0	111.5	Q189 A190 Q191 M195 K196 G197 L198 P200 P201	Q189-L193 HydrophobicContact CG-CD1 4.32Å; Q189-L193 WeakPolarHBondContact O-CG 3.38Å; Q189-L193 PolarHBondContact O-N 3.48Å; A190-L193 PolarHBondContact O-N 2.68Å; Q191-L193 VanDerWaalsContact C-N 3.31Å; Q191-L193 PolarHBondContact O-N 2.86Å; L193-M195 VanDerWaalsContact C-N 3.32Å; L193-M195 PolarHBondContact O-N 3.1Å; L193-K196 CarbonylContact O-C 3.52Å; L193-K196 WeakPolarHBondContact O-CA 3.28Å; L193-K196 WeakPolarHBondContact O-CB 3.36Å; L193-K196 PolarHBondContact O-N 3.34Å; L193-G197 PolarHBondContact O-N 2.97Å; L193-L198 CarbonylContact C-O 3.26Å; L193-L198 VanDerWaalsContact C-O 3.26Å; L193-L198 HydrophobicContact CB-CB 4.22Å; L193-L198 HydrophobicContact CD2-CB 4.28Å; L193-L198 HydrophobicContact CD2-CD1 3.94Å; L193-L198 WeakPolarHBondContact O-CB 3.28Å; L193-L198 PolarHBondContact O-N 2.83Å; L193-P200 HydrophobicContact CB-CG 4.21Å; L193-P200 HydrophobicContact CD1-CB 4.26Å; L193-P201 VanDerWaalsContact CD1-CD 3.48Å
194	Q	88.6	Confident	82.9	Confident	48 Å²	48	61.9 Å²	61.9	22%	0.224	34%	0.341	C	S	.	.	H	α-helix	trans	-59.5	-41.4	175.7	-74.9	-178.6	-17.4	0	0	112.2	C159 L161 A190 Q191 K196 G197 L198 P200	C159-Q194 PolarHBondContact O-NE2 3.14Å; L161-Q194 VanDerWaalsContact CB-OE1 3.24Å; A190-Q194 WeakPolarHBondContact O-CG 3.48Å; A190-Q194 PolarHBondContact O-N 3Å; Q191-Q194 PolarHBondContact O-N 3.13Å; Q194-K196 PolarHBondContact O-N 2.87Å; Q194-G197 PolarHBondContact O-N 3.3Å; Q194-L198 PolarHBondContact N-O 3.3Å; Q194-P200 HydrophobicContact CG-CG 3.86Å
195	M	85	Confident	81	Confident	146 Å²	146	64.9 Å²	64.9	72%	0.719	36%	0.361	S	S	*	.	H	α-helix	trans	-61	-26.4	174.6	-73.2	-64.5	-59.9	0	0	113.1	Q191 L193 G197	Q191-M195 VanDerWaalsContact O-CG 3.27Å; Q191-M195 WeakPolarHBondContact O-CG 2.87Å; Q191-M195 PolarHBondContact O-N 2.85Å; L193-M195 VanDerWaalsContact C-N 3.32Å; L193-M195 PolarHBondContact O-N 3.1Å; M195-G197 VanDerWaalsContact C-N 3.32Å
196	K	86.7	Confident	79.1	Confident	130 Å²	130	67.1 Å²	67.1	57%	0.565	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	3.4	174	-69	178.9	175.4	-174.9	0	113.3	H192 L193 Q194 L198	H192-K196 VanDerWaalsContact CE1-CE 3.47Å; H192-K196 WeakPolarHBondContact CE1-CE 3.2Å; H192-K196 WeakPolarHBondContact NE2-CE 3.39Å; H192-K196 PolarHBondContact NE2-NZ 2.77Å; H192-K196 WeakPolarHBondContact O-CG 3.46Å; H192-K196 PolarHBondContact O-N 3.5Å; L193-K196 CarbonylContact O-C 3.52Å; L193-K196 WeakPolarHBondContact O-CA 3.28Å; L193-K196 WeakPolarHBondContact O-CB 3.36Å; L193-K196 PolarHBondContact O-N 3.34Å; Q194-K196 PolarHBondContact O-N 2.87Å; K196-L198 VanDerWaalsContact C-N 3.26Å; K196-L198 HydrophobicContact CB-CD1 4.05Å; K196-L198 HydrophobicContact CB-CG 4.21Å; K196-L198 HydrophobicContact CD-CD1 4.42Å; K196-L198 PolarHBondContact O-N 3.19Å
197	G	81.7	Confident	76.9	Confident	71 Å²	71	70 Å²	70	73%	0.732	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.6	20.4	-174	0	0	0	0	0	113.7	L193 Q194 M195	L193-G197 PolarHBondContact O-N 2.97Å; Q194-G197 PolarHBondContact O-N 3.3Å; M195-G197 VanDerWaalsContact C-N 3.32Å
198	L	80.1	Confident	74.8	Confident	95 Å²	95	72.4 Å²	72.4	50%	0.497	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-102.2	141.3	179.1	-63.9	168.6	0	0	0	110.3	L193 Q194 K196 P200	L193-L198 CarbonylContact C-O 3.26Å; L193-L198 VanDerWaalsContact C-O 3.26Å; L193-L198 HydrophobicContact CB-CB 4.22Å; L193-L198 HydrophobicContact CD2-CB 4.28Å; L193-L198 HydrophobicContact CD2-CD1 3.94Å; L193-L198 WeakPolarHBondContact O-CB 3.28Å; L193-L198 PolarHBondContact O-N 2.83Å; Q194-L198 PolarHBondContact N-O 3.3Å; K196-L198 VanDerWaalsContact C-N 3.26Å; K196-L198 HydrophobicContact CB-CD1 4.05Å; K196-L198 HydrophobicContact CB-CG 4.21Å; K196-L198 HydrophobicContact CD-CD1 4.42Å; K196-L198 PolarHBondContact O-N 3.19Å; L198-P200 WeakPolarHBondContact O-CD 3.32Å
199	C	74.4	Confident	72.2	Confident	122 Å²	122	74.6 Å²	74.6	82%	0.824	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-71.7	126.5	170.4	-65.4	0	0	0	0	109.7
200	P	70.3	Confident	69.7	Low	14 Å²	14	75 Å²	75	9%	0.091	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-64.6	150.5	175	-24.2	37.1	0	0	0	112	V155 A190 L193 Q194 L198 Y202	V155-P200 HydrophobicContact CG1-CB 3.5Å; V155-P200 VanDerWaalsContact CG1-CB 3.5Å; V155-P200 HydrophobicContact CG1-CG 3.38Å; A190-P200 HydrophobicContact CB-CB 3.55Å; A190-P200 HydrophobicContact CB-CG 3.63Å; A190-P200 WeakPolarHBondContact O-CG 3.08Å; L193-P200 HydrophobicContact CB-CG 4.21Å; L193-P200 HydrophobicContact CD1-CB 4.26Å; Q194-P200 HydrophobicContact CG-CG 3.86Å; L198-P200 WeakPolarHBondContact O-CD 3.32Å; P200-Y202 PolarHBondContact O-N 3.34Å
201	P	68.6	Low	67.4	Low	45 Å²	45	79.8 Å²	79.8	29%	0.292	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-62.9	130.5	177.8	26.6	-33.4	0	0	0	109.9	Y186 L193 M203	Y186-P201 WeakPolarHBondContact CE2-O 3.44Å; Y186-P201 PolarHBondContact OH-O 2.8Å; L193-P201 VanDerWaalsContact CD1-CD 3.48Å; P201-M203 PolarHBondContact O-N 3.03Å
202	Y	69.5	Low	64.8	Low	73 Å²	73	82.7 Å²	82.7	29%	0.286	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-71.7	123.1	166.2	173.1	-113.5	0	0	0	108.4	E149 S152 R153 A156 P200 P204	E149-Y202 PolarHBondContact OE1-OH 3.23Å; S152-Y202 WeakPolarHBondContact OG-CE2 3.39Å; R153-Y202 VanDerWaalsContact CD-CE2 3.48Å; R153-Y202 HydrophobicContact CG-CE2 3.84Å; R153-Y202 VanDerWaalsContact CZ-CZ 3.49Å; R153-Y202 PolarHBondContact NE-OH 3.35Å; R153-Y202 VanDerWaalsContact NH1-CE1 3.3Å; R153-Y202 PolarHBondContact NH1-OH 3.48Å; A156-Y202 HydrophobicContact CB-CD2 4.09Å; A156-Y202 HydrophobicContact CB-CG 4.42Å; P200-Y202 PolarHBondContact O-N 3.34Å; Y202-P204 HydrophobicContact CE1-CB 3.9Å; Y202-P204 WeakPolarHBondContact O-CD 3.43Å
203	M	61.1	Low	61.9	Low	31 Å²	31	80.7 Å²	80.7	15%	0.153	47%	0.468	C	S	.	.			trans	-95.5	112.7	171.4	-80.1	-178.6	168.3	0	0	108.8	L148 S152 Y186 P201 L211	L148-M203 HydrophobicContact CD2-SD 4.36Å; S152-M203 PolarHBondContact OG-O 2.82Å; Y186-M203 HydrophobicContact CD2-CE 4.38Å; Y186-M203 HydrophobicContact CD2-CG 4.36Å; Y186-M203 HydrophobicContact CD2-SD 3.69Å; Y186-M203 HydrophobicContact CE2-CB 4.47Å; Y186-M203 HydrophobicContact CE2-CG 4.04Å; Y186-M203 HydrophobicContact CE2-SD 3.99Å; P201-M203 PolarHBondContact O-N 3.03Å; M203-L211 HydrophobicContact CE-CD1 4.01Å; M203-L211 HydrophobicContact SD-CD1 3.67Å
204	P	57.9	Low	59.1	Low	43 Å²	43	84.3 Å²	84.3	28%	0.279	49%	0.492	S	S	.	.			trans	-74.1	151	170.6	29.3	-31.6	0	0	0	110.9	Y202 T206 E207	Y202-P204 HydrophobicContact CE1-CB 3.9Å; Y202-P204 WeakPolarHBondContact O-CD 3.43Å; P204-T206 PolarHBondContact O-N 3.47Å; P204-E207 PolarHBondContact O-N 3.15Å
205	S	55.1	Low	56.2	Low	72 Å²	72	91.8 Å²	91.8	50%	0.503	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47	-20.3	-178.5	57.9	0	0	0	0	117.2	E149	E149-S205 VanDerWaalsContact CD-N 3.27Å; E149-S205 PolarHBondContact OE1-N 3.18Å; E149-S205 WeakPolarHBondContact OE2-CA 3.24Å; E149-S205 PolarHBondContact OE2-N 3.18Å
206	T	52.7	Low	53.7	Low	102 Å²	102	91.4 Å²	91.4	63%	0.626	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-35.4	175.3	47.8	0	0	0	0	112.9	P204	P204-T206 PolarHBondContact O-N 3.47Å
207	E	47.7	Very low	51.3	Low	71 Å²	71	90.9 Å²	90.9	33%	0.332	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-17.7	-176.8	-64.6	-178.6	167.1	0	0	113	P204 K209 D210	P204-E207 PolarHBondContact O-N 3.15Å; E207-K209 PolarHBondContact O-N 3.4Å; E207-K209 VanDerWaalsContact O-N 3.13Å; E207-D210 PolarHBondContact O-N 2.81Å
208	V	48.6	Very low	49.2	Very low	51 Å²	51	91.2 Å²	91.2	31%	0.309	54%	0.543	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-24.4	178.3	-179.8	0	0	0	0	112	L148 E149	L148-V208 HydrophobicContact CB-CG1 4.24Å; L148-V208 HydrophobicContact CD2-CG1 4.1Å; L148-V208 HydrophobicContact CD2-CG2 4.16Å; L148-V208 HydrophobicContact CG-CG2 4.42Å; E149-V208 WeakPolarHBondContact OE2-CG2 3.41Å
209	K	38.2	Very low	47.1	Very low	165 Å²	165	90.6 Å²	90.6	72%	0.717	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-22.5	177.5	-72.6	-179.4	-179.7	173.5	0	113.6	E207 C212	E207-K209 PolarHBondContact O-N 3.4Å; E207-K209 VanDerWaalsContact O-N 3.13Å; K209-C212 PolarHBondContact O-SG 2.92Å
210	D	38.9	Very low	45.1	Very low	106 Å²	106	93.2 Å²	93.2	57%	0.567	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.1	-12.9	-173.5	-60.1	-29.3	0	0	0	112.3	E207 C212	E207-D210 PolarHBondContact O-N 2.81Å; D210-C212 VanDerWaalsContact C-N 3.25Å; D210-C212 PolarHBondContact O-N 3.43Å
211	L	43.1	Very low	43.4	Very low	100 Å²	100	97.3 Å²	97.3	52%	0.524	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.3	-8.9	175.4	-70.7	161.3	0	0	0	113.8	L148 M203 G213	L148-L211 HydrophobicContact CD2-CD1 3.77Å; M203-L211 HydrophobicContact CE-CD1 4.01Å; M203-L211 HydrophobicContact SD-CD1 3.67Å; L211-G213 VanDerWaalsContact C-N 3.31Å; L211-G213 PolarHBondContact O-N 2.92Å
212	C	35.5	Very low	41.7	Very low	110 Å²	110	98.1 Å²	98.1	74%	0.743	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	56.5	169.3	71.2	0	0	0	0	112.1	K209 D210	K209-C212 PolarHBondContact O-SG 2.92Å; D210-C212 VanDerWaalsContact C-N 3.25Å; D210-C212 PolarHBondContact O-N 3.43Å
213	G	28.2	Very low	39.8	Very low	64 Å²	64	103 Å²	103	66%	0.66	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	80.9	73.9	158	0	0	0	0	0	116.8	L211	L211-G213 VanDerWaalsContact C-N 3.31Å; L211-G213 PolarHBondContact O-N 2.92Å
214	T	28.2	Very low	38.3	Very low	111 Å²	111	108.2 Å²	108.2	68%	0.681	65%	0.653	S	S	*	*			trans	-150.8	120.8	133.8	46.6	0	0	0	0	108.7	D216	T214-D216 PolarHBondContact O-N 3.38Å
215	E	29	Very low	36.8	Very low	206 Å²	206	114.4 Å²	114.4	96%	0.963	68%	0.684	S	S	*	*			trans	-71.7	115.4	172.5	-61.7	173.3	150.6	0	0	109.5
216	D	31.6	Very low	35.5	Very low	137 Å²	137	115.2 Å²	115.2	73%	0.733	69%	0.689	S	S	*	*			trans	-99.9	126.9	164.2	38.6	-16	0	0	0	110.9	T214 A218	T214-D216 PolarHBondContact O-N 3.38Å; D216-A218 PolarHBondContact O-N 3.3Å
217	A	36.4	Very low	34.4	Very low	119 Å²	119	115.2 Å²	115.2	98%	0.983	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	26	-159.1	0	0	0	0	0	116.5
218	A	38.6	Very low	33.8	Very low	78 Å²	78	116.8 Å²	116.8	65%	0.645	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.1	-6.9	-174.7	0	0	0	0	0	115.8	D216 Q220	D216-A218 PolarHBondContact O-N 3.3Å; A218-Q220 PolarHBondContact O-N 3.17Å
219	G	35.5	Very low	33.2	Very low	83 Å²	83	118 Å²	118	86%	0.856	72%	0.718	S	S	*	*			trans	51.9	19.6	155.3	0	0	0	0	0	119.1
220	Q	33.4	Very low	33.1	Very low	177 Å²	177	118.6 Å²	118.6	83%	0.827	72%	0.724	S	S	*	*			trans	-120.2	123.1	178.5	-75.2	174.6	-72.4	0	0	109.6	A218 A222	A218-Q220 PolarHBondContact O-N 3.17Å; Q220-A222 PolarHBondContact O-N 3.28Å
221	P	33.2	Very low	33	Very low	100 Å²	100	120.7 Å²	120.7	65%	0.649	74%	0.735	S	S	*	*			trans	-63.9	133.7	170.5	28.1	-31	0	0	0	108	L223	P221-L223 PolarHBondContact O-N 3.47Å
222	A	33.3	Very low	32.8	Very low	62 Å²	62	119.7 Å²	119.7	51%	0.512	73%	0.728	S	S	.	*			trans	-60.6	105	169.9	0	0	0	0	0	108.3	Q220 M224	Q220-A222 PolarHBondContact O-N 3.28Å; A222-M224 PolarHBondContact O-N 3Å
223	L	29.2	Very low	32.8	Very low	175 Å²	175	119.5 Å²	119.5	92%	0.916	72%	0.724	S	S	*	*			trans	-67.1	84.5	155.9	-85.1	168.7	0	0	0	106	P221 D225	P221-L223 PolarHBondContact O-N 3.47Å; L223-D225 PolarHBondContact O-N 2.98Å
224	M	30.7	Very low	32.8	Very low	140 Å²	140	126.4 Å²	126.4	69%	0.69	73%	0.731	S	S	*	*			trans	-88.1	104.6	176.8	-159.2	82.7	175.4	0	0	108.1	A222 C226	A222-M224 PolarHBondContact O-N 3Å; M224-C226 HydrophobicContact CG-CB 4.24Å; M224-C226 WeakPolarHBondContact CG-SG 3.4Å; M224-C226 PolarHBondContact O-N 3.31Å
225	D	26.3	Very low	32.8	Very low	173 Å²	173	124.8 Å²	124.8	93%	0.925	74%	0.736	S	S	*	*			trans	-63.7	74.5	160.3	-78.7	-33.5	0	0	0	108.7	L223	L223-D225 PolarHBondContact O-N 2.98Å
226	C	27	Very low	32.7	Very low	89 Å²	89	124.2 Å²	124.2	60%	0.601	73%	0.731	S	S	*	*			trans	-100.4	103.2	170.5	-84.9	0	0	0	0	109	M224 L228	M224-C226 HydrophobicContact CG-CB 4.24Å; M224-C226 WeakPolarHBondContact CG-SG 3.4Å; M224-C226 PolarHBondContact O-N 3.31Å; C226-L228 PolarHBondContact O-N 2.92Å
227	A	30.8	Very low	32.6	Very low	103 Å²	103	123.3 Å²	123.3	85%	0.851	73%	0.731	S	S	*	*			trans	-18.3	92.8	161.9	0	0	0	0	0	114.2
228	L	34.6	Very low	32.2	Very low	104 Å²	104	123.2 Å²	123.2	55%	0.545	72%	0.721	S	S	.	*			trans	-62.2	146.9	142.4	-67.7	169.2	0	0	0	106.5	C226 E230 M232	C226-L228 PolarHBondContact O-N 2.92Å; L228-E230 PolarHBondContact O-N 3.45Å; L228-M232 HydrophobicContact CB-CB 4.15Å; L228-M232 HydrophobicContact CB-SD 4.41Å; L228-M232 HydrophobicContact CD1-SD 4.16Å; L228-M232 HydrophobicContact CD2-SD 4.1Å; L228-M232 HydrophobicContact CG-SD 4.46Å
229	P	35.3	Very low	31.7	Very low	75 Å²	75	125.5 Å²	125.5	49%	0.487	73%	0.727	S	S	.	*			trans	-47.7	138	174.7	19.2	-29.7	0	0	0	109	D231 M232	P229-D231 PolarHBondContact O-N 3.31Å; P229-M232 PolarHBondContact O-N 3.34Å
230	E	36.9	Very low	31.7	Very low	179 Å²	179	125.8 Å²	125.8	84%	0.836	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-56.6	-4.7	-176.5	-65.7	-165.1	164	0	0	113.2	L228 V233	L228-E230 PolarHBondContact O-N 3.45Å; E230-V233 WeakPolarHBondContact O-CG2 3.14Å
231	D	36.1	Very low	31.8	Very low	150 Å²	150	124.1 Å²	124.1	80%	0.802	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-84.3	-10.6	176.2	-30.8	-25.4	0	0	0	113.1	P229 V233	P229-D231 PolarHBondContact O-N 3.31Å; D231-V233 VanDerWaalsContact C-N 3.32Å
232	M	39	Very low	31.7	Very low	78 Å²	78	129.2 Å²	129.2	38%	0.384	73%	0.726	S	S	.	*	G	3₁₀ helix	trans	-92.5	21.9	175	-82.8	-155	-165.1	0	0	113.7	V123 F157 L228 P229 Y234	V123-M232 HydrophobicContact CG2-CE 4.14Å; F157-M232 HydrophobicContact CE1-CE 3.58Å; F157-M232 HydrophobicContact CZ-CE 3.73Å; L228-M232 HydrophobicContact CB-CB 4.15Å; L228-M232 HydrophobicContact CB-SD 4.41Å; L228-M232 HydrophobicContact CD1-SD 4.16Å; L228-M232 HydrophobicContact CD2-SD 4.1Å; L228-M232 HydrophobicContact CG-SD 4.46Å; P229-M232 PolarHBondContact O-N 3.34Å; M232-Y234 PolarHBondContact O-N 2.99Å
233	V	34.9	Very low	31.7	Very low	107 Å²	107	133.6 Å²	133.6	65%	0.648	74%	0.736	S	S	*	*	S	Bend	trans	-70.6	97	171.6	-177.5	0	0	0	0	108.8	E230 D231	E230-V233 WeakPolarHBondContact O-CG2 3.14Å; D231-V233 VanDerWaalsContact C-N 3.32Å
234	Y	29.8	Very low	32	Very low	208 Å²	208	132 Å²	132	82%	0.816	73%	0.728	S	S	*	*			trans	55.8	85	147.5	-72.5	-96	0	0	0	117.8	M232	M232-Y234 PolarHBondContact O-N 2.99Å
235	G	27.1	Very low	32.6	Very low	77 Å²	77	135 Å²	135	79%	0.794	74%	0.74	S	S	*	*			trans	-94.2	-10.3	160.7	0	0	0	0	0	115
236	F	27.9	Very low	33	Very low	194 Å²	194	133.6 Å²	133.6	85%	0.851	73%	0.732	S	S	*	*			trans	-106.2	94.2	177.3	-91.6	-91.7	0	0	0	110.7	C238	F236-C238 PolarHBondContact O-N 2.95Å; F236-C238 VanDerWaalsContact O-N 3.12Å
237	V	29.6	Very low	33.4	Very low	119 Å²	119	134.5 Å²	134.5	72%	0.721	74%	0.737	S	S	*	*			trans	-47.1	115.7	156.5	-177.7	0	0	0	0	107.3	V239	V237-V239 HydrophobicContact CB-CG2 4.41Å; V237-V239 HydrophobicContact CG1-CG2 3.92Å; V237-V239 PolarHBondContact O-N 2.86Å
238	C	27.9	Very low	33.9	Very low	117 Å²	117	144.4 Å²	144.4	79%	0.791	75%	0.754	S	S	*	*			trans	-64.1	85.3	168.5	-157.5	0	0	0	0	107.7	F236 S240	F236-C238 PolarHBondContact O-N 2.95Å; F236-C238 VanDerWaalsContact O-N 3.12Å; C238-S240 PolarHBondContact O-N 3.37Å; C238-S240 VanDerWaalsContact O-N 3.09Å
239	V	28.2	Very low	33.9	Very low	126 Å²	126	146.4 Å²	146.4	76%	0.764	77%	0.765	S	S	*	*			trans	-79.9	80.1	166.1	-177.7	0	0	0	0	106	V237	V237-V239 HydrophobicContact CB-CG2 4.41Å; V237-V239 HydrophobicContact CG1-CG2 3.92Å; V237-V239 PolarHBondContact O-N 2.86Å
240	S	33.9	Very low	33.8	Very low	89 Å²	89	150.2 Å²	150.2	62%	0.622	78%	0.779	S	S	*	*			trans	-153.8	93.9	164.4	-78.6	0	0	0	0	111.3	C238	C238-S240 PolarHBondContact O-N 3.37Å; C238-S240 VanDerWaalsContact O-N 3.09Å
241	I	35.1	Very low	33.7	Very low	142 Å²	142	148.6 Å²	148.6	73%	0.728	78%	0.776	S	S	*	*			trans	69.6	72.6	139.7	-42.9	166.1	0	0	0	116	Q243	I241-Q243 HydrophobicContact CG2-CB 3.93Å; I241-Q243 PolarHBondContact O-N 3.38Å; I241-Q243 VanDerWaalsContact O-N 3.13Å
242	E	31.1	Very low	33.5	Very low	206 Å²	206	148.5 Å²	148.5	96%	0.963	78%	0.775	S	S	*	*			trans	-76.3	73.7	142.3	-81.9	-171.7	167.2	0	0	108.7
243	Q	33.7	Very low	33.2	Very low	155 Å²	155	152.9 Å²	152.9	72%	0.724	80%	0.799	S	S	*	*			trans	-131.1	96.4	156	-73.7	-164	-7.7	0	0	106.5	I241	I241-Q243 HydrophobicContact CG2-CB 3.93Å; I241-Q243 PolarHBondContact O-N 3.38Å; I241-Q243 VanDerWaalsContact O-N 3.13Å
244	N	36.8	Very low	33.1	Very low	141 Å²	141	155.9 Å²	155.9	75%	0.754	81%	0.809	S	S	*	*			trans	170.2	71.2	145.4	-84.6	-24.4	0	0	0	110.3	L246	N244-L246 PolarHBondContact O-N 3.25Å
245	H	42.9	Very low	33.3	Very low	203 Å²	203	152.2 Å²	152.2	94%	0.94	81%	0.809	S	S	*	*			trans	-77.1	100.5	144.9	-95	-45.4	0	0	0	107.7
246	L	35	Very low	33.8	Very low	143 Å²	143	158 Å²	158	75%	0.749	81%	0.81	S	S	*	*			trans	-91.7	162.3	160.3	-83	172.5	0	0	0	109.2	N244	N244-L246 PolarHBondContact O-N 3.25Å
247	P	35.8	Very low	34.3	Very low	108 Å²	108	155 Å²	155	70%	0.701	81%	0.806	S	S	*	*				-98.7	161.6	-122.2	37	-37.8	0	0	0	115.5
248	Y	41.4	Very low	34.7	Very low	311 Å²	311	158.3 Å²	158.3	100%	1.22	81%	0.814	S	S	*	*			trans	-136.1	0	142.7	-95.4	-78.3	0	0	0	109.1

Retrieved 248 of 248 residues in 69.1 ms (Link to these results)

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