X5ML89_CAEEL Loading...

RING-type domain-containing protein

AlphaFold DB , UniProt , Accession X5ML89, Species CAEEL (Caenorhabditis elegans), Gene grif-1, Length 210 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	35.4	Very low	40.6	Very low	242 Å²	242	154.5 Å²	154.5	100%	1.192	82%	0.822	S	S	*	*				0	85	0	-79.9	-174.9	172.4	0	0	105.9	S3	M1-S3 PolarHBondContact O-N 3.49Å
2	D	35.4	Very low	42.4	Very low	170 Å²	170	150.2 Å²	150.2	91%	0.909	80%	0.797	S	S	*	*			trans	-74.8	117.5	-178.5	-78.5	-44.1	0	0	0	109.2	M4	D2-M4 PolarHBondContact O-N 3.34Å
3	S	38.8	Very low	45.1	Very low	114 Å²	114	141 Å²	141	80%	0.797	75%	0.752	S	S	*	*			trans	-57.4	120.7	179.8	-159.1	0	0	0	0	110	M1	M1-S3 PolarHBondContact O-N 3.49Å
4	M	38.7	Very low	48.2	Very low	174 Å²	174	139.8 Å²	139.8	86%	0.857	74%	0.737	S	S	*	*			trans	21.8	102.3	154	-55.9	-131.1	-154.7	0	0	115.6	D2 G6	D2-M4 PolarHBondContact O-N 3.34Å; M4-G6 PolarHBondContact O-N 3.32Å
5	R	43.3	Very low	51	Low	243 Å²	243	131.3 Å²	131.3	92%	0.917	69%	0.692	S	S	*	*			trans	-46.3	111	147.8	-72.4	178.1	174.2	-145	-2.5	106.5	E7	R5-E7 PolarHBondContact O-N 3.29Å
6	G	37.4	Very low	53.6	Low	70 Å²	70	126.4 Å²	126.4	72%	0.722	68%	0.677	S	S	*	*			trans	-49.5	117.5	173.5	0	0	0	0	0	107.8	M4 A8	M4-G6 PolarHBondContact O-N 3.32Å; G6-A8 PolarHBondContact O-N 3.12Å
7	E	36.9	Very low	55.9	Low	184 Å²	184	119.1 Å²	119.1	86%	0.86	64%	0.638	S	S	*	*			trans	-48.7	127.8	164.2	-74.4	176.4	152.6	0	0	105.9	R5 D9	R5-E7 PolarHBondContact O-N 3.29Å; E7-D9 VanDerWaalsContact C-N 3.28Å; E7-D9 PolarHBondContact O-N 3.39Å
8	A	40.1	Very low	58	Low	73 Å²	73	117.1 Å²	117.1	60%	0.603	63%	0.63	S	S	*	*			trans	-57.8	102.8	172.5	0	0	0	0	0	106	G6 H10	G6-A8 PolarHBondContact O-N 3.12Å; A8-H10 PolarHBondContact O-N 3.39Å
9	D	39.9	Very low	59.7	Low	137 Å²	137	113.5 Å²	113.5	73%	0.733	62%	0.624	S	S	*	*			trans	-56.4	92.2	165.3	-97.4	-23.6	0	0	0	105.2	E7 N11	E7-D9 VanDerWaalsContact C-N 3.28Å; E7-D9 PolarHBondContact O-N 3.39Å; D9-N11 PolarHBondContact O-N 3.05Å
10	H	47.4	Very low	61.4	Low	164 Å²	164	110.7 Å²	110.7	76%	0.759	61%	0.612	S	S	*	*			trans	-63.1	82.5	158.2	-63.9	-52.6	0	0	0	103.8	A8 I12	A8-H10 PolarHBondContact O-N 3.39Å; H10-I12 WeakPolarHBondContact O-CG1 3.38Å; H10-I12 PolarHBondContact O-N 3.2Å
11	N	53.9	Low	62.8	Low	129 Å²	129	111.7 Å²	111.7	69%	0.69	62%	0.616	S	S	*	*			trans	-64.3	88.2	179.6	-108.5	-29.9	0	0	0	106.8	D9 S13	D9-N11 PolarHBondContact O-N 3.05Å; N11-S13 PolarHBondContact O-N 2.95Å
12	I	62.1	Low	65.5	Low	102 Å²	102	101.2 Å²	101.2	52%	0.523	57%	0.571	S	S	.	*			trans	-62.4	102	173.6	-64.8	175.1	0	0	0	105.1	H10 F14	H10-I12 WeakPolarHBondContact O-CG1 3.38Å; H10-I12 PolarHBondContact O-N 3.2Å; I12-F14 HydrophobicContact CB-CE2 4.35Å; I12-F14 HydrophobicContact CG2-CD2 4.06Å; I12-F14 HydrophobicContact CG2-CE1 4.4Å; I12-F14 HydrophobicContact CG2-CE2 3.39Å; I12-F14 HydrophobicContact CG2-CZ 3.58Å
13	S	77.2	Confident	68.1	Low	31 Å²	31	98.1 Å²	98.1	22%	0.217	56%	0.557	C	S	.	*			trans	-87.9	128.4	178.8	-166.5	0	0	0	0	109	N11 E26	N11-S13 PolarHBondContact O-N 2.95Å; S13-E26 WeakPolarHBondContact CB-OE2 3.37Å; S13-E26 VanDerWaalsContact O-CB 3.31Å; S13-E26 WeakPolarHBondContact O-CB 3.45Å; S13-E26 PolarHBondContact O-N 3.13Å
14	F	88.6	Confident	70.7	Confident	124 Å²	124	96.3 Å²	96.3	54%	0.544	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	133.1	171.7	-68.5	-83.9	0	0	0	109.1	I12 V23 Y24 H25	I12-F14 HydrophobicContact CB-CE2 4.35Å; I12-F14 HydrophobicContact CG2-CD2 4.06Å; I12-F14 HydrophobicContact CG2-CE1 4.4Å; I12-F14 HydrophobicContact CG2-CE2 3.39Å; I12-F14 HydrophobicContact CG2-CZ 3.58Å; F14-V23 HydrophobicContact CB-CG1 3.67Å; F14-V23 HydrophobicContact CD1-CG1 4.34Å; F14-V23 HydrophobicContact CG-CG1 4.35Å; F14-Y24 CarbonylContact C-O 3.51Å; F14-Y24 VanDerWaalsContact CA-O 3.31Å; F14-Y24 WeakPolarHBondContact CA-O 3.32Å; F14-H25 HydrophobicContact CD1-CB 4.41Å; F14-H25 HydrophobicContact CE1-CB 4.22Å
15	L	89.4	Confident	73.1	Confident	12 Å²	12	90.1 Å²	90.1	6%	0.063	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	143.2	-177.5	-63.1	179.2	0	0	0	110.4	Y24 E26 T29 N55 A58 L78	L15-Y24 PolarHBondContact N-O 2.94Å; L15-Y24 PolarHBondContact O-N 2.84Å; L15-E26 HydrophobicContact CD1-CB 4.41Å; L15-E26 HydrophobicContact CD1-CG 3.88Å; L15-T29 HydrophobicContact CB-CG2 4.42Å; L15-N55 HydrophobicContact CD2-CB 4.05Å; L15-N55 VanDerWaalsContact CD2-CG 3.41Å; L15-N55 WeakPolarHBondContact CD2-OD1 3.49Å; L15-A58 HydrophobicContact CB-CB 4.36Å; L15-A58 HydrophobicContact CD1-CB 4.34Å; L15-L78 HydrophobicContact CD1-CD1 3.8Å; L15-L78 HydrophobicContact CD1-CD2 3.69Å; L15-L78 HydrophobicContact CD1-CG 4.44Å
16	A	92.6	Very high	75.2	Confident	54 Å²	54	78.6 Å²	78.6	45%	0.446	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	131.8	172.8	0	0	0	0	0	110.1	G22	A16-G22 CarbonylContact C-O 3.56Å; A16-G22 WeakPolarHBondContact CA-O 3.5Å
17	C	93.9	Very high	77.6	Confident	1 Å²	1	80.6 Å²	80.6	1%	0.007	45%	0.448	C	S	.	.			trans	-71.7	128.1	171.7	175	0	0	0	0	110	G19 C20 N21 G22 Y24 A58 C60 C63	C17-G19 PolarHBondContact O-N 3.34Å; C17-G19 PolarHBondContact SG-N 3.45Å; C17-G19 VanDerWaalsContact SG-N 3.4Å; C17-C20 PolarHBondContact O-N 2.93Å; C17-C20 VanDerWaalsContact SG-SG 3.65Å; C17-N21 WeakPolarHBondContact O-CA 3.47Å; C17-N21 PolarHBondContact O-N 2.94Å; C17-G22 PolarHBondContact N-O 3.5Å; C17-Y24 HydrophobicContact CB-CD2 3.84Å; C17-Y24 HydrophobicContact CB-CE2 3.7Å; C17-A58 WeakPolarHBondContact CA-O 3.49Å; C17-C60 HydrophobicContact CB-CB 4.02Å; C17-C60 PolarHBondContact SG-N 3.35Å; C17-C60 VanDerWaalsContact SG-SG 3.66Å; C17-C63 VanDerWaalsContact SG-SG 3.68Å
18	V	93	Very high	80.1	Confident	84 Å²	84	75.3 Å²	75.3	51%	0.509	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-27.4	179.5	-178.1	0	0	0	0	112.4	Q56 A58 L59	V18-Q56 WeakPolarHBondContact CG2-O 3.42Å; V18-A58 WeakPolarHBondContact CG2-O 3.47Å; V18-A58 PolarHBondContact N-O 3.01Å; V18-L59 HydrophobicContact CB-CD2 4.5Å
19	G	90.2	Very high	82.5	Confident	49 Å²	49	71.9 Å²	71.9	51%	0.505	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-32.4	-177.1	0	0	0	0	0	114.7	C17	C17-G19 PolarHBondContact O-N 3.34Å; C17-G19 PolarHBondContact SG-N 3.45Å; C17-G19 VanDerWaalsContact SG-N 3.4Å
20	C	93.1	Very high	85.1	Confident	57 Å²	57	66.6 Å²	66.6	39%	0.385	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.7	-0.4	-174.4	67.1	0	0	0	0	114.7	C17 G22	C17-C20 PolarHBondContact O-N 2.93Å; C17-C20 VanDerWaalsContact SG-SG 3.65Å; C20-G22 PolarHBondContact O-N 3.18Å
21	N	92	Very high	87.3	Confident	131 Å²	131	58.8 Å²	58.8	70%	0.701	33%	0.333	S	S	*	.			trans	56.1	9.5	-174.7	-60.7	-34.4	0	0	0	115.3	C17	C17-N21 WeakPolarHBondContact O-CA 3.47Å; C17-N21 PolarHBondContact O-N 2.94Å
22	G	90.8	Very high	89.1	Confident	23 Å²	23	52.7 Å²	52.7	24%	0.237	30%	0.3	C	S	.	.			trans	-69.1	147.3	172.5	0	0	0	0	0	111.2	A16 C17 C20 Y24	A16-G22 CarbonylContact C-O 3.56Å; A16-G22 WeakPolarHBondContact CA-O 3.5Å; C17-G22 PolarHBondContact N-O 3.5Å; C20-G22 PolarHBondContact O-N 3.18Å; G22-Y24 VanDerWaalsContact C-CE2 3.44Å; G22-Y24 WeakPolarHBondContact O-CD2 3.37Å; G22-Y24 VanDerWaalsContact O-CE2 3.28Å; G22-Y24 WeakPolarHBondContact O-CE2 3.45Å
23	V	91.7	Very high	90.4	Very high	104 Å²	104	48.8 Å²	48.8	63%	0.63	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	125.2	178.5	-179.6	0	0	0	0	109.3	F14	F14-V23 HydrophobicContact CB-CG1 3.67Å; F14-V23 HydrophobicContact CD1-CG1 4.34Å; F14-V23 HydrophobicContact CG-CG1 4.35Å
24	Y	91.9	Very high	91	Very high	76 Å²	76	51.2 Å²	51.2	30%	0.298	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	154.2	-176.5	-62	-86.9	0	0	0	110.9	F14 L15 C17 G22 C60	F14-Y24 CarbonylContact C-O 3.51Å; F14-Y24 VanDerWaalsContact CA-O 3.31Å; F14-Y24 WeakPolarHBondContact CA-O 3.32Å; L15-Y24 PolarHBondContact N-O 2.94Å; L15-Y24 PolarHBondContact O-N 2.84Å; C17-Y24 HydrophobicContact CB-CD2 3.84Å; C17-Y24 HydrophobicContact CB-CE2 3.7Å; G22-Y24 VanDerWaalsContact C-CE2 3.44Å; G22-Y24 WeakPolarHBondContact O-CD2 3.37Å; G22-Y24 VanDerWaalsContact O-CE2 3.28Å; G22-Y24 WeakPolarHBondContact O-CE2 3.45Å; Y24-C60 HydrophobicContact CD1-CB 3.96Å; Y24-C60 HydrophobicContact CD2-CB 3.47Å; Y24-C60 VanDerWaalsContact CD2-CB 3.47Å; Y24-C60 HydrophobicContact CE1-CB 3.84Å; Y24-C60 HydrophobicContact CE2-CB 3.33Å; Y24-C60 HydrophobicContact CG-CB 3.78Å
25	H	90.1	Very high	91	Very high	44 Å²	44	48.7 Å²	48.7	20%	0.204	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	137.2	171	-172.2	-63.4	0	0	0	109	F14 K27 D28	F14-H25 HydrophobicContact CD1-CB 4.41Å; F14-H25 HydrophobicContact CE1-CB 4.22Å; H25-K27 VanDerWaalsContact C-N 3.29Å; H25-K27 HydrophobicContact CB-CG 4.47Å; H25-K27 WeakPolarHBondContact ND1-CG 3.44Å; H25-K27 PolarHBondContact ND1-N 3.07Å; H25-K27 VanDerWaalsContact ND1-N 3.16Å; H25-K27 PolarHBondContact O-N 3.35Å; H25-D28 WeakPolarHBondContact O-CA 3.48Å; H25-D28 WeakPolarHBondContact O-CB 3.32Å; H25-D28 PolarHBondContact O-N 3.42Å
26	E	86.6	Confident	90.9	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.009	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-52.6	-43	-175.3	-170.8	-161.6	160	0	0	113.9	S13 L15 D28 T29 L78 Q79 R82	S13-E26 WeakPolarHBondContact CB-OE2 3.37Å; S13-E26 VanDerWaalsContact O-CB 3.31Å; S13-E26 WeakPolarHBondContact O-CB 3.45Å; S13-E26 PolarHBondContact O-N 3.13Å; L15-E26 HydrophobicContact CD1-CB 4.41Å; L15-E26 HydrophobicContact CD1-CG 3.88Å; E26-D28 PolarHBondContact O-N 3.28Å; E26-D28 VanDerWaalsContact O-N 3.07Å; E26-T29 PolarHBondContact O-N 2.97Å; E26-T29 PolarHBondContact O-OG1 3.38Å; E26-L78 HydrophobicContact CG-CD2 3.51Å; E26-Q79 HydrophobicContact CG-CB 4.25Å; E26-Q79 WeakPolarHBondContact OE1-CA 3.42Å; E26-R82 VanDerWaalsContact CD-NH2 3.34Å; E26-R82 VanDerWaalsContact OE1-CD 3.27Å; E26-R82 WeakPolarHBondContact OE1-CD 3.34Å; E26-R82 IonicContact OE1-CZ 3.19Å; E26-R82 IonicContact OE1-NE 2.61Å; E26-R82 PolarHBondContact OE1-NE 3.43Å; E26-R82 IonicContact OE1-NH2 3.93Å; E26-R82 PolarHBondContact OE1-NH2 2.98Å; E26-R82 IonicContact OE2-CZ 2.94Å; E26-R82 IonicContact OE2-NE 3.3Å; E26-R82 PolarHBondContact OE2-NE 2.99Å; E26-R82 IonicContact OE2-NH1 3.59Å; E26-R82 IonicContact OE2-NH2 3.12Å; E26-R82 PolarHBondContact OE2-NH2 3.15Å
27	K	87.8	Confident	90.5	Very high	111 Å²	111	50.1 Å²	50.1	48%	0.483	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-51	-29.4	173.6	84.3	-169.4	174	178.3	0	114.6	H25	H25-K27 VanDerWaalsContact C-N 3.29Å; H25-K27 HydrophobicContact CB-CG 4.47Å; H25-K27 WeakPolarHBondContact ND1-CG 3.44Å; H25-K27 PolarHBondContact ND1-N 3.07Å; H25-K27 VanDerWaalsContact ND1-N 3.16Å; H25-K27 PolarHBondContact O-N 3.35Å
28	D	89.3	Confident	90.1	Very high	74 Å²	74	50.1 Å²	50.1	40%	0.396	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-97.2	6.6	-177.2	-56	-46.8	0	0	0	111.7	H25 E26 S61	H25-D28 WeakPolarHBondContact O-CA 3.48Å; H25-D28 WeakPolarHBondContact O-CB 3.32Å; H25-D28 PolarHBondContact O-N 3.42Å; E26-D28 PolarHBondContact O-N 3.28Å; E26-D28 VanDerWaalsContact O-N 3.07Å; D28-S61 PolarHBondContact O-OG 3.27Å
29	T	92.2	Very high	89.7	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	146	176.8	65.5	0	0	0	0	111.9	L15 E26 L59 L78	L15-T29 HydrophobicContact CB-CG2 4.42Å; E26-T29 PolarHBondContact O-N 2.97Å; E26-T29 PolarHBondContact O-OG1 3.38Å; T29-L59 WeakPolarHBondContact CA-O 3.47Å; T29-L78 WeakPolarHBondContact O-CB 3.36Å; T29-L78 PolarHBondContact O-N 3.25Å
30	N	93.5	Very high	89	Confident	26 Å²	26	55.5 Å²	55.5	14%	0.139	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	161.2	-175.2	-61.7	-82	0	0	0	109.7	L59 L64 I76	N30-L59 PolarHBondContact N-O 3.15Å; N30-L59 WeakPolarHBondContact O-CB 3.49Å; N30-L59 PolarHBondContact O-N 3.36Å; N30-L64 HydrophobicContact CB-CD1 4.46Å; N30-L64 HydrophobicContact CB-CD2 3.83Å; N30-I76 CarbonylContact C-O 3.53Å; N30-I76 WeakPolarHBondContact CA-O 3.34Å
31	I	92.8	Very high	88.3	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	130.2	173.9	-64.2	173.1	0	0	0	107.4	S36 I38 L54 S75 I76 L78 L81	I31-S36 WeakPolarHBondContact CG2-OG 3.43Å; I31-I38 HydrophobicContact CD1-CD1 3.98Å; I31-I38 HydrophobicContact CG2-CB 4.37Å; I31-I38 HydrophobicContact CG2-CD1 3.99Å; I31-L54 HydrophobicContact CD1-CB 4.17Å; I31-L54 HydrophobicContact CD1-CD2 3.96Å; I31-S75 CarbonylContact O-C 3.54Å; I31-S75 WeakPolarHBondContact O-CA 3.38Å; I31-S75 WeakPolarHBondContact O-CB 3.49Å; I31-I76 HydrophobicContact CB-CG1 3.98Å; I31-I76 HydrophobicContact CG2-CG1 4.49Å; I31-I76 PolarHBondContact N-O 3.06Å; I31-I76 PolarHBondContact O-N 2.89Å; I31-L78 HydrophobicContact CD1-CB 4.3Å; I31-L78 HydrophobicContact CD1-CD1 4.01Å; I31-L78 HydrophobicContact CD1-CG 4Å; I31-L78 HydrophobicContact CG1-CB 4.22Å; I31-L78 HydrophobicContact CG1-CD1 3.97Å; I31-L78 HydrophobicContact CG1-CG 4.26Å; I31-L81 HydrophobicContact CD1-CD2 4.29Å
32	C	92.8	Very high	87.6	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.007	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	110.8	172.3	178.7	0	0	0	0	109.2	T34 C35 S36 L59 H68 H73 V74	C32-T34 PolarHBondContact O-N 3.41Å; C32-C35 HydrophobicContact CB-CB 4.05Å; C32-C35 PolarHBondContact O-N 3.35Å; C32-C35 VanDerWaalsContact O-N 3.12Å; C32-C35 PolarHBondContact SG-SG 2.94Å; C32-S36 WeakPolarHBondContact O-CB 3.41Å; C32-S36 PolarHBondContact O-N 2.83Å; C32-S36 VanDerWaalsContact O-N 3.12Å; C32-S36 PolarHBondContact O-OG 3.01Å; C32-L59 HydrophobicContact CB-CD1 3.61Å; C32-H68 WeakPolarHBondContact CB-ND1 3.45Å; C32-H68 PolarHBondContact SG-ND1 3.12Å; C32-H73 VanDerWaalsContact SG-CB 3.57Å; C32-V74 CarbonylContact C-O 3.56Å; C32-V74 WeakPolarHBondContact CA-O 3.42Å
33	T	90.1	Very high	87.3	Confident	20 Å²	20	57.9 Å²	57.9	12%	0.123	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-18.8	-176.9	60.5	0	0	0	0	112.6	I38 K40 V74 I76	T33-I38 WeakPolarHBondContact CA-O 3.47Å; T33-I38 WeakPolarHBondContact CB-O 3.44Å; T33-I38 WeakPolarHBondContact CG2-O 3.46Å; T33-K40 HydrophobicContact CG2-CB 4.32Å; T33-V74 PolarHBondContact N-O 2.9Å; T33-V74 WeakPolarHBondContact OG1-CB 3.49Å; T33-V74 PolarHBondContact OG1-O 2.99Å; T33-V74 VanDerWaalsContact OG1-O 3.11Å; T33-I76 HydrophobicContact CG2-CB 4.42Å; T33-I76 HydrophobicContact CG2-CD1 3.92Å; T33-I76 HydrophobicContact CG2-CG1 3.9Å; T33-I76 HydrophobicContact CG2-CG2 3.84Å
34	T	88.6	Confident	86.9	Confident	83 Å²	83	53.9 Å²	53.9	51%	0.509	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-22.2	173.3	-44.8	0	0	0	0	113	C32 V74	C32-T34 PolarHBondContact O-N 3.41Å; T34-V74 PolarHBondContact OG1-N 3.18Å; T34-V74 VanDerWaalsContact OG1-N 3.15Å
35	C	88.1	Confident	86.6	Confident	70 Å²	70	51.7 Å²	51.7	47%	0.473	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.9	3.1	-176.7	-62.3	0	0	0	0	113	C32 H68 H73	C32-C35 HydrophobicContact CB-CB 4.05Å; C32-C35 PolarHBondContact O-N 3.35Å; C32-C35 VanDerWaalsContact O-N 3.12Å; C32-C35 PolarHBondContact SG-SG 2.94Å; C35-H68 PolarHBondContact SG-ND1 2.88Å; C35-H73 PolarHBondContact SG-CE1 2.87Å; C35-H73 PolarHBondContact SG-ND1 3.25Å
36	S	88.1	Confident	86.4	Confident	17 Å²	17	54.4 Å²	54.4	12%	0.119	29%	0.291	C	S	.	.	S	Bend	trans	-130.4	159.9	-179.5	65.3	0	0	0	0	108.7	I31 C32 I38 Y57	I31-S36 WeakPolarHBondContact CG2-OG 3.43Å; C32-S36 WeakPolarHBondContact O-CB 3.41Å; C32-S36 PolarHBondContact O-N 2.83Å; C32-S36 VanDerWaalsContact O-N 3.12Å; C32-S36 PolarHBondContact O-OG 3.01Å; S36-I38 PolarHBondContact O-N 3.49Å; S36-I38 VanDerWaalsContact O-N 3.15Å; S36-I38 PolarHBondContact OG-N 3.09Å; S36-Y57 VanDerWaalsContact CB-CD1 3.49Å
37	P	84.1	Confident	86.4	Confident	80 Å²	80	54.4 Å²	54.4	52%	0.519	29%	0.291	S	S	.	.	S	Bend	trans	-68.5	-3.2	172.1	29.5	-35.4	0	0	0	112.9	I39 Y57	P37-I39 PolarHBondContact O-N 2.95Å; P37-Y57 HydrophobicContact CG-CE1 4.35Å; P37-Y57 HydrophobicContact CG-CE2 4.36Å
38	I	85.5	Confident	86.3	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.005	28%	0.277	C	S	.	.			trans	-86.4	105.2	-176.2	-56.9	166.5	0	0	0	108.5	I31 T33 S36 A42 L47 V52 L54 Y57 I76 L81	I31-I38 HydrophobicContact CD1-CD1 3.98Å; I31-I38 HydrophobicContact CG2-CB 4.37Å; I31-I38 HydrophobicContact CG2-CD1 3.99Å; T33-I38 WeakPolarHBondContact CA-O 3.47Å; T33-I38 WeakPolarHBondContact CB-O 3.44Å; T33-I38 WeakPolarHBondContact CG2-O 3.46Å; S36-I38 PolarHBondContact O-N 3.49Å; S36-I38 VanDerWaalsContact O-N 3.15Å; S36-I38 PolarHBondContact OG-N 3.09Å; I38-A42 HydrophobicContact CG2-CB 4.44Å; I38-L47 HydrophobicContact CG1-CD2 4.19Å; I38-L47 HydrophobicContact CG2-CD1 4.22Å; I38-L47 HydrophobicContact CG2-CD2 4.29Å; I38-V52 HydrophobicContact CD1-CG1 3.91Å; I38-V52 HydrophobicContact CG1-CG1 4.02Å; I38-L54 HydrophobicContact CD1-CD2 3.62Å; I38-Y57 HydrophobicContact CD1-CD2 3.88Å; I38-Y57 HydrophobicContact CD1-CE2 4.44Å; I38-Y57 HydrophobicContact CD1-CG 4.44Å; I38-I76 HydrophobicContact CG2-CD1 3.89Å; I38-L81 HydrophobicContact CG2-CD2 4.18Å
39	I	83.9	Confident	86.2	Confident	116 Å²	116	53.7 Å²	53.7	60%	0.595	29%	0.288	S	S	*	.			trans	-73.8	152.3	176.7	-52.6	172.1	0	0	0	109.2	P37 D41 A42	P37-I39 PolarHBondContact O-N 2.95Å; I39-D41 PolarHBondContact O-N 3.16Å; I39-A42 HydrophobicContact CB-CB 4.44Å; I39-A42 WeakPolarHBondContact O-CB 3.42Å; I39-A42 PolarHBondContact O-N 3.49Å
40	K	76.7	Confident	85.9	Confident	130 Å²	130	59.9 Å²	59.9	57%	0.565	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-36.5	-179.8	-168.2	-168.5	-177.6	-176.9	0	113.3	T33 V74 I76	T33-K40 HydrophobicContact CG2-CB 4.32Å; K40-V74 HydrophobicContact CD-CG1 3.99Å; K40-V74 HydrophobicContact CG-CG1 4.29Å; K40-I76 HydrophobicContact CG-CG2 4.06Å
41	D	78.6	Confident	85.4	Confident	142 Å²	142	61.3 Å²	61.3	76%	0.759	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	14.2	-177.6	-51.6	-44.7	0	0	0	112.2	I39 H43	I39-D41 PolarHBondContact O-N 3.16Å; D41-H43 PolarHBondContact O-N 2.97Å
42	A	77.1	Confident	85.1	Confident	20 Å²	20	62.5 Å²	62.5	17%	0.165	35%	0.345	C	S	.	.			trans	-59.3	127.1	179.6	0	0	0	0	0	110.3	I38 I39 L47	I38-A42 HydrophobicContact CG2-CB 4.44Å; I39-A42 HydrophobicContact CB-CB 4.44Å; I39-A42 WeakPolarHBondContact O-CB 3.42Å; I39-A42 PolarHBondContact O-N 3.49Å; A42-L47 HydrophobicContact CB-CD1 4.15Å; A42-L47 HydrophobicContact CB-CD2 4.05Å; A42-L47 HydrophobicContact CB-CG 4.13Å
43	H	83.4	Confident	84.9	Confident	99 Å²	99	66.8 Å²	66.8	46%	0.458	37%	0.366	S	S	.	.			trans	-74.9	133.8	179.8	-159.8	-82.8	0	0	0	109.1	D41 T45 E46 L47	D41-H43 PolarHBondContact O-N 2.97Å; H43-T45 PolarHBondContact CE1-OG1 3.04Å; H43-T45 WeakPolarHBondContact ND1-CB 3.46Å; H43-T45 PolarHBondContact ND1-N 2.85Å; H43-T45 PolarHBondContact ND1-OG1 3.17Å; H43-T45 PolarHBondContact O-N 3.43Å; H43-T45 VanDerWaalsContact O-N 3.07Å; H43-E46 HydrophobicContact CB-CG 4.01Å; H43-E46 PolarHBondContact N-OE2 3.26Å; H43-E46 WeakPolarHBondContact O-CB 3.43Å; H43-E46 PolarHBondContact O-N 3Å; H43-L47 PolarHBondContact O-N 3.01Å
44	P	84.3	Confident	84.8	Confident	19 Å²	19	66.3 Å²	66.3	12%	0.123	36%	0.363	C	S	.	.	H	α-helix	trans	-52.1	-36.6	-179.7	-29.7	35.6	0	0	0	113.5	E46 L47 I48 L81 E84 M85 Q88	P44-E46 PolarHBondContact O-N 2.92Å; P44-L47 PolarHBondContact O-N 3.46Å; P44-I48 WeakPolarHBondContact O-CD1 3.43Å; P44-I48 VanDerWaalsContact O-CG1 3.24Å; P44-I48 WeakPolarHBondContact O-CG1 3.42Å; P44-I48 PolarHBondContact O-N 2.98Å; P44-I48 VanDerWaalsContact O-N 3.08Å; P44-L81 HydrophobicContact CG-CD1 4.45Å; P44-E84 HydrophobicContact CB-CG 4.14Å; P44-E84 HydrophobicContact CG-CB 4.13Å; P44-E84 HydrophobicContact CG-CG 3.61Å; P44-M85 HydrophobicContact CB-CG 3.88Å; P44-Q88 HydrophobicContact CB-CG 4.21Å
45	T	84.4	Confident	84.7	Confident	30 Å²	30	65.9 Å²	65.9	18%	0.184	36%	0.358	C	S	.	.	H	α-helix	trans	-58.4	-43.9	175.1	-46.6	0	0	0	0	113.3	H43 I48 E49	H43-T45 PolarHBondContact CE1-OG1 3.04Å; H43-T45 WeakPolarHBondContact ND1-CB 3.46Å; H43-T45 PolarHBondContact ND1-N 2.85Å; H43-T45 PolarHBondContact ND1-OG1 3.17Å; H43-T45 PolarHBondContact O-N 3.43Å; H43-T45 VanDerWaalsContact O-N 3.07Å; T45-I48 PolarHBondContact O-N 3.04Å; T45-E49 WeakPolarHBondContact O-CG 3.42Å; T45-E49 PolarHBondContact O-N 3.3Å; T45-E49 VanDerWaalsContact O-N 3.09Å
46	E	86.5	Confident	84.8	Confident	101 Å²	101	67.9 Å²	67.9	47%	0.472	36%	0.36	S	S	.	.	H	α-helix	trans	-67.4	-40.5	179.6	-64.2	168.8	173	0	0	110.6	H43 P44 I48 E49 Q50	H43-E46 HydrophobicContact CB-CG 4.01Å; H43-E46 PolarHBondContact N-OE2 3.26Å; H43-E46 WeakPolarHBondContact O-CB 3.43Å; H43-E46 PolarHBondContact O-N 3Å; P44-E46 PolarHBondContact O-N 2.92Å; E46-I48 VanDerWaalsContact C-N 3.3Å; E46-I48 PolarHBondContact O-N 3.29Å; E46-E49 PolarHBondContact O-N 3.09Å; E46-Q50 WeakPolarHBondContact O-CB 3.42Å; E46-Q50 VanDerWaalsContact O-CG 3.26Å; E46-Q50 WeakPolarHBondContact O-CG 3.48Å; E46-Q50 PolarHBondContact O-N 3.38Å
47	L	86.3	Confident	85	Confident	3 Å²	3	70.3 Å²	70.3	2%	0.016	37%	0.367	C	S	.	.	H	α-helix	trans	-64	-35.8	177.1	-64.3	175.5	0	0	0	112.2	I38 A42 H43 P44 G51 V52 L81 M85	I38-L47 HydrophobicContact CG1-CD2 4.19Å; I38-L47 HydrophobicContact CG2-CD1 4.22Å; I38-L47 HydrophobicContact CG2-CD2 4.29Å; A42-L47 HydrophobicContact CB-CD1 4.15Å; A42-L47 HydrophobicContact CB-CD2 4.05Å; A42-L47 HydrophobicContact CB-CG 4.13Å; H43-L47 PolarHBondContact O-N 3.01Å; P44-L47 PolarHBondContact O-N 3.46Å; L47-G51 PolarHBondContact O-N 3.28Å; L47-V52 HydrophobicContact CD2-CB 4.44Å; L47-V52 HydrophobicContact CD2-CG2 4.13Å; L47-V52 PolarHBondContact O-N 3.39Å; L47-L81 HydrophobicContact CD1-CD1 3.91Å; L47-L81 HydrophobicContact CD1-CD2 4.06Å; L47-L81 HydrophobicContact CD1-CG 4.34Å; L47-M85 HydrophobicContact CB-CE 3.76Å; L47-M85 HydrophobicContact CB-SD 3.94Å; L47-M85 HydrophobicContact CD1-SD 4.1Å
48	I	86.1	Confident	85.4	Confident	35 Å²	35	66.5 Å²	66.5	18%	0.179	34%	0.342	C	S	.	.	H	α-helix	trans	-67.6	-45.2	175	-65.4	162	0	0	0	110.3	P44 T45 E46 Q50 G51 M85 Q88 E89	P44-I48 WeakPolarHBondContact O-CD1 3.43Å; P44-I48 VanDerWaalsContact O-CG1 3.24Å; P44-I48 WeakPolarHBondContact O-CG1 3.42Å; P44-I48 PolarHBondContact O-N 2.98Å; P44-I48 VanDerWaalsContact O-N 3.08Å; T45-I48 PolarHBondContact O-N 3.04Å; E46-I48 VanDerWaalsContact C-N 3.3Å; E46-I48 PolarHBondContact O-N 3.29Å; I48-Q50 VanDerWaalsContact C-N 3.31Å; I48-Q50 PolarHBondContact O-N 3.08Å; I48-G51 PolarHBondContact O-N 2.91Å; I48-M85 HydrophobicContact CD1-CB 4.23Å; I48-M85 VanDerWaalsContact CD1-O 3.25Å; I48-M85 WeakPolarHBondContact CD1-O 3.35Å; I48-M85 HydrophobicContact CG1-CB 4.16Å; I48-M85 HydrophobicContact CG1-CE 3.74Å; I48-M85 HydrophobicContact CG1-CG 4.24Å; I48-Q88 HydrophobicContact CD1-CB 3.71Å; I48-E89 HydrophobicContact CD1-CB 4.43Å
49	E	86.3	Confident	85.9	Confident	134 Å²	134	67.1 Å²	67.1	63%	0.626	35%	0.345	S	S	*	.	H	α-helix	trans	-64.9	-35.4	179.8	-74.8	169.8	-165.4	0	0	112.7	T45 E46 G51 R92	T45-E49 WeakPolarHBondContact O-CG 3.42Å; T45-E49 PolarHBondContact O-N 3.3Å; T45-E49 VanDerWaalsContact O-N 3.09Å; E46-E49 PolarHBondContact O-N 3.09Å; E49-G51 PolarHBondContact O-N 2.84Å; E49-R92 IonicContact OE1-CZ 3.85Å; E49-R92 IonicContact OE1-NH2 2.72Å; E49-R92 PolarHBondContact OE1-NH2 3.37Å
50	Q	86.3	Confident	86.3	Confident	131 Å²	131	61.7 Å²	61.7	61%	0.612	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-9	173.8	-69.7	172.4	13	0	0	113.2	E46 I48 V52	E46-Q50 WeakPolarHBondContact O-CB 3.42Å; E46-Q50 VanDerWaalsContact O-CG 3.26Å; E46-Q50 WeakPolarHBondContact O-CG 3.48Å; E46-Q50 PolarHBondContact O-N 3.38Å; I48-Q50 VanDerWaalsContact C-N 3.31Å; I48-Q50 PolarHBondContact O-N 3.08Å; Q50-V52 VanDerWaalsContact C-N 3.32Å; Q50-V52 HydrophobicContact CB-CG2 3.77Å; Q50-V52 PolarHBondContact O-N 3.36Å
51	G	83.9	Confident	87	Confident	55 Å²	55	57.9 Å²	57.9	57%	0.567	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	30.9	-179.1	0	0	0	0	0	113.6	L47 I48 E49 I53	L47-G51 PolarHBondContact O-N 3.28Å; I48-G51 PolarHBondContact O-N 2.91Å; E49-G51 PolarHBondContact O-N 2.84Å; G51-I53 PolarHBondContact O-N 2.92Å
52	V	86.3	Confident	87.7	Confident	26 Å²	26	55.8 Å²	55.8	16%	0.158	30%	0.3	C	S	.	.			trans	-70	125.4	-174.8	-179	0	0	0	0	110.9	I38 L47 Q50 L54 Y57	I38-V52 HydrophobicContact CD1-CG1 3.91Å; I38-V52 HydrophobicContact CG1-CG1 4.02Å; L47-V52 HydrophobicContact CD2-CB 4.44Å; L47-V52 HydrophobicContact CD2-CG2 4.13Å; L47-V52 PolarHBondContact O-N 3.39Å; Q50-V52 VanDerWaalsContact C-N 3.32Å; Q50-V52 HydrophobicContact CB-CG2 3.77Å; Q50-V52 PolarHBondContact O-N 3.36Å; V52-L54 HydrophobicContact CG1-CD2 4.46Å; V52-L54 PolarHBondContact O-N 2.83Å; V52-Y57 HydrophobicContact CG1-CE2 4.12Å
53	I	87.4	Confident	88.4	Confident	91 Å²	91	55 Å²	55	47%	0.467	29%	0.294	S	S	.	.			trans	-93.2	99.3	176	-57.1	172.4	0	0	0	109.1	G51 N55 Q56	G51-I53 PolarHBondContact O-N 2.92Å; I53-N55 HydrophobicContact CG2-CB 4.26Å; I53-N55 PolarHBondContact O-N 3.5Å; I53-N55 VanDerWaalsContact O-N 3.14Å; I53-Q56 HydrophobicContact CB-CG 4.15Å; I53-Q56 HydrophobicContact CG2-CG 4.03Å; I53-Q56 WeakPolarHBondContact O-CB 3.43Å; I53-Q56 PolarHBondContact O-N 3.17Å; I53-Q56 VanDerWaalsContact O-N 3.15Å
54	L	88	Confident	88.8	Confident	10 Å²	10	50.8 Å²	50.8	5%	0.052	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-54.2	-35.3	-177	-61.4	-175.3	0	0	0	113.7	I31 I38 V52 Q56 Y57 L78 L81 R82 M85	I31-L54 HydrophobicContact CD1-CB 4.17Å; I31-L54 HydrophobicContact CD1-CD2 3.96Å; I38-L54 HydrophobicContact CD1-CD2 3.62Å; V52-L54 HydrophobicContact CG1-CD2 4.46Å; V52-L54 PolarHBondContact O-N 2.83Å; L54-Q56 PolarHBondContact O-N 3.16Å; L54-Q56 VanDerWaalsContact O-N 3.12Å; L54-Y57 PolarHBondContact O-N 3.02Å; L54-L78 HydrophobicContact CB-CD1 4.45Å; L54-L78 HydrophobicContact CB-CG 4.46Å; L54-L81 HydrophobicContact CD1-CD2 4.15Å; L54-L81 HydrophobicContact CD1-CG 4.11Å; L54-L81 HydrophobicContact CD2-CD2 3.77Å; L54-L81 HydrophobicContact CD2-CG 4.47Å; L54-R82 HydrophobicContact CD1-CB 3.86Å; L54-R82 HydrophobicContact CD1-CG 4.36Å; L54-M85 HydrophobicContact CD1-SD 3.69Å; L54-M85 HydrophobicContact CD2-SD 3.95Å; L54-M85 HydrophobicContact CG-SD 3.92Å
55	N	87.9	Confident	89.1	Confident	74 Å²	74	55 Å²	55	40%	0.396	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-59.8	-26.3	-177	-61.4	-6.9	0	0	0	113.1	L15 I53 Y57 A58	L15-N55 HydrophobicContact CD2-CB 4.05Å; L15-N55 VanDerWaalsContact CD2-CG 3.41Å; L15-N55 WeakPolarHBondContact CD2-OD1 3.49Å; I53-N55 HydrophobicContact CG2-CB 4.26Å; I53-N55 PolarHBondContact O-N 3.5Å; I53-N55 VanDerWaalsContact O-N 3.14Å; N55-Y57 PolarHBondContact O-N 3.44Å; N55-A58 PolarHBondContact O-N 2.83Å
56	Q	90.3	Very high	89.3	Confident	112 Å²	112	60.8 Å²	60.8	52%	0.523	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-71.6	-11	179	-64.7	178.4	-6.1	0	0	113.2	V18 I53 L54	V18-Q56 WeakPolarHBondContact CG2-O 3.42Å; I53-Q56 HydrophobicContact CB-CG 4.15Å; I53-Q56 HydrophobicContact CG2-CG 4.03Å; I53-Q56 WeakPolarHBondContact O-CB 3.43Å; I53-Q56 PolarHBondContact O-N 3.17Å; I53-Q56 VanDerWaalsContact O-N 3.15Å; L54-Q56 PolarHBondContact O-N 3.16Å; L54-Q56 VanDerWaalsContact O-N 3.12Å
57	Y	92.1	Very high	89.4	Confident	68 Å²	68	58.5 Å²	58.5	27%	0.267	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-119	11.5	-177.7	-54.3	-74.5	0	0	0	112.6	S36 P37 I38 V52 L54 N55 L59	S36-Y57 VanDerWaalsContact CB-CD1 3.49Å; P37-Y57 HydrophobicContact CG-CE1 4.35Å; P37-Y57 HydrophobicContact CG-CE2 4.36Å; I38-Y57 HydrophobicContact CD1-CD2 3.88Å; I38-Y57 HydrophobicContact CD1-CE2 4.44Å; I38-Y57 HydrophobicContact CD1-CG 4.44Å; V52-Y57 HydrophobicContact CG1-CE2 4.12Å; L54-Y57 PolarHBondContact O-N 3.02Å; N55-Y57 PolarHBondContact O-N 3.44Å; Y57-L59 PolarHBondContact O-N 3.38Å
58	A	93.1	Very high	89.5	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	126.3	-176.8	0	0	0	0	0	111.7	L15 C17 V18 N55 L78	L15-A58 HydrophobicContact CB-CB 4.36Å; L15-A58 HydrophobicContact CD1-CB 4.34Å; C17-A58 WeakPolarHBondContact CA-O 3.49Å; V18-A58 WeakPolarHBondContact CG2-O 3.47Å; V18-A58 PolarHBondContact N-O 3.01Å; N55-A58 PolarHBondContact O-N 2.83Å; A58-L78 HydrophobicContact CB-CD1 3.78Å
59	L	94.2	Very high	89.5	Confident	13 Å²	13	61.4 Å²	61.4	7%	0.068	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	131.4	176.8	-66.8	168	0	0	0	109.7	V18 T29 N30 C32 Y57 L64 H68	V18-L59 HydrophobicContact CB-CD2 4.5Å; T29-L59 WeakPolarHBondContact CA-O 3.47Å; N30-L59 PolarHBondContact N-O 3.15Å; N30-L59 WeakPolarHBondContact O-CB 3.49Å; N30-L59 PolarHBondContact O-N 3.36Å; C32-L59 HydrophobicContact CB-CD1 3.61Å; Y57-L59 PolarHBondContact O-N 3.38Å; L59-L64 HydrophobicContact CD1-CD1 4.34Å; L59-H68 VanDerWaalsContact CD1-CE1 3.49Å; L59-H68 WeakPolarHBondContact CD1-CE1 3.46Å; L59-H68 WeakPolarHBondContact CD1-NE2 3.05Å
60	C	94.1	Very high	89.4	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.014	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	153.9	170.3	73.4	0	0	0	0	110.8	C17 Y24 T62 C63 L64	C17-C60 HydrophobicContact CB-CB 4.02Å; C17-C60 PolarHBondContact SG-N 3.35Å; C17-C60 VanDerWaalsContact SG-SG 3.66Å; Y24-C60 HydrophobicContact CD1-CB 3.96Å; Y24-C60 HydrophobicContact CD2-CB 3.47Å; Y24-C60 VanDerWaalsContact CD2-CB 3.47Å; Y24-C60 HydrophobicContact CE1-CB 3.84Å; Y24-C60 HydrophobicContact CE2-CB 3.33Å; Y24-C60 HydrophobicContact CG-CB 3.78Å; C60-T62 PolarHBondContact O-N 2.88Å; C60-T62 VanDerWaalsContact O-N 3.1Å; C60-C63 PolarHBondContact O-N 2.95Å; C60-C63 VanDerWaalsContact O-N 3.11Å; C60-C63 PolarHBondContact SG-N 3.1Å; C60-L64 WeakPolarHBondContact O-CB 3.48Å; C60-L64 PolarHBondContact O-N 3.38Å
61	S	91.3	Very high	89.4	Confident	51 Å²	51	63.6 Å²	63.6	36%	0.357	32%	0.324	S	S	.	.	H	α-helix	trans	-52.8	-34.3	179.9	-56.7	0	0	0	0	113.6	D28 L65	D28-S61 PolarHBondContact O-OG 3.27Å; S61-L65 WeakPolarHBondContact O-CB 3.43Å; S61-L65 VanDerWaalsContact O-CG 3.27Å; S61-L65 WeakPolarHBondContact O-CG 3.3Å; S61-L65 PolarHBondContact O-N 3.38Å
62	T	91.9	Very high	89.6	Confident	97 Å²	97	68.1 Å²	68.1	60%	0.595	34%	0.336	S	S	*	.	H	α-helix	trans	-68.3	-47.4	178.1	-48	0	0	0	0	112.5	C60 L64 L65 R66	C60-T62 PolarHBondContact O-N 2.88Å; C60-T62 VanDerWaalsContact O-N 3.1Å; T62-L64 VanDerWaalsContact C-N 3.29Å; T62-L64 PolarHBondContact O-N 3.17Å; T62-L65 PolarHBondContact O-N 2.91Å; T62-R66 WeakPolarHBondContact O-CB 3.37Å; T62-R66 PolarHBondContact O-N 3.47Å
63	C	92.6	Very high	89.8	Confident	5 Å²	5	69.2 Å²	69.2	3%	0.034	34%	0.339	C	S	.	.	H	α-helix	trans	-64.5	-39.9	176.3	-69.8	0	0	0	0	110.4	C17 C60 R66 D67 H68	C17-C63 VanDerWaalsContact SG-SG 3.68Å; C60-C63 PolarHBondContact O-N 2.95Å; C60-C63 VanDerWaalsContact O-N 3.11Å; C60-C63 PolarHBondContact SG-N 3.1Å; C63-R66 PolarHBondContact O-N 3.25Å; C63-D67 PolarHBondContact O-N 3.02Å; C63-H68 PolarHBondContact O-CD2 2.91Å
64	L	91.9	Very high	89.9	Confident	9 Å²	9	67.9 Å²	67.9	5%	0.047	34%	0.335	C	S	.	.	I	π-helix	trans	-58.2	-50.8	176.4	-171.4	75.3	0	0	0	111.9	N30 L59 C60 T62 H68 I69	N30-L64 HydrophobicContact CB-CD1 4.46Å; N30-L64 HydrophobicContact CB-CD2 3.83Å; L59-L64 HydrophobicContact CD1-CD1 4.34Å; C60-L64 WeakPolarHBondContact O-CB 3.48Å; C60-L64 PolarHBondContact O-N 3.38Å; T62-L64 VanDerWaalsContact C-N 3.29Å; T62-L64 PolarHBondContact O-N 3.17Å; L64-H68 HydrophobicContact CD1-CB 4.02Å; L64-H68 WeakPolarHBondContact O-CA 3.49Å; L64-H68 WeakPolarHBondContact O-CB 3.4Å; L64-H68 PolarHBondContact O-N 3.42Å; L64-H68 VanDerWaalsContact O-N 3.12Å; L64-I69 HydrophobicContact CD2-CD1 3.86Å; L64-I69 HydrophobicContact CG-CD1 3.86Å; L64-I69 HydrophobicContact CG-CG1 4.14Å; L64-I69 PolarHBondContact O-N 3.41Å
65	L	90	Very high	90.1	Very high	109 Å²	109	69.5 Å²	69.5	57%	0.571	35%	0.347	S	S	*	.	I	π-helix	trans	-63.6	-43.7	179.6	-75.1	167	0	0	0	112.2	S61 T62 I69	S61-L65 WeakPolarHBondContact O-CB 3.43Å; S61-L65 VanDerWaalsContact O-CG 3.27Å; S61-L65 WeakPolarHBondContact O-CG 3.3Å; S61-L65 PolarHBondContact O-N 3.38Å; T62-L65 PolarHBondContact O-N 2.91Å; L65-I69 HydrophobicContact CD2-CD1 3.72Å; L65-I69 HydrophobicContact CG-CD1 4.31Å
66	R	89.3	Confident	90.2	Very high	151 Å²	151	67.5 Å²	67.5	57%	0.57	34%	0.336	S	S	*	.	I	π-helix	trans	-70.8	-48.2	-174.7	-168.5	-176.5	70.1	-167.7	-3.4	112.7	T62 C63	T62-R66 WeakPolarHBondContact O-CB 3.37Å; T62-R66 PolarHBondContact O-N 3.47Å; C63-R66 PolarHBondContact O-N 3.25Å
67	D	88.3	Confident	90.3	Very high	52 Å²	52	64.2 Å²	64.2	28%	0.278	33%	0.325	S	S	.	.	I	π-helix	trans	-112.7	-13.4	-162.4	-61.9	-35.1	0	0	0	114.2	C63 K71	C63-D67 PolarHBondContact O-N 3.02Å; D67-K71 VanDerWaalsContact O-CD 3.24Å; D67-K71 WeakPolarHBondContact O-CD 3.42Å; D67-K71 WeakPolarHBondContact O-CE 3.46Å; D67-K71 PolarHBondContact O-NZ 2.96Å
68	H	88.9	Confident	90.2	Very high	27 Å²	27	61 Å²	61	13%	0.125	31%	0.313	C	S	.	.	I	π-helix	trans	-117.5	-58	-175.9	-59.6	-100.2	0	0	0	112.2	C32 C35 L59 C63 L64 K70 K71 N72 H73	C32-H68 WeakPolarHBondContact CB-ND1 3.45Å; C32-H68 PolarHBondContact SG-ND1 3.12Å; C35-H68 PolarHBondContact SG-ND1 2.88Å; L59-H68 VanDerWaalsContact CD1-CE1 3.49Å; L59-H68 WeakPolarHBondContact CD1-CE1 3.46Å; L59-H68 WeakPolarHBondContact CD1-NE2 3.05Å; C63-H68 PolarHBondContact O-CD2 2.91Å; L64-H68 HydrophobicContact CD1-CB 4.02Å; L64-H68 WeakPolarHBondContact O-CA 3.49Å; L64-H68 WeakPolarHBondContact O-CB 3.4Å; L64-H68 PolarHBondContact O-N 3.42Å; L64-H68 VanDerWaalsContact O-N 3.12Å; H68-K70 VanDerWaalsContact C-N 3.32Å; H68-K70 PolarHBondContact O-N 3.48Å; H68-K71 CarbonylContact O-C 3.56Å; H68-K71 WeakPolarHBondContact O-CA 3.4Å; H68-K71 PolarHBondContact O-N 3.31Å; H68-N72 PolarHBondContact O-N 2.97Å; H68-H73 HydrophobicContact CB-CB 4.03Å; H68-H73 AromaticContact ND1-ND1 3.62Å; H68-H73 WeakPolarHBondContact O-CB 3.46Å; H68-H73 PolarHBondContact O-N 3.42Å
69	I	85.4	Confident	90	Very high	72 Å²	72	64.4 Å²	64.4	37%	0.369	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-63.4	-40.3	-178.1	-69.5	168.6	0	0	0	110.7	L64 L65 K71 N72	L64-I69 HydrophobicContact CD2-CD1 3.86Å; L64-I69 HydrophobicContact CG-CD1 3.86Å; L64-I69 HydrophobicContact CG-CG1 4.14Å; L64-I69 PolarHBondContact O-N 3.41Å; L65-I69 HydrophobicContact CD2-CD1 3.72Å; L65-I69 HydrophobicContact CG-CD1 4.31Å; I69-K71 PolarHBondContact O-N 3.25Å; I69-K71 VanDerWaalsContact O-N 3.1Å; I69-N72 PolarHBondContact O-N 2.93Å
70	K	83.7	Confident	89.8	Confident	179 Å²	179	67.6 Å²	67.6	78%	0.778	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	-58.4	-23.5	174.3	-169	177.3	179.3	-177.9	0	113.4	H68	H68-K70 VanDerWaalsContact C-N 3.32Å; H68-K70 PolarHBondContact O-N 3.48Å
71	K	86.5	Confident	89.5	Confident	133 Å²	133	68.6 Å²	68.6	58%	0.578	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-98.9	15	177.8	-59.8	-176.4	-171.5	162.4	0	113	D67 H68 I69 H73	D67-K71 VanDerWaalsContact O-CD 3.24Å; D67-K71 WeakPolarHBondContact O-CD 3.42Å; D67-K71 WeakPolarHBondContact O-CE 3.46Å; D67-K71 PolarHBondContact O-NZ 2.96Å; H68-K71 CarbonylContact O-C 3.56Å; H68-K71 WeakPolarHBondContact O-CA 3.4Å; H68-K71 PolarHBondContact O-N 3.31Å; I69-K71 PolarHBondContact O-N 3.25Å; I69-K71 VanDerWaalsContact O-N 3.1Å; K71-H73 VanDerWaalsContact C-N 3.25Å; K71-H73 PolarHBondContact O-CD2 3.28Å; K71-H73 PolarHBondContact O-N 2.69Å
72	N	87.6	Confident	89.4	Confident	150 Å²	150	69.6 Å²	69.6	80%	0.802	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	28.2	-176.2	-59.6	-33.5	0	0	0	114.4	H68 I69	H68-N72 PolarHBondContact O-N 2.97Å; I69-N72 PolarHBondContact O-N 2.93Å
73	H	92.3	Very high	89.3	Confident	49 Å²	49	68.4 Å²	68.4	23%	0.227	34%	0.344	C	S	.	.			trans	-75.9	152.2	172.7	-64.5	-175.6	0	0	0	111.4	C32 C35 H68 K71	C32-H73 VanDerWaalsContact SG-CB 3.57Å; C35-H73 PolarHBondContact SG-CE1 2.87Å; C35-H73 PolarHBondContact SG-ND1 3.25Å; H68-H73 HydrophobicContact CB-CB 4.03Å; H68-H73 AromaticContact ND1-ND1 3.62Å; H68-H73 WeakPolarHBondContact O-CB 3.46Å; H68-H73 PolarHBondContact O-N 3.42Å; K71-H73 VanDerWaalsContact C-N 3.25Å; K71-H73 PolarHBondContact O-CD2 3.28Å; K71-H73 PolarHBondContact O-N 2.69Å
74	V	89.4	Confident	89.1	Confident	63 Å²	63	70.8 Å²	70.8	38%	0.382	35%	0.354	S	S	.	.			trans	-96	145.2	177.1	-179.9	0	0	0	0	109.8	C32 T33 T34 K40	C32-V74 CarbonylContact C-O 3.56Å; C32-V74 WeakPolarHBondContact CA-O 3.42Å; T33-V74 PolarHBondContact N-O 2.9Å; T33-V74 WeakPolarHBondContact OG1-CB 3.49Å; T33-V74 PolarHBondContact OG1-O 2.99Å; T33-V74 VanDerWaalsContact OG1-O 3.11Å; T34-V74 PolarHBondContact OG1-N 3.18Å; T34-V74 VanDerWaalsContact OG1-N 3.15Å; K40-V74 HydrophobicContact CD-CG1 3.99Å; K40-V74 HydrophobicContact CG-CG1 4.29Å
75	S	90.5	Very high	89	Confident	44 Å²	44	71.4 Å²	71.4	31%	0.308	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	154.2	-179.7	63.4	0	0	0	0	113	I31	I31-S75 CarbonylContact O-C 3.54Å; I31-S75 WeakPolarHBondContact O-CA 3.38Å; I31-S75 WeakPolarHBondContact O-CB 3.49Å
76	I	91.4	Very high	88.9	Confident	31 Å²	31	71.1 Å²	71.1	16%	0.159	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	151.3	173.6	60.4	-179.4	0	0	0	109.5	N30 I31 T33 I38 K40 L81	N30-I76 CarbonylContact C-O 3.53Å; N30-I76 WeakPolarHBondContact CA-O 3.34Å; I31-I76 HydrophobicContact CB-CG1 3.98Å; I31-I76 HydrophobicContact CG2-CG1 4.49Å; I31-I76 PolarHBondContact N-O 3.06Å; I31-I76 PolarHBondContact O-N 2.89Å; T33-I76 HydrophobicContact CG2-CB 4.42Å; T33-I76 HydrophobicContact CG2-CD1 3.92Å; T33-I76 HydrophobicContact CG2-CG1 3.9Å; T33-I76 HydrophobicContact CG2-CG2 3.84Å; I38-I76 HydrophobicContact CG2-CD1 3.89Å; K40-I76 HydrophobicContact CG-CG2 4.06Å; I76-L81 HydrophobicContact CD1-CD2 3.8Å
77	S	91	Very high	89	Confident	44 Å²	44	71 Å²	71	31%	0.308	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	136.8	174.9	-177.3	0	0	0	0	110	P80	S77-P80 VanDerWaalsContact OG-CD 3.28Å; S77-P80 WeakPolarHBondContact OG-CD 3.45Å
78	L	90.5	Very high	89.1	Confident	0 Å²	0	70.3 Å²	70.3	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-72	-43.2	-175.3	-173.2	151.9	0	0	0	111.8	L15 E26 T29 I31 L54 A58 L81 R82	L15-L78 HydrophobicContact CD1-CD1 3.8Å; L15-L78 HydrophobicContact CD1-CD2 3.69Å; L15-L78 HydrophobicContact CD1-CG 4.44Å; E26-L78 HydrophobicContact CG-CD2 3.51Å; T29-L78 WeakPolarHBondContact O-CB 3.36Å; T29-L78 PolarHBondContact O-N 3.25Å; I31-L78 HydrophobicContact CD1-CB 4.3Å; I31-L78 HydrophobicContact CD1-CD1 4.01Å; I31-L78 HydrophobicContact CD1-CG 4Å; I31-L78 HydrophobicContact CG1-CB 4.22Å; I31-L78 HydrophobicContact CG1-CD1 3.97Å; I31-L78 HydrophobicContact CG1-CG 4.26Å; L54-L78 HydrophobicContact CB-CD1 4.45Å; L54-L78 HydrophobicContact CB-CG 4.46Å; A58-L78 HydrophobicContact CB-CD1 3.78Å; L78-L81 PolarHBondContact O-N 2.95Å; L78-R82 HydrophobicContact CD2-CB 4.4Å; L78-R82 PolarHBondContact O-N 2.96Å
79	Q	89.5	Confident	89.1	Confident	71 Å²	71	71.7 Å²	71.7	33%	0.332	35%	0.354	S	S	.	.	H	α-helix	trans	-62.6	-49.4	-171.9	-177.9	-173.2	16.6	0	0	113.5	E26 L81 R82 V83	E26-Q79 HydrophobicContact CG-CB 4.25Å; E26-Q79 WeakPolarHBondContact OE1-CA 3.42Å; Q79-L81 VanDerWaalsContact C-N 3.26Å; Q79-L81 PolarHBondContact O-N 3.42Å; Q79-R82 PolarHBondContact O-N 3.36Å; Q79-V83 HydrophobicContact CG-CG2 4.38Å; Q79-V83 VanDerWaalsContact O-CG2 3.32Å; Q79-V83 WeakPolarHBondContact O-CG2 3.42Å; Q79-V83 PolarHBondContact O-N 3.27Å
80	P	89.4	Confident	89.4	Confident	80 Å²	80	71.5 Å²	71.5	52%	0.519	35%	0.354	S	S	.	.	H	α-helix	trans	-59.3	-38.9	177.8	-24.1	35.4	0	0	0	112.6	S77 V83 E84	S77-P80 VanDerWaalsContact OG-CD 3.28Å; S77-P80 WeakPolarHBondContact OG-CD 3.45Å; P80-V83 PolarHBondContact O-N 3.38Å; P80-E84 PolarHBondContact O-N 3.33Å
81	L	88.1	Confident	89.8	Confident	23 Å²	23	67.7 Å²	67.7	12%	0.12	34%	0.339	C	S	.	.	H	α-helix	trans	-65.5	-45.9	177.7	-177.7	64.6	0	0	0	111.6	I31 I38 P44 L47 L54 I76 L78 Q79 V83 E84 M85	I31-L81 HydrophobicContact CD1-CD2 4.29Å; I38-L81 HydrophobicContact CG2-CD2 4.18Å; P44-L81 HydrophobicContact CG-CD1 4.45Å; L47-L81 HydrophobicContact CD1-CD1 3.91Å; L47-L81 HydrophobicContact CD1-CD2 4.06Å; L47-L81 HydrophobicContact CD1-CG 4.34Å; L54-L81 HydrophobicContact CD1-CD2 4.15Å; L54-L81 HydrophobicContact CD1-CG 4.11Å; L54-L81 HydrophobicContact CD2-CD2 3.77Å; L54-L81 HydrophobicContact CD2-CG 4.47Å; I76-L81 HydrophobicContact CD1-CD2 3.8Å; L78-L81 PolarHBondContact O-N 2.95Å; Q79-L81 VanDerWaalsContact C-N 3.26Å; Q79-L81 PolarHBondContact O-N 3.42Å; L81-V83 VanDerWaalsContact C-N 3.34Å; L81-V83 PolarHBondContact O-N 2.93Å; L81-E84 PolarHBondContact O-N 3.29Å; L81-M85 HydrophobicContact CG-SD 4.44Å; L81-M85 WeakPolarHBondContact O-CG 3.4Å; L81-M85 PolarHBondContact O-N 2.73Å
82	R	89	Confident	90	Very high	72 Å²	72	65.9 Å²	65.9	27%	0.272	33%	0.328	S	S	.	.	H	α-helix	trans	-60.4	-44.1	177.2	-169.9	-171.6	67.3	140.8	-1.8	111.5	E26 L54 L78 Q79 M85 Q86	E26-R82 VanDerWaalsContact CD-NH2 3.34Å; E26-R82 VanDerWaalsContact OE1-CD 3.27Å; E26-R82 WeakPolarHBondContact OE1-CD 3.34Å; E26-R82 IonicContact OE1-CZ 3.19Å; E26-R82 IonicContact OE1-NE 2.61Å; E26-R82 PolarHBondContact OE1-NE 3.43Å; E26-R82 IonicContact OE1-NH2 3.93Å; E26-R82 PolarHBondContact OE1-NH2 2.98Å; E26-R82 IonicContact OE2-CZ 2.94Å; E26-R82 IonicContact OE2-NE 3.3Å; E26-R82 PolarHBondContact OE2-NE 2.99Å; E26-R82 IonicContact OE2-NH1 3.59Å; E26-R82 IonicContact OE2-NH2 3.12Å; E26-R82 PolarHBondContact OE2-NH2 3.15Å; L54-R82 HydrophobicContact CD1-CB 3.86Å; L54-R82 HydrophobicContact CD1-CG 4.36Å; L78-R82 HydrophobicContact CD2-CB 4.4Å; L78-R82 PolarHBondContact O-N 2.96Å; Q79-R82 PolarHBondContact O-N 3.36Å; R82-M85 PolarHBondContact O-N 3.03Å; R82-Q86 WeakPolarHBondContact O-CB 3.33Å; R82-Q86 PolarHBondContact O-N 3.14Å
83	V	89.2	Confident	90.2	Very high	72 Å²	72	65.8 Å²	65.8	44%	0.436	32%	0.317	S	S	.	.	H	α-helix	trans	-62	-43.8	179	170.7	0	0	0	0	110.8	Q79 P80 L81 Q86 R87	Q79-V83 HydrophobicContact CG-CG2 4.38Å; Q79-V83 VanDerWaalsContact O-CG2 3.32Å; Q79-V83 WeakPolarHBondContact O-CG2 3.42Å; Q79-V83 PolarHBondContact O-N 3.27Å; P80-V83 PolarHBondContact O-N 3.38Å; L81-V83 VanDerWaalsContact C-N 3.34Å; L81-V83 PolarHBondContact O-N 2.93Å; V83-Q86 PolarHBondContact O-N 3.08Å; V83-R87 WeakPolarHBondContact O-CB 3.44Å; V83-R87 PolarHBondContact O-N 3.42Å
84	E	89.3	Confident	90.2	Very high	56 Å²	56	67.9 Å²	67.9	26%	0.262	33%	0.329	S	S	.	.	H	α-helix	trans	-69.2	-39.1	178.5	-168.6	60.2	-151.1	0	0	111.8	P44 P80 L81 Q86 R87 Q88	P44-E84 HydrophobicContact CB-CG 4.14Å; P44-E84 HydrophobicContact CG-CB 4.13Å; P44-E84 HydrophobicContact CG-CG 3.61Å; P80-E84 PolarHBondContact O-N 3.33Å; L81-E84 PolarHBondContact O-N 3.29Å; E84-Q86 VanDerWaalsContact C-N 3.34Å; E84-Q86 PolarHBondContact O-N 3.26Å; E84-R87 WeakPolarHBondContact O-CB 3.47Å; E84-R87 PolarHBondContact O-N 2.77Å; E84-R87 IonicContact OE1-CZ 2.6Å; E84-R87 IonicContact OE1-NH1 3.32Å; E84-R87 PolarHBondContact OE1-NH1 3.36Å; E84-R87 WeakPolarHBondContact OE2-CD 3.45Å; E84-R87 IonicContact OE2-NH1 3.3Å; E84-R87 PolarHBondContact OE2-NH1 2.91Å; E84-R87 VanDerWaalsContact OE2-NH1 3.12Å; E84-Q88 WeakPolarHBondContact O-CG 3.47Å; E84-Q88 PolarHBondContact O-N 3.33Å; E84-Q88 PolarHBondContact OE1-NE2 3.35Å; E84-Q88 VanDerWaalsContact OE1-NE2 3.08Å
85	M	88.8	Confident	90.5	Very high	22 Å²	22	68 Å²	68	11%	0.108	33%	0.33	C	S	.	.	H	α-helix	trans	-58.9	-45.6	171.6	-74.6	179.8	69.6	0	0	111.6	P44 L47 I48 L54 L81 R82 R87 Q88 E89	P44-M85 HydrophobicContact CB-CG 3.88Å; L47-M85 HydrophobicContact CB-CE 3.76Å; L47-M85 HydrophobicContact CB-SD 3.94Å; L47-M85 HydrophobicContact CD1-SD 4.1Å; I48-M85 HydrophobicContact CD1-CB 4.23Å; I48-M85 VanDerWaalsContact CD1-O 3.25Å; I48-M85 WeakPolarHBondContact CD1-O 3.35Å; I48-M85 HydrophobicContact CG1-CB 4.16Å; I48-M85 HydrophobicContact CG1-CE 3.74Å; I48-M85 HydrophobicContact CG1-CG 4.24Å; L54-M85 HydrophobicContact CD1-SD 3.69Å; L54-M85 HydrophobicContact CD2-SD 3.95Å; L54-M85 HydrophobicContact CG-SD 3.92Å; L81-M85 HydrophobicContact CG-SD 4.44Å; L81-M85 WeakPolarHBondContact O-CG 3.4Å; L81-M85 PolarHBondContact O-N 2.73Å; R82-M85 PolarHBondContact O-N 3.03Å; M85-R87 VanDerWaalsContact C-N 3.31Å; M85-R87 PolarHBondContact O-N 3.08Å; M85-Q88 PolarHBondContact O-N 2.86Å; M85-E89 WeakPolarHBondContact O-CB 3.4Å; M85-E89 PolarHBondContact O-N 2.95Å
86	Q	89.3	Confident	90.6	Very high	103 Å²	103	67.3 Å²	67.3	48%	0.481	33%	0.329	S	S	.	.	H	α-helix	trans	-63.3	-38.1	177.2	-173.7	177.2	7.2	0	0	112	R82 V83 E84 E89 N90	R82-Q86 WeakPolarHBondContact O-CB 3.33Å; R82-Q86 PolarHBondContact O-N 3.14Å; V83-Q86 PolarHBondContact O-N 3.08Å; E84-Q86 VanDerWaalsContact C-N 3.34Å; E84-Q86 PolarHBondContact O-N 3.26Å; Q86-E89 PolarHBondContact O-N 3.27Å; Q86-N90 WeakPolarHBondContact O-CB 3.42Å; Q86-N90 PolarHBondContact O-N 3.23Å; Q86-N90 PolarHBondContact O-ND2 3.49Å
87	R	90.2	Very high	90.8	Very high	148 Å²	148	71.5 Å²	71.5	56%	0.558	35%	0.351	S	S	*	.	H	α-helix	trans	-61.4	-47.6	174.9	-179.6	-171.2	171.3	-165.2	-0.7	111.6	V83 E84 M85 N90 Q91	V83-R87 WeakPolarHBondContact O-CB 3.44Å; V83-R87 PolarHBondContact O-N 3.42Å; E84-R87 WeakPolarHBondContact O-CB 3.47Å; E84-R87 PolarHBondContact O-N 2.77Å; E84-R87 IonicContact OE1-CZ 2.6Å; E84-R87 IonicContact OE1-NH1 3.32Å; E84-R87 PolarHBondContact OE1-NH1 3.36Å; E84-R87 WeakPolarHBondContact OE2-CD 3.45Å; E84-R87 IonicContact OE2-NH1 3.3Å; E84-R87 PolarHBondContact OE2-NH1 2.91Å; E84-R87 VanDerWaalsContact OE2-NH1 3.12Å; M85-R87 VanDerWaalsContact C-N 3.31Å; M85-R87 PolarHBondContact O-N 3.08Å; R87-N90 PolarHBondContact O-N 2.9Å; R87-Q91 WeakPolarHBondContact O-CB 3.41Å; R87-Q91 PolarHBondContact O-N 3.24Å
88	Q	91.4	Very high	90.9	Very high	37 Å²	37	74.4 Å²	74.4	17%	0.173	36%	0.36	C	S	.	.	H	α-helix	trans	-62.4	-43.2	178.4	-67	-59.4	-34.8	0	0	111.6	P44 I48 E84 M85 Q91 R92	P44-Q88 HydrophobicContact CB-CG 4.21Å; I48-Q88 HydrophobicContact CD1-CB 3.71Å; E84-Q88 WeakPolarHBondContact O-CG 3.47Å; E84-Q88 PolarHBondContact O-N 3.33Å; E84-Q88 PolarHBondContact OE1-NE2 3.35Å; E84-Q88 VanDerWaalsContact OE1-NE2 3.08Å; M85-Q88 PolarHBondContact O-N 2.86Å; Q88-Q91 PolarHBondContact O-N 3.16Å; Q88-R92 WeakPolarHBondContact O-CG 3.35Å; Q88-R92 PolarHBondContact O-N 3.16Å
89	E	89.4	Confident	91.1	Very high	56 Å²	56	79 Å²	79	26%	0.262	39%	0.385	S	S	.	.	H	α-helix	trans	-62.7	-44.1	175.3	179.3	59.1	-160.9	0	0	112.2	I48 M85 Q86 Q91 R92 R93	I48-E89 HydrophobicContact CD1-CB 4.43Å; M85-E89 WeakPolarHBondContact O-CB 3.4Å; M85-E89 PolarHBondContact O-N 2.95Å; Q86-E89 PolarHBondContact O-N 3.27Å; E89-Q91 VanDerWaalsContact C-N 3.32Å; E89-Q91 PolarHBondContact O-N 3.06Å; E89-R92 WeakPolarHBondContact O-CB 3.35Å; E89-R92 PolarHBondContact O-N 3.31Å; E89-R93 WeakPolarHBondContact O-CG 3.37Å; E89-R93 PolarHBondContact O-N 3.43Å; E89-R93 IonicContact OE1-CZ 3.38Å; E89-R93 IonicContact OE1-NE 2.88Å; E89-R93 PolarHBondContact OE1-NE 3.29Å; E89-R93 IonicContact OE1-NH2 3Å; E89-R93 PolarHBondContact OE1-NH2 3.5Å
90	N	91.2	Very high	91.4	Very high	68 Å²	68	80.4 Å²	80.4	36%	0.364	40%	0.395	S	S	.	.	H	α-helix	trans	-62.5	-40.5	175.1	-74.9	-17.6	0	0	0	111.8	Q86 R87 R93 I94	Q86-N90 WeakPolarHBondContact O-CB 3.42Å; Q86-N90 PolarHBondContact O-N 3.23Å; Q86-N90 PolarHBondContact O-ND2 3.49Å; R87-N90 PolarHBondContact O-N 2.9Å; N90-R93 PolarHBondContact O-N 2.97Å; N90-I94 VanDerWaalsContact O-CG1 3.28Å; N90-I94 WeakPolarHBondContact O-CG1 3.47Å; N90-I94 PolarHBondContact O-N 3.17Å
91	Q	92.3	Very high	91.6	Very high	99 Å²	99	81.8 Å²	81.8	46%	0.463	40%	0.397	S	S	.	.	H	α-helix	trans	-61	-45.3	176.1	-177.4	175	-12.3	0	0	111.3	R87 Q88 E89 R93 I94 V95	R87-Q91 WeakPolarHBondContact O-CB 3.41Å; R87-Q91 PolarHBondContact O-N 3.24Å; Q88-Q91 PolarHBondContact O-N 3.16Å; E89-Q91 VanDerWaalsContact C-N 3.32Å; E89-Q91 PolarHBondContact O-N 3.06Å; Q91-R93 VanDerWaalsContact C-N 3.31Å; Q91-R93 PolarHBondContact O-N 3.39Å; Q91-I94 PolarHBondContact O-N 2.85Å; Q91-V95 WeakPolarHBondContact O-CG2 3.34Å; Q91-V95 PolarHBondContact O-N 2.89Å
92	R	90.4	Very high	91.9	Very high	96 Å²	96	85.5 Å²	85.5	36%	0.362	41%	0.413	S	S	.	.	H	α-helix	trans	-56.5	-45	174.4	-73.5	173.5	171.9	-170	-10.9	111.8	E49 Q88 E89 V95 G96	E49-R92 IonicContact OE1-CZ 3.85Å; E49-R92 IonicContact OE1-NH2 2.72Å; E49-R92 PolarHBondContact OE1-NH2 3.37Å; Q88-R92 WeakPolarHBondContact O-CG 3.35Å; Q88-R92 PolarHBondContact O-N 3.16Å; E89-R92 WeakPolarHBondContact O-CB 3.35Å; E89-R92 PolarHBondContact O-N 3.31Å; R92-V95 PolarHBondContact O-N 3.47Å; R92-G96 PolarHBondContact O-N 2.71Å
93	R	91.1	Very high	92.1	Very high	147 Å²	147	87.7 Å²	87.7	56%	0.555	43%	0.425	S	S	*	.	H	α-helix	trans	-64.1	-43.8	177.7	-69.6	174	-171.4	-169.5	1.9	112.5	E89 N90 Q91 V95 G96 L97	E89-R93 WeakPolarHBondContact O-CG 3.37Å; E89-R93 PolarHBondContact O-N 3.43Å; E89-R93 IonicContact OE1-CZ 3.38Å; E89-R93 IonicContact OE1-NE 2.88Å; E89-R93 PolarHBondContact OE1-NE 3.29Å; E89-R93 IonicContact OE1-NH2 3Å; E89-R93 PolarHBondContact OE1-NH2 3.5Å; N90-R93 PolarHBondContact O-N 2.97Å; Q91-R93 VanDerWaalsContact C-N 3.31Å; Q91-R93 PolarHBondContact O-N 3.39Å; R93-V95 VanDerWaalsContact C-N 3.35Å; R93-V95 PolarHBondContact O-N 3.41Å; R93-G96 PolarHBondContact O-N 2.87Å; R93-L97 WeakPolarHBondContact O-CB 3.26Å; R93-L97 WeakPolarHBondContact O-CG 3.49Å; R93-L97 PolarHBondContact O-N 3.46Å
94	I	93.5	Very high	92.3	Very high	94 Å²	94	88.8 Å²	88.8	48%	0.482	43%	0.432	S	S	.	.	H	α-helix	trans	-60.1	-46.9	178.1	-72.4	162.8	0	0	0	110.3	N90 Q91 G96 L97 Q98	N90-I94 VanDerWaalsContact O-CG1 3.28Å; N90-I94 WeakPolarHBondContact O-CG1 3.47Å; N90-I94 PolarHBondContact O-N 3.17Å; Q91-I94 PolarHBondContact O-N 2.85Å; I94-G96 PolarHBondContact O-N 3.36Å; I94-L97 PolarHBondContact O-N 2.94Å; I94-Q98 HydrophobicContact CG2-CG 4.47Å; I94-Q98 WeakPolarHBondContact O-CG 3.44Å; I94-Q98 PolarHBondContact O-N 2.97Å
95	V	94.8	Very high	92.4	Very high	66 Å²	66	89.8 Å²	89.8	40%	0.4	44%	0.436	S	S	.	.	H	α-helix	trans	-60.9	-46.8	177.9	173	0	0	0	0	110.8	Q91 R92 R93 L97 Q98 D99	Q91-V95 WeakPolarHBondContact O-CG2 3.34Å; Q91-V95 PolarHBondContact O-N 2.89Å; R92-V95 PolarHBondContact O-N 3.47Å; R93-V95 VanDerWaalsContact C-N 3.35Å; R93-V95 PolarHBondContact O-N 3.41Å; V95-L97 VanDerWaalsContact C-N 3.29Å; V95-L97 PolarHBondContact O-N 3.33Å; V95-Q98 WeakPolarHBondContact O-CB 3.4Å; V95-Q98 PolarHBondContact O-N 3.49Å; V95-Q98 VanDerWaalsContact O-N 3.11Å; V95-D99 PolarHBondContact O-N 3.14Å
96	G	93.9	Very high	92.6	Very high	29 Å²	29	96 Å²	96	30%	0.299	46%	0.458	S	S	.	.	H	α-helix	trans	-60.8	-36.4	176.6	0	0	0	0	0	113.6	R92 R93 I94 N100	R92-G96 PolarHBondContact O-N 2.71Å; R93-G96 PolarHBondContact O-N 2.87Å; I94-G96 PolarHBondContact O-N 3.36Å; G96-N100 PolarHBondContact O-N 2.99Å; G96-N100 VanDerWaalsContact O-N 3.13Å; G96-N100 PolarHBondContact O-ND2 3.44Å
97	L	94.1	Very high	92.8	Very high	119 Å²	119	94.2 Å²	94.2	62%	0.623	45%	0.452	S	S	*	.	H	α-helix	trans	-68.5	-39.2	174	-73.2	171.9	0	0	0	112.2	R93 I94 V95 N100 L101	R93-L97 WeakPolarHBondContact O-CB 3.26Å; R93-L97 WeakPolarHBondContact O-CG 3.49Å; R93-L97 PolarHBondContact O-N 3.46Å; I94-L97 PolarHBondContact O-N 2.94Å; V95-L97 VanDerWaalsContact C-N 3.29Å; V95-L97 PolarHBondContact O-N 3.33Å; L97-N100 PolarHBondContact O-N 3.23Å; L97-L101 WeakPolarHBondContact O-CB 3.33Å; L97-L101 PolarHBondContact O-N 3.14Å
98	Q	93.8	Very high	92.9	Very high	104 Å²	104	93.1 Å²	93.1	49%	0.486	45%	0.452	S	S	.	.	H	α-helix	trans	-62.3	-45.3	175	-74.7	177.3	-34.1	0	0	111.3	I94 V95 N100 L101 H102	I94-Q98 HydrophobicContact CG2-CG 4.47Å; I94-Q98 WeakPolarHBondContact O-CG 3.44Å; I94-Q98 PolarHBondContact O-N 2.97Å; V95-Q98 WeakPolarHBondContact O-CB 3.4Å; V95-Q98 PolarHBondContact O-N 3.49Å; V95-Q98 VanDerWaalsContact O-N 3.11Å; Q98-N100 VanDerWaalsContact C-N 3.33Å; Q98-N100 PolarHBondContact O-N 2.98Å; Q98-L101 PolarHBondContact O-N 2.98Å; Q98-H102 PolarHBondContact O-CD2 2.89Å; Q98-H102 PolarHBondContact O-N 3.02Å
99	D	95	Very high	92.9	Very high	98 Å²	98	98.1 Å²	98.1	52%	0.524	47%	0.469	S	S	.	.	H	α-helix	trans	-60.9	-43.2	177.7	-72.7	-21.6	0	0	0	111.9	V95 H102 K103	V95-D99 PolarHBondContact O-N 3.14Å; D99-H102 PolarHBondContact O-N 3.28Å; D99-K103 PolarHBondContact O-N 3.03Å
100	N	95.2	Very high	93.1	Very high	100 Å²	100	101.6 Å²	101.6	54%	0.535	49%	0.485	S	S	.	.	H	α-helix	trans	-62.7	-42.9	175.1	-75.9	-30	0	0	0	112	G96 L97 Q98 K103 V104	G96-N100 PolarHBondContact O-N 2.99Å; G96-N100 VanDerWaalsContact O-N 3.13Å; G96-N100 PolarHBondContact O-ND2 3.44Å; L97-N100 PolarHBondContact O-N 3.23Å; Q98-N100 VanDerWaalsContact C-N 3.33Å; Q98-N100 PolarHBondContact O-N 2.98Å; N100-K103 WeakPolarHBondContact O-CB 3.44Å; N100-K103 PolarHBondContact O-N 2.86Å; N100-V104 WeakPolarHBondContact O-CG2 3.46Å; N100-V104 PolarHBondContact O-N 2.94Å
101	L	94.3	Very high	93.1	Very high	109 Å²	109	104.4 Å²	104.4	57%	0.571	50%	0.496	S	S	*	.	H	α-helix	trans	-62.5	-43.8	177	-170.4	151.7	0	0	0	111.1	L97 Q98 K103 V104 Q105	L97-L101 WeakPolarHBondContact O-CB 3.33Å; L97-L101 PolarHBondContact O-N 3.14Å; Q98-L101 PolarHBondContact O-N 2.98Å; L101-K103 VanDerWaalsContact C-N 3.31Å; L101-K103 PolarHBondContact O-N 3.49Å; L101-V104 PolarHBondContact O-N 3.26Å; L101-Q105 WeakPolarHBondContact O-CB 3.25Å; L101-Q105 PolarHBondContact O-N 3.49Å
102	H	93.4	Very high	93	Very high	100 Å²	100	103.5 Å²	103.5	46%	0.463	49%	0.494	S	S	.	.	H	α-helix	trans	-62.7	-36.4	175.5	-76.4	-54.9	0	0	0	112.8	Q98 D99 R106	Q98-H102 PolarHBondContact O-CD2 2.89Å; Q98-H102 PolarHBondContact O-N 3.02Å; D99-H102 PolarHBondContact O-N 3.28Å; H102-R106 WeakPolarHBondContact O-CG 3.42Å; H102-R106 PolarHBondContact O-N 3.38Å; H102-R106 VanDerWaalsContact O-N 3.11Å
103	K	94.1	Very high	92.9	Very high	118 Å²	118	102.8 Å²	102.8	51%	0.513	50%	0.498	S	S	.	.	H	α-helix	trans	-63.8	-53.5	173.1	-174	-179.1	176	-176.4	0	111.3	D99 N100 L101 Q105 R106 D107	D99-K103 PolarHBondContact O-N 3.03Å; N100-K103 WeakPolarHBondContact O-CB 3.44Å; N100-K103 PolarHBondContact O-N 2.86Å; L101-K103 VanDerWaalsContact C-N 3.31Å; L101-K103 PolarHBondContact O-N 3.49Å; K103-Q105 VanDerWaalsContact C-N 3.25Å; K103-Q105 PolarHBondContact O-N 3.11Å; K103-R106 WeakPolarHBondContact O-CB 3.48Å; K103-R106 PolarHBondContact O-N 3.39Å; K103-D107 VanDerWaalsContact O-CG 3.3Å; K103-D107 PolarHBondContact O-N 2.95Å
104	V	93.2	Very high	93	Very high	96 Å²	96	97.7 Å²	97.7	58%	0.582	49%	0.487	S	S	*	.	H	α-helix	trans	-57.9	-40	179.3	172.8	0	0	0	0	111.5	N100 L101 R106 D107 F108	N100-V104 WeakPolarHBondContact O-CG2 3.46Å; N100-V104 PolarHBondContact O-N 2.94Å; L101-V104 PolarHBondContact O-N 3.26Å; V104-R106 PolarHBondContact O-N 3.15Å; V104-D107 PolarHBondContact O-N 3.24Å; V104-F108 WeakPolarHBondContact O-CB 3.47Å; V104-F108 PolarHBondContact O-N 3.43Å
105	Q	91.4	Very high	92.8	Very high	77 Å²	77	96.6 Å²	96.6	36%	0.36	49%	0.485	S	S	.	.	H	α-helix	trans	-65	-37.9	177.2	-171	-178	6.8	0	0	112.6	L101 K103 R109	L101-Q105 WeakPolarHBondContact O-CB 3.25Å; L101-Q105 PolarHBondContact O-N 3.49Å; K103-Q105 VanDerWaalsContact C-N 3.25Å; K103-Q105 PolarHBondContact O-N 3.11Å; Q105-R109 WeakPolarHBondContact O-CG 3.24Å; Q105-R109 PolarHBondContact O-N 2.95Å; Q105-R109 VanDerWaalsContact O-N 3.15Å
106	R	93.4	Very high	92.2	Very high	152 Å²	152	98.7 Å²	98.7	57%	0.574	49%	0.491	S	S	*	.	H	α-helix	trans	-66.4	-50	174.3	-77.7	-174.1	-68.9	-173.9	-1.1	111	H102 K103 V104 F108 R109 E110	H102-R106 WeakPolarHBondContact O-CG 3.42Å; H102-R106 PolarHBondContact O-N 3.38Å; H102-R106 VanDerWaalsContact O-N 3.11Å; K103-R106 WeakPolarHBondContact O-CB 3.48Å; K103-R106 PolarHBondContact O-N 3.39Å; V104-R106 PolarHBondContact O-N 3.15Å; R106-F108 VanDerWaalsContact C-N 3.26Å; R106-F108 PolarHBondContact O-N 2.89Å; R106-R109 WeakPolarHBondContact O-CB 3.37Å; R106-R109 PolarHBondContact O-N 2.93Å; R106-E110 PolarHBondContact O-N 3.19Å
107	D	93.6	Very high	91.9	Very high	65 Å²	65	104.1 Å²	104.1	35%	0.348	51%	0.509	S	S	.	.	H	α-helix	trans	-57.4	-42	179.5	-61.8	-9.8	0	0	0	110.9	K103 V104 E110 Q111	K103-D107 VanDerWaalsContact O-CG 3.3Å; K103-D107 PolarHBondContact O-N 2.95Å; V104-D107 PolarHBondContact O-N 3.24Å; D107-E110 PolarHBondContact O-N 3.35Å; D107-Q111 WeakPolarHBondContact O-CG 3.43Å; D107-Q111 PolarHBondContact O-N 2.95Å
108	F	92.4	Very high	91.5	Very high	126 Å²	126	106.7 Å²	106.7	55%	0.553	51%	0.51	S	S	*	.	H	α-helix	trans	-62	-43.6	175.2	177.5	-102.2	0	0	0	112.7	V104 R106 E110 Q111 L112	V104-F108 WeakPolarHBondContact O-CB 3.47Å; V104-F108 PolarHBondContact O-N 3.43Å; R106-F108 VanDerWaalsContact C-N 3.26Å; R106-F108 PolarHBondContact O-N 2.89Å; F108-E110 VanDerWaalsContact C-N 3.34Å; F108-E110 PolarHBondContact O-N 2.88Å; F108-Q111 PolarHBondContact O-N 3.44Å; F108-L112 WeakPolarHBondContact O-CB 3.28Å; F108-L112 PolarHBondContact O-N 3.34Å
109	R	90.7	Very high	90.8	Very high	142 Å²	142	109.6 Å²	109.6	54%	0.536	52%	0.517	S	S	.	.	H	α-helix	trans	-63	-40.8	177.6	-77.2	173.5	173.8	171.8	-1	111.8	Q105 R106 L112 N113	Q105-R109 WeakPolarHBondContact O-CG 3.24Å; Q105-R109 PolarHBondContact O-N 2.95Å; Q105-R109 VanDerWaalsContact O-N 3.15Å; R106-R109 WeakPolarHBondContact O-CB 3.37Å; R106-R109 PolarHBondContact O-N 2.93Å; R109-L112 PolarHBondContact O-N 3.42Å; R109-N113 VanDerWaalsContact O-CG 3.27Å; R109-N113 PolarHBondContact O-N 3.22Å
110	E	92.8	Very high	89.9	Confident	128 Å²	128	107.9 Å²	107.9	60%	0.598	52%	0.517	S	S	*	.	H	α-helix	trans	-64.2	-44.7	176.5	-70.3	176	-172.2	0	0	111.4	R106 D107 F108 L112 N113 A114	R106-E110 PolarHBondContact O-N 3.19Å; D107-E110 PolarHBondContact O-N 3.35Å; F108-E110 VanDerWaalsContact C-N 3.34Å; F108-E110 PolarHBondContact O-N 2.88Å; E110-L112 VanDerWaalsContact C-N 3.35Å; E110-L112 PolarHBondContact O-N 3.19Å; E110-N113 PolarHBondContact O-N 2.89Å; E110-A114 WeakPolarHBondContact O-CB 3.4Å; E110-A114 PolarHBondContact O-N 3.45Å
111	Q	91.8	Very high	89.1	Confident	127 Å²	127	105.6 Å²	105.6	59%	0.593	52%	0.516	S	S	*	.	H	α-helix	trans	-62.9	-40.1	175.5	-72.3	177.7	8.8	0	0	112.6	D107 F108 T115	D107-Q111 WeakPolarHBondContact O-CG 3.43Å; D107-Q111 PolarHBondContact O-N 2.95Å; F108-Q111 PolarHBondContact O-N 3.44Å; Q111-T115 WeakPolarHBondContact O-CB 3.47Å; Q111-T115 PolarHBondContact O-N 2.72Å; Q111-T115 PolarHBondContact O-OG1 3.45Å
112	L	89.4	Confident	88.3	Confident	81 Å²	81	107.2 Å²	107.2	42%	0.424	52%	0.515	S	S	.	.	H	α-helix	trans	-60.8	-50	175.5	-173.2	82.9	0	0	0	110.4	F108 R109 E110 A114 T115 M116	F108-L112 WeakPolarHBondContact O-CB 3.28Å; F108-L112 PolarHBondContact O-N 3.34Å; R109-L112 PolarHBondContact O-N 3.42Å; E110-L112 VanDerWaalsContact C-N 3.35Å; E110-L112 PolarHBondContact O-N 3.19Å; L112-A114 PolarHBondContact O-N 2.94Å; L112-T115 PolarHBondContact O-N 3.02Å; L112-T115 VanDerWaalsContact O-N 3.14Å; L112-M116 HydrophobicContact CD2-CE 4.46Å; L112-M116 WeakPolarHBondContact O-CG 3.39Å; L112-M116 PolarHBondContact O-N 2.91Å
113	N	89.9	Confident	87.2	Confident	81 Å²	81	105.3 Å²	105.3	43%	0.433	51%	0.508	S	S	.	.	H	α-helix	trans	-60	-48.4	179.4	-71.6	-12.5	0	0	0	111.5	R109 E110 T115 M116 E117	R109-N113 VanDerWaalsContact O-CG 3.27Å; R109-N113 PolarHBondContact O-N 3.22Å; E110-N113 PolarHBondContact O-N 2.89Å; N113-T115 PolarHBondContact O-N 3.49Å; N113-M116 PolarHBondContact O-N 3.32Å; N113-M116 VanDerWaalsContact O-N 3.14Å; N113-E117 WeakPolarHBondContact O-CG 3.43Å; N113-E117 PolarHBondContact O-N 3.13Å
114	A	91.2	Very high	86.1	Confident	40 Å²	40	101.7 Å²	101.7	33%	0.331	51%	0.505	S	S	.	.	H	α-helix	trans	-62.7	-28	177.4	0	0	0	0	0	113.1	E110 L112 R118	E110-A114 WeakPolarHBondContact O-CB 3.4Å; E110-A114 PolarHBondContact O-N 3.45Å; L112-A114 PolarHBondContact O-N 2.94Å; A114-R118 WeakPolarHBondContact O-CG 3.49Å; A114-R118 PolarHBondContact O-N 3.43Å; A114-R118 PolarHBondContact O-NE 3.39Å
115	T	89.4	Confident	85	Confident	71 Å²	71	100.2 Å²	100.2	44%	0.436	50%	0.499	S	S	.	.	H	α-helix	trans	-77.3	-41.5	174.9	-56	0	0	0	0	111	Q111 L112 N113 R118 W119	Q111-T115 WeakPolarHBondContact O-CB 3.47Å; Q111-T115 PolarHBondContact O-N 2.72Å; Q111-T115 PolarHBondContact O-OG1 3.45Å; L112-T115 PolarHBondContact O-N 3.02Å; L112-T115 VanDerWaalsContact O-N 3.14Å; N113-T115 PolarHBondContact O-N 3.49Å; T115-R118 PolarHBondContact O-N 2.89Å; T115-R118 PolarHBondContact OG1-NH2 3.26Å; T115-W119 WeakPolarHBondContact O-CB 3.19Å; T115-W119 PolarHBondContact O-N 3.41Å
116	M	83.9	Confident	84	Confident	109 Å²	109	99.5 Å²	99.5	54%	0.537	50%	0.495	S	S	.	.	H	α-helix	trans	-63.6	-41.4	175.3	-72.6	-153.4	-68.2	0	0	112.1	L112 N113 W119 A120	L112-M116 HydrophobicContact CD2-CE 4.46Å; L112-M116 WeakPolarHBondContact O-CG 3.39Å; L112-M116 PolarHBondContact O-N 2.91Å; N113-M116 PolarHBondContact O-N 3.32Å; N113-M116 VanDerWaalsContact O-N 3.14Å; M116-W119 PolarHBondContact O-N 3.04Å; M116-A120 WeakPolarHBondContact O-CB 3.37Å; M116-A120 PolarHBondContact O-N 2.88Å
117	E	87.4	Confident	82.9	Confident	143 Å²	143	96.3 Å²	96.3	67%	0.668	49%	0.489	S	S	*	.	H	α-helix	trans	-61.1	-45.8	174.9	-74.2	174.8	-178.3	0	0	111.8	N113 W119 A120 G121	N113-E117 WeakPolarHBondContact O-CG 3.43Å; N113-E117 PolarHBondContact O-N 3.13Å; E117-W119 VanDerWaalsContact C-N 3.31Å; E117-W119 PolarHBondContact O-N 3Å; E117-A120 PolarHBondContact O-N 2.94Å; E117-G121 PolarHBondContact O-N 3.11Å
118	R	86	Confident	81.8	Confident	173 Å²	173	98.6 Å²	98.6	65%	0.653	50%	0.501	S	S	*	.	H	α-helix	trans	-60.5	-41.2	174.1	-82.1	-177.9	-75	155.5	-3.9	112	A114 T115 G121 W122	A114-R118 WeakPolarHBondContact O-CG 3.49Å; A114-R118 PolarHBondContact O-N 3.43Å; A114-R118 PolarHBondContact O-NE 3.39Å; T115-R118 PolarHBondContact O-N 2.89Å; T115-R118 PolarHBondContact OG1-NH2 3.26Å; R118-G121 PolarHBondContact O-N 3.1Å; R118-W122 WeakPolarHBondContact O-CB 3.12Å; R118-W122 PolarHBondContact O-N 3.05Å
119	W	77.9	Confident	80.6	Confident	165 Å²	165	94.9 Å²	94.9	63%	0.625	49%	0.49	S	S	*	.	H	α-helix	trans	-67.7	-42.5	179.5	-162.6	76.6	0	0	0	112	T115 M116 E117 G121 W122 N123	T115-W119 WeakPolarHBondContact O-CB 3.19Å; T115-W119 PolarHBondContact O-N 3.41Å; M116-W119 PolarHBondContact O-N 3.04Å; E117-W119 VanDerWaalsContact C-N 3.31Å; E117-W119 PolarHBondContact O-N 3Å; W119-G121 PolarHBondContact O-N 3.09Å; W119-W122 PolarHBondContact O-N 3.35Å; W119-N123 WeakPolarHBondContact O-CB 3.33Å; W119-N123 PolarHBondContact O-N 3.02Å
120	A	76.5	Confident	79.7	Confident	63 Å²	63	92.8 Å²	92.8	52%	0.521	49%	0.488	S	S	.	.	H	α-helix	trans	-61.3	-43.8	174.5	0	0	0	0	0	111.9	M116 E117 N123 G124	M116-A120 WeakPolarHBondContact O-CB 3.37Å; M116-A120 PolarHBondContact O-N 2.88Å; E117-A120 PolarHBondContact O-N 2.94Å; A120-N123 PolarHBondContact O-N 2.88Å; A120-G124 PolarHBondContact O-N 3.27Å; A120-G124 VanDerWaalsContact O-N 3.17Å
121	G	77.4	Confident	78.9	Confident	51 Å²	51	90.5 Å²	90.5	53%	0.526	48%	0.48	S	S	.	.	H	α-helix	trans	-64.3	-40.5	174.9	0	0	0	0	0	113.1	E117 R118 W119 S125	E117-G121 PolarHBondContact O-N 3.11Å; R118-G121 PolarHBondContact O-N 3.1Å; W119-G121 PolarHBondContact O-N 3.09Å; G121-S125 PolarHBondContact O-N 3.42Å
122	W	78.3	Confident	77.7	Confident	143 Å²	143	90.9 Å²	90.9	54%	0.542	48%	0.48	S	S	.	.	H	α-helix	trans	-64.2	-44.2	174.6	177.6	71	0	0	0	112	R118 W119 G124 S125 H126	R118-W122 WeakPolarHBondContact O-CB 3.12Å; R118-W122 PolarHBondContact O-N 3.05Å; W119-W122 PolarHBondContact O-N 3.35Å; W122-G124 VanDerWaalsContact C-N 3.34Å; W122-G124 PolarHBondContact O-N 3.08Å; W122-S125 CarbonylContact O-C 3.53Å; W122-S125 PolarHBondContact O-N 3.44Å; W122-S125 VanDerWaalsContact O-N 3.08Å; W122-H126 AromaticContact CZ2-CD2 3.8Å; W122-H126 WeakPolarHBondContact O-CB 3.43Å; W122-H126 PolarHBondContact O-N 3.29Å
123	N	70.8	Confident	76.5	Confident	61 Å²	61	93.8 Å²	93.8	33%	0.326	49%	0.489	S	S	.	.	H	α-helix	trans	-61.9	-42.3	-179.3	-159.5	50.9	0	0	0	111.7	W119 A120 S125 H126 D127	W119-N123 WeakPolarHBondContact O-CB 3.33Å; W119-N123 PolarHBondContact O-N 3.02Å; A120-N123 PolarHBondContact O-N 2.88Å; N123-S125 VanDerWaalsContact C-N 3.29Å; N123-S125 PolarHBondContact O-N 3.26Å; N123-H126 WeakPolarHBondContact O-CB 3.36Å; N123-H126 PolarHBondContact O-N 3.4Å; N123-H126 VanDerWaalsContact O-N 3.16Å; N123-D127 PolarHBondContact O-N 3.33Å; N123-D127 VanDerWaalsContact O-N 3.16Å
124	G	69.9	Low	75.8	Confident	42 Å²	42	98.6 Å²	98.6	43%	0.433	50%	0.501	S	S	.	.	H	α-helix	trans	-61.2	-35.5	173.7	0	0	0	0	0	113.5	A120 W122	A120-G124 PolarHBondContact O-N 3.27Å; A120-G124 VanDerWaalsContact O-N 3.17Å; W122-G124 VanDerWaalsContact C-N 3.34Å; W122-G124 PolarHBondContact O-N 3.08Å
125	S	70.8	Confident	75.1	Confident	65 Å²	65	102.9 Å²	102.9	46%	0.455	52%	0.515	S	S	.	.	H	α-helix	trans	-77.9	-28	174.8	-175.1	0	0	0	0	113.4	G121 W122 N123 S129	G121-S125 PolarHBondContact O-N 3.42Å; W122-S125 CarbonylContact O-C 3.53Å; W122-S125 PolarHBondContact O-N 3.44Å; W122-S125 VanDerWaalsContact O-N 3.08Å; N123-S125 VanDerWaalsContact C-N 3.29Å; N123-S125 PolarHBondContact O-N 3.26Å; S125-S129 WeakPolarHBondContact O-CB 3.39Å; S125-S129 PolarHBondContact O-N 3.26Å; S125-S129 PolarHBondContact O-OG 3.35Å
126	H	70.9	Confident	74.2	Confident	61 Å²	61	104.9 Å²	104.9	28%	0.282	52%	0.522	S	S	.	.	H	α-helix	trans	-68.6	-46.4	-180	175.3	-88.2	0	0	0	110.5	W122 N123 L128 S129 M130	W122-H126 AromaticContact CZ2-CD2 3.8Å; W122-H126 WeakPolarHBondContact O-CB 3.43Å; W122-H126 PolarHBondContact O-N 3.29Å; N123-H126 WeakPolarHBondContact O-CB 3.36Å; N123-H126 PolarHBondContact O-N 3.4Å; N123-H126 VanDerWaalsContact O-N 3.16Å; H126-L128 PolarHBondContact O-N 3.5Å; H126-S129 WeakPolarHBondContact O-CB 3.19Å; H126-S129 PolarHBondContact O-N 3.36Å; H126-S129 VanDerWaalsContact O-N 3.08Å; H126-M130 WeakPolarHBondContact O-CG 3.37Å; H126-M130 PolarHBondContact O-N 2.94Å
127	D	69.4	Low	73.7	Confident	85 Å²	85	101.1 Å²	101.1	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-62	-45.9	177.9	-67.8	-17.5	0	0	0	111.4	N123 S129 M130 D131	N123-D127 PolarHBondContact O-N 3.33Å; N123-D127 VanDerWaalsContact O-N 3.16Å; D127-S129 PolarHBondContact O-N 3.24Å; D127-M130 PolarHBondContact O-N 3.5Å; D127-M130 VanDerWaalsContact O-N 3.14Å; D127-D131 PolarHBondContact O-N 3.19Å
128	L	70.3	Confident	73.3	Confident	113 Å²	113	99.2 Å²	99.2	59%	0.592	51%	0.505	S	S	*	.	H	α-helix	trans	-58.2	-34.7	172.5	-84.3	163.3	0	0	0	113.3	H126 K132	H126-L128 PolarHBondContact O-N 3.5Å; L128-K132 WeakPolarHBondContact O-CG 3.42Å; L128-K132 PolarHBondContact O-N 2.92Å
129	S	68.4	Low	72.9	Confident	48 Å²	48	94.8 Å²	94.8	34%	0.336	50%	0.498	S	S	.	.	H	α-helix	trans	-74.2	-40.2	177.3	-59.6	0	0	0	0	111.2	S125 H126 D127 D131 K132 F133	S125-S129 WeakPolarHBondContact O-CB 3.39Å; S125-S129 PolarHBondContact O-N 3.26Å; S125-S129 PolarHBondContact O-OG 3.35Å; H126-S129 WeakPolarHBondContact O-CB 3.19Å; H126-S129 PolarHBondContact O-N 3.36Å; H126-S129 VanDerWaalsContact O-N 3.08Å; D127-S129 PolarHBondContact O-N 3.24Å; S129-D131 VanDerWaalsContact C-N 3.35Å; S129-K132 PolarHBondContact O-N 3.43Å; S129-F133 WeakPolarHBondContact O-CD2 3.43Å; S129-F133 PolarHBondContact O-N 3.07Å
130	M	71.9	Confident	73.1	Confident	98 Å²	98	94.4 Å²	94.4	48%	0.483	50%	0.497	S	S	.	.	H	α-helix	trans	-64.6	-37.7	177	-74.3	-62.1	-127.7	0	0	112.5	H126 D127 F133 R134	H126-M130 WeakPolarHBondContact O-CG 3.37Å; H126-M130 PolarHBondContact O-N 2.94Å; D127-M130 PolarHBondContact O-N 3.5Å; D127-M130 VanDerWaalsContact O-N 3.14Å; M130-F133 PolarHBondContact O-N 3.29Å; M130-R134 PolarHBondContact O-N 3.01Å
131	D	75.6	Confident	73.3	Confident	81 Å²	81	95.8 Å²	95.8	43%	0.433	50%	0.496	S	S	.	.	H	α-helix	trans	-64	-44.9	174.3	-72.8	-21.9	0	0	0	111.4	D127 S129 F133 R134 E135	D127-D131 PolarHBondContact O-N 3.19Å; S129-D131 VanDerWaalsContact C-N 3.35Å; D131-F133 VanDerWaalsContact C-N 3.31Å; D131-F133 PolarHBondContact O-N 2.98Å; D131-R134 WeakPolarHBondContact O-CB 3.2Å; D131-R134 PolarHBondContact O-N 3.14Å; D131-R134 VanDerWaalsContact O-N 3.15Å; D131-E135 PolarHBondContact O-N 3.47Å
132	K	66.8	Low	73.3	Confident	135 Å²	135	100 Å²	100	59%	0.587	50%	0.502	S	S	*	.	H	α-helix	trans	-60.7	-38.6	173	-74.3	177.2	-179.3	177.1	0	112.6	L128 S129 R134 E135 L136	L128-K132 WeakPolarHBondContact O-CG 3.42Å; L128-K132 PolarHBondContact O-N 2.92Å; S129-K132 PolarHBondContact O-N 3.43Å; K132-R134 VanDerWaalsContact C-N 3.34Å; K132-E135 PolarHBondContact O-N 3.15Å; K132-L136 WeakPolarHBondContact O-CB 3.42Å; K132-L136 VanDerWaalsContact O-CG 3.3Å; K132-L136 WeakPolarHBondContact O-CG 3.27Å; K132-L136 PolarHBondContact O-N 3.46Å
133	F	63.3	Low	73.6	Confident	142 Å²	142	99.3 Å²	99.3	62%	0.623	50%	0.503	S	S	*	.	H	α-helix	trans	-65.3	-37.3	175.9	-81.9	-62.6	0	0	0	112.3	S129 M130 D131 G137	S129-F133 WeakPolarHBondContact O-CD2 3.43Å; S129-F133 PolarHBondContact O-N 3.07Å; M130-F133 PolarHBondContact O-N 3.29Å; D131-F133 VanDerWaalsContact C-N 3.31Å; D131-F133 PolarHBondContact O-N 2.98Å; F133-G137 PolarHBondContact O-N 2.93Å
134	R	75.9	Confident	74.4	Confident	182 Å²	182	103 Å²	103	69%	0.687	52%	0.516	S	S	*	.	H	α-helix	trans	-63.5	-49	172.5	-83.1	-177.7	176.3	154.3	-1.6	111.7	M130 D131 K132 L136 G137 D138	M130-R134 PolarHBondContact O-N 3.01Å; D131-R134 WeakPolarHBondContact O-CB 3.2Å; D131-R134 PolarHBondContact O-N 3.14Å; D131-R134 VanDerWaalsContact O-N 3.15Å; K132-R134 VanDerWaalsContact C-N 3.34Å; R134-L136 VanDerWaalsContact C-N 3.31Å; R134-L136 PolarHBondContact O-N 3.37Å; R134-G137 WeakPolarHBondContact O-CA 3.42Å; R134-G137 PolarHBondContact O-N 2.88Å; R134-D138 PolarHBondContact O-N 2.99Å
135	E	77.4	Confident	75	Confident	130 Å²	130	106 Å²	106	61%	0.607	53%	0.526	S	S	*	.	H	α-helix	trans	-58	-43.3	178	-71.2	178.8	171.4	0	0	112	D131 K132 G137 D138 T139	D131-E135 PolarHBondContact O-N 3.47Å; K132-E135 PolarHBondContact O-N 3.15Å; E135-G137 VanDerWaalsContact C-N 3.35Å; E135-D138 PolarHBondContact O-N 3.42Å; E135-T139 WeakPolarHBondContact O-CB 3.4Å; E135-T139 PolarHBondContact O-N 2.88Å; E135-T139 PolarHBondContact O-OG1 3.23Å
136	L	69.8	Low	75.4	Confident	112 Å²	112	110.2 Å²	110.2	59%	0.586	53%	0.532	S	S	*	.	H	α-helix	trans	-65.6	-37	175.3	-72.8	170.9	0	0	0	112.4	K132 R134 T139 Y140	K132-L136 WeakPolarHBondContact O-CB 3.42Å; K132-L136 VanDerWaalsContact O-CG 3.3Å; K132-L136 WeakPolarHBondContact O-CG 3.27Å; K132-L136 PolarHBondContact O-N 3.46Å; R134-L136 VanDerWaalsContact C-N 3.31Å; R134-L136 PolarHBondContact O-N 3.37Å; L136-T139 PolarHBondContact O-N 3.37Å; L136-Y140 WeakPolarHBondContact O-CB 3.41Å; L136-Y140 PolarHBondContact O-N 3.42Å
137	G	72.8	Confident	76.1	Confident	30 Å²	30	111.3 Å²	111.3	31%	0.309	54%	0.54	S	S	.	.	H	α-helix	trans	-62.3	-43.5	173.6	0	0	0	0	0	112.6	F133 R134 E135 Y140 N141	F133-G137 PolarHBondContact O-N 2.93Å; R134-G137 WeakPolarHBondContact O-CA 3.42Å; R134-G137 PolarHBondContact O-N 2.88Å; E135-G137 VanDerWaalsContact C-N 3.35Å; G137-Y140 PolarHBondContact O-N 3.35Å; G137-N141 PolarHBondContact O-N 3.33Å; G137-N141 PolarHBondContact O-ND2 3.48Å
138	D	79.2	Confident	76.9	Confident	103 Å²	103	109.9 Å²	109.9	55%	0.551	54%	0.54	S	S	*	.	H	α-helix	trans	-65.3	-42.2	176.3	-70.2	-19.2	0	0	0	111.4	R134 E135 Y140 N141 Q142	R134-D138 PolarHBondContact O-N 2.99Å; E135-D138 PolarHBondContact O-N 3.42Å; D138-Y140 VanDerWaalsContact C-N 3.35Å; D138-Y140 PolarHBondContact O-N 2.89Å; D138-N141 PolarHBondContact O-N 3.45Å; D138-Q142 WeakPolarHBondContact O-CG 3.41Å; D138-Q142 PolarHBondContact O-N 3.06Å
139	T	77.9	Confident	77.5	Confident	81 Å²	81	109.6 Å²	109.6	50%	0.497	54%	0.535	S	S	.	.	H	α-helix	trans	-63.7	-40.4	176.7	-46.4	0	0	0	0	111.6	E135 L136 Q142 K143	E135-T139 WeakPolarHBondContact O-CB 3.4Å; E135-T139 PolarHBondContact O-N 2.88Å; E135-T139 PolarHBondContact O-OG1 3.23Å; L136-T139 PolarHBondContact O-N 3.37Å; T139-Q142 PolarHBondContact O-N 3.21Å; T139-K143 PolarHBondContact O-N 3.28Å
140	Y	81.8	Confident	78.3	Confident	157 Å²	157	109 Å²	109	62%	0.616	53%	0.529	S	S	*	.	H	α-helix	trans	-64.5	-42.9	175.6	177.8	-100	0	0	0	112	L136 G137 D138 K143 K144	L136-Y140 WeakPolarHBondContact O-CB 3.41Å; L136-Y140 PolarHBondContact O-N 3.42Å; G137-Y140 PolarHBondContact O-N 3.35Å; D138-Y140 VanDerWaalsContact C-N 3.35Å; D138-Y140 PolarHBondContact O-N 2.89Å; Y140-K143 PolarHBondContact O-N 2.97Å; Y140-K144 PolarHBondContact O-N 3.15Å
141	N	81.1	Confident	79	Confident	92 Å²	92	111.2 Å²	111.2	49%	0.492	54%	0.538	S	S	.	.	H	α-helix	trans	-63.9	-42.1	175.8	-75.6	-31.7	0	0	0	111.8	G137 D138 K143 K144 V145	G137-N141 PolarHBondContact O-N 3.33Å; G137-N141 PolarHBondContact O-ND2 3.48Å; D138-N141 PolarHBondContact O-N 3.45Å; N141-K143 PolarHBondContact O-N 2.9Å; N141-K144 WeakPolarHBondContact O-CB 3.37Å; N141-K144 PolarHBondContact O-N 3.47Å; N141-V145 WeakPolarHBondContact O-CG2 3.35Å; N141-V145 PolarHBondContact O-N 3.3Å; N141-V145 VanDerWaalsContact O-N 3.12Å
142	Q	77.6	Confident	79.6	Confident	138 Å²	138	113.5 Å²	113.5	65%	0.645	55%	0.546	S	S	*	.	H	α-helix	trans	-59.9	-43.9	173.7	-76.4	179.8	-3.1	0	0	112	D138 T139 K144 V145 Y146	D138-Q142 WeakPolarHBondContact O-CG 3.41Å; D138-Q142 PolarHBondContact O-N 3.06Å; T139-Q142 PolarHBondContact O-N 3.21Å; Q142-K144 VanDerWaalsContact C-N 3.33Å; Q142-K144 PolarHBondContact O-N 3.27Å; Q142-V145 PolarHBondContact O-N 3.46Å; Q142-Y146 PolarHBondContact O-N 3.37Å
143	K	83.5	Confident	80.3	Confident	129 Å²	129	110.8 Å²	110.8	56%	0.561	54%	0.537	S	S	*	.	H	α-helix	trans	-59.3	-43.5	175.7	-176.2	-177.9	176.5	-177.7	0	111.8	T139 Y140 N141 V145 Y146 D147	T139-K143 PolarHBondContact O-N 3.28Å; Y140-K143 PolarHBondContact O-N 2.97Å; N141-K143 PolarHBondContact O-N 2.9Å; K143-V145 VanDerWaalsContact C-N 3.32Å; K143-V145 PolarHBondContact O-N 3.08Å; K143-Y146 WeakPolarHBondContact O-CB 3.17Å; K143-Y146 PolarHBondContact O-N 3.12Å; K143-D147 PolarHBondContact O-N 3.02Å
144	K	87.8	Confident	81.3	Confident	140 Å²	140	112.8 Å²	112.8	61%	0.609	54%	0.541	S	S	*	.	H	α-helix	trans	-60.2	-41.7	178	-172.7	-177.6	177.9	-176	0	112.1	Y140 N141 Q142 A148	Y140-K144 PolarHBondContact O-N 3.15Å; N141-K144 WeakPolarHBondContact O-CB 3.37Å; N141-K144 PolarHBondContact O-N 3.47Å; Q142-K144 VanDerWaalsContact C-N 3.33Å; Q142-K144 PolarHBondContact O-N 3.27Å; K144-A148 WeakPolarHBondContact O-CB 3.39Å; K144-A148 PolarHBondContact O-N 3.29Å; K144-A148 VanDerWaalsContact O-N 3.1Å
145	V	83.3	Confident	81.9	Confident	105 Å²	105	105.8 Å²	105.8	64%	0.636	53%	0.525	S	S	*	.	H	α-helix	trans	-65.2	-43	175.2	175.6	0	0	0	0	110.7	N141 Q142 K143 A148 F149	N141-V145 WeakPolarHBondContact O-CG2 3.35Å; N141-V145 PolarHBondContact O-N 3.3Å; N141-V145 VanDerWaalsContact O-N 3.12Å; Q142-V145 PolarHBondContact O-N 3.46Å; K143-V145 VanDerWaalsContact C-N 3.32Å; K143-V145 PolarHBondContact O-N 3.08Å; V145-A148 PolarHBondContact O-N 2.75Å; V145-F149 WeakPolarHBondContact O-CB 3.42Å; V145-F149 PolarHBondContact O-N 3.12Å
146	Y	79.3	Confident	82.3	Confident	152 Å²	152	106 Å²	106	60%	0.596	52%	0.524	S	S	*	.	H	α-helix	trans	-62.3	-45.2	177.1	-172.2	-94.9	0	0	0	112.2	Q142 K143 A148 F149 V150	Q142-Y146 PolarHBondContact O-N 3.37Å; K143-Y146 WeakPolarHBondContact O-CB 3.17Å; K143-Y146 PolarHBondContact O-N 3.12Å; Y146-A148 VanDerWaalsContact C-N 3.34Å; Y146-A148 PolarHBondContact O-N 3.22Å; Y146-F149 WeakPolarHBondContact O-CB 3.31Å; Y146-F149 PolarHBondContact O-N 3.47Å; Y146-F149 VanDerWaalsContact O-N 3.17Å; Y146-V150 HydrophobicContact CD1-CG2 3.86Å; Y146-V150 HydrophobicContact CE1-CG2 3.5Å; Y146-V150 VanDerWaalsContact CE1-CG2 3.5Å; Y146-V150 WeakPolarHBondContact O-CG2 3.24Å; Y146-V150 PolarHBondContact O-N 3.44Å
147	D	85.5	Confident	83	Confident	84 Å²	84	103.9 Å²	103.9	45%	0.449	52%	0.516	S	S	.	.	H	α-helix	trans	-62.7	-41.2	178	-74.8	-20.2	0	0	0	111.5	K143 F149 V150 H151	K143-D147 PolarHBondContact O-N 3.02Å; D147-F149 VanDerWaalsContact C-N 3.34Å; D147-F149 PolarHBondContact O-N 3.3Å; D147-V150 PolarHBondContact O-N 2.61Å; D147-H151 WeakPolarHBondContact O-CB 3.47Å; D147-H151 PolarHBondContact O-N 3.12Å
148	A	86.4	Confident	83.6	Confident	55 Å²	55	104.3 Å²	104.3	46%	0.455	52%	0.517	S	S	.	.	H	α-helix	trans	-62.6	-41.6	174.1	0	0	0	0	0	111.9	K144 V145 Y146 H151 Q152	K144-A148 WeakPolarHBondContact O-CB 3.39Å; K144-A148 PolarHBondContact O-N 3.29Å; K144-A148 VanDerWaalsContact O-N 3.1Å; V145-A148 PolarHBondContact O-N 2.75Å; Y146-A148 VanDerWaalsContact C-N 3.34Å; Y146-A148 PolarHBondContact O-N 3.22Å; A148-H151 PolarHBondContact O-N 3.46Å; A148-Q152 WeakPolarHBondContact O-CG 3.31Å; A148-Q152 PolarHBondContact O-N 3.48Å
149	F	82.4	Confident	84	Confident	108 Å²	108	106.8 Å²	106.8	47%	0.474	52%	0.523	S	S	.	.	H	α-helix	trans	-63.7	-45.8	175.5	176.3	-105.7	0	0	0	112.1	V145 Y146 D147 H151 Q152 L153	V145-F149 WeakPolarHBondContact O-CB 3.42Å; V145-F149 PolarHBondContact O-N 3.12Å; Y146-F149 WeakPolarHBondContact O-CB 3.31Å; Y146-F149 PolarHBondContact O-N 3.47Å; Y146-F149 VanDerWaalsContact O-N 3.17Å; D147-F149 VanDerWaalsContact C-N 3.34Å; D147-F149 PolarHBondContact O-N 3.3Å; F149-H151 VanDerWaalsContact C-N 3.28Å; F149-H151 PolarHBondContact O-N 2.97Å; F149-Q152 WeakPolarHBondContact O-CB 3.33Å; F149-Q152 PolarHBondContact O-N 3.26Å; F149-Q152 VanDerWaalsContact O-N 3.16Å; F149-L153 HydrophobicContact CD1-CD1 3.87Å; F149-L153 HydrophobicContact CD1-CG 4.38Å; F149-L153 HydrophobicContact CE1-CD1 3.32Å; F149-L153 HydrophobicContact CE1-CG 3.98Å; F149-L153 HydrophobicContact CE2-CG 4.37Å; F149-L153 HydrophobicContact CZ-CD1 3.71Å; F149-L153 HydrophobicContact CZ-CD2 4.19Å; F149-L153 HydrophobicContact CZ-CG 3.97Å; F149-L153 PolarHBondContact O-N 2.86Å
150	V	84.6	Confident	84.4	Confident	34 Å²	34	108.3 Å²	108.3	21%	0.206	53%	0.527	C	S	.	.	H	α-helix	trans	-60.8	-39.3	175.6	170.9	0	0	0	0	111	Y146 D147 L153 R154	Y146-V150 HydrophobicContact CD1-CG2 3.86Å; Y146-V150 HydrophobicContact CE1-CG2 3.5Å; Y146-V150 VanDerWaalsContact CE1-CG2 3.5Å; Y146-V150 WeakPolarHBondContact O-CG2 3.24Å; Y146-V150 PolarHBondContact O-N 3.44Å; D147-V150 PolarHBondContact O-N 2.61Å; V150-L153 PolarHBondContact O-N 3.29Å; V150-R154 WeakPolarHBondContact O-CG 3.49Å; V150-R154 PolarHBondContact O-N 3.32Å
151	H	88.3	Confident	84.6	Confident	146 Å²	146	106.1 Å²	106.1	68%	0.676	52%	0.522	S	S	*	.	H	α-helix	trans	-65.1	-39.6	176.6	-161	-48.9	0	0	0	112	D147 A148 F149 G155	D147-H151 WeakPolarHBondContact O-CB 3.47Å; D147-H151 PolarHBondContact O-N 3.12Å; A148-H151 PolarHBondContact O-N 3.46Å; F149-H151 VanDerWaalsContact C-N 3.28Å; F149-H151 PolarHBondContact O-N 2.97Å; H151-G155 PolarHBondContact O-N 3.33Å; H151-G155 VanDerWaalsContact O-N 3.09Å
152	Q	87.1	Confident	85	Confident	128 Å²	128	108 Å²	108	60%	0.598	53%	0.526	S	S	*	.	H	α-helix	trans	-65.1	-41.8	173	-73.4	-175.3	0.8	0	0	112	A148 F149 G155 K156	A148-Q152 WeakPolarHBondContact O-CG 3.31Å; A148-Q152 PolarHBondContact O-N 3.48Å; F149-Q152 WeakPolarHBondContact O-CB 3.33Å; F149-Q152 PolarHBondContact O-N 3.26Å; F149-Q152 VanDerWaalsContact O-N 3.16Å; Q152-G155 PolarHBondContact O-N 3.15Å; Q152-K156 PolarHBondContact O-N 3.12Å
153	L	80.8	Confident	85.4	Confident	78 Å²	78	107 Å²	107	41%	0.408	52%	0.524	S	S	.	.	H	α-helix	trans	-58.8	-50.7	175.6	-78.5	178.6	0	0	0	111	F149 V150 G155 K156 T157	F149-L153 HydrophobicContact CD1-CD1 3.87Å; F149-L153 HydrophobicContact CD1-CG 4.38Å; F149-L153 HydrophobicContact CE1-CD1 3.32Å; F149-L153 HydrophobicContact CE1-CG 3.98Å; F149-L153 HydrophobicContact CE2-CG 4.37Å; F149-L153 HydrophobicContact CZ-CD1 3.71Å; F149-L153 HydrophobicContact CZ-CD2 4.19Å; F149-L153 HydrophobicContact CZ-CG 3.97Å; F149-L153 PolarHBondContact O-N 2.86Å; V150-L153 PolarHBondContact O-N 3.29Å; L153-G155 VanDerWaalsContact C-N 3.28Å; L153-G155 PolarHBondContact O-N 3.05Å; L153-K156 PolarHBondContact O-N 3.3Å; L153-T157 PolarHBondContact O-N 3.49Å; L153-T157 PolarHBondContact O-OG1 3.4Å
154	R	85.9	Confident	85.3	Confident	184 Å²	184	103.1 Å²	103.1	69%	0.694	52%	0.516	S	S	*	.	H	α-helix	trans	-56.1	-42.6	176.6	-73.5	179.3	-179	177.9	1.3	112.2	V150 K156 T157 A158	V150-R154 WeakPolarHBondContact O-CG 3.49Å; V150-R154 PolarHBondContact O-N 3.32Å; R154-K156 VanDerWaalsContact C-N 3.34Å; R154-K156 PolarHBondContact O-N 2.79Å; R154-T157 PolarHBondContact O-N 2.93Å; R154-A158 WeakPolarHBondContact O-CB 3.36Å; R154-A158 PolarHBondContact O-N 2.89Å
155	G	86.8	Confident	85.4	Confident	35 Å²	35	101.7 Å²	101.7	36%	0.361	51%	0.512	S	S	.	.	H	α-helix	trans	-62.9	-37.8	176.4	0	0	0	0	0	113.3	H151 Q152 L153 K159	H151-G155 PolarHBondContact O-N 3.33Å; H151-G155 VanDerWaalsContact O-N 3.09Å; Q152-G155 PolarHBondContact O-N 3.15Å; L153-G155 VanDerWaalsContact C-N 3.28Å; L153-G155 PolarHBondContact O-N 3.05Å; G155-K159 WeakPolarHBondContact O-CG 3.45Å; G155-K159 PolarHBondContact O-N 2.87Å
156	K	87.2	Confident	85.5	Confident	135 Å²	135	101 Å²	101	59%	0.587	50%	0.501	S	S	*	.	H	α-helix	trans	-71.5	-43.4	174.5	-74	-176.9	176.6	-179.9	0	111.8	Q152 L153 R154 A158 K159 I160	Q152-K156 PolarHBondContact O-N 3.12Å; L153-K156 PolarHBondContact O-N 3.3Å; R154-K156 VanDerWaalsContact C-N 3.34Å; R154-K156 PolarHBondContact O-N 2.79Å; K156-A158 VanDerWaalsContact C-N 3.33Å; K156-A158 PolarHBondContact O-N 3.26Å; K156-K159 WeakPolarHBondContact O-CB 3.46Å; K156-K159 PolarHBondContact O-N 2.86Å; K156-K159 VanDerWaalsContact O-N 3.08Å; K156-I160 WeakPolarHBondContact O-CG1 3.49Å; K156-I160 PolarHBondContact O-N 2.95Å
157	T	85	Confident	85.8	Confident	67 Å²	67	97.7 Å²	97.7	41%	0.411	50%	0.497	S	S	.	.	H	α-helix	trans	-58.4	-45.3	176.7	-53	0	0	0	0	111.2	L153 R154 K159 I160 E161	L153-T157 PolarHBondContact O-N 3.49Å; L153-T157 PolarHBondContact O-OG1 3.4Å; R154-T157 PolarHBondContact O-N 2.93Å; T157-K159 VanDerWaalsContact C-N 3.26Å; T157-K159 PolarHBondContact O-N 3.26Å; T157-I160 WeakPolarHBondContact O-CB 3.49Å; T157-I160 PolarHBondContact O-N 2.74Å; T157-E161 WeakPolarHBondContact O-CG 3.18Å; T157-E161 PolarHBondContact O-N 3.01Å
158	A	85	Confident	85.7	Confident	40 Å²	40	98.9 Å²	98.9	33%	0.331	50%	0.503	S	S	.	.	H	α-helix	trans	-61.8	-31.9	176.3	0	0	0	0	0	113.3	R154 K156 K162	R154-A158 WeakPolarHBondContact O-CB 3.36Å; R154-A158 PolarHBondContact O-N 2.89Å; K156-A158 VanDerWaalsContact C-N 3.33Å; K156-A158 PolarHBondContact O-N 3.26Å; A158-K162 WeakPolarHBondContact O-CG 3.28Å; A158-K162 PolarHBondContact O-N 3.47Å; A158-K162 VanDerWaalsContact O-N 3.09Å
159	K	87.9	Confident	85.7	Confident	155 Å²	155	102.5 Å²	102.5	67%	0.674	51%	0.505	S	S	*	.	H	α-helix	trans	-70.7	-39	173.3	-72.2	176.8	-178.7	-175.8	0	111.7	G155 K156 T157 K162 L163	G155-K159 WeakPolarHBondContact O-CG 3.45Å; G155-K159 PolarHBondContact O-N 2.87Å; K156-K159 WeakPolarHBondContact O-CB 3.46Å; K156-K159 PolarHBondContact O-N 2.86Å; K156-K159 VanDerWaalsContact O-N 3.08Å; T157-K159 VanDerWaalsContact C-N 3.26Å; T157-K159 PolarHBondContact O-N 3.26Å; K159-K162 PolarHBondContact O-N 3.22Å; K159-L163 WeakPolarHBondContact O-CB 3.37Å; K159-L163 PolarHBondContact O-N 2.95Å
160	I	85	Confident	85.8	Confident	113 Å²	113	106.2 Å²	106.2	58%	0.579	52%	0.516	S	S	*	.	H	α-helix	trans	-65.9	-43.8	176.5	-66.4	166.7	0	0	0	110.2	K156 T157 L163 A164	K156-I160 WeakPolarHBondContact O-CG1 3.49Å; K156-I160 PolarHBondContact O-N 2.95Å; T157-I160 WeakPolarHBondContact O-CB 3.49Å; T157-I160 PolarHBondContact O-N 2.74Å; I160-L163 WeakPolarHBondContact O-CB 3.36Å; I160-L163 PolarHBondContact O-N 2.78Å; I160-L163 VanDerWaalsContact O-N 3.17Å; I160-A164 WeakPolarHBondContact O-CB 3.28Å; I160-A164 PolarHBondContact O-N 2.77Å
161	E	85.9	Confident	85.7	Confident	111 Å²	111	108.5 Å²	108.5	52%	0.519	53%	0.526	S	S	.	.	H	α-helix	trans	-59	-48.1	175.2	-72.9	168.4	176.9	0	0	111.2	T157 L163 A164 E165	T157-E161 WeakPolarHBondContact O-CG 3.18Å; T157-E161 PolarHBondContact O-N 3.01Å; E161-L163 VanDerWaalsContact C-N 3.32Å; E161-L163 PolarHBondContact O-N 2.96Å; E161-A164 WeakPolarHBondContact O-CB 3.42Å; E161-A164 PolarHBondContact O-N 3.29Å; E161-A164 VanDerWaalsContact O-N 3.15Å; E161-E165 WeakPolarHBondContact O-CG 3.15Å; E161-E165 PolarHBondContact O-N 3.37Å
162	K	89.1	Confident	85.5	Confident	132 Å²	132	105.1 Å²	105.1	57%	0.574	51%	0.514	S	S	*	.	H	α-helix	trans	-58.5	-42.9	173.4	-75.9	-179.8	-179.2	-173.6	0	112.3	A158 K159 A164 E165 H166	A158-K162 WeakPolarHBondContact O-CG 3.28Å; A158-K162 PolarHBondContact O-N 3.47Å; A158-K162 VanDerWaalsContact O-N 3.09Å; K159-K162 PolarHBondContact O-N 3.22Å; K162-A164 VanDerWaalsContact C-N 3.32Å; K162-A164 PolarHBondContact O-N 3.44Å; K162-E165 PolarHBondContact O-N 2.82Å; K162-H166 WeakPolarHBondContact O-CB 3.48Å; K162-H166 PolarHBondContact O-CD2 3.32Å; K162-H166 PolarHBondContact O-N 2.65Å
163	L	86.8	Confident	85.1	Confident	115 Å²	115	103.6 Å²	103.6	60%	0.602	51%	0.506	S	S	*	.	H	α-helix	trans	-62.4	-42.6	177.2	-173.2	70.1	0	0	0	110.9	K159 I160 E161 H166 V167	K159-L163 WeakPolarHBondContact O-CB 3.37Å; K159-L163 PolarHBondContact O-N 2.95Å; I160-L163 WeakPolarHBondContact O-CB 3.36Å; I160-L163 PolarHBondContact O-N 2.78Å; I160-L163 VanDerWaalsContact O-N 3.17Å; E161-L163 VanDerWaalsContact C-N 3.32Å; E161-L163 PolarHBondContact O-N 2.96Å; L163-H166 WeakPolarHBondContact O-CB 3.44Å; L163-H166 PolarHBondContact O-N 3.17Å; L163-V167 WeakPolarHBondContact O-CG2 3.32Å; L163-V167 PolarHBondContact O-N 3.21Å
164	A	82.2	Confident	84.8	Confident	49 Å²	49	104.7 Å²	104.7	41%	0.405	51%	0.512	S	S	.	.	H	α-helix	trans	-61.6	-44.1	176.1	0	0	0	0	0	111.6	I160 E161 K162 H166 V167 L168	I160-A164 WeakPolarHBondContact O-CB 3.28Å; I160-A164 PolarHBondContact O-N 2.77Å; E161-A164 WeakPolarHBondContact O-CB 3.42Å; E161-A164 PolarHBondContact O-N 3.29Å; E161-A164 VanDerWaalsContact O-N 3.15Å; K162-A164 VanDerWaalsContact C-N 3.32Å; K162-A164 PolarHBondContact O-N 3.44Å; A164-H166 VanDerWaalsContact C-N 3.31Å; A164-H166 PolarHBondContact O-N 2.6Å; A164-V167 PolarHBondContact O-N 3.43Å; A164-L168 WeakPolarHBondContact O-CB 3.37Å; A164-L168 WeakPolarHBondContact O-CG 3.36Å; A164-L168 PolarHBondContact O-N 3.38Å
165	E	88.6	Confident	84.4	Confident	109 Å²	109	99.3 Å²	99.3	51%	0.509	50%	0.497	S	S	.	.	H	α-helix	trans	-61.7	-36.4	173.2	-70.7	173.2	179.7	0	0	112.8	E161 K162 R169	E161-E165 WeakPolarHBondContact O-CG 3.15Å; E161-E165 PolarHBondContact O-N 3.37Å; K162-E165 PolarHBondContact O-N 2.82Å; E165-R169 WeakPolarHBondContact O-CB 3.5Å; E165-R169 WeakPolarHBondContact O-CG 3.45Å; E165-R169 PolarHBondContact O-N 2.97Å; E165-R169 VanDerWaalsContact O-N 3.07Å; E165-R169 PolarHBondContact O-NE 2.9Å
166	H	86.8	Confident	83.8	Confident	90 Å²	90	104.4 Å²	104.4	42%	0.417	51%	0.505	S	S	.	.	H	α-helix	trans	-66.8	-44.4	174.2	-91.2	-101.3	0	0	0	111.6	K162 L163 A164 R169 W170	K162-H166 WeakPolarHBondContact O-CB 3.48Å; K162-H166 PolarHBondContact O-CD2 3.32Å; K162-H166 PolarHBondContact O-N 2.65Å; L163-H166 WeakPolarHBondContact O-CB 3.44Å; L163-H166 PolarHBondContact O-N 3.17Å; A164-H166 VanDerWaalsContact C-N 3.31Å; A164-H166 PolarHBondContact O-N 2.6Å; H166-R169 PolarHBondContact CD2-NH2 2.81Å; H166-R169 PolarHBondContact NE2-NH2 2.97Å; H166-R169 PolarHBondContact O-N 3.43Å; H166-W170 PolarHBondContact O-N 2.82Å
167	V	84.9	Confident	83	Confident	83 Å²	83	104.5 Å²	104.5	50%	0.503	51%	0.508	S	S	.	.	H	α-helix	trans	-63.3	-44	177.5	170.6	0	0	0	0	111	L163 A164 R169 W170 N171	L163-V167 WeakPolarHBondContact O-CG2 3.32Å; L163-V167 PolarHBondContact O-N 3.21Å; A164-V167 PolarHBondContact O-N 3.43Å; V167-R169 PolarHBondContact O-N 3.11Å; V167-W170 PolarHBondContact O-N 3.34Å; V167-N171 PolarHBondContact O-N 3.46Å
168	L	84.3	Confident	82	Confident	109 Å²	109	108.4 Å²	108.4	57%	0.571	52%	0.523	S	S	*	.	H	α-helix	trans	-60.2	-45.7	175.5	-72.4	170.8	0	0	0	111.4	A164 W170 N171 D172	A164-L168 WeakPolarHBondContact O-CB 3.37Å; A164-L168 WeakPolarHBondContact O-CG 3.36Å; A164-L168 PolarHBondContact O-N 3.38Å; L168-W170 VanDerWaalsContact C-N 3.35Å; L168-W170 PolarHBondContact O-N 3.05Å; L168-N171 WeakPolarHBondContact O-CB 3.4Å; L168-N171 PolarHBondContact O-N 3.11Å; L168-D172 VanDerWaalsContact O-CG 3.3Å; L168-D172 PolarHBondContact O-N 2.7Å
169	R	84.9	Confident	81	Confident	132 Å²	132	114.3 Å²	114.3	50%	0.498	54%	0.544	S	S	.	.	H	α-helix	trans	-62	-39.6	176.1	-80	-176.6	-71.4	170.8	-3.5	113.2	E165 H166 V167 N171 D172 E173	E165-R169 WeakPolarHBondContact O-CB 3.5Å; E165-R169 WeakPolarHBondContact O-CG 3.45Å; E165-R169 PolarHBondContact O-N 2.97Å; E165-R169 VanDerWaalsContact O-N 3.07Å; E165-R169 PolarHBondContact O-NE 2.9Å; H166-R169 PolarHBondContact CD2-NH2 2.81Å; H166-R169 PolarHBondContact NE2-NH2 2.97Å; H166-R169 PolarHBondContact O-N 3.43Å; V167-R169 PolarHBondContact O-N 3.11Å; R169-N171 VanDerWaalsContact C-N 3.33Å; R169-D172 PolarHBondContact O-N 3.12Å; R169-E173 WeakPolarHBondContact O-CB 3.47Å; R169-E173 PolarHBondContact O-N 2.96Å
170	W	85.5	Confident	79.1	Confident	186 Å²	186	117 Å²	117	71%	0.705	55%	0.55	S	S	*	.	H	α-helix	trans	-64.4	-40.1	174.6	-81.1	3.4	0	0	0	112	H166 V167 L168 E173 L174	H166-W170 PolarHBondContact O-N 2.82Å; V167-W170 PolarHBondContact O-N 3.34Å; L168-W170 VanDerWaalsContact C-N 3.35Å; L168-W170 PolarHBondContact O-N 3.05Å; W170-E173 PolarHBondContact O-N 3.42Å; W170-L174 WeakPolarHBondContact O-CB 3.47Å; W170-L174 PolarHBondContact O-N 2.88Å
171	N	82.6	Confident	77.4	Confident	81 Å²	81	117 Å²	117	43%	0.433	56%	0.557	S	S	.	*	H	α-helix	trans	-61.6	-47.3	175.1	-169.5	76.2	0	0	0	111.3	V167 L168 R169 E173 L174 D175	V167-N171 PolarHBondContact O-N 3.46Å; L168-N171 WeakPolarHBondContact O-CB 3.4Å; L168-N171 PolarHBondContact O-N 3.11Å; R169-N171 VanDerWaalsContact C-N 3.33Å; N171-E173 VanDerWaalsContact C-N 3.29Å; N171-E173 PolarHBondContact O-N 3.04Å; N171-L174 WeakPolarHBondContact O-CB 3.22Å; N171-L174 PolarHBondContact O-N 3.44Å; N171-D175 PolarHBondContact ND2-OD2 3.49Å; N171-D175 VanDerWaalsContact ND2-OD2 3.13Å; N171-D175 PolarHBondContact O-N 2.93Å
172	D	82.7	Confident	75.6	Confident	76 Å²	76	117.7 Å²	117.7	41%	0.406	57%	0.571	S	S	.	*	H	α-helix	trans	-61.8	-35.5	177.3	-64.3	-16.5	0	0	0	112.7	L168 R169 R176	L168-D172 VanDerWaalsContact O-CG 3.3Å; L168-D172 PolarHBondContact O-N 2.7Å; R169-D172 PolarHBondContact O-N 3.12Å; D172-R176 WeakPolarHBondContact O-CG 3.41Å; D172-R176 PolarHBondContact O-N 3.1Å; D172-R176 VanDerWaalsContact O-N 3.12Å
173	E	78.6	Confident	73.4	Confident	96 Å²	96	116.1 Å²	116.1	45%	0.449	58%	0.583	S	S	.	*	H	α-helix	trans	-70.7	-42.2	177.8	-158.9	74.3	-167	0	0	111.4	R169 W170 N171 R176 E177	R169-E173 WeakPolarHBondContact O-CB 3.47Å; R169-E173 PolarHBondContact O-N 2.96Å; W170-E173 PolarHBondContact O-N 3.42Å; N171-E173 VanDerWaalsContact C-N 3.29Å; N171-E173 PolarHBondContact O-N 3.04Å; E173-R176 PolarHBondContact O-N 3.3Å; E173-R176 IonicContact OE2-CZ 3.69Å; E173-R176 IonicContact OE2-NH1 2.84Å; E173-R176 PolarHBondContact OE2-NH1 3.07Å; E173-E177 PolarHBondContact O-N 2.86Å
174	L	76	Confident	71.3	Confident	100 Å²	100	120 Å²	120	52%	0.524	60%	0.598	S	S	.	*	H	α-helix	trans	-59.2	-46.4	172.7	-87.6	156.9	0	0	0	111.3	W170 N171 R176 E177 M178	W170-L174 WeakPolarHBondContact O-CB 3.47Å; W170-L174 PolarHBondContact O-N 2.88Å; N171-L174 WeakPolarHBondContact O-CB 3.22Å; N171-L174 PolarHBondContact O-N 3.44Å; L174-R176 VanDerWaalsContact C-N 3.3Å; L174-R176 PolarHBondContact O-N 2.92Å; L174-E177 PolarHBondContact O-N 3.19Å; L174-M178 WeakPolarHBondContact O-CG 3.27Å; L174-M178 PolarHBondContact O-N 3.16Å
175	D	76.8	Confident	69.3	Low	71 Å²	71	129.4 Å²	129.4	38%	0.38	62%	0.623	S	S	.	*	H	α-helix	trans	-60.9	-39.8	178.2	-72.9	-30.2	0	0	0	111.2	N171 M178 E179	N171-D175 PolarHBondContact ND2-OD2 3.49Å; N171-D175 VanDerWaalsContact ND2-OD2 3.13Å; N171-D175 PolarHBondContact O-N 2.93Å; D175-M178 PolarHBondContact O-N 2.94Å; D175-E179 PolarHBondContact O-N 2.7Å
176	R	75.1	Confident	67.3	Low	142 Å²	142	132 Å²	132	54%	0.536	64%	0.639	S	S	.	*	H	α-helix	trans	-68	-37	174.2	-75	-174.1	-135.1	135.9	9.6	114	D172 E173 L174 M178 E179	D172-R176 WeakPolarHBondContact O-CG 3.41Å; D172-R176 PolarHBondContact O-N 3.1Å; D172-R176 VanDerWaalsContact O-N 3.12Å; E173-R176 PolarHBondContact O-N 3.3Å; E173-R176 IonicContact OE2-CZ 3.69Å; E173-R176 IonicContact OE2-NH1 2.84Å; E173-R176 PolarHBondContact OE2-NH1 3.07Å; L174-R176 VanDerWaalsContact C-N 3.3Å; L174-R176 PolarHBondContact O-N 2.92Å; R176-M178 VanDerWaalsContact C-N 3.28Å; R176-E179 PolarHBondContact O-N 3.1Å
177	E	69.9	Low	65.2	Low	138 Å²	138	133.8 Å²	133.8	65%	0.645	66%	0.659	S	S	*	*	H	α-helix	trans	-66.1	-33.7	175.7	-77.4	-169.5	161.3	0	0	111.7	E173 L174 E179	E173-E177 PolarHBondContact O-N 2.86Å; L174-E177 PolarHBondContact O-N 3.19Å; E177-E179 VanDerWaalsContact C-N 3.33Å; E177-E179 PolarHBondContact O-N 2.97Å
178	M	64	Low	63	Low	148 Å²	148	141.6 Å²	141.6	73%	0.729	68%	0.679	S	S	*	*	H	α-helix	trans	-71.4	-23.5	175.9	-67.9	-167.7	-19	0	0	113.8	L174 D175 R176	L174-M178 WeakPolarHBondContact O-CG 3.27Å; L174-M178 PolarHBondContact O-N 3.16Å; D175-M178 PolarHBondContact O-N 2.94Å; R176-M178 VanDerWaalsContact C-N 3.28Å
179	E	63.8	Low	60.8	Low	164 Å²	164	141.6 Å²	141.6	77%	0.766	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-5.5	178.9	-73.5	-176.4	162.4	0	0	114.5	D175 R176 E177	D175-E179 PolarHBondContact O-N 2.7Å; R176-E179 PolarHBondContact O-N 3.1Å; E177-E179 VanDerWaalsContact C-N 3.33Å; E177-E179 PolarHBondContact O-N 2.97Å
180	R	47.8	Very low	58.4	Low	212 Å²	212	140.8 Å²	140.8	80%	0.8	70%	0.703	S	S	*	*	S	Bend	trans	-83.6	128.6	-179.9	-119.1	-180	-175.1	170.7	3.1	112.3
181	P	49.9	Very low	56.3	Low	112 Å²	112	138.4 Å²	138.4	73%	0.727	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-77.1	148.6	176.1	2.4	11.9	0	0	0	112.3
182	P	48.7	Very low	55.1	Low	126 Å²	126	140.1 Å²	140.1	82%	0.818	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-78.1	126.1	-176.6	30.8	-32.2	0	0	0	111.9
183	A	42.7	Very low	53.1	Low	99 Å²	99	141 Å²	141	82%	0.818	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-77.9	146.6	163.7	0	0	0	0	0	110.8
184	H	42.4	Very low	51.8	Low	198 Å²	198	142.7 Å²	142.7	92%	0.917	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-61	165.4	-161.3	-83	-79.2	0	0	0	119.2
185	R	40	Very low	50.5	Low	246 Å²	246	142.2 Å²	142.2	93%	0.928	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-67.3	161.5	-173.1	-73.8	-178.9	171.3	-178.6	-2.4	118.1
186	L	46.5	Very low	49.3	Very low	162 Å²	162	144.7 Å²	144.7	85%	0.848	79%	0.792	S	S	*	*			trans	-51.3	175.7	178.1	-61.2	158.7	0	0	0	119.7
187	P	41.8	Very low	48.7	Very low	129 Å²	129	142.9 Å²	142.9	84%	0.838	80%	0.799	S	S	*	*				-144.1	163.7	98.2	34.7	-16.3	0	0	0	118.7
188	R	39.3	Very low	47.1	Very low	247 Å²	247	145 Å²	145	93%	0.932	81%	0.806	S	S	*	*			trans	-64	167.8	172.8	-109.5	172.3	170.3	178.6	-2.9	113.3
189	S	38.6	Very low	45.9	Very low	108 Å²	108	143.9 Å²	143.9	76%	0.755	80%	0.804	S	S	*	*			cis	-159	162.9	28.7	58.9	0	0	0	0	109.9
190	S	34.2	Very low	45	Very low	116 Å²	116	143.5 Å²	143.5	81%	0.811	81%	0.807	S	S	*	*				176.3	147.4	81.9	51.2	0	0	0	0	112.6
191	T	42.1	Very low	44.7	Very low	135 Å²	135	138.2 Å²	138.2	83%	0.828	80%	0.802	S	S	*	*			trans	-90.8	174.6	173.3	7.1	0	0	0	0	112.6
192	P	57.3	Low	44.5	Very low	118 Å²	118	138.6 Å²	138.6	77%	0.766	80%	0.802	S	S	*	*			cis	-145.7	162.2	20.2	38.5	-15.7	0	0	0	121.5
193	A	39.7	Very low	44.1	Very low	95 Å²	95	137 Å²	137	79%	0.785	80%	0.799	S	S	*	*			trans	49.6	163.3	145.7	0	0	0	0	0	123.8
194	P	51.4	Low	44	Very low	130 Å²	130	141.3 Å²	141.3	84%	0.844	80%	0.796	S	S	*	*			cis	-132.9	178.1	4.9	38.8	-17.7	0	0	0	117.2
195	A	48.3	Very low	44	Very low	91 Å²	91	141.5 Å²	141.5	75%	0.752	79%	0.79	S	S	*	*			trans	-78	175.1	-177.9	0	0	0	0	0	114.7
196	P	51.8	Low	43.9	Very low	122 Å²	122	138 Å²	138	79%	0.792	78%	0.782	S	S	*	*				-155.1	-152.7	72.5	46.8	-22.9	0	0	0	114.9
197	P	63	Low	43.4	Very low	104 Å²	104	137 Å²	137	68%	0.675	77%	0.772	S	S	*	*				-121.4	-160	-117.1	35	-10.3	0	0	0	114.6
198	F	36.4	Very low	43.2	Very low	183 Å²	183	137.1 Å²	137.1	80%	0.803	76%	0.762	S	S	*	*			trans	107.6	136.9	170.5	-75	-86.4	0	0	0	115.5
199	D	38.1	Very low	43.1	Very low	125 Å²	125	134.3 Å²	134.3	67%	0.668	76%	0.759	S	S	*	*			cis	-159.9	154.7	-4.1	-154	-6.6	0	0	0	110.5
200	N	45.5	Very low	43.2	Very low	156 Å²	156	141.7 Å²	141.7	83%	0.834	78%	0.778	S	S	*	*			trans	-82.4	113.4	166	-88.9	-29.3	0	0	0	110
201	S	41.9	Very low	43.6	Very low	101 Å²	101	143 Å²	143	71%	0.706	78%	0.776	S	S	*	*			trans	178.2	128.8	151.2	48.2	0	0	0	0	106.8
202	V	44.4	Very low	43.7	Very low	120 Å²	120	143.4 Å²	143.4	73%	0.727	77%	0.774	S	S	*	*			cis	-153.5	115.2	48.9	172.2	0	0	0	0	108	Y204	V202-Y204 HydrophobicContact CG1-CD2 4.36Å
203	A	41.8	Very low	42.9	Very low	91 Å²	91	144.8 Å²	144.8	75%	0.752	77%	0.774	S	S	*	*			trans	-76	130.9	147.3	0	0	0	0	0	107
204	Y	40.1	Very low	43.1	Very low	190 Å²	190	147.7 Å²	147.7	75%	0.745	77%	0.773	S	S	*	*			trans	-158.5	123.1	145.2	-99	-52.9	0	0	0	114.4	V202	V202-Y204 HydrophobicContact CG1-CD2 4.36Å
205	Y	40.9	Very low	42.6	Very low	203 Å²	203	148.8 Å²	148.8	80%	0.796	77%	0.769	S	S	*	*			trans	77	109.5	153.9	-72.7	-68.4	0	0	0	123.5
206	F	37.8	Very low	42.2	Very low	173 Å²	173	152.7 Å²	152.7	76%	0.759	77%	0.77	S	S	*	*			trans	-65.4	152.9	151.8	-112.9	-107	0	0	0	112.2
207	E	37.6	Very low	41.5	Very low	139 Å²	139	154.9 Å²	154.9	65%	0.65	77%	0.769	S	S	*	*			trans	85.2	131.9	136.6	-95.9	166.8	-162.2	0	0	125.2
208	H	37.8	Very low	39.9	Very low	133 Å²	133	158.8 Å²	158.8	62%	0.616	78%	0.776	S	S	*	*			trans	79.8	120.2	141.9	-73	-55.8	0	0	0	122.5
209	Q	35.4	Very low	40.2	Very low	188 Å²	188	156.8 Å²	156.8	88%	0.879	77%	0.773	S	S	*	*				-177.4	109.8	114	-94.2	165.6	17.8	0	0	107.1
210	F	40.7	Very low	40.4	Very low	262 Å²	262	159.6 Å²	159.6	100%	1.149	78%	0.783	S	S	*	*				21.9	0	87.5	-78.4	-70.2	0	0	0	115.9

Retrieved 210 of 210 residues in 40.1 ms (Link to these results)

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