A0A5K4F6R0_SCHMA Loading...

GDNF domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F6R0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 91 aa.

						>A0A5K4F6R0_SCHMA|A0A5K4F6R0
MLTYFCAVTFGAESLHLCNEKLRATMEYCFQKNGRYSIPLTELKRLRDACMNDRNCKTKAKDCLLSKLKSSELGNCPSLRTYIQSIDRMFK
					

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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	43.9	Very low	51.1	Low	221 Å²	221	119.3 Å²	119.3	100%	1.089	64%	0.641	S	S	*	*				0	64.9	0	-156.9	-177	-106.5	0	0	108.7
2	L	46.2	Very low	52.5	Low	146 Å²	146	114.2 Å²	114.2	76%	0.764	63%	0.628	S	S	*	*			trans	-118.8	-6.4	-174.9	-94.5	152.4	0	0	0	112.6	Y4	L2-Y4 PolarHBondContact O-N 3.5Å
3	T	49.9	Very low	53.8	Low	112 Å²	112	116 Å²	116	69%	0.687	63%	0.629	S	S	*	*	H	α-helix	trans	-79.2	-16.8	-173.2	44.9	0	0	0	0	114
4	Y	47.7	Very low	55.1	Low	181 Å²	181	111.2 Å²	111.2	71%	0.71	61%	0.608	S	S	*	*	H	α-helix	trans	-72.6	-33.9	-179.4	-89.9	-89.1	0	0	0	113.3	L2 V8	L2-Y4 PolarHBondContact O-N 3.5Å; Y4-V8 WeakPolarHBondContact O-CG2 3.47Å
5	F	47.4	Very low	56.6	Low	163 Å²	163	108.2 Å²	108.2	72%	0.715	59%	0.591	S	S	*	*	H	α-helix	trans	-72.7	-31.7	-178.1	-77.1	-84.2	0	0	0	113.2	T9	F5-T9 WeakPolarHBondContact O-CG2 3.39Å; F5-T9 PolarHBondContact O-N 3.25Å; F5-T9 PolarHBondContact O-OG1 2.96Å
6	C	47.5	Very low	58.2	Low	68 Å²	68	108.4 Å²	108.4	46%	0.459	59%	0.586	S	S	.	*	H	α-helix	trans	-69.2	-39.9	177	-61	0	0	0	0	112	V8 T9 F10	C6-V8 VanDerWaalsContact C-N 3.29Å; C6-V8 PolarHBondContact O-N 3.05Å; C6-T9 WeakPolarHBondContact CA-OG1 3.42Å; C6-T9 PolarHBondContact O-N 2.99Å; C6-T9 PolarHBondContact O-OG1 2.85Å; C6-F10 HydrophobicContact CB-CD2 4.45Å; C6-F10 HydrophobicContact CB-CE2 4.2Å; C6-F10 WeakPolarHBondContact O-CB 2.91Å; C6-F10 WeakPolarHBondContact O-CD2 3.37Å; C6-F10 WeakPolarHBondContact O-CG 3.42Å; C6-F10 PolarHBondContact O-N 3.41Å
7	A	51	Low	59.7	Low	69 Å²	69	107.5 Å²	107.5	57%	0.57	58%	0.581	S	S	*	*	H	α-helix	trans	-63.3	-36.9	179.5	0	0	0	0	0	112.6	G11	A7-G11 PolarHBondContact O-N 3.42Å; A7-G11 VanDerWaalsContact O-N 3.1Å
8	V	52.8	Low	61	Low	105 Å²	105	102.1 Å²	102.1	64%	0.636	55%	0.552	S	S	*	*	H	α-helix	trans	-72.6	-40.9	-179	-173.6	0	0	0	0	111.3	Y4 C6 G11 A12	Y4-V8 WeakPolarHBondContact O-CG2 3.47Å; C6-V8 VanDerWaalsContact C-N 3.29Å; C6-V8 PolarHBondContact O-N 3.05Å; V8-G11 PolarHBondContact O-N 3.34Å; V8-A12 PolarHBondContact O-N 3.13Å
9	T	58.2	Low	62.2	Low	74 Å²	74	100.4 Å²	100.4	45%	0.454	54%	0.543	S	S	.	.	H	α-helix	trans	-67.2	-42.5	178.4	45.8	0	0	0	0	111.9	F5 C6 G11 A12 E13	F5-T9 WeakPolarHBondContact O-CG2 3.39Å; F5-T9 PolarHBondContact O-N 3.25Å; F5-T9 PolarHBondContact O-OG1 2.96Å; C6-T9 WeakPolarHBondContact CA-OG1 3.42Å; C6-T9 PolarHBondContact O-N 2.99Å; C6-T9 PolarHBondContact O-OG1 2.85Å; T9-G11 VanDerWaalsContact C-N 3.33Å; T9-G11 PolarHBondContact O-N 2.95Å; T9-A12 PolarHBondContact O-N 3.07Å; T9-A12 VanDerWaalsContact O-N 3.13Å; T9-E13 PolarHBondContact O-N 3.1Å
10	F	56.6	Low	63.4	Low	138 Å²	138	101 Å²	101	61%	0.605	54%	0.542	S	S	*	.	H	α-helix	trans	-67.8	-35.5	178.6	-75.1	-131.8	0	0	0	111.4	C6 A12 S14	C6-F10 HydrophobicContact CB-CD2 4.45Å; C6-F10 HydrophobicContact CB-CE2 4.2Å; C6-F10 WeakPolarHBondContact O-CB 2.91Å; C6-F10 WeakPolarHBondContact O-CD2 3.37Å; C6-F10 WeakPolarHBondContact O-CG 3.42Å; C6-F10 PolarHBondContact O-N 3.41Å; F10-A12 VanDerWaalsContact C-N 3.35Å; F10-S14 VanDerWaalsContact O-CB 3.32Å; F10-S14 WeakPolarHBondContact O-CB 3.34Å; F10-S14 PolarHBondContact O-N 3.44Å; F10-S14 PolarHBondContact O-OG 3.2Å
11	G	60.7	Low	64.5	Low	35 Å²	35	100.2 Å²	100.2	36%	0.361	53%	0.533	S	S	.	.	H	α-helix	trans	-62.8	-39.4	171.2	0	0	0	0	0	112.7	A7 V8 T9 S14 L15	A7-G11 PolarHBondContact O-N 3.42Å; A7-G11 VanDerWaalsContact O-N 3.1Å; V8-G11 PolarHBondContact O-N 3.34Å; T9-G11 VanDerWaalsContact C-N 3.33Å; T9-G11 PolarHBondContact O-N 2.95Å; G11-S14 PolarHBondContact O-OG 3.04Å; G11-S14 VanDerWaalsContact O-OG 3.07Å; G11-L15 VanDerWaalsContact O-CB 3.23Å; G11-L15 WeakPolarHBondContact O-CB 3.38Å; G11-L15 PolarHBondContact O-N 3.21Å; G11-L15 VanDerWaalsContact O-N 3.08Å
12	A	67.7	Low	66.5	Low	58 Å²	58	90.5 Å²	90.5	48%	0.479	49%	0.486	S	S	.	.	H	α-helix	trans	-71.6	-43.5	178.7	0	0	0	0	0	112.8	V8 T9 F10 L15 H16	V8-A12 PolarHBondContact O-N 3.13Å; T9-A12 PolarHBondContact O-N 3.07Å; T9-A12 VanDerWaalsContact O-N 3.13Å; F10-A12 VanDerWaalsContact C-N 3.35Å; A12-L15 PolarHBondContact O-N 3.44Å; A12-H16 WeakPolarHBondContact O-CB 3.5Å; A12-H16 PolarHBondContact O-N 3.47Å
13	E	70	Confident	68.5	Low	138 Å²	138	90.4 Å²	90.4	65%	0.645	48%	0.475	S	S	*	.	H	α-helix	trans	-65.1	-45.1	177.3	-77.8	-176.8	148.7	0	0	112	T9 L15 H16 L17	T9-E13 PolarHBondContact O-N 3.1Å; E13-L15 VanDerWaalsContact C-N 3.32Å; E13-L15 PolarHBondContact O-N 3.07Å; E13-H16 PolarHBondContact O-N 2.92Å; E13-L17 WeakPolarHBondContact O-CB 3.27Å; E13-L17 PolarHBondContact O-N 3.28Å
14	S	72.5	Confident	70.4	Confident	49 Å²	49	87.7 Å²	87.7	34%	0.343	46%	0.464	S	S	.	.	H	α-helix	trans	-62.4	-40.3	176.5	56.9	0	0	0	0	111.8	F10 G11 C18	F10-S14 VanDerWaalsContact O-CB 3.32Å; F10-S14 WeakPolarHBondContact O-CB 3.34Å; F10-S14 PolarHBondContact O-N 3.44Å; F10-S14 PolarHBondContact O-OG 3.2Å; G11-S14 PolarHBondContact O-OG 3.04Å; G11-S14 VanDerWaalsContact O-OG 3.07Å; S14-C18 WeakPolarHBondContact O-CB 3.32Å; S14-C18 PolarHBondContact O-N 3.08Å; S14-C18 PolarHBondContact O-SG 3.01Å
15	L	77.4	Confident	72.4	Confident	66 Å²	66	80.1 Å²	80.1	35%	0.346	44%	0.437	S	S	.	.	H	α-helix	trans	-65.9	-40.1	174.1	-175.6	65.7	0	0	0	112.2	G11 A12 E13 C18 N19	G11-L15 VanDerWaalsContact O-CB 3.23Å; G11-L15 WeakPolarHBondContact O-CB 3.38Å; G11-L15 PolarHBondContact O-N 3.21Å; G11-L15 VanDerWaalsContact O-N 3.08Å; A12-L15 PolarHBondContact O-N 3.44Å; E13-L15 VanDerWaalsContact C-N 3.32Å; E13-L15 PolarHBondContact O-N 3.07Å; L15-C18 WeakPolarHBondContact O-CB 3.23Å; L15-C18 PolarHBondContact O-N 3.1Å; L15-N19 PolarHBondContact O-N 3.45Å; L15-N19 PolarHBondContact O-ND2 2.75Å
16	H	81.8	Confident	74.4	Confident	112 Å²	112	73.4 Å²	73.4	52%	0.519	41%	0.408	S	S	.	.	H	α-helix	trans	-61.3	-50.3	176.5	-176	71	0	0	0	111	A12 E13 C18 N19 E20	A12-H16 WeakPolarHBondContact O-CB 3.5Å; A12-H16 PolarHBondContact O-N 3.47Å; E13-H16 PolarHBondContact O-N 2.92Å; H16-C18 PolarHBondContact O-N 2.02Å; H16-N19 WeakPolarHBondContact O-CB 2.9Å; H16-N19 PolarHBondContact O-N 3.35Å; H16-N19 VanDerWaalsContact O-N 3.1Å; H16-E20 PolarHBondContact O-N 3.25Å
17	L	83.6	Confident	76.5	Confident	93 Å²	93	72.4 Å²	72.4	49%	0.487	40%	0.397	S	S	.	.	H	α-helix	trans	-57.2	-40.1	176	-170.2	75.4	0	0	0	111.7	E13 E20 K21	E13-L17 WeakPolarHBondContact O-CB 3.27Å; E13-L17 PolarHBondContact O-N 3.28Å; L17-E20 PolarHBondContact O-N 3.16Å; L17-K21 WeakPolarHBondContact O-CB 3.39Å; L17-K21 WeakPolarHBondContact O-CG 3.42Å; L17-K21 PolarHBondContact O-N 2.95Å
18	C	83.7	Confident	78.4	Confident	10 Å²	10	74 Å²	74	7%	0.068	39%	0.389	C	S	.	.	H	α-helix	trans	-66.4	-41.1	176.1	-77.4	0	0	0	0	113.5	S14 L15 H16 E20 K21 L22 C76	S14-C18 WeakPolarHBondContact O-CB 3.32Å; S14-C18 PolarHBondContact O-N 3.08Å; S14-C18 PolarHBondContact O-SG 3.01Å; L15-C18 WeakPolarHBondContact O-CB 3.23Å; L15-C18 PolarHBondContact O-N 3.1Å; H16-C18 PolarHBondContact O-N 2.02Å; C18-E20 VanDerWaalsContact C-N 3.35Å; C18-K21 PolarHBondContact O-N 3.45Å; C18-L22 WeakPolarHBondContact O-CB 3.5Å; C18-L22 PolarHBondContact O-N 2.93Å; C18-C76 VanDerWaalsContact CA-SG 3.56Å; C18-C76 HydrophobicContact CB-CB 3.62Å; C18-C76 WeakPolarHBondContact CB-SG 3.49Å; C18-C76 WeakPolarHBondContact SG-CA 3.38Å; C18-C76 WeakPolarHBondContact SG-CB 3.45Å; C18-C76 CovalentContact SG-SG 2.02Å; C18-C76 PolarHBondContact SG-SG 3.19Å
19	N	82.9	Confident	80.3	Confident	70 Å²	70	69 Å²	69	37%	0.374	36%	0.358	S	S	.	.	H	α-helix	trans	-62.5	-42.2	173.7	-76.2	-39.2	0	0	0	111.4	L15 H16 L22 R23 Y82	L15-N19 PolarHBondContact O-N 3.45Å; L15-N19 PolarHBondContact O-ND2 2.75Å; H16-N19 WeakPolarHBondContact O-CB 2.9Å; H16-N19 PolarHBondContact O-N 3.35Å; H16-N19 VanDerWaalsContact O-N 3.1Å; N19-L22 PolarHBondContact O-N 3.01Å; N19-R23 WeakPolarHBondContact O-CB 2.93Å; N19-R23 PolarHBondContact O-N 3.1Å; N19-Y82 PolarHBondContact OD1-OH 3.33Å
20	E	87.5	Confident	81.9	Confident	112 Å²	112	65.5 Å²	65.5	52%	0.523	34%	0.337	S	S	.	.	H	α-helix	trans	-64.2	-46.4	176.7	-68.4	-145.9	122.1	0	0	111.9	H16 L17 C18 L22 R23 A24	H16-E20 PolarHBondContact O-N 3.25Å; L17-E20 PolarHBondContact O-N 3.16Å; C18-E20 VanDerWaalsContact C-N 3.35Å; E20-L22 VanDerWaalsContact C-N 3.33Å; E20-L22 PolarHBondContact O-N 2.9Å; E20-R23 WeakPolarHBondContact O-CB 3.49Å; E20-R23 PolarHBondContact O-N 3.19Å; E20-A24 PolarHBondContact O-N 3.42Å
21	K	86.4	Confident	83.5	Confident	84 Å²	84	63.8 Å²	63.8	37%	0.365	33%	0.331	S	S	.	.	H	α-helix	trans	-60.9	-41.4	175.4	-75.4	-177.1	175.1	-170.4	0	112.3	L17 C18 T25 L73	L17-K21 WeakPolarHBondContact O-CB 3.39Å; L17-K21 WeakPolarHBondContact O-CG 3.42Å; L17-K21 PolarHBondContact O-N 2.95Å; C18-K21 PolarHBondContact O-N 3.45Å; K21-T25 WeakPolarHBondContact O-CB 3.34Å; K21-T25 PolarHBondContact O-N 3.42Å; K21-T25 PolarHBondContact O-OG1 3.19Å; K21-L73 HydrophobicContact CB-CD2 3.69Å; K21-L73 HydrophobicContact CD-CD2 4.4Å
22	L	85.3	Confident	84.9	Confident	18 Å²	18	68.5 Å²	68.5	9%	0.094	34%	0.341	C	S	.	.	H	α-helix	trans	-62.4	-46.1	175.4	177.7	68.4	0	0	0	110.8	C18 N19 E20 A24 T25 M26 L68 Y82 I86	C18-L22 WeakPolarHBondContact O-CB 3.5Å; C18-L22 PolarHBondContact O-N 2.93Å; N19-L22 PolarHBondContact O-N 3.01Å; E20-L22 VanDerWaalsContact C-N 3.33Å; E20-L22 PolarHBondContact O-N 2.9Å; L22-A24 PolarHBondContact O-N 2.72Å; L22-T25 WeakPolarHBondContact O-CB 3.29Å; L22-T25 PolarHBondContact O-N 2.91Å; L22-M26 HydrophobicContact CG-SD 4.31Å; L22-M26 WeakPolarHBondContact O-CG 3.33Å; L22-M26 PolarHBondContact O-N 2.64Å; L22-L68 HydrophobicContact CD1-CD2 3.83Å; L22-Y82 HydrophobicContact CD2-CD1 3.15Å; L22-Y82 HydrophobicContact CD2-CD2 4.23Å; L22-Y82 HydrophobicContact CD2-CE1 3.37Å; L22-Y82 HydrophobicContact CD2-CE2 4.44Å; L22-Y82 HydrophobicContact CD2-CG 3.61Å; L22-I86 HydrophobicContact CD1-CD1 4.46Å
23	R	87.7	Confident	86	Confident	144 Å²	144	67.5 Å²	67.5	54%	0.543	33%	0.328	S	S	.	.	H	α-helix	trans	-57.7	-50.3	178	-172.3	-170.5	167.8	156	-2.7	111.1	N19 E20 T25 M26 E27 L43	N19-R23 WeakPolarHBondContact O-CB 2.93Å; N19-R23 PolarHBondContact O-N 3.1Å; E20-R23 WeakPolarHBondContact O-CB 3.49Å; E20-R23 PolarHBondContact O-N 3.19Å; R23-T25 VanDerWaalsContact C-N 3.28Å; R23-T25 PolarHBondContact O-N 3.27Å; R23-M26 WeakPolarHBondContact O-CB 3.25Å; R23-M26 PolarHBondContact O-N 2.87Å; R23-M26 VanDerWaalsContact O-N 3.14Å; R23-E27 IonicContact CZ-OE1 3.86Å; R23-E27 IonicContact NE-OE1 3.07Å; R23-E27 PolarHBondContact NE-OE1 3.22Å; R23-E27 VanDerWaalsContact NE-OE1 3.07Å; R23-E27 IonicContact NH2-OE1 3.72Å; R23-E27 WeakPolarHBondContact O-CG 3.49Å; R23-E27 PolarHBondContact O-N 3.31Å; R23-L43 HydrophobicContact CG-CD2 3.55Å
24	A	89.6	Confident	86.7	Confident	55 Å²	55	61.6 Å²	61.6	46%	0.455	30%	0.304	S	S	.	.	H	α-helix	trans	-60.7	-38.2	176.9	0	0	0	0	0	111.9	E20 L22 E27 Y28	E20-A24 PolarHBondContact O-N 3.42Å; L22-A24 PolarHBondContact O-N 2.72Å; A24-E27 PolarHBondContact O-N 3.43Å; A24-Y28 WeakPolarHBondContact O-CB 3.44Å; A24-Y28 PolarHBondContact O-N 3.44Å
25	T	89.9	Confident	87.1	Confident	22 Å²	22	70.7 Å²	70.7	14%	0.135	33%	0.331	C	S	.	.	H	α-helix	trans	-64.2	-41.6	175.4	-58.5	0	0	0	0	111.7	K21 L22 R23 C29 L64 K67	K21-T25 WeakPolarHBondContact O-CB 3.34Å; K21-T25 PolarHBondContact O-N 3.42Å; K21-T25 PolarHBondContact O-OG1 3.19Å; L22-T25 WeakPolarHBondContact O-CB 3.29Å; L22-T25 PolarHBondContact O-N 2.91Å; R23-T25 VanDerWaalsContact C-N 3.28Å; R23-T25 PolarHBondContact O-N 3.27Å; T25-C29 WeakPolarHBondContact O-CB 3.45Å; T25-C29 PolarHBondContact O-N 2.88Å; T25-C29 PolarHBondContact O-SG 3.24Å; T25-C29 VanDerWaalsContact O-SG 3.42Å; T25-L64 HydrophobicContact CG2-CD2 3.94Å; T25-K67 HydrophobicContact CG2-CB 3.45Å; T25-K67 VanDerWaalsContact CG2-CB 3.45Å; T25-K67 HydrophobicContact CG2-CG 3.87Å
26	M	90.1	Very high	87.1	Confident	22 Å²	22	70.3 Å²	70.3	11%	0.108	33%	0.325	C	S	.	.	H	α-helix	trans	-62.6	-48	174.3	-68	177.2	72.7	0	0	111.3	L22 R23 Y28 C29 F30 L43 L64 M89	L22-M26 HydrophobicContact CG-SD 4.31Å; L22-M26 WeakPolarHBondContact O-CG 3.33Å; L22-M26 PolarHBondContact O-N 2.64Å; R23-M26 WeakPolarHBondContact O-CB 3.25Å; R23-M26 PolarHBondContact O-N 2.87Å; R23-M26 VanDerWaalsContact O-N 3.14Å; M26-Y28 PolarHBondContact O-N 3.36Å; M26-C29 PolarHBondContact O-N 3.08Å; M26-F30 HydrophobicContact CB-CD2 4.32Å; M26-F30 HydrophobicContact CB-CE2 3.9Å; M26-F30 HydrophobicContact CE-CE2 3.9Å; M26-F30 HydrophobicContact CE-CZ 4.04Å; M26-F30 WeakPolarHBondContact O-CB 3.45Å; M26-F30 WeakPolarHBondContact O-CD2 3.32Å; M26-F30 WeakPolarHBondContact O-CG 3.4Å; M26-F30 PolarHBondContact O-N 3.29Å; M26-L43 HydrophobicContact CB-CD1 3.71Å; M26-L43 HydrophobicContact CB-CD2 4.33Å; M26-L43 HydrophobicContact SD-CD2 4.5Å; M26-L64 HydrophobicContact CB-CD2 4.35Å; M26-L64 HydrophobicContact CG-CD2 3.77Å; M26-M89 HydrophobicContact CE-CE 3.57Å; M26-M89 HydrophobicContact CE-SD 3.68Å
27	E	91.4	Very high	86.6	Confident	47 Å²	47	71 Å²	71	22%	0.22	34%	0.342	C	S	.	.	H	α-helix	trans	-57.1	-50.3	177.2	-69.8	174.5	-176	0	0	111	R23 A24 C29 F30 Q31 L43 L46	R23-E27 IonicContact CZ-OE1 3.86Å; R23-E27 IonicContact NE-OE1 3.07Å; R23-E27 PolarHBondContact NE-OE1 3.22Å; R23-E27 VanDerWaalsContact NE-OE1 3.07Å; R23-E27 IonicContact NH2-OE1 3.72Å; R23-E27 WeakPolarHBondContact O-CG 3.49Å; R23-E27 PolarHBondContact O-N 3.31Å; A24-E27 PolarHBondContact O-N 3.43Å; E27-C29 PolarHBondContact O-N 3.24Å; E27-F30 PolarHBondContact O-N 3.49Å; E27-Q31 VanDerWaalsContact O-CB 3.3Å; E27-Q31 WeakPolarHBondContact O-CB 3.4Å; E27-Q31 WeakPolarHBondContact O-CG 3.36Å; E27-Q31 PolarHBondContact O-N 2.57Å; E27-L43 HydrophobicContact CG-CB 3.88Å; E27-L43 HydrophobicContact CG-CD1 3.75Å; E27-L43 HydrophobicContact CG-CD2 4.41Å; E27-L43 HydrophobicContact CG-CG 4.21Å; E27-L46 HydrophobicContact CB-CD1 4.4Å; E27-L46 HydrophobicContact CG-CD1 4.39Å
28	Y	91.5	Very high	86	Confident	103 Å²	103	72.1 Å²	72.1	40%	0.404	35%	0.348	S	S	.	.	H	α-helix	trans	-58.7	-49.3	176.7	169.2	-100.8	0	0	0	112.6	A24 M26 F30 Q31 K32	A24-Y28 WeakPolarHBondContact O-CB 3.44Å; A24-Y28 PolarHBondContact O-N 3.44Å; M26-Y28 PolarHBondContact O-N 3.36Å; Y28-F30 VanDerWaalsContact C-N 3.32Å; Y28-F30 PolarHBondContact O-N 2.93Å; Y28-Q31 PolarHBondContact O-N 3.46Å; Y28-K32 HydrophobicContact CE1-CD 4.11Å; Y28-K32 HydrophobicContact CE2-CD 4.15Å; Y28-K32 VanDerWaalsContact O-CB 3.22Å; Y28-K32 WeakPolarHBondContact O-CB 3.25Å; Y28-K32 PolarHBondContact O-N 3.07Å; Y28-K32 WeakPolarHBondContact OH-CD 3.41Å; Y28-K32 PolarHBondContact OH-NZ 3.07Å; Y28-K32 VanDerWaalsContact OH-NZ 3.11Å
29	C	92.3	Very high	85.5	Confident	0 Å²	0	77 Å²	77	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-67	-33.2	-177.4	-75.8	0	0	0	0	112.2	T25 M26 E27 N33 C63 L64	T25-C29 WeakPolarHBondContact O-CB 3.45Å; T25-C29 PolarHBondContact O-N 2.88Å; T25-C29 PolarHBondContact O-SG 3.24Å; T25-C29 VanDerWaalsContact O-SG 3.42Å; M26-C29 PolarHBondContact O-N 3.08Å; E27-C29 PolarHBondContact O-N 3.24Å; C29-N33 WeakPolarHBondContact O-CB 3.34Å; C29-N33 PolarHBondContact O-N 2.86Å; C29-N33 PolarHBondContact O-ND2 3.42Å; C29-C63 VanDerWaalsContact CA-SG 3.53Å; C29-C63 HydrophobicContact CB-CB 3.75Å; C29-C63 WeakPolarHBondContact CB-SG 3.12Å; C29-C63 WeakPolarHBondContact SG-CB 3.46Å; C29-C63 CovalentContact SG-SG 2.05Å; C29-C63 PolarHBondContact SG-SG 3.45Å; C29-L64 HydrophobicContact CB-CD2 4.14Å; C29-L64 HydrophobicContact CB-CG 3.87Å
30	F	92.4	Very high	85.2	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-71.8	-50.3	173.1	-62.5	-39.3	0	0	0	111.3	M26 E27 Y28 K32 N33 G34 Y36 L43 L46 R47 C50 M51 A60 L64 F90	M26-F30 HydrophobicContact CB-CD2 4.32Å; M26-F30 HydrophobicContact CB-CE2 3.9Å; M26-F30 HydrophobicContact CE-CE2 3.9Å; M26-F30 HydrophobicContact CE-CZ 4.04Å; M26-F30 WeakPolarHBondContact O-CB 3.45Å; M26-F30 WeakPolarHBondContact O-CD2 3.32Å; M26-F30 WeakPolarHBondContact O-CG 3.4Å; M26-F30 PolarHBondContact O-N 3.29Å; E27-F30 PolarHBondContact O-N 3.49Å; Y28-F30 VanDerWaalsContact C-N 3.32Å; Y28-F30 PolarHBondContact O-N 2.93Å; F30-K32 VanDerWaalsContact C-N 3.33Å; F30-K32 PolarHBondContact O-N 3.14Å; F30-N33 PolarHBondContact O-N 3.37Å; F30-G34 PolarHBondContact O-N 2.89Å; F30-Y36 WeakPolarHBondContact O-CE2 3.34Å; F30-Y36 PolarHBondContact O-OH 3.41Å; F30-Y36 VanDerWaalsContact O-OH 3.07Å; F30-L43 HydrophobicContact CD2-CD1 3.58Å; F30-L43 HydrophobicContact CE2-CD1 3.59Å; F30-L46 HydrophobicContact CB-CB 3.94Å; F30-L46 HydrophobicContact CB-CD2 4.38Å; F30-L46 HydrophobicContact CD2-CB 4.22Å; F30-L46 HydrophobicContact CG-CB 4.47Å; F30-R47 HydrophobicContact CD2-CB 4.12Å; F30-R47 HydrophobicContact CE2-CB 3.59Å; F30-R47 HydrophobicContact CE2-CG 3.98Å; F30-R47 HydrophobicContact CZ-CB 3.95Å; F30-R47 HydrophobicContact CZ-CG 3.83Å; F30-C50 HydrophobicContact CB-CB 4.46Å; F30-C50 HydrophobicContact CD1-CB 3.81Å; F30-C50 HydrophobicContact CE1-CB 4.41Å; F30-C50 HydrophobicContact CG-CB 4.35Å; F30-M51 HydrophobicContact CE1-CE 4.04Å; F30-M51 HydrophobicContact CZ-CE 4.2Å; F30-A60 HydrophobicContact CD1-CB 3.8Å; F30-A60 HydrophobicContact CE1-CB 4.06Å; F30-L64 HydrophobicContact CE1-CD1 4.26Å; F30-L64 HydrophobicContact CZ-CD1 4.38Å; F30-F90 HydrophobicContact CE1-CE1 4.46Å; F30-F90 HydrophobicContact CE1-CE2 4.43Å; F30-F90 AromaticContact CE1-CZ 3.69Å; F30-F90 HydrophobicContact CE1-CZ 3.69Å; F30-F90 HydrophobicContact CZ-CZ 4.31Å
31	Q	89.8	Confident	84.8	Confident	102 Å²	102	75.6 Å²	75.6	48%	0.477	38%	0.38	S	S	.	.	H	α-helix	trans	-55.3	-45.8	178.7	-78.2	-177.4	-11.5	0	0	112.9	E27 Y28 N33 L40 L46	E27-Q31 VanDerWaalsContact O-CB 3.3Å; E27-Q31 WeakPolarHBondContact O-CB 3.4Å; E27-Q31 WeakPolarHBondContact O-CG 3.36Å; E27-Q31 PolarHBondContact O-N 2.57Å; Y28-Q31 PolarHBondContact O-N 3.46Å; Q31-N33 VanDerWaalsContact C-N 3.32Å; Q31-N33 PolarHBondContact O-N 2.91Å; Q31-L40 PolarHBondContact NE2-O 3.38Å; Q31-L46 HydrophobicContact CG-CD1 3.77Å; Q31-L46 HydrophobicContact CG-CD2 3.51Å; Q31-L46 HydrophobicContact CG-CG 4.31Å
32	K	89.8	Confident	84.8	Confident	134 Å²	134	76.9 Å²	76.9	58%	0.583	39%	0.387	S	S	*	.	H	α-helix	trans	-66.6	-32.8	-178.4	-179.4	171.5	-177.7	174.6	0	113.4	Y28 F30	Y28-K32 HydrophobicContact CE1-CD 4.11Å; Y28-K32 HydrophobicContact CE2-CD 4.15Å; Y28-K32 VanDerWaalsContact O-CB 3.22Å; Y28-K32 WeakPolarHBondContact O-CB 3.25Å; Y28-K32 PolarHBondContact O-N 3.07Å; Y28-K32 WeakPolarHBondContact OH-CD 3.41Å; Y28-K32 PolarHBondContact OH-NZ 3.07Å; Y28-K32 VanDerWaalsContact OH-NZ 3.11Å; F30-K32 VanDerWaalsContact C-N 3.33Å; F30-K32 PolarHBondContact O-N 3.14Å
33	N	90.9	Very high	84.8	Confident	37 Å²	37	77.4 Å²	77.4	20%	0.198	39%	0.39	C	S	.	.	H	α-helix	trans	-103.4	-14.1	-171.2	-67	-61.4	0	0	0	113.8	C29 F30 Q31 K59 A60	C29-N33 WeakPolarHBondContact O-CB 3.34Å; C29-N33 PolarHBondContact O-N 2.86Å; C29-N33 PolarHBondContact O-ND2 3.42Å; F30-N33 PolarHBondContact O-N 3.37Å; Q31-N33 VanDerWaalsContact C-N 3.32Å; Q31-N33 PolarHBondContact O-N 2.91Å; N33-K59 HydrophobicContact CB-CB 3.94Å; N33-K59 VanDerWaalsContact OD1-CB 3.31Å; N33-K59 WeakPolarHBondContact OD1-CB 3.22Å; N33-A60 HydrophobicContact CB-CB 4.45Å
34	G	85.2	Confident	84.9	Confident	14 Å²	14	77.1 Å²	77.1	14%	0.144	39%	0.393	C	S	.	.			trans	-89.3	151.6	174.5	0	0	0	0	0	112.7	F30 C56	F30-G34 PolarHBondContact O-N 2.89Å; G34-C56 VanDerWaalsContact CA-SG 3.52Å; G34-C56 PolarHBondContact N-SG 2.9Å; G34-C56 VanDerWaalsContact N-SG 3.37Å
35	R	80.2	Confident	84.8	Confident	240 Å²	240	82 Å²	82	91%	0.906	40%	0.399	S	S	*	.			trans	-104.1	87.3	168.9	-72.5	-175.7	173.4	-176	-2.6	108.6
36	Y	77.5	Confident	84.8	Confident	57 Å²	57	81 Å²	81	22%	0.224	39%	0.393	C	S	.	.			trans	-95.3	128.4	-180	-46.4	-67.9	0	0	0	109.6	F30 I38 L40 L46 A49	F30-Y36 WeakPolarHBondContact O-CE2 3.34Å; F30-Y36 PolarHBondContact O-OH 3.41Å; F30-Y36 VanDerWaalsContact O-OH 3.07Å; Y36-I38 WeakPolarHBondContact CB-O 3.09Å; Y36-I38 PolarHBondContact O-N 3.17Å; Y36-L40 HydrophobicContact CD1-CD1 3.49Å; Y36-L40 VanDerWaalsContact CD1-CD1 3.49Å; Y36-L40 HydrophobicContact CD1-CG 4.28Å; Y36-L40 HydrophobicContact CE1-CD1 3.75Å; Y36-L40 HydrophobicContact CG-CD1 4.04Å; Y36-L40 HydrophobicContact CG-CG 4.37Å; Y36-L46 HydrophobicContact CD2-CD2 4.12Å; Y36-L46 HydrophobicContact CE1-CD2 4.43Å; Y36-L46 HydrophobicContact CE2-CD2 3.58Å; Y36-L46 PolarHBondContact OH-O 3.48Å; Y36-A49 HydrophobicContact CD1-CB 4.13Å; Y36-A49 HydrophobicContact CE1-CB 3.6Å
37	S	72	Confident	84.8	Confident	126 Å²	126	83.9 Å²	83.9	88%	0.881	40%	0.403	S	S	*	.	S	Bend	trans	-70.8	-21.6	172.7	47.7	0	0	0	0	112.5
38	I	71.2	Confident	84.7	Confident	117 Å²	117	84.4 Å²	84.4	60%	0.6	41%	0.407	S	S	*	.	S	Bend	trans	-131.1	136	-179.9	-55.2	174.6	0	0	0	107.4	Y36 L40	Y36-I38 WeakPolarHBondContact CB-O 3.09Å; Y36-I38 PolarHBondContact O-N 3.17Å; I38-L40 PolarHBondContact O-N 3.13Å
39	P	72.5	Confident	84.7	Confident	114 Å²	114	81.2 Å²	81.2	74%	0.74	40%	0.402	S	S	*	.			trans	-58.7	111.8	174	21.9	-31	0	0	0	110
40	L	75.4	Confident	84.7	Confident	34 Å²	34	81.2 Å²	81.2	18%	0.178	40%	0.402	C	S	.	.			trans	-84.3	117.4	172.8	-61.5	177.1	0	0	0	108	Q31 Y36 I38 R45 L46 A49	Q31-L40 PolarHBondContact NE2-O 3.38Å; Y36-L40 HydrophobicContact CD1-CD1 3.49Å; Y36-L40 VanDerWaalsContact CD1-CD1 3.49Å; Y36-L40 HydrophobicContact CD1-CG 4.28Å; Y36-L40 HydrophobicContact CE1-CD1 3.75Å; Y36-L40 HydrophobicContact CG-CD1 4.04Å; Y36-L40 HydrophobicContact CG-CG 4.37Å; I38-L40 PolarHBondContact O-N 3.13Å; L40-R45 HydrophobicContact CD1-CB 4.48Å; L40-R45 HydrophobicContact CD2-CB 4.33Å; L40-L46 HydrophobicContact CB-CD2 3.63Å; L40-L46 HydrophobicContact CB-CG 3.66Å; L40-L46 HydrophobicContact CD1-CD2 4.27Å; L40-L46 WeakPolarHBondContact O-CD1 3.47Å; L40-L46 WeakPolarHBondContact O-CG 3.41Å; L40-A49 HydrophobicContact CD1-CB 3.85Å
41	T	79.2	Confident	84.5	Confident	118 Å²	118	83.1 Å²	83.1	72%	0.724	41%	0.412	S	S	*	.			trans	-93.5	-25.6	179.4	50.7	0	0	0	0	112.6
42	E	86.4	Confident	84.5	Confident	110 Å²	110	85.2 Å²	85.2	51%	0.514	43%	0.426	S	S	.	.	S	Bend	trans	-84.4	121.8	177.8	-70.2	-178.1	-170.4	0	0	111.3	K44 R45 L46	E42-K44 PolarHBondContact O-N 3.09Å; E42-K44 VanDerWaalsContact O-N 3.16Å; E42-R45 HydrophobicContact CB-CB 4.25Å; E42-R45 HydrophobicContact CB-CG 4.32Å; E42-R45 PolarHBondContact O-N 2.89Å; E42-L46 PolarHBondContact O-N 3.14Å
43	L	86.9	Confident	84.6	Confident	30 Å²	30	81.8 Å²	81.8	16%	0.157	41%	0.414	C	S	.	.	H	α-helix	trans	-51.1	-40.1	175.8	175.2	55.7	0	0	0	112.9	R23 M26 E27 F30 R45 L46 R47	R23-L43 HydrophobicContact CG-CD2 3.55Å; M26-L43 HydrophobicContact CB-CD1 3.71Å; M26-L43 HydrophobicContact CB-CD2 4.33Å; M26-L43 HydrophobicContact SD-CD2 4.5Å; E27-L43 HydrophobicContact CG-CB 3.88Å; E27-L43 HydrophobicContact CG-CD1 3.75Å; E27-L43 HydrophobicContact CG-CD2 4.41Å; E27-L43 HydrophobicContact CG-CG 4.21Å; F30-L43 HydrophobicContact CD2-CD1 3.58Å; F30-L43 HydrophobicContact CE2-CD1 3.59Å; L43-R45 PolarHBondContact O-N 2.05Å; L43-L46 PolarHBondContact O-N 2.86Å; L43-R47 VanDerWaalsContact O-CB 3.29Å; L43-R47 WeakPolarHBondContact O-CB 3.39Å; L43-R47 PolarHBondContact O-N 3.32Å
44	K	88.1	Confident	84.5	Confident	138 Å²	138	90.5 Å²	90.5	60%	0.6	44%	0.444	S	S	*	.	H	α-helix	trans	-60.4	-47.8	178.5	-174.7	-178.8	175.7	-174.6	0	111.2	E42 R47 D48	E42-K44 PolarHBondContact O-N 3.09Å; E42-K44 VanDerWaalsContact O-N 3.16Å; K44-R47 PolarHBondContact O-N 2.97Å; K44-D48 WeakPolarHBondContact O-CB 3.09Å; K44-D48 PolarHBondContact O-N 2.95Å
45	R	89.1	Confident	84.8	Confident	157 Å²	157	95.2 Å²	95.2	59%	0.592	47%	0.466	S	S	*	.	H	α-helix	trans	-65.9	-42.4	178.3	-74.6	-177.3	147.2	-163.9	-4.1	112	L40 E42 L43 R47 D48 A49	L40-R45 HydrophobicContact CD1-CB 4.48Å; L40-R45 HydrophobicContact CD2-CB 4.33Å; E42-R45 HydrophobicContact CB-CB 4.25Å; E42-R45 HydrophobicContact CB-CG 4.32Å; E42-R45 PolarHBondContact O-N 2.89Å; L43-R45 PolarHBondContact O-N 2.05Å; R45-R47 VanDerWaalsContact C-N 3.34Å; R45-R47 PolarHBondContact O-N 3.44Å; R45-D48 PolarHBondContact O-N 3.11Å; R45-A49 VanDerWaalsContact O-CB 3.28Å; R45-A49 WeakPolarHBondContact O-CB 3.32Å; R45-A49 PolarHBondContact O-N 2.89Å
46	L	89.4	Confident	85.4	Confident	1 Å²	1	83.8 Å²	83.8	1%	0.005	42%	0.423	C	S	.	.	H	α-helix	trans	-56	-49.4	174.2	-83.9	167.7	0	0	0	111.7	E27 F30 Q31 Y36 L40 E42 L43 C50	E27-L46 HydrophobicContact CB-CD1 4.4Å; E27-L46 HydrophobicContact CG-CD1 4.39Å; F30-L46 HydrophobicContact CB-CB 3.94Å; F30-L46 HydrophobicContact CB-CD2 4.38Å; F30-L46 HydrophobicContact CD2-CB 4.22Å; F30-L46 HydrophobicContact CG-CB 4.47Å; Q31-L46 HydrophobicContact CG-CD1 3.77Å; Q31-L46 HydrophobicContact CG-CD2 3.51Å; Q31-L46 HydrophobicContact CG-CG 4.31Å; Y36-L46 HydrophobicContact CD2-CD2 4.12Å; Y36-L46 HydrophobicContact CE1-CD2 4.43Å; Y36-L46 HydrophobicContact CE2-CD2 3.58Å; Y36-L46 PolarHBondContact OH-O 3.48Å; L40-L46 HydrophobicContact CB-CD2 3.63Å; L40-L46 HydrophobicContact CB-CG 3.66Å; L40-L46 HydrophobicContact CD1-CD2 4.27Å; L40-L46 WeakPolarHBondContact O-CD1 3.47Å; L40-L46 WeakPolarHBondContact O-CG 3.41Å; E42-L46 PolarHBondContact O-N 3.14Å; L43-L46 PolarHBondContact O-N 2.86Å; L46-C50 VanDerWaalsContact O-CB 3.25Å; L46-C50 WeakPolarHBondContact O-CB 3.29Å; L46-C50 PolarHBondContact O-N 2.94Å
47	R	90.2	Very high	86.1	Confident	82 Å²	82	83.7 Å²	83.7	31%	0.309	42%	0.423	S	S	.	.	H	α-helix	trans	-59.3	-54.9	176.9	-179.2	-162.3	65.8	-174.5	1.5	110.3	F30 L43 K44 R45 A49 C50 M51 M89	F30-R47 HydrophobicContact CD2-CB 4.12Å; F30-R47 HydrophobicContact CE2-CB 3.59Å; F30-R47 HydrophobicContact CE2-CG 3.98Å; F30-R47 HydrophobicContact CZ-CB 3.95Å; F30-R47 HydrophobicContact CZ-CG 3.83Å; L43-R47 VanDerWaalsContact O-CB 3.29Å; L43-R47 WeakPolarHBondContact O-CB 3.39Å; L43-R47 PolarHBondContact O-N 3.32Å; K44-R47 PolarHBondContact O-N 2.97Å; R45-R47 VanDerWaalsContact C-N 3.34Å; R45-R47 PolarHBondContact O-N 3.44Å; R47-A49 VanDerWaalsContact C-N 3.32Å; R47-A49 PolarHBondContact O-N 3.35Å; R47-C50 CarbonylContact O-C 3.58Å; R47-C50 PolarHBondContact O-N 2.99Å; R47-C50 VanDerWaalsContact O-N 3.08Å; R47-M51 HydrophobicContact CG-CE 4.01Å; R47-M51 HydrophobicContact CG-CG 4.09Å; R47-M51 VanDerWaalsContact O-CG 3.23Å; R47-M51 WeakPolarHBondContact O-CG 3.47Å; R47-M51 PolarHBondContact O-N 3.05Å; R47-M89 HydrophobicContact CG-SD 4.1Å
48	D	90.1	Very high	87	Confident	59 Å²	59	81.5 Å²	81.5	32%	0.316	41%	0.405	S	S	.	.	H	α-helix	trans	-61.5	-42.4	-173.9	-64.5	-10.2	0	0	0	110.9	K44 R45 M51 N52	K44-D48 WeakPolarHBondContact O-CB 3.09Å; K44-D48 PolarHBondContact O-N 2.95Å; R45-D48 PolarHBondContact O-N 3.11Å; D48-M51 PolarHBondContact O-N 3.38Å; D48-N52 PolarHBondContact O-N 2.95Å; D48-N52 PolarHBondContact O-ND2 2.92Å; D48-N52 VanDerWaalsContact O-ND2 3.07Å
49	A	90.6	Very high	88.1	Confident	36 Å²	36	81.2 Å²	81.2	30%	0.298	40%	0.399	S	S	.	.	H	α-helix	trans	-64.2	-41.5	173.9	0	0	0	0	0	112.4	Y36 L40 R45 R47 N52 D53	Y36-A49 HydrophobicContact CD1-CB 4.13Å; Y36-A49 HydrophobicContact CE1-CB 3.6Å; L40-A49 HydrophobicContact CD1-CB 3.85Å; R45-A49 VanDerWaalsContact O-CB 3.28Å; R45-A49 WeakPolarHBondContact O-CB 3.32Å; R45-A49 PolarHBondContact O-N 2.89Å; R47-A49 VanDerWaalsContact C-N 3.32Å; R47-A49 PolarHBondContact O-N 3.35Å; A49-N52 PolarHBondContact O-N 3.03Å; A49-D53 PolarHBondContact O-N 3.46Å
50	C	91.2	Very high	89.1	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-66.6	-37.9	176.4	-170.2	0	0	0	0	112.9	F30 L46 R47 N52 D53 C56 K57	F30-C50 HydrophobicContact CB-CB 4.46Å; F30-C50 HydrophobicContact CD1-CB 3.81Å; F30-C50 HydrophobicContact CE1-CB 4.41Å; F30-C50 HydrophobicContact CG-CB 4.35Å; L46-C50 VanDerWaalsContact O-CB 3.25Å; L46-C50 WeakPolarHBondContact O-CB 3.29Å; L46-C50 PolarHBondContact O-N 2.94Å; R47-C50 CarbonylContact O-C 3.58Å; R47-C50 PolarHBondContact O-N 2.99Å; R47-C50 VanDerWaalsContact O-N 3.08Å; C50-N52 VanDerWaalsContact C-N 3.25Å; C50-N52 PolarHBondContact O-N 3.16Å; C50-D53 PolarHBondContact O-N 3.42Å; C50-D53 VanDerWaalsContact O-N 3.16Å; C50-C56 WeakPolarHBondContact CA-SG 3.37Å; C50-C56 HydrophobicContact CB-CB 4.05Å; C50-C56 WeakPolarHBondContact CB-SG 3.26Å; C50-C56 WeakPolarHBondContact SG-CB 3.3Å; C50-C56 PolarHBondContact SG-O 3.33Å; C50-C56 CovalentContact SG-SG 2.04Å; C50-C56 PolarHBondContact SG-SG 3.49Å; C50-K57 PolarHBondContact O-N 3.32Å
51	M	89.2	Confident	89.9	Confident	40 Å²	40	77 Å²	77	20%	0.197	37%	0.368	C	S	.	.	H	α-helix	trans	-68.3	-26.9	179.4	-67.7	-61.1	162.6	0	0	112.5	F30 R47 D48 K57 M89 F90	F30-M51 HydrophobicContact CE1-CE 4.04Å; F30-M51 HydrophobicContact CZ-CE 4.2Å; R47-M51 HydrophobicContact CG-CE 4.01Å; R47-M51 HydrophobicContact CG-CG 4.09Å; R47-M51 VanDerWaalsContact O-CG 3.23Å; R47-M51 WeakPolarHBondContact O-CG 3.47Å; R47-M51 PolarHBondContact O-N 3.05Å; D48-M51 PolarHBondContact O-N 3.38Å; M51-K57 HydrophobicContact SD-CD 4.33Å; M51-K57 HydrophobicContact SD-CG 4.06Å; M51-M89 HydrophobicContact CE-CG 3.96Å; M51-M89 HydrophobicContact CE-SD 4.2Å; M51-F90 HydrophobicContact CE-CD1 3.68Å; M51-F90 HydrophobicContact CE-CD2 3.78Å; M51-F90 HydrophobicContact CE-CE1 3.39Å; M51-F90 HydrophobicContact CE-CE2 3.53Å; M51-F90 HydrophobicContact CE-CG 3.9Å; M51-F90 HydrophobicContact CE-CZ 3.36Å; M51-F90 HydrophobicContact SD-CD1 3.85Å; M51-F90 HydrophobicContact SD-CE1 3.96Å; M51-F90 HydrophobicContact SD-CG 4.26Å
52	N	90.3	Very high	90.5	Very high	145 Å²	145	76 Å²	76	78%	0.775	36%	0.358	S	S	*	.	H	α-helix	trans	-80	-15	174.3	-70.7	-34.5	0	0	0	113.4	D48 A49 C50	D48-N52 PolarHBondContact O-N 2.95Å; D48-N52 PolarHBondContact O-ND2 2.92Å; D48-N52 VanDerWaalsContact O-ND2 3.07Å; A49-N52 PolarHBondContact O-N 3.03Å; C50-N52 VanDerWaalsContact C-N 3.25Å; C50-N52 PolarHBondContact O-N 3.16Å
53	D	90.5	Very high	90.8	Very high	62 Å²	62	71.9 Å²	71.9	33%	0.332	34%	0.341	S	S	.	.	S	Bend	trans	-101.9	113.1	174.3	-180	-40.9	0	0	0	109.8	A49 C50 N55 C56 K57	A49-D53 PolarHBondContact O-N 3.46Å; C50-D53 PolarHBondContact O-N 3.42Å; C50-D53 VanDerWaalsContact O-N 3.16Å; D53-N55 PolarHBondContact O-N 2.86Å; D53-N55 WeakPolarHBondContact OD1-CA 3.48Å; D53-N55 VanDerWaalsContact OD1-CB 3.28Å; D53-N55 WeakPolarHBondContact OD1-CB 3.33Å; D53-N55 PolarHBondContact OD1-N 3.41Å; D53-C56 HydrophobicContact CB-CB 3.75Å; D53-C56 PolarHBondContact O-N 2.88Å; D53-C56 VanDerWaalsContact O-N 3.12Å; D53-C56 PolarHBondContact OD1-N 3.19Å; D53-K57 WeakPolarHBondContact O-CB 3.4Å; D53-K57 PolarHBondContact O-N 3.15Å
54	R	90.2	Very high	91	Very high	221 Å²	221	70.4 Å²	70.4	83%	0.834	33%	0.334	S	S	*	.	H	α-helix	trans	-58.6	-34.9	-176.9	-164.2	178.5	-168.4	-176.4	3.6	113.1	T58	R54-T58 PolarHBondContact O-N 2.9Å; R54-T58 PolarHBondContact O-OG1 3.07Å
55	N	90.9	Very high	91.1	Very high	112 Å²	112	65.4 Å²	65.4	60%	0.599	31%	0.313	S	S	*	.	H	α-helix	trans	-73.1	-43.5	177.9	-106.6	-4.2	0	0	0	110.9	D53 K59	D53-N55 PolarHBondContact O-N 2.86Å; D53-N55 WeakPolarHBondContact OD1-CA 3.48Å; D53-N55 VanDerWaalsContact OD1-CB 3.28Å; D53-N55 WeakPolarHBondContact OD1-CB 3.33Å; D53-N55 PolarHBondContact OD1-N 3.41Å; N55-K59 WeakPolarHBondContact O-CB 3.41Å; N55-K59 WeakPolarHBondContact O-CG 3.03Å; N55-K59 PolarHBondContact O-N 3.34Å; N55-K59 VanDerWaalsContact O-N 3.1Å
56	C	92.3	Very high	91.1	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-61.5	-47.1	175.1	-169.1	0	0	0	0	110.5	G34 C50 D53 T58 K59 A60	G34-C56 VanDerWaalsContact CA-SG 3.52Å; G34-C56 PolarHBondContact N-SG 2.9Å; G34-C56 VanDerWaalsContact N-SG 3.37Å; C50-C56 WeakPolarHBondContact CA-SG 3.37Å; C50-C56 HydrophobicContact CB-CB 4.05Å; C50-C56 WeakPolarHBondContact CB-SG 3.26Å; C50-C56 WeakPolarHBondContact SG-CB 3.3Å; C50-C56 PolarHBondContact SG-O 3.33Å; C50-C56 CovalentContact SG-SG 2.04Å; C50-C56 PolarHBondContact SG-SG 3.49Å; D53-C56 HydrophobicContact CB-CB 3.75Å; D53-C56 PolarHBondContact O-N 2.88Å; D53-C56 VanDerWaalsContact O-N 3.12Å; D53-C56 PolarHBondContact OD1-N 3.19Å; C56-T58 PolarHBondContact O-N 3.37Å; C56-K59 PolarHBondContact O-N 3.42Å; C56-A60 WeakPolarHBondContact O-CB 3.49Å; C56-A60 PolarHBondContact O-N 2.91Å
57	K	92.1	Very high	91.1	Very high	55 Å²	55	65.5 Å²	65.5	24%	0.239	33%	0.328	C	S	.	.	H	α-helix	trans	-52	-52.5	178.6	-171.3	174.6	174.4	177.1	0	111.5	C50 M51 D53 K61 F90 K91	C50-K57 PolarHBondContact O-N 3.32Å; M51-K57 HydrophobicContact SD-CD 4.33Å; M51-K57 HydrophobicContact SD-CG 4.06Å; D53-K57 WeakPolarHBondContact O-CB 3.4Å; D53-K57 PolarHBondContact O-N 3.15Å; K57-K61 WeakPolarHBondContact O-CB 3.4Å; K57-K61 PolarHBondContact O-N 3.46Å; K57-K61 VanDerWaalsContact O-N 3.14Å; K57-F90 HydrophobicContact CB-CD1 4.49Å; K57-F90 WeakPolarHBondContact CE-O 3.2Å; K57-F90 HydrophobicContact CG-CD1 3.58Å; K57-F90 HydrophobicContact CG-CE1 4.2Å; K57-F90 PolarHBondContact NZ-O 3.42Å; K57-F90 WeakPolarHBondContact O-CD1 3.35Å; K57-F90 WeakPolarHBondContact O-CE1 2.92Å; K57-K91 PolarHBondContact NZ-O 3.22Å
58	T	91.4	Very high	90.7	Very high	81 Å²	81	61.6 Å²	61.6	50%	0.497	31%	0.313	S	S	.	.	H	α-helix	trans	-64.1	-50.7	179.6	-56.5	0	0	0	0	111.9	R54 C56 A60 K61 D62	R54-T58 PolarHBondContact O-N 2.9Å; R54-T58 PolarHBondContact O-OG1 3.07Å; C56-T58 PolarHBondContact O-N 3.37Å; T58-A60 PolarHBondContact O-N 2.91Å; T58-K61 WeakPolarHBondContact O-CB 3.39Å; T58-K61 PolarHBondContact O-N 3.43Å; T58-D62 PolarHBondContact O-N 2.9Å; T58-D62 VanDerWaalsContact O-N 3.14Å
59	K	93.9	Very high	90.3	Very high	111 Å²	111	66.6 Å²	66.6	48%	0.483	33%	0.333	S	S	.	.	H	α-helix	trans	-68.6	-36.3	-175.4	-67.3	-179.5	176.5	-176.7	0	113.3	N33 N55 C56 D62 C63	N33-K59 HydrophobicContact CB-CB 3.94Å; N33-K59 VanDerWaalsContact OD1-CB 3.31Å; N33-K59 WeakPolarHBondContact OD1-CB 3.22Å; N55-K59 WeakPolarHBondContact O-CB 3.41Å; N55-K59 WeakPolarHBondContact O-CG 3.03Å; N55-K59 PolarHBondContact O-N 3.34Å; N55-K59 VanDerWaalsContact O-N 3.1Å; C56-K59 PolarHBondContact O-N 3.42Å; K59-D62 PolarHBondContact O-N 3.45Å; K59-C63 VanDerWaalsContact O-CB 3.28Å; K59-C63 WeakPolarHBondContact O-CB 3.45Å; K59-C63 PolarHBondContact O-N 2.77Å
60	A	93.8	Very high	89.7	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-67.2	-38.7	176.3	0	0	0	0	0	111	F30 N33 C56 T58 C63 L64 F90	F30-A60 HydrophobicContact CD1-CB 3.8Å; F30-A60 HydrophobicContact CE1-CB 4.06Å; N33-A60 HydrophobicContact CB-CB 4.45Å; C56-A60 WeakPolarHBondContact O-CB 3.49Å; C56-A60 PolarHBondContact O-N 2.91Å; T58-A60 PolarHBondContact O-N 2.91Å; A60-C63 PolarHBondContact O-N 3.24Å; A60-L64 WeakPolarHBondContact O-CB 3.39Å; A60-L64 WeakPolarHBondContact O-CD1 3.31Å; A60-L64 VanDerWaalsContact O-CG 3.25Å; A60-L64 WeakPolarHBondContact O-CG 3.28Å; A60-L64 PolarHBondContact O-N 2.92Å; A60-F90 HydrophobicContact CB-CE1 3.97Å; A60-F90 HydrophobicContact CB-CZ 3.96Å
61	K	92.2	Very high	88.5	Confident	59 Å²	59	71.5 Å²	71.5	26%	0.257	36%	0.364	S	S	.	.	H	α-helix	trans	-57.8	-50.8	172.4	-175.7	178.3	178	167.1	0	111.3	K57 T58 C63 L64 L65 D87 F90	K57-K61 WeakPolarHBondContact O-CB 3.4Å; K57-K61 PolarHBondContact O-N 3.46Å; K57-K61 VanDerWaalsContact O-N 3.14Å; T58-K61 WeakPolarHBondContact O-CB 3.39Å; T58-K61 PolarHBondContact O-N 3.43Å; K61-C63 PolarHBondContact O-N 3.39Å; K61-L64 PolarHBondContact O-N 3.42Å; K61-L65 HydrophobicContact CG-CD1 4.02Å; K61-L65 HydrophobicContact CG-CG 4.46Å; K61-L65 WeakPolarHBondContact O-CG 3.25Å; K61-L65 PolarHBondContact O-N 3.14Å; K61-D87 WeakPolarHBondContact CE-OD1 3.33Å; K61-D87 IonicContact NZ-OD1 2.77Å; K61-D87 PolarHBondContact NZ-OD1 3.23Å; K61-F90 HydrophobicContact CB-CB 4.47Å; K61-F90 HydrophobicContact CB-CD1 3.73Å; K61-F90 HydrophobicContact CB-CD2 4.44Å; K61-F90 HydrophobicContact CB-CE1 3.94Å; K61-F90 HydrophobicContact CB-CG 3.99Å; K61-F90 HydrophobicContact CB-CZ 4.32Å; K61-F90 HydrophobicContact CD-CB 4.01Å; K61-F90 HydrophobicContact CD-CG 4.42Å; K61-F90 HydrophobicContact CG-CB 4.37Å; K61-F90 HydrophobicContact CG-CD1 4.48Å; K61-F90 HydrophobicContact CG-CG 4.26Å
62	D	91.8	Very high	87.4	Confident	97 Å²	97	75.4 Å²	75.4	52%	0.519	38%	0.382	S	S	.	.	H	α-helix	trans	-63.8	-41.7	-179.1	-68.5	-20.4	0	0	0	112	T58 K59 L64 L65 S66	T58-D62 PolarHBondContact O-N 2.9Å; T58-D62 VanDerWaalsContact O-N 3.14Å; K59-D62 PolarHBondContact O-N 3.45Å; D62-L64 VanDerWaalsContact C-N 3.35Å; D62-L64 PolarHBondContact O-N 3.47Å; D62-L65 PolarHBondContact O-N 3.44Å; D62-S66 VanDerWaalsContact O-CB 3.29Å; D62-S66 WeakPolarHBondContact O-CB 3.38Å; D62-S66 PolarHBondContact O-N 3.16Å
63	C	92.8	Very high	86.6	Confident	23 Å²	23	68.7 Å²	68.7	16%	0.155	35%	0.346	C	S	.	.	H	α-helix	trans	-56.7	-48.4	173.5	178.5	0	0	0	0	111.6	C29 K59 A60 K61 S66 K67	C29-C63 VanDerWaalsContact CA-SG 3.53Å; C29-C63 HydrophobicContact CB-CB 3.75Å; C29-C63 WeakPolarHBondContact CB-SG 3.12Å; C29-C63 WeakPolarHBondContact SG-CB 3.46Å; C29-C63 CovalentContact SG-SG 2.05Å; C29-C63 PolarHBondContact SG-SG 3.45Å; K59-C63 VanDerWaalsContact O-CB 3.28Å; K59-C63 WeakPolarHBondContact O-CB 3.45Å; K59-C63 PolarHBondContact O-N 2.77Å; A60-C63 PolarHBondContact O-N 3.24Å; K61-C63 PolarHBondContact O-N 3.39Å; C63-S66 PolarHBondContact O-N 2.9Å; C63-K67 WeakPolarHBondContact O-CB 3.33Å; C63-K67 WeakPolarHBondContact O-CG 3.29Å; C63-K67 PolarHBondContact O-N 3.48Å
64	L	91.6	Very high	85.6	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-65.1	-45.6	-178.5	-78.8	162.6	0	0	0	112.1	T25 M26 C29 F30 A60 K61 D62 S66 K67 L68 I86 F90	T25-L64 HydrophobicContact CG2-CD2 3.94Å; M26-L64 HydrophobicContact CB-CD2 4.35Å; M26-L64 HydrophobicContact CG-CD2 3.77Å; C29-L64 HydrophobicContact CB-CD2 4.14Å; C29-L64 HydrophobicContact CB-CG 3.87Å; F30-L64 HydrophobicContact CE1-CD1 4.26Å; F30-L64 HydrophobicContact CZ-CD1 4.38Å; A60-L64 WeakPolarHBondContact O-CB 3.39Å; A60-L64 WeakPolarHBondContact O-CD1 3.31Å; A60-L64 VanDerWaalsContact O-CG 3.25Å; A60-L64 WeakPolarHBondContact O-CG 3.28Å; A60-L64 PolarHBondContact O-N 2.92Å; K61-L64 PolarHBondContact O-N 3.42Å; D62-L64 VanDerWaalsContact C-N 3.35Å; D62-L64 PolarHBondContact O-N 3.47Å; L64-S66 VanDerWaalsContact C-N 3.33Å; L64-S66 PolarHBondContact O-N 3.14Å; L64-K67 PolarHBondContact O-N 3.28Å; L64-L68 WeakPolarHBondContact O-CB 3.45Å; L64-L68 VanDerWaalsContact O-CG 3.32Å; L64-L68 WeakPolarHBondContact O-CG 3.25Å; L64-L68 PolarHBondContact O-N 3.39Å; L64-I86 HydrophobicContact CB-CD1 3.64Å; L64-I86 HydrophobicContact CB-CG2 4.19Å; L64-I86 HydrophobicContact CD1-CD1 4.03Å; L64-I86 HydrophobicContact CD1-CG2 4.3Å; L64-I86 HydrophobicContact CD2-CD1 3.84Å; L64-I86 HydrophobicContact CG-CD1 4.02Å; L64-F90 HydrophobicContact CD1-CE2 3.58Å; L64-F90 HydrophobicContact CD1-CZ 3.62Å
65	L	89.2	Confident	84.8	Confident	33 Å²	33	64.4 Å²	64.4	17%	0.173	35%	0.35	C	S	.	.	H	α-helix	trans	-64.1	-39.3	177.3	-70.3	175.7	0	0	0	111.8	K61 D62 K69 I83	K61-L65 HydrophobicContact CG-CD1 4.02Å; K61-L65 HydrophobicContact CG-CG 4.46Å; K61-L65 WeakPolarHBondContact O-CG 3.25Å; K61-L65 PolarHBondContact O-N 3.14Å; D62-L65 PolarHBondContact O-N 3.44Å; L65-K69 WeakPolarHBondContact O-CB 3.03Å; L65-K69 VanDerWaalsContact O-CG 3.26Å; L65-K69 WeakPolarHBondContact O-CG 3.46Å; L65-K69 PolarHBondContact O-N 2.93Å; L65-K69 VanDerWaalsContact O-N 3.07Å; L65-I83 HydrophobicContact CD2-CG2 3.99Å
66	S	89.9	Confident	84.1	Confident	83 Å²	83	59.6 Å²	59.6	58%	0.58	33%	0.325	S	S	*	.	H	α-helix	trans	-62.7	-45.8	175.1	178.1	0	0	0	0	111.4	D62 C63 L64 K69 S70	D62-S66 VanDerWaalsContact O-CB 3.29Å; D62-S66 WeakPolarHBondContact O-CB 3.38Å; D62-S66 PolarHBondContact O-N 3.16Å; C63-S66 PolarHBondContact O-N 2.9Å; L64-S66 VanDerWaalsContact C-N 3.33Å; L64-S66 PolarHBondContact O-N 3.14Å; S66-K69 PolarHBondContact O-N 3.37Å; S66-S70 PolarHBondContact O-N 3.49Å
67	K	87.9	Confident	83	Confident	76 Å²	76	62.5 Å²	62.5	33%	0.33	34%	0.344	S	S	.	.	H	α-helix	trans	-67.9	-39.3	178.7	-74.7	-68	-169.1	174.9	0	113	T25 C63 L64 K69 S70	T25-K67 HydrophobicContact CG2-CB 3.45Å; T25-K67 VanDerWaalsContact CG2-CB 3.45Å; T25-K67 HydrophobicContact CG2-CG 3.87Å; C63-K67 WeakPolarHBondContact O-CB 3.33Å; C63-K67 WeakPolarHBondContact O-CG 3.29Å; C63-K67 PolarHBondContact O-N 3.48Å; L64-K67 PolarHBondContact O-N 3.28Å; K67-K69 VanDerWaalsContact C-N 3.3Å; K67-K69 PolarHBondContact O-N 3.48Å; K67-S70 VanDerWaalsContact O-CB 3.29Å; K67-S70 WeakPolarHBondContact O-CB 3.28Å; K67-S70 PolarHBondContact O-N 3.39Å; K67-S70 VanDerWaalsContact O-N 3.08Å; K67-S70 PolarHBondContact O-OG 2.87Å
68	L	82.1	Confident	82.2	Confident	0 Å²	0	63 Å²	63	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-65.4	-33.9	175.4	-75.9	171.7	0	0	0	112.9	L22 L64 S70 L73 L79 I83 I86	L22-L68 HydrophobicContact CD1-CD2 3.83Å; L64-L68 WeakPolarHBondContact O-CB 3.45Å; L64-L68 VanDerWaalsContact O-CG 3.32Å; L64-L68 WeakPolarHBondContact O-CG 3.25Å; L64-L68 PolarHBondContact O-N 3.39Å; L68-S70 PolarHBondContact O-N 2.9Å; L68-L73 HydrophobicContact CD2-CB 4.31Å; L68-L73 HydrophobicContact CD2-CD1 3.56Å; L68-L73 HydrophobicContact CD2-CG 4.47Å; L68-L73 HydrophobicContact CG-CD1 4.27Å; L68-L79 HydrophobicContact CB-CD1 4Å; L68-L79 HydrophobicContact CD2-CD1 3.46Å; L68-L79 VanDerWaalsContact CD2-CD1 3.46Å; L68-L79 HydrophobicContact CG-CD1 4.3Å; L68-L79 WeakPolarHBondContact O-CD1 3.03Å; L68-L79 WeakPolarHBondContact O-CD2 3.17Å; L68-I83 HydrophobicContact CB-CG1 4.19Å; L68-I83 HydrophobicContact CD1-CG1 3.82Å; L68-I86 HydrophobicContact CD1-CD1 3.39Å; L68-I86 HydrophobicContact CD1-CG1 4.31Å; L68-I86 HydrophobicContact CG-CD1 4.43Å
69	K	81.4	Confident	81.4	Confident	165 Å²	165	60.8 Å²	60.8	72%	0.717	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-11.6	174.3	-71.5	175.5	-178.4	-177.5	0	113.2	L65 S66 K67	L65-K69 WeakPolarHBondContact O-CB 3.03Å; L65-K69 VanDerWaalsContact O-CG 3.26Å; L65-K69 WeakPolarHBondContact O-CG 3.46Å; L65-K69 PolarHBondContact O-N 2.93Å; L65-K69 VanDerWaalsContact O-N 3.07Å; S66-K69 PolarHBondContact O-N 3.37Å; K67-K69 VanDerWaalsContact C-N 3.3Å; K67-K69 PolarHBondContact O-N 3.48Å
70	S	79	Confident	80.6	Confident	35 Å²	35	64.9 Å²	64.9	25%	0.245	35%	0.352	C	S	.	.	S	Bend	trans	-73	153.2	175.8	81.4	0	0	0	0	111.3	S66 K67 L68 E72 L73 G74	S66-S70 PolarHBondContact O-N 3.49Å; K67-S70 VanDerWaalsContact O-CB 3.29Å; K67-S70 WeakPolarHBondContact O-CB 3.28Å; K67-S70 PolarHBondContact O-N 3.39Å; K67-S70 VanDerWaalsContact O-N 3.08Å; K67-S70 PolarHBondContact O-OG 2.87Å; L68-S70 PolarHBondContact O-N 2.9Å; S70-E72 PolarHBondContact O-N 3.08Å; S70-E72 VanDerWaalsContact O-N 3.1Å; S70-L73 PolarHBondContact O-N 3.22Å; S70-G74 PolarHBondContact O-N 3.36Å; S70-G74 VanDerWaalsContact O-N 3.16Å
71	S	65.4	Low	80	Confident	103 Å²	103	68.4 Å²	68.4	72%	0.72	37%	0.373	S	S	*	.	H	α-helix	trans	-57.9	-25.4	-177.7	56.6	0	0	0	0	113.7	L73 G74	S71-L73 VanDerWaalsContact C-N 3.31Å; S71-L73 PolarHBondContact O-N 2.8Å; S71-G74 PolarHBondContact O-N 2.9Å
72	E	67.5	Low	79.3	Confident	123 Å²	123	66.7 Å²	66.7	58%	0.575	37%	0.365	S	S	*	.	H	α-helix	trans	-62.4	-33.8	-178.9	-83.3	-173.2	131.7	0	0	114.1	S70	S70-E72 PolarHBondContact O-N 3.08Å; S70-E72 VanDerWaalsContact O-N 3.1Å
73	L	72.3	Confident	78.7	Confident	4 Å²	4	64.2 Å²	64.2	2%	0.021	35%	0.352	C	S	.	.	H	α-helix	trans	-104.4	-8.2	175	-68.8	170.5	0	0	0	111.9	K21 L68 S70 S71 N75 C76 L79	K21-L73 HydrophobicContact CB-CD2 3.69Å; K21-L73 HydrophobicContact CD-CD2 4.4Å; L68-L73 HydrophobicContact CD2-CB 4.31Å; L68-L73 HydrophobicContact CD2-CD1 3.56Å; L68-L73 HydrophobicContact CD2-CG 4.47Å; L68-L73 HydrophobicContact CG-CD1 4.27Å; S70-L73 PolarHBondContact O-N 3.22Å; S71-L73 VanDerWaalsContact C-N 3.31Å; S71-L73 PolarHBondContact O-N 2.8Å; L73-N75 PolarHBondContact O-N 2.98Å; L73-C76 VanDerWaalsContact O-CB 3.25Å; L73-C76 WeakPolarHBondContact O-CB 3.23Å; L73-C76 PolarHBondContact O-N 3.38Å; L73-L79 HydrophobicContact CB-CD1 4.04Å
74	G	69.3	Low	78.1	Confident	42 Å²	42	67.2 Å²	67.2	43%	0.433	36%	0.363	S	S	.	.	H	α-helix	trans	-55.5	-34.4	175.2	0	0	0	0	0	113.9	S70 S71 C76	S70-G74 PolarHBondContact O-N 3.36Å; S70-G74 VanDerWaalsContact O-N 3.16Å; S71-G74 PolarHBondContact O-N 2.9Å; G74-C76 VanDerWaalsContact C-N 3.27Å; G74-C76 PolarHBondContact O-N 3.37Å
75	N	73.7	Confident	77.6	Confident	151 Å²	151	69.7 Å²	69.7	81%	0.807	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-2.3	179.3	-67.2	-18.3	0	0	0	113.5	L73 P77	L73-N75 PolarHBondContact O-N 2.98Å; N75-P77 WeakPolarHBondContact O-CD 3.4Å
76	C	75.8	Confident	77.3	Confident	10 Å²	10	68.3 Å²	68.3	7%	0.068	37%	0.373	C	S	.	.	S	Bend	trans	-76.6	121.4	-178.4	-72	0	0	0	0	111.5	C18 L73 G74 S78 L79 Y82	C18-C76 VanDerWaalsContact CA-SG 3.56Å; C18-C76 HydrophobicContact CB-CB 3.62Å; C18-C76 WeakPolarHBondContact CB-SG 3.49Å; C18-C76 WeakPolarHBondContact SG-CA 3.38Å; C18-C76 WeakPolarHBondContact SG-CB 3.45Å; C18-C76 CovalentContact SG-SG 2.02Å; C18-C76 PolarHBondContact SG-SG 3.19Å; L73-C76 VanDerWaalsContact O-CB 3.25Å; L73-C76 WeakPolarHBondContact O-CB 3.23Å; L73-C76 PolarHBondContact O-N 3.38Å; G74-C76 VanDerWaalsContact C-N 3.27Å; G74-C76 PolarHBondContact O-N 3.37Å; C76-S78 PolarHBondContact O-N 3.38Å; C76-L79 PolarHBondContact O-N 2.81Å; C76-Y82 HydrophobicContact CB-CE2 4.49Å
77	P	69	Low	77	Confident	62 Å²	62	67 Å²	67	40%	0.403	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	130	168.7	24.7	-30.4	0	0	0	107.8	N75	N75-P77 WeakPolarHBondContact O-CD 3.4Å
78	S	75.2	Confident	76.8	Confident	66 Å²	66	71.8 Å²	71.8	46%	0.462	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.1	20.8	-175.8	-43	0	0	0	0	117.5	C76 R80 T81 Y82	C76-S78 PolarHBondContact O-N 3.38Å; S78-R80 PolarHBondContact O-N 2.04Å; S78-R80 VanDerWaalsContact O-N 3.14Å; S78-T81 WeakPolarHBondContact O-CA 3.1Å; S78-T81 VanDerWaalsContact O-CB 3.25Å; S78-T81 WeakPolarHBondContact O-CB 3.45Å; S78-T81 PolarHBondContact O-N 3.44Å; S78-Y82 PolarHBondContact O-N 2.88Å; S78-Y82 VanDerWaalsContact O-N 3.09Å
79	L	76.2	Confident	76.7	Confident	34 Å²	34	74.6 Å²	74.6	18%	0.178	39%	0.39	C	S	.	.	H	α-helix	trans	-49.2	-42.3	172.1	-176.8	64.2	0	0	0	113.3	L68 L73 C76 T81 Y82 I83	L68-L79 HydrophobicContact CB-CD1 4Å; L68-L79 HydrophobicContact CD2-CD1 3.46Å; L68-L79 VanDerWaalsContact CD2-CD1 3.46Å; L68-L79 HydrophobicContact CG-CD1 4.3Å; L68-L79 WeakPolarHBondContact O-CD1 3.03Å; L68-L79 WeakPolarHBondContact O-CD2 3.17Å; L73-L79 HydrophobicContact CB-CD1 4.04Å; C76-L79 PolarHBondContact O-N 2.81Å; L79-T81 VanDerWaalsContact C-N 3.27Å; L79-T81 PolarHBondContact O-N 3.29Å; L79-Y82 PolarHBondContact O-N 3.12Å; L79-Y82 VanDerWaalsContact O-N 3.13Å; L79-I83 HydrophobicContact CG-CD1 4.27Å; L79-I83 WeakPolarHBondContact O-CG1 3.34Å; L79-I83 PolarHBondContact O-N 3.02Å
80	R	77.4	Confident	76.7	Confident	197 Å²	197	67.4 Å²	67.4	74%	0.743	36%	0.358	S	S	*	.	H	α-helix	trans	-59.1	-39.3	176.8	-168.3	177.5	-174.6	-173.6	1.5	112.1	S78 I83 Q84	S78-R80 PolarHBondContact O-N 2.04Å; S78-R80 VanDerWaalsContact O-N 3.14Å; R80-I83 PolarHBondContact O-N 3.19Å; R80-Q84 WeakPolarHBondContact O-CG 3.27Å; R80-Q84 PolarHBondContact O-N 2.77Å
81	T	80.3	Confident	76.6	Confident	73 Å²	73	76 Å²	76	45%	0.448	39%	0.391	S	S	.	.	H	α-helix	trans	-65.6	-41.1	176	-50.5	0	0	0	0	111.1	S78 L79 Q84 S85	S78-T81 WeakPolarHBondContact O-CA 3.1Å; S78-T81 VanDerWaalsContact O-CB 3.25Å; S78-T81 WeakPolarHBondContact O-CB 3.45Å; S78-T81 PolarHBondContact O-N 3.44Å; L79-T81 VanDerWaalsContact C-N 3.27Å; L79-T81 PolarHBondContact O-N 3.29Å; T81-Q84 PolarHBondContact O-N 3.36Å; T81-S85 WeakPolarHBondContact O-CB 3.48Å; T81-S85 PolarHBondContact O-N 3.12Å; T81-S85 PolarHBondContact O-OG 3.42Å
82	Y	77.4	Confident	77.2	Confident	23 Å²	23	74.7 Å²	74.7	9%	0.09	38%	0.375	C	S	.	.	H	α-helix	trans	-63.8	-44.2	175.6	-62.9	-48.7	0	0	0	112.2	N19 L22 C76 S78 L79 Q84 S85 I86	N19-Y82 PolarHBondContact OD1-OH 3.33Å; L22-Y82 HydrophobicContact CD2-CD1 3.15Å; L22-Y82 HydrophobicContact CD2-CD2 4.23Å; L22-Y82 HydrophobicContact CD2-CE1 3.37Å; L22-Y82 HydrophobicContact CD2-CE2 4.44Å; L22-Y82 HydrophobicContact CD2-CG 3.61Å; C76-Y82 HydrophobicContact CB-CE2 4.49Å; S78-Y82 PolarHBondContact O-N 2.88Å; S78-Y82 VanDerWaalsContact O-N 3.09Å; L79-Y82 PolarHBondContact O-N 3.12Å; L79-Y82 VanDerWaalsContact O-N 3.13Å; Y82-Q84 VanDerWaalsContact C-N 3.31Å; Y82-Q84 PolarHBondContact O-N 3.31Å; Y82-S85 PolarHBondContact O-N 3.38Å; Y82-S85 VanDerWaalsContact O-N 3.16Å; Y82-I86 WeakPolarHBondContact O-CG1 3.45Å; Y82-I86 PolarHBondContact O-N 3.21Å
83	I	78.7	Confident	77.7	Confident	46 Å²	46	72.2 Å²	72.2	24%	0.236	37%	0.365	C	S	.	.	H	α-helix	trans	-56.8	-47.3	175.3	-67.7	170	0	0	0	110.4	L65 L68 L79 R80 S85 I86 D87	L65-I83 HydrophobicContact CD2-CG2 3.99Å; L68-I83 HydrophobicContact CB-CG1 4.19Å; L68-I83 HydrophobicContact CD1-CG1 3.82Å; L79-I83 HydrophobicContact CG-CD1 4.27Å; L79-I83 WeakPolarHBondContact O-CG1 3.34Å; L79-I83 PolarHBondContact O-N 3.02Å; R80-I83 PolarHBondContact O-N 3.19Å; I83-S85 VanDerWaalsContact C-N 3.35Å; I83-S85 PolarHBondContact O-N 3.1Å; I83-I86 PolarHBondContact O-N 3.39Å; I83-D87 PolarHBondContact O-N 3.01Å
84	Q	81	Confident	78	Confident	86 Å²	86	75.9 Å²	75.9	40%	0.402	38%	0.384	S	S	.	.	H	α-helix	trans	-62	-40.4	177.4	-73.8	178.4	-10.8	0	0	112.8	R80 T81 Y82 I86 D87 R88	R80-Q84 WeakPolarHBondContact O-CG 3.27Å; R80-Q84 PolarHBondContact O-N 2.77Å; T81-Q84 PolarHBondContact O-N 3.36Å; Y82-Q84 VanDerWaalsContact C-N 3.31Å; Y82-Q84 PolarHBondContact O-N 3.31Å; Q84-I86 VanDerWaalsContact C-N 3.34Å; Q84-D87 PolarHBondContact O-N 3.4Å; Q84-R88 WeakPolarHBondContact O-CG 3.37Å; Q84-R88 PolarHBondContact O-N 3.2Å
85	S	81	Confident	78.5	Confident	52 Å²	52	77.9 Å²	77.9	36%	0.364	38%	0.381	S	S	.	.	H	α-helix	trans	-63.5	-40.2	175.7	-69.6	0	0	0	0	111.9	T81 Y82 I83 R88 M89	T81-S85 WeakPolarHBondContact O-CB 3.48Å; T81-S85 PolarHBondContact O-N 3.12Å; T81-S85 PolarHBondContact O-OG 3.42Å; Y82-S85 PolarHBondContact O-N 3.38Å; Y82-S85 VanDerWaalsContact O-N 3.16Å; I83-S85 VanDerWaalsContact C-N 3.35Å; I83-S85 PolarHBondContact O-N 3.1Å; S85-R88 PolarHBondContact O-N 3.27Å; S85-M89 WeakPolarHBondContact O-CB 3.07Å; S85-M89 PolarHBondContact O-N 2.77Å
86	I	83.3	Confident	78.8	Confident	3 Å²	3	73.4 Å²	73.4	2%	0.015	35%	0.354	C	S	.	.	H	α-helix	trans	-64.6	-48.6	174.3	-67.3	-168.9	0	0	0	110.2	L22 L64 L68 Y82 I83 Q84 R88 M89 F90	L22-I86 HydrophobicContact CD1-CD1 4.46Å; L64-I86 HydrophobicContact CB-CD1 3.64Å; L64-I86 HydrophobicContact CB-CG2 4.19Å; L64-I86 HydrophobicContact CD1-CD1 4.03Å; L64-I86 HydrophobicContact CD1-CG2 4.3Å; L64-I86 HydrophobicContact CD2-CD1 3.84Å; L64-I86 HydrophobicContact CG-CD1 4.02Å; L68-I86 HydrophobicContact CD1-CD1 3.39Å; L68-I86 HydrophobicContact CD1-CG1 4.31Å; L68-I86 HydrophobicContact CG-CD1 4.43Å; Y82-I86 WeakPolarHBondContact O-CG1 3.45Å; Y82-I86 PolarHBondContact O-N 3.21Å; I83-I86 PolarHBondContact O-N 3.39Å; Q84-I86 VanDerWaalsContact C-N 3.34Å; I86-R88 PolarHBondContact O-N 3.4Å; I86-M89 WeakPolarHBondContact O-CB 3.28Å; I86-M89 PolarHBondContact O-N 3.07Å; I86-F90 HydrophobicContact CG2-CD2 3.8Å; I86-F90 HydrophobicContact CG2-CE2 3.83Å; I86-F90 VanDerWaalsContact O-CD2 3.27Å; I86-F90 WeakPolarHBondContact O-CD2 3.4Å; I86-F90 PolarHBondContact O-N 3.16Å; I86-F90 VanDerWaalsContact O-N 3.12Å
87	D	82.7	Confident	79	Confident	55 Å²	55	77.6 Å²	77.6	29%	0.294	37%	0.373	S	S	.	.	H	α-helix	trans	-56.8	-37.6	177.3	-88.1	-34.5	0	0	0	112.8	K61 I83 Q84 K91	K61-D87 WeakPolarHBondContact CE-OD1 3.33Å; K61-D87 IonicContact NZ-OD1 2.77Å; K61-D87 PolarHBondContact NZ-OD1 3.23Å; I83-D87 PolarHBondContact O-N 3.01Å; Q84-D87 PolarHBondContact O-N 3.4Å; D87-K91 WeakPolarHBondContact O-CG 3.46Å; D87-K91 PolarHBondContact O-N 2.81Å
88	R	84.2	Confident	79.8	Confident	178 Å²	178	78.7 Å²	78.7	67%	0.672	37%	0.371	S	S	*	.	H	α-helix	trans	-67.6	-40.8	174.5	-71	175.1	-169.5	176.7	4.2	112.8	Q84 S85 I86 F90 K91	Q84-R88 WeakPolarHBondContact O-CG 3.37Å; Q84-R88 PolarHBondContact O-N 3.2Å; S85-R88 PolarHBondContact O-N 3.27Å; I86-R88 PolarHBondContact O-N 3.4Å; R88-F90 PolarHBondContact O-N 2.84Å; R88-K91 PolarHBondContact O-N 3.25Å
89	M	80.3	Confident	80.1	Confident	59 Å²	59	79.7 Å²	79.7	29%	0.291	36%	0.364	S	S	.	.	H	α-helix	trans	-65.8	-27	-178.3	-160.1	-177.1	-42	0	0	112.7	M26 R47 M51 S85 I86	M26-M89 HydrophobicContact CE-CE 3.57Å; M26-M89 HydrophobicContact CE-SD 3.68Å; R47-M89 HydrophobicContact CG-SD 4.1Å; M51-M89 HydrophobicContact CE-CG 3.96Å; M51-M89 HydrophobicContact CE-SD 4.2Å; S85-M89 WeakPolarHBondContact O-CB 3.07Å; S85-M89 PolarHBondContact O-N 2.77Å; I86-M89 WeakPolarHBondContact O-CB 3.28Å; I86-M89 PolarHBondContact O-N 3.07Å
90	F	81.9	Confident	80.4	Confident	14 Å²	14	83.5 Å²	83.5	6%	0.061	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105	6.4	-177.8	-72.7	-97.6	0	0	0	114.3	F30 M51 K57 A60 K61 L64 I86 R88	F30-F90 HydrophobicContact CE1-CE1 4.46Å; F30-F90 HydrophobicContact CE1-CE2 4.43Å; F30-F90 AromaticContact CE1-CZ 3.69Å; F30-F90 HydrophobicContact CE1-CZ 3.69Å; F30-F90 HydrophobicContact CZ-CZ 4.31Å; M51-F90 HydrophobicContact CE-CD1 3.68Å; M51-F90 HydrophobicContact CE-CD2 3.78Å; M51-F90 HydrophobicContact CE-CE1 3.39Å; M51-F90 HydrophobicContact CE-CE2 3.53Å; M51-F90 HydrophobicContact CE-CG 3.9Å; M51-F90 HydrophobicContact CE-CZ 3.36Å; M51-F90 HydrophobicContact SD-CD1 3.85Å; M51-F90 HydrophobicContact SD-CE1 3.96Å; M51-F90 HydrophobicContact SD-CG 4.26Å; K57-F90 HydrophobicContact CB-CD1 4.49Å; K57-F90 WeakPolarHBondContact CE-O 3.2Å; K57-F90 HydrophobicContact CG-CD1 3.58Å; K57-F90 HydrophobicContact CG-CE1 4.2Å; K57-F90 PolarHBondContact NZ-O 3.42Å; K57-F90 WeakPolarHBondContact O-CD1 3.35Å; K57-F90 WeakPolarHBondContact O-CE1 2.92Å; A60-F90 HydrophobicContact CB-CE1 3.97Å; A60-F90 HydrophobicContact CB-CZ 3.96Å; K61-F90 HydrophobicContact CB-CB 4.47Å; K61-F90 HydrophobicContact CB-CD1 3.73Å; K61-F90 HydrophobicContact CB-CD2 4.44Å; K61-F90 HydrophobicContact CB-CE1 3.94Å; K61-F90 HydrophobicContact CB-CG 3.99Å; K61-F90 HydrophobicContact CB-CZ 4.32Å; K61-F90 HydrophobicContact CD-CB 4.01Å; K61-F90 HydrophobicContact CD-CG 4.42Å; K61-F90 HydrophobicContact CG-CB 4.37Å; K61-F90 HydrophobicContact CG-CD1 4.48Å; K61-F90 HydrophobicContact CG-CG 4.26Å; L64-F90 HydrophobicContact CD1-CE2 3.58Å; L64-F90 HydrophobicContact CD1-CZ 3.62Å; I86-F90 HydrophobicContact CG2-CD2 3.8Å; I86-F90 HydrophobicContact CG2-CE2 3.83Å; I86-F90 VanDerWaalsContact O-CD2 3.27Å; I86-F90 WeakPolarHBondContact O-CD2 3.4Å; I86-F90 PolarHBondContact O-N 3.16Å; I86-F90 VanDerWaalsContact O-N 3.12Å; R88-F90 PolarHBondContact O-N 2.84Å
91	K	76.9	Confident	80.7	Confident	216 Å²	216	73.2 Å²	73.2	94%	0.939	35%	0.347	S	S	*	.			trans	-73	0	164.6	-81.2	179.9	-179.3	-168.9	0	108.2	K57 D87 R88	K57-K91 PolarHBondContact NZ-O 3.22Å; D87-K91 WeakPolarHBondContact O-CG 3.46Å; D87-K91 PolarHBondContact O-N 2.81Å; R88-K91 PolarHBondContact O-N 3.25Å

Retrieved 91 of 91 residues in 203.6 ms (Link to these results)

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