A0A077ZBA0_TRITR Loading...

FERM N domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZBA0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 109 aa.

						>A0A077ZBA0_TRITR|A0A077ZBA0
MMESKFGSMLSRVGSYSTVSKVLRCKVYLLDDNNSIDIEYNKNYTGECLLNQVCDQLNIVEKDYFGLRFVDSNHVRYWLDPTKLVVRQVKSKVHFFNIYIFFVLRKQRN
					

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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	40.6	Very low	44.7	Very low	248 Å²	248	160.4 Å²	160.4	100%	1.222	86%	0.857	S	S	*	*				0	89.5	0	-86.7	174.7	170.3	0	0	108.7
2	M	41.5	Very low	45.1	Very low	192 Å²	192	167 Å²	167	95%	0.946	86%	0.861	S	S	*	*			trans	-146.2	94.7	166.3	-76.8	-167.8	-175.2	0	0	105.8
3	E	39	Very low	45.4	Very low	181 Å²	181	164.5 Å²	164.5	85%	0.846	86%	0.858	S	S	*	*			trans	-139.7	130.1	170.3	-81.9	-157.1	96.7	0	0	110.7
4	S	37.1	Very low	45.3	Very low	99 Å²	99	156.9 Å²	156.9	69%	0.692	84%	0.839	S	S	*	*			trans	71.4	109.1	142.1	66.5	0	0	0	0	118.4
5	K	47.7	Very low	45.2	Very low	195 Å²	195	153.9 Å²	153.9	85%	0.848	84%	0.835	S	S	*	*				-172.5	109.5	93.9	-99.5	171.9	178.9	-176.6	0	111.4	G7	K5-G7 PolarHBondContact O-N 3.45Å
6	F	52.2	Low	45.3	Very low	226 Å²	226	158.1 Å²	158.1	99%	0.991	84%	0.837	S	S	*	*			trans	-64.1	46.2	162.5	-134.1	-92.3	0	0	0	111.9
7	G	40.7	Very low	45.5	Very low	61 Å²	61	152.7 Å²	152.7	63%	0.629	82%	0.815	S	S	*	*			trans	-135.2	74.9	-165.3	0	0	0	0	0	113.6	K5	K5-G7 PolarHBondContact O-N 3.45Å
8	S	49.7	Very low	46	Very low	106 Å²	106	152.1 Å²	152.1	74%	0.741	82%	0.818	S	S	*	*			trans	-170.8	54	156.1	-161.6	0	0	0	0	112.9
9	M	49	Very low	46.7	Very low	181 Å²	181	150.1 Å²	150.1	89%	0.892	81%	0.812	S	S	*	*	S	Bend	trans	-110.3	15.6	179.3	-76.3	-161	83.8	0	0	116.1
10	L	46.6	Very low	47.7	Very low	174 Å²	174	145.6 Å²	145.6	91%	0.911	79%	0.792	S	S	*	*			trans	-132	14.3	-174.1	-70.2	176	0	0	0	118.2
11	S	47.2	Very low	49.1	Very low	101 Å²	101	144.9 Å²	144.9	71%	0.706	78%	0.781	S	S	*	*	S	Bend	trans	-98.4	14.5	-172.8	60.5	0	0	0	0	117.7
12	R	49.7	Very low	51.3	Low	240 Å²	240	137.4 Å²	137.4	91%	0.906	75%	0.749	S	S	*	*			trans	-126.1	19.1	-175.8	-65.9	-166.9	-166.9	-178.2	5.4	117.9
13	V	49.8	Very low	53.7	Low	135 Å²	135	129.4 Å²	129.4	82%	0.818	71%	0.71	S	S	*	*			trans	-97.7	91.8	163.1	-177.5	0	0	0	0	108.3	S15	V13-S15 PolarHBondContact O-N 3.43Å
14	G	43.9	Very low	56.2	Low	58 Å²	58	127.6 Å²	127.6	60%	0.598	70%	0.696	S	S	*	*			trans	-61.5	124.9	170.1	0	0	0	0	0	109.7	Y16	G14-Y16 PolarHBondContact O-N 3.01Å
15	S	44	Very low	58.8	Low	111 Å²	111	122.9 Å²	122.9	78%	0.776	66%	0.663	S	S	*	*			trans	-54.1	108.9	178.2	-50.6	0	0	0	0	110.9	V13 S17	V13-S15 PolarHBondContact O-N 3.43Å; S15-S17 PolarHBondContact O-N 2.96Å
16	Y	46.5	Very low	60.9	Low	221 Å²	221	116.1 Å²	116.1	87%	0.867	63%	0.633	S	S	*	*			trans	-65.7	79.6	154.3	-67.7	-86.9	0	0	0	107	G14 T18	G14-Y16 PolarHBondContact O-N 3.01Å; Y16-T18 PolarHBondContact O-N 2.92Å; Y16-T18 PolarHBondContact O-OG1 2.61Å
17	S	48.4	Very low	62.9	Low	67 Å²	67	105.4 Å²	105.4	47%	0.469	59%	0.586	S	S	.	*			trans	-66.7	101.9	168.4	56.1	0	0	0	0	107.1	S15 V19	S15-S17 PolarHBondContact O-N 2.96Å; S17-V19 PolarHBondContact O-N 3.33Å
18	T	54.7	Low	65.4	Low	142 Å²	142	105.3 Å²	105.3	87%	0.871	57%	0.567	S	S	*	*			trans	-63.3	1.2	176.5	-28.3	0	0	0	0	113.1	Y16 S20	Y16-T18 PolarHBondContact O-N 2.92Å; Y16-T18 PolarHBondContact O-OG1 2.61Å; T18-S20 PolarHBondContact O-N 3.33Å
19	V	60.1	Low	67.4	Low	114 Å²	114	101.8 Å²	101.8	69%	0.691	54%	0.54	S	S	*	.	S	Bend	trans	-81	112.4	172.8	-173.7	0	0	0	0	108.6	S17 K21	S17-V19 PolarHBondContact O-N 3.33Å; V19-K21 PolarHBondContact O-N 3.38Å
20	S	66.4	Low	69.2	Low	59 Å²	59	97.4 Å²	97.4	41%	0.413	52%	0.519	S	S	.	.			trans	-54.7	104.6	168.9	-73.7	0	0	0	0	109.7	T18 V22 N41	T18-S20 PolarHBondContact O-N 3.33Å; S20-V22 PolarHBondContact O-N 3.03Å; S20-N41 WeakPolarHBondContact CB-ND2 3.37Å
21	K	77.1	Confident	70.9	Confident	132 Å²	132	92.9 Å²	92.9	57%	0.574	50%	0.496	S	S	*	.			trans	-63.1	118.2	175.7	-69.6	-174.9	179.1	-177.8	0	109	V19	V19-K21 PolarHBondContact O-N 3.38Å
22	V	87.2	Confident	72.1	Confident	90 Å²	90	93 Å²	93	55%	0.545	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	126.8	169.2	-178.7	0	0	0	0	107.8	S20 E39	S20-V22 PolarHBondContact O-N 3.03Å; V22-E39 HydrophobicContact CG1-CB 3.79Å; V22-E39 HydrophobicContact CG1-CG 4.32Å
23	L	90	Very high	73.6	Confident	24 Å²	24	88.5 Å²	88.5	13%	0.126	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	158.9	176.5	-59	172.2	0	0	0	108.7	E39 Y40 K42 V86	L23-E39 CarbonylContact O-C 3.5Å; L23-E39 WeakPolarHBondContact O-CA 3.38Å; L23-Y40 WeakPolarHBondContact CA-O 3.43Å; L23-Y40 HydrophobicContact CB-CD1 3.97Å; L23-Y40 HydrophobicContact CB-CD2 4.24Å; L23-Y40 HydrophobicContact CB-CE1 3.5Å; L23-Y40 VanDerWaalsContact CB-CE1 3.5Å; L23-Y40 HydrophobicContact CB-CE2 3.82Å; L23-Y40 HydrophobicContact CB-CG 4.3Å; L23-Y40 WeakPolarHBondContact CB-O 3.42Å; L23-Y40 HydrophobicContact CD1-CD2 4.37Å; L23-Y40 HydrophobicContact CD1-CE2 3.58Å; L23-Y40 HydrophobicContact CG-CE2 4.34Å; L23-Y40 PolarHBondContact N-O 3.27Å; L23-Y40 PolarHBondContact O-N 3.45Å; L23-K42 HydrophobicContact CD1-CB 4.29Å; L23-V86 HydrophobicContact CD1-CG1 3.41Å; L23-V86 VanDerWaalsContact CD1-CG1 3.41Å
24	R	91.6	Very high	75.5	Confident	144 Å²	144	86.1 Å²	86.1	54%	0.543	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	145.8	-179.4	-64.9	-174.9	174.9	162.3	-2.3	110.8	I38 E39 H94 F95	R24-I38 CarbonylContact C-O 3.48Å; R24-I38 VanDerWaalsContact CA-O 3.3Å; R24-I38 WeakPolarHBondContact CA-O 3.49Å; R24-E39 HydrophobicContact CG-CG 4.17Å; R24-E39 IonicContact CZ-OE1 2.73Å; R24-E39 IonicContact NE-OE1 2.72Å; R24-E39 PolarHBondContact NE-OE1 3.47Å; R24-E39 IonicContact NH2-OE1 2.78Å; R24-E39 PolarHBondContact NH2-OE1 2.83Å; R24-H94 PolarHBondContact N-O 3.49Å; R24-F95 HydrophobicContact CB-CD2 4.07Å; R24-F95 WeakPolarHBondContact O-CA 3.27Å
25	C	92.1	Very high	77.8	Confident	0 Å²	0	85.5 Å²	85.5	0%	0	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	150.7	169.1	61.6	0	0	0	0	110.7	I38 Y40 F96 I98	C25-I38 PolarHBondContact N-O 3.33Å; C25-I38 PolarHBondContact O-N 2.75Å; C25-Y40 HydrophobicContact CB-CE1 4.13Å; C25-F96 WeakPolarHBondContact CA-O 3.46Å; C25-F96 HydrophobicContact CB-CD1 3.94Å; C25-F96 HydrophobicContact CB-CD2 4.45Å; C25-F96 HydrophobicContact CB-CE1 3.52Å; C25-F96 HydrophobicContact CB-CE2 4.15Å; C25-F96 HydrophobicContact CB-CG 4.36Å; C25-F96 HydrophobicContact CB-CZ 3.65Å; C25-F96 WeakPolarHBondContact CB-O 3.39Å; C25-I98 HydrophobicContact CB-CD1 4.15Å; C25-I98 HydrophobicContact CB-CG1 4.47Å
26	K	92.8	Very high	80.1	Confident	53 Å²	53	81.8 Å²	81.8	23%	0.23	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	129.3	171.8	-170.7	162	-109.7	-167.6	0	109.6	Y28 S35 I36 F95 F96 N97 I98	K26-Y28 HydrophobicContact CB-CE2 4.32Å; K26-Y28 HydrophobicContact CD-CE2 4.01Å; K26-Y28 HydrophobicContact CG-CD2 4.36Å; K26-Y28 HydrophobicContact CG-CE2 3.9Å; K26-S35 WeakPolarHBondContact CE-OG 3.45Å; K26-S35 PolarHBondContact NZ-OG 2.8Å; K26-I36 WeakPolarHBondContact CA-O 3.47Å; K26-F95 HydrophobicContact CB-CE1 3.9Å; K26-F95 HydrophobicContact CB-CE2 4.13Å; K26-F95 HydrophobicContact CB-CZ 3.48Å; K26-F95 VanDerWaalsContact CB-CZ 3.48Å; K26-F95 HydrophobicContact CD-CZ 4.22Å; K26-F95 HydrophobicContact CG-CZ 4.37Å; K26-F96 PolarHBondContact N-O 3Å; K26-N97 CarbonylContact O-C 3.48Å; K26-N97 WeakPolarHBondContact O-CA 3.41Å; K26-I98 PolarHBondContact O-N 2.84Å
27	V	93.6	Very high	82.4	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	114	176.6	-176.3	0	0	0	0	108.5	S35 I36 I38 V53 I98 I100	V27-S35 CarbonylContact O-C 3.45Å; V27-S35 WeakPolarHBondContact O-CA 3.4Å; V27-S35 WeakPolarHBondContact O-CB 3.18Å; V27-I36 HydrophobicContact CB-CG1 3.91Å; V27-I36 PolarHBondContact N-O 3.43Å; V27-I36 PolarHBondContact O-N 2.85Å; V27-I38 HydrophobicContact CB-CG1 4.42Å; V27-I38 HydrophobicContact CG2-CB 4.46Å; V27-I38 HydrophobicContact CG2-CG1 3.58Å; V27-V53 HydrophobicContact CB-CG2 4.42Å; V27-V53 HydrophobicContact CG1-CG1 4.03Å; V27-V53 HydrophobicContact CG1-CG2 4.26Å; V27-V53 HydrophobicContact CG2-CG2 3.75Å; V27-I98 CarbonylContact C-O 3.55Å; V27-I98 VanDerWaalsContact CA-O 3.28Å; V27-I98 WeakPolarHBondContact CA-O 3.2Å; V27-I98 HydrophobicContact CG1-CG2 4.43Å; V27-I98 HydrophobicContact CG2-CB 4.1Å; V27-I98 HydrophobicContact CG2-CG2 4.34Å; V27-I100 HydrophobicContact CG1-CB 4.37Å
28	Y	93.4	Very high	84.6	Confident	59 Å²	59	72.6 Å²	72.6	23%	0.231	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	132.4	172.1	-68.4	-96.4	0	0	0	109.2	K26 N97 I98 Y99 I100	K26-Y28 HydrophobicContact CB-CE2 4.32Å; K26-Y28 HydrophobicContact CD-CE2 4.01Å; K26-Y28 HydrophobicContact CG-CD2 4.36Å; K26-Y28 HydrophobicContact CG-CE2 3.9Å; Y28-N97 HydrophobicContact CD2-CB 4.17Å; Y28-N97 HydrophobicContact CE2-CB 3.72Å; Y28-I98 PolarHBondContact N-O 3.38Å; Y28-Y99 HydrophobicContact CD2-CD1 4.49Å; Y28-Y99 HydrophobicContact CD2-CE1 4.09Å; Y28-Y99 HydrophobicContact CG-CD1 4.21Å; Y28-Y99 AromaticContact CG-CE1 3.9Å; Y28-Y99 HydrophobicContact CG-CE1 3.9Å; Y28-I100 PolarHBondContact O-N 3.1Å
29	L	91	Very high	86.4	Confident	33 Å²	33	70 Å²	70	17%	0.173	36%	0.362	C	S	.	.			trans	-81.5	172.7	-179	-54.3	-168.6	0	0	0	110.7	D31 D32 N34 I36 L57 I100	L29-D31 PolarHBondContact O-N 3.22Å; L29-D31 VanDerWaalsContact O-N 3.12Å; L29-D32 PolarHBondContact O-N 3.34Å; L29-N34 HydrophobicContact CB-CB 4.21Å; L29-N34 HydrophobicContact CD1-CB 3.71Å; L29-N34 HydrophobicContact CG-CB 4.06Å; L29-N34 PolarHBondContact N-O 2.93Å; L29-I36 HydrophobicContact CD2-CD1 4.46Å; L29-I36 HydrophobicContact CD2-CG1 4.43Å; L29-L57 HydrophobicContact CD1-CD2 3.91Å; L29-L57 HydrophobicContact CD2-CD1 3.58Å; L29-L57 HydrophobicContact CD2-CD2 3.93Å; L29-L57 HydrophobicContact CD2-CG 4.38Å; L29-I100 HydrophobicContact CD2-CG2 4.4Å
30	L	86.8	Confident	87.9	Confident	88 Å²	88	65.3 Å²	65.3	46%	0.461	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-23.1	-174.1	-67.6	170.1	0	0	0	114.7	D32 F65 I100 F102	L30-D32 VanDerWaalsContact C-N 3.32Å; L30-F65 HydrophobicContact CD1-CE1 4.17Å; L30-I100 HydrophobicContact CD2-CG2 4.32Å; L30-I100 WeakPolarHBondContact CD2-O 3.45Å; L30-I100 HydrophobicContact CG-CG2 4.11Å; L30-F102 HydrophobicContact CD1-CD2 3.94Å; L30-F102 HydrophobicContact CD1-CE2 3.28Å; L30-F102 HydrophobicContact CD1-CZ 3.82Å; L30-F102 HydrophobicContact CD2-CD2 4.02Å; L30-F102 HydrophobicContact CD2-CE2 4.23Å; L30-F102 HydrophobicContact CG-CE2 4.4Å
31	D	82	Confident	89.1	Confident	80 Å²	80	64.4 Å²	64.4	43%	0.428	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	1.2	179.4	64.4	-2.7	0	0	0	113.3	L29 N33 N34	L29-D31 PolarHBondContact O-N 3.22Å; L29-D31 VanDerWaalsContact O-N 3.12Å; D31-N33 PolarHBondContact O-N 3.07Å; D31-N33 PolarHBondContact OD1-N 3.24Å; D31-N34 PolarHBondContact OD1-N 3.01Å; D31-N34 PolarHBondContact OD2-ND2 3.18Å
32	D	73.9	Confident	89.7	Confident	104 Å²	104	62.9 Å²	62.9	56%	0.556	32%	0.316	S	S	*	.	S	Bend	trans	53.2	-6.1	-174.8	-73.7	-29.9	0	0	0	115.9	L29 L30	L29-D32 PolarHBondContact O-N 3.34Å; L30-D32 VanDerWaalsContact C-N 3.32Å
33	N	80.8	Confident	89.9	Confident	144 Å²	144	63.6 Å²	63.6	77%	0.77	32%	0.317	S	S	*	.	S	Bend	trans	-90.4	-25.1	-179.1	-71.7	-22.2	0	0	0	112	D31	D31-N33 PolarHBondContact O-N 3.07Å; D31-N33 PolarHBondContact OD1-N 3.24Å
34	N	89	Confident	90.2	Very high	86 Å²	86	65.9 Å²	65.9	46%	0.46	32%	0.324	S	S	.	.			trans	-109.3	145.7	-179.2	-69.2	-49.7	0	0	0	111.4	L29 D31	L29-N34 HydrophobicContact CB-CB 4.21Å; L29-N34 HydrophobicContact CD1-CB 3.71Å; L29-N34 HydrophobicContact CG-CB 4.06Å; L29-N34 PolarHBondContact N-O 2.93Å; D31-N34 PolarHBondContact OD1-N 3.01Å; D31-N34 PolarHBondContact OD2-ND2 3.18Å
35	S	92.8	Very high	90.4	Very high	44 Å²	44	60.6 Å²	60.6	31%	0.308	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	149	174.6	65	0	0	0	0	111.3	K26 V27	K26-S35 WeakPolarHBondContact CE-OG 3.45Å; K26-S35 PolarHBondContact NZ-OG 2.8Å; V27-S35 CarbonylContact O-C 3.45Å; V27-S35 WeakPolarHBondContact O-CA 3.4Å; V27-S35 WeakPolarHBondContact O-CB 3.18Å
36	I	92.9	Very high	90.5	Very high	33 Å²	33	60.8 Å²	60.8	17%	0.169	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	146.6	175.4	62.8	178.3	0	0	0	110	K26 V27 L29 I38 V53 Q56 L57	K26-I36 WeakPolarHBondContact CA-O 3.47Å; V27-I36 HydrophobicContact CB-CG1 3.91Å; V27-I36 PolarHBondContact N-O 3.43Å; V27-I36 PolarHBondContact O-N 2.85Å; L29-I36 HydrophobicContact CD2-CD1 4.46Å; L29-I36 HydrophobicContact CD2-CG1 4.43Å; I36-I38 HydrophobicContact CD1-CD1 3.74Å; I36-I38 HydrophobicContact CD1-CG1 4.43Å; I36-I38 HydrophobicContact CG1-CD1 4.02Å; I36-I38 HydrophobicContact CG1-CG1 4.31Å; I36-V53 HydrophobicContact CD1-CG1 4.34Å; I36-Q56 HydrophobicContact CD1-CB 4.44Å; I36-L57 HydrophobicContact CD1-CD1 4.14Å; I36-L57 HydrophobicContact CD1-CD2 3.99Å; I36-L57 HydrophobicContact CD1-CG 3.91Å; I36-L57 HydrophobicContact CG2-CD2 4.31Å
37	D	93.6	Very high	90.7	Very high	95 Å²	95	63.3 Å²	63.3	51%	0.508	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	124.1	174.3	-69.1	-75.9	0	0	0	109.8	F95	D37-F95 WeakPolarHBondContact OD1-CE2 3.41Å; D37-F95 WeakPolarHBondContact OD1-CZ 3.5Å
38	I	94	Very high	90.8	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	125.4	-179	-56.5	-61.9	0	0	0	109.6	R24 C25 V27 I36 L49 Q52 V53	R24-I38 CarbonylContact C-O 3.48Å; R24-I38 VanDerWaalsContact CA-O 3.3Å; R24-I38 WeakPolarHBondContact CA-O 3.49Å; C25-I38 PolarHBondContact N-O 3.33Å; C25-I38 PolarHBondContact O-N 2.75Å; V27-I38 HydrophobicContact CB-CG1 4.42Å; V27-I38 HydrophobicContact CG2-CB 4.46Å; V27-I38 HydrophobicContact CG2-CG1 3.58Å; I36-I38 HydrophobicContact CD1-CD1 3.74Å; I36-I38 HydrophobicContact CD1-CG1 4.43Å; I36-I38 HydrophobicContact CG1-CD1 4.02Å; I36-I38 HydrophobicContact CG1-CG1 4.31Å; I38-L49 HydrophobicContact CB-CD1 4.45Å; I38-L49 HydrophobicContact CG2-CD1 3.54Å; I38-Q52 HydrophobicContact CG2-CG 4.29Å; I38-V53 HydrophobicContact CD1-CG2 3.97Å; I38-V53 HydrophobicContact CG1-CG2 3.78Å
39	E	92.9	Very high	90.9	Very high	89 Å²	89	63 Å²	63	42%	0.416	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	133.3	166.8	-56.1	-156.1	142.8	0	0	110.3	V22 L23 R24 Q52	V22-E39 HydrophobicContact CG1-CB 3.79Å; V22-E39 HydrophobicContact CG1-CG 4.32Å; L23-E39 CarbonylContact O-C 3.5Å; L23-E39 WeakPolarHBondContact O-CA 3.38Å; R24-E39 HydrophobicContact CG-CG 4.17Å; R24-E39 IonicContact CZ-OE1 2.73Å; R24-E39 IonicContact NE-OE1 2.72Å; R24-E39 PolarHBondContact NE-OE1 3.47Å; R24-E39 IonicContact NH2-OE1 2.78Å; R24-E39 PolarHBondContact NH2-OE1 2.83Å; E39-Q52 PolarHBondContact O-NE2 3.11Å; E39-Q52 PolarHBondContact O-OE1 3.41Å
40	Y	92.2	Very high	91.1	Very high	15 Å²	15	62.5 Å²	62.5	6%	0.059	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	160.2	-179.4	73.8	-81.4	0	0	0	111.7	L23 C25 L49 V85 V86 F96	L23-Y40 WeakPolarHBondContact CA-O 3.43Å; L23-Y40 HydrophobicContact CB-CD1 3.97Å; L23-Y40 HydrophobicContact CB-CD2 4.24Å; L23-Y40 HydrophobicContact CB-CE1 3.5Å; L23-Y40 VanDerWaalsContact CB-CE1 3.5Å; L23-Y40 HydrophobicContact CB-CE2 3.82Å; L23-Y40 HydrophobicContact CB-CG 4.3Å; L23-Y40 WeakPolarHBondContact CB-O 3.42Å; L23-Y40 HydrophobicContact CD1-CD2 4.37Å; L23-Y40 HydrophobicContact CD1-CE2 3.58Å; L23-Y40 HydrophobicContact CG-CE2 4.34Å; L23-Y40 PolarHBondContact N-O 3.27Å; L23-Y40 PolarHBondContact O-N 3.45Å; C25-Y40 HydrophobicContact CB-CE1 4.13Å; Y40-L49 HydrophobicContact CD1-CD1 4.37Å; Y40-L49 HydrophobicContact CG-CD1 4.17Å; Y40-V85 HydrophobicContact CE2-CB 4.13Å; Y40-V85 HydrophobicContact CE2-CG1 4.08Å; Y40-V86 HydrophobicContact CE2-CG1 4.25Å; Y40-F96 AromaticContact CE1-CE1 3.82Å; Y40-F96 HydrophobicContact CE1-CE1 3.82Å; Y40-F96 HydrophobicContact CE1-CZ 4.25Å; Y40-F96 AromaticContact CZ-CE1 3.79Å; Y40-F96 WeakPolarHBondContact OH-CE1 3.41Å
41	N	91.1	Very high	91.5	Very high	39 Å²	39	60.9 Å²	60.9	21%	0.209	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	154	179.9	-164.5	-57.7	0	0	0	110.8	S20 N43 Y44	S20-N41 WeakPolarHBondContact CB-ND2 3.37Å; N41-N43 PolarHBondContact O-N 3.47Å; N41-N43 PolarHBondContact OD1-N 3.21Å; N41-Y44 HydrophobicContact CB-CD1 3.91Å; N41-Y44 HydrophobicContact CB-CE1 4.1Å; N41-Y44 WeakPolarHBondContact O-CB 3.28Å; N41-Y44 PolarHBondContact O-N 2.87Å
42	K	90.2	Very high	92.1	Very high	101 Å²	101	59 Å²	59	44%	0.439	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-22	172.2	63.1	172.4	-174.8	-174	0	114.4	L23 V86	L23-K42 HydrophobicContact CD1-CB 4.29Å; K42-V86 HydrophobicContact CB-CG1 4.42Å; K42-V86 WeakPolarHBondContact O-CG2 3.37Å
43	N	91.9	Very high	93.1	Very high	105 Å²	105	54 Å²	54	56%	0.561	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-2.3	179.9	-63.5	-11.3	0	0	0	114.2	N41 L84	N41-N43 PolarHBondContact O-N 3.47Å; N41-N43 PolarHBondContact OD1-N 3.21Å; N43-L84 WeakPolarHBondContact O-CD2 3.33Å
44	Y	94.8	Very high	93.7	Very high	71 Å²	71	47.1 Å²	47.1	28%	0.278	24%	0.242	S	C	.	.			trans	-69.5	134.9	-179.7	-88.9	33.8	0	0	0	111.9	N41 C48 L49 Q52 L84 V85	N41-Y44 HydrophobicContact CB-CD1 3.91Å; N41-Y44 HydrophobicContact CB-CE1 4.1Å; N41-Y44 WeakPolarHBondContact O-CB 3.28Å; N41-Y44 PolarHBondContact O-N 2.87Å; Y44-C48 HydrophobicContact CD1-CB 4.33Å; Y44-C48 HydrophobicContact CD2-CB 3.7Å; Y44-C48 HydrophobicContact CE2-CB 4.14Å; Y44-C48 HydrophobicContact CG-CB 3.82Å; Y44-L49 HydrophobicContact CD2-CB 4.39Å; Y44-Q52 PolarHBondContact OH-OE1 2.84Å; Y44-L84 WeakPolarHBondContact O-CA 3.09Å; Y44-V85 PolarHBondContact O-N 3.02Å
45	T	96.2	Very high	93.9	Very high	34 Å²	34	47.6 Å²	47.6	21%	0.209	25%	0.245	C	C	.	.	B	Isolated β-bridge	trans	-80.9	168.4	163.3	64.4	0	0	0	0	110.6	E47 C48 L49 P81 K83 L84 V85	T45-E47 PolarHBondContact O-N 3.01Å; T45-C48 PolarHBondContact O-N 3.29Å; T45-C48 PolarHBondContact OG1-N 2.94Å; T45-C48 PolarHBondContact OG1-SG 2.95Å; T45-C48 VanDerWaalsContact OG1-SG 3.33Å; T45-L49 PolarHBondContact O-N 3.27Å; T45-L49 VanDerWaalsContact O-N 3.14Å; T45-P81 VanDerWaalsContact CB-O 3.32Å; T45-P81 WeakPolarHBondContact CB-O 3.37Å; T45-P81 PolarHBondContact OG1-O 3.35Å; T45-K83 WeakPolarHBondContact CA-O 3.39Å; T45-L84 HydrophobicContact CG2-CD2 4.36Å; T45-V85 WeakPolarHBondContact O-CG2 3.32Å
46	G	94.9	Very high	94	Very high	3 Å²	3	50.3 Å²	50.3	3%	0.031	25%	0.253	C	S	.	.	H	α-helix	trans	-57.9	-35.5	172.6	0	0	0	0	0	112.7	L49 L50 P81 K83	G46-L49 PolarHBondContact O-N 2.94Å; G46-L50 WeakPolarHBondContact O-CB 3.38Å; G46-L50 PolarHBondContact O-N 3.44Å; G46-P81 PolarHBondContact N-O 3.07Å; G46-K83 PolarHBondContact N-O 2.85Å
47	E	96	Very high	93.9	Very high	106 Å²	106	51.1 Å²	51.1	50%	0.495	26%	0.257	S	S	.	.	H	α-helix	trans	-66.4	-46.1	175.6	-176.9	175	-163.9	0	0	112.6	T45 L49 L50 N51 P81	T45-E47 PolarHBondContact O-N 3.01Å; E47-L49 PolarHBondContact O-N 3.48Å; E47-L50 PolarHBondContact O-N 3.14Å; E47-N51 WeakPolarHBondContact O-CB 3.32Å; E47-N51 PolarHBondContact O-N 2.84Å; E47-N51 PolarHBondContact O-ND2 3.2Å; E47-P81 HydrophobicContact CB-CB 4Å; E47-P81 WeakPolarHBondContact CB-O 3.28Å; E47-P81 PolarHBondContact N-O 2.78Å
48	C	96.4	Very high	93.9	Very high	54 Å²	54	53.6 Å²	53.6	37%	0.365	27%	0.27	S	S	.	.	H	α-helix	trans	-57.8	-41.7	175.5	-66	0	0	0	0	111.4	Y44 T45 Q52	Y44-C48 HydrophobicContact CD1-CB 4.33Å; Y44-C48 HydrophobicContact CD2-CB 3.7Å; Y44-C48 HydrophobicContact CE2-CB 4.14Å; Y44-C48 HydrophobicContact CG-CB 3.82Å; T45-C48 PolarHBondContact O-N 3.29Å; T45-C48 PolarHBondContact OG1-N 2.94Å; T45-C48 PolarHBondContact OG1-SG 2.95Å; T45-C48 VanDerWaalsContact OG1-SG 3.33Å; C48-Q52 PolarHBondContact O-N 2.86Å; C48-Q52 VanDerWaalsContact O-N 3.11Å
49	L	95.5	Very high	93.8	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-67.4	-45.2	179.1	-172.5	61.1	0	0	0	111.9	I38 Y40 Y44 T45 G46 E47 N51 Q52 V53 L67 L79 V85 I98	I38-L49 HydrophobicContact CB-CD1 4.45Å; I38-L49 HydrophobicContact CG2-CD1 3.54Å; Y40-L49 HydrophobicContact CD1-CD1 4.37Å; Y40-L49 HydrophobicContact CG-CD1 4.17Å; Y44-L49 HydrophobicContact CD2-CB 4.39Å; T45-L49 PolarHBondContact O-N 3.27Å; T45-L49 VanDerWaalsContact O-N 3.14Å; G46-L49 PolarHBondContact O-N 2.94Å; E47-L49 PolarHBondContact O-N 3.48Å; L49-N51 VanDerWaalsContact C-N 3.33Å; L49-N51 PolarHBondContact O-N 3.32Å; L49-Q52 PolarHBondContact O-N 3.38Å; L49-V53 WeakPolarHBondContact O-CG2 3.32Å; L49-V53 PolarHBondContact O-N 3.1Å; L49-L67 HydrophobicContact CB-CD1 4.12Å; L49-L67 HydrophobicContact CD2-CD1 3.96Å; L49-L67 HydrophobicContact CG-CD1 3.78Å; L49-L79 HydrophobicContact CD2-CD2 4.13Å; L49-V85 HydrophobicContact CB-CG2 4.11Å; L49-V85 HydrophobicContact CD2-CG1 4.05Å; L49-V85 HydrophobicContact CD2-CG2 3.93Å; L49-I98 HydrophobicContact CD2-CD1 3.36Å; L49-I98 HydrophobicContact CG-CD1 4.47Å
50	L	94.9	Very high	93.6	Very high	22 Å²	22	57.5 Å²	57.5	12%	0.115	30%	0.298	C	S	.	.	H	α-helix	trans	-59.7	-44.8	175.6	176.2	63.9	0	0	0	111.3	G46 E47 Q52 V53 C54 F65 L67	G46-L50 WeakPolarHBondContact O-CB 3.38Å; G46-L50 PolarHBondContact O-N 3.44Å; E47-L50 PolarHBondContact O-N 3.14Å; L50-Q52 VanDerWaalsContact C-N 3.33Å; L50-Q52 PolarHBondContact O-N 2.94Å; L50-V53 WeakPolarHBondContact O-CB 3.49Å; L50-V53 PolarHBondContact O-N 3.17Å; L50-C54 WeakPolarHBondContact O-CB 3.34Å; L50-C54 PolarHBondContact O-N 3.38Å; L50-C54 PolarHBondContact O-SG 3.31Å; L50-C54 VanDerWaalsContact O-SG 3.38Å; L50-F65 HydrophobicContact CD1-CB 3.94Å; L50-F65 VanDerWaalsContact CD2-O 3.32Å; L50-F65 WeakPolarHBondContact CD2-O 3.46Å; L50-L67 HydrophobicContact CB-CD1 4.1Å; L50-L67 HydrophobicContact CB-CG 4.21Å; L50-L67 HydrophobicContact CD1-CD2 3.99Å; L50-L67 HydrophobicContact CD1-CG 3.98Å
51	N	95.4	Very high	93.5	Very high	53 Å²	53	62.6 Å²	62.6	28%	0.283	32%	0.323	S	S	.	.	H	α-helix	trans	-58.5	-46.3	178.1	-77.3	-26.6	0	0	0	111.6	E47 L49 V53 C54 D55 K62	E47-N51 WeakPolarHBondContact O-CB 3.32Å; E47-N51 PolarHBondContact O-N 2.84Å; E47-N51 PolarHBondContact O-ND2 3.2Å; L49-N51 VanDerWaalsContact C-N 3.33Å; L49-N51 PolarHBondContact O-N 3.32Å; N51-V53 PolarHBondContact O-N 3.18Å; N51-C54 PolarHBondContact O-N 3.05Å; N51-D55 WeakPolarHBondContact O-CB 3.3Å; N51-D55 PolarHBondContact O-N 3.04Å; N51-K62 WeakPolarHBondContact OD1-CD 3.47Å
52	Q	95	Very high	93.5	Very high	40 Å²	40	63 Å²	63	19%	0.187	32%	0.323	C	S	.	.	H	α-helix	trans	-63.3	-40	177.7	-176.2	170.9	-31.2	0	0	112.6	I38 E39 Y44 C48 L49 L50 D55 Q56	I38-Q52 HydrophobicContact CG2-CG 4.29Å; E39-Q52 PolarHBondContact O-NE2 3.11Å; E39-Q52 PolarHBondContact O-OE1 3.41Å; Y44-Q52 PolarHBondContact OH-OE1 2.84Å; C48-Q52 PolarHBondContact O-N 2.86Å; C48-Q52 VanDerWaalsContact O-N 3.11Å; L49-Q52 PolarHBondContact O-N 3.38Å; L50-Q52 VanDerWaalsContact C-N 3.33Å; L50-Q52 PolarHBondContact O-N 2.94Å; Q52-D55 PolarHBondContact O-N 2.96Å; Q52-Q56 WeakPolarHBondContact O-CG 3.46Å; Q52-Q56 PolarHBondContact O-N 3.34Å
53	V	94.1	Very high	93.3	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-60.1	-50.4	173.4	168.1	0	0	0	0	110.6	V27 I36 I38 L49 L50 N51 D55 Q56 L57 I100	V27-V53 HydrophobicContact CB-CG2 4.42Å; V27-V53 HydrophobicContact CG1-CG1 4.03Å; V27-V53 HydrophobicContact CG1-CG2 4.26Å; V27-V53 HydrophobicContact CG2-CG2 3.75Å; I36-V53 HydrophobicContact CD1-CG1 4.34Å; I38-V53 HydrophobicContact CD1-CG2 3.97Å; I38-V53 HydrophobicContact CG1-CG2 3.78Å; L49-V53 WeakPolarHBondContact O-CG2 3.32Å; L49-V53 PolarHBondContact O-N 3.1Å; L50-V53 WeakPolarHBondContact O-CB 3.49Å; L50-V53 PolarHBondContact O-N 3.17Å; N51-V53 PolarHBondContact O-N 3.18Å; V53-D55 VanDerWaalsContact C-N 3.34Å; V53-D55 PolarHBondContact O-N 3Å; V53-Q56 PolarHBondContact O-N 3.38Å; V53-L57 HydrophobicContact CG1-CD1 3.83Å; V53-L57 WeakPolarHBondContact O-CG 3.19Å; V53-L57 PolarHBondContact O-N 2.66Å; V53-L57 VanDerWaalsContact O-N 3.1Å; V53-I100 HydrophobicContact CG1-CD1 3.97Å
54	C	93.9	Very high	93.2	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-63	-39.7	179.6	-70.7	0	0	0	0	112.4	L50 N51 L57 N58 I59 K62	L50-C54 WeakPolarHBondContact O-CB 3.34Å; L50-C54 PolarHBondContact O-N 3.38Å; L50-C54 PolarHBondContact O-SG 3.31Å; L50-C54 VanDerWaalsContact O-SG 3.38Å; N51-C54 PolarHBondContact O-N 3.05Å; C54-L57 CarbonylContact O-C 3.59Å; C54-L57 PolarHBondContact O-N 2.93Å; C54-N58 PolarHBondContact O-N 2.73Å; C54-I59 HydrophobicContact CB-CB 3.93Å; C54-I59 HydrophobicContact CB-CG2 4.35Å; C54-I59 PolarHBondContact O-N 2.78Å; C54-K62 HydrophobicContact CB-CB 4.42Å; C54-K62 HydrophobicContact CB-CD 3.75Å; C54-K62 HydrophobicContact CB-CG 3.67Å
55	D	94.4	Very high	93.1	Very high	95 Å²	95	59.9 Å²	59.9	51%	0.508	31%	0.309	S	S	.	.	H	α-helix	trans	-62.8	-43.9	177.4	-71.4	-31.4	0	0	0	111.3	N51 Q52 V53 L57 N58 K62	N51-D55 WeakPolarHBondContact O-CB 3.3Å; N51-D55 PolarHBondContact O-N 3.04Å; Q52-D55 PolarHBondContact O-N 2.96Å; V53-D55 VanDerWaalsContact C-N 3.34Å; V53-D55 PolarHBondContact O-N 3Å; D55-L57 VanDerWaalsContact C-N 3.27Å; D55-L57 PolarHBondContact O-N 3.21Å; D55-N58 PolarHBondContact O-N 3.37Å; D55-K62 VanDerWaalsContact CG-NZ 3.26Å; D55-K62 WeakPolarHBondContact OD1-CE 3.34Å; D55-K62 IonicContact OD1-NZ 2.61Å; D55-K62 PolarHBondContact OD1-NZ 3.14Å; D55-K62 IonicContact OD2-NZ 3.33Å; D55-K62 PolarHBondContact OD2-NZ 2.98Å
56	Q	93.2	Very high	92.9	Very high	101 Å²	101	58.6 Å²	58.6	47%	0.472	30%	0.303	S	S	.	.	H	α-helix	trans	-65.2	-30.6	175.9	-74.8	-166.8	-8.8	0	0	113.3	I36 Q52 V53	I36-Q56 HydrophobicContact CD1-CB 4.44Å; Q52-Q56 WeakPolarHBondContact O-CG 3.46Å; Q52-Q56 PolarHBondContact O-N 3.34Å; V53-Q56 PolarHBondContact O-N 3.38Å
57	L	91.9	Very high	92.9	Very high	50 Å²	50	58.6 Å²	58.6	26%	0.262	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	2.7	178.9	-64.5	172.9	0	0	0	113.3	L29 I36 V53 C54 D55 I59 I100	L29-L57 HydrophobicContact CD1-CD2 3.91Å; L29-L57 HydrophobicContact CD2-CD1 3.58Å; L29-L57 HydrophobicContact CD2-CD2 3.93Å; L29-L57 HydrophobicContact CD2-CG 4.38Å; I36-L57 HydrophobicContact CD1-CD1 4.14Å; I36-L57 HydrophobicContact CD1-CD2 3.99Å; I36-L57 HydrophobicContact CD1-CG 3.91Å; I36-L57 HydrophobicContact CG2-CD2 4.31Å; V53-L57 HydrophobicContact CG1-CD1 3.83Å; V53-L57 WeakPolarHBondContact O-CG 3.19Å; V53-L57 PolarHBondContact O-N 2.66Å; V53-L57 VanDerWaalsContact O-N 3.1Å; C54-L57 CarbonylContact O-C 3.59Å; C54-L57 PolarHBondContact O-N 2.93Å; D55-L57 VanDerWaalsContact C-N 3.27Å; D55-L57 PolarHBondContact O-N 3.21Å; L57-I59 HydrophobicContact CB-CD1 3.77Å; L57-I59 HydrophobicContact CB-CG1 3.81Å; L57-I59 HydrophobicContact CD1-CD1 3.9Å; L57-I59 PolarHBondContact O-N 2.83Å; L57-I100 HydrophobicContact CD1-CD1 4.24Å
58	N	93.2	Very high	92.8	Very high	147 Å²	147	56.3 Å²	56.3	79%	0.786	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.7	35.1	-173.3	-58.9	-59.3	0	0	0	113.7	C54 D55	C54-N58 PolarHBondContact O-N 2.73Å; D55-N58 PolarHBondContact O-N 3.37Å
59	I	90.9	Very high	92.6	Very high	35 Å²	35	54.4 Å²	54.4	18%	0.179	28%	0.275	C	S	.	.			trans	-85	115.7	177.2	-64	172.1	0	0	0	109.2	C54 L57 F65 I100	C54-I59 HydrophobicContact CB-CB 3.93Å; C54-I59 HydrophobicContact CB-CG2 4.35Å; C54-I59 PolarHBondContact O-N 2.78Å; L57-I59 HydrophobicContact CB-CD1 3.77Å; L57-I59 HydrophobicContact CB-CG1 3.81Å; L57-I59 HydrophobicContact CD1-CD1 3.9Å; L57-I59 PolarHBondContact O-N 2.83Å; I59-F65 HydrophobicContact CD1-CE1 4.2Å; I59-F65 HydrophobicContact CD1-CE2 4.42Å; I59-F65 HydrophobicContact CD1-CZ 4.11Å; I59-F65 HydrophobicContact CG2-CD2 3.69Å; I59-F65 HydrophobicContact CG2-CE2 3.28Å; I59-F65 HydrophobicContact CG2-CZ 3.9Å; I59-I100 HydrophobicContact CD1-CD1 3.97Å
60	V	90.7	Very high	92.2	Very high	136 Å²	136	56.9 Å²	56.9	82%	0.824	29%	0.289	S	S	*	.	S	Bend	trans	-78.1	-45.2	178.2	-179.9	0	0	0	0	111.4	K62	V60-K62 VanDerWaalsContact C-N 3.32Å; V60-K62 PolarHBondContact O-N 2.84Å
61	E	90	Very high	91.9	Very high	123 Å²	123	57.6 Å²	57.6	58%	0.575	29%	0.293	S	S	*	.			trans	-89.6	64	-171.5	-54.3	-177.3	112.7	0	0	112.4	D63 Y64 F65	E61-D63 PolarHBondContact O-N 3.29Å; E61-Y64 HydrophobicContact CB-CD2 3.44Å; E61-Y64 VanDerWaalsContact CB-CD2 3.44Å; E61-Y64 HydrophobicContact CB-CE2 3.71Å; E61-Y64 HydrophobicContact CG-CD2 4.36Å; E61-Y64 HydrophobicContact CG-CE2 4.21Å; E61-Y64 PolarHBondContact O-N 3.42Å; E61-F65 VanDerWaalsContact O-CD2 3.28Å; E61-F65 WeakPolarHBondContact O-CD2 3.28Å; E61-F65 WeakPolarHBondContact O-CE2 3.49Å
62	K	89.5	Confident	91.4	Very high	48 Å²	48	60.1 Å²	60.1	21%	0.209	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-59.1	-29.3	-174.1	-49.7	-172.4	-177	-179.3	0	113.8	N51 C54 D55 V60 Y64 F65	N51-K62 WeakPolarHBondContact OD1-CD 3.47Å; C54-K62 HydrophobicContact CB-CB 4.42Å; C54-K62 HydrophobicContact CB-CD 3.75Å; C54-K62 HydrophobicContact CB-CG 3.67Å; D55-K62 VanDerWaalsContact CG-NZ 3.26Å; D55-K62 WeakPolarHBondContact OD1-CE 3.34Å; D55-K62 IonicContact OD1-NZ 2.61Å; D55-K62 PolarHBondContact OD1-NZ 3.14Å; D55-K62 IonicContact OD2-NZ 3.33Å; D55-K62 PolarHBondContact OD2-NZ 2.98Å; V60-K62 VanDerWaalsContact C-N 3.32Å; V60-K62 PolarHBondContact O-N 2.84Å; K62-Y64 PolarHBondContact O-N 2.9Å; K62-Y64 VanDerWaalsContact O-N 3.1Å; K62-F65 PolarHBondContact O-N 2.84Å
63	D	87.4	Confident	91.1	Very high	107 Å²	107	63.7 Å²	63.7	57%	0.572	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-57.1	-23.4	178	-75.3	-2.8	0	0	0	113.7	E61 F65 K106	E61-D63 PolarHBondContact O-N 3.29Å; D63-F65 VanDerWaalsContact C-N 3.3Å; D63-K106 IonicContact OD2-NZ 2.84Å; D63-K106 PolarHBondContact OD2-NZ 2.82Å
64	Y	89.9	Confident	90.8	Very high	77 Å²	77	71.5 Å²	71.5	30%	0.302	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-84.6	-4.3	177.7	-64.3	-63	0	0	0	113.4	E61 K62 F102 V103 K106	E61-Y64 HydrophobicContact CB-CD2 3.44Å; E61-Y64 VanDerWaalsContact CB-CD2 3.44Å; E61-Y64 HydrophobicContact CB-CE2 3.71Å; E61-Y64 HydrophobicContact CG-CD2 4.36Å; E61-Y64 HydrophobicContact CG-CE2 4.21Å; E61-Y64 PolarHBondContact O-N 3.42Å; K62-Y64 PolarHBondContact O-N 2.9Å; K62-Y64 VanDerWaalsContact O-N 3.1Å; Y64-F102 CarbonylContact O-C 3.54Å; Y64-F102 WeakPolarHBondContact O-CA 3.39Å; Y64-V103 PolarHBondContact O-N 3.19Å; Y64-K106 HydrophobicContact CE1-CB 4.18Å
65	F	91.6	Very high	90.6	Very high	26 Å²	26	74.5 Å²	74.5	11%	0.114	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	154.8	-172.7	-62.2	-90.1	0	0	0	111.8	L30 L50 I59 E61 K62 D63 I100 F101 F102	L30-F65 HydrophobicContact CD1-CE1 4.17Å; L50-F65 HydrophobicContact CD1-CB 3.94Å; L50-F65 VanDerWaalsContact CD2-O 3.32Å; L50-F65 WeakPolarHBondContact CD2-O 3.46Å; I59-F65 HydrophobicContact CD1-CE1 4.2Å; I59-F65 HydrophobicContact CD1-CE2 4.42Å; I59-F65 HydrophobicContact CD1-CZ 4.11Å; I59-F65 HydrophobicContact CG2-CD2 3.69Å; I59-F65 HydrophobicContact CG2-CE2 3.28Å; I59-F65 HydrophobicContact CG2-CZ 3.9Å; E61-F65 VanDerWaalsContact O-CD2 3.28Å; E61-F65 WeakPolarHBondContact O-CD2 3.28Å; E61-F65 WeakPolarHBondContact O-CE2 3.49Å; K62-F65 PolarHBondContact O-N 2.84Å; D63-F65 VanDerWaalsContact C-N 3.3Å; F65-I100 HydrophobicContact CB-CD1 4.22Å; F65-I100 HydrophobicContact CB-CG1 4.19Å; F65-I100 HydrophobicContact CD1-CD1 3.61Å; F65-I100 HydrophobicContact CD1-CG1 3.81Å; F65-I100 HydrophobicContact CE1-CD1 4.27Å; F65-I100 HydrophobicContact CG-CD1 4.1Å; F65-I100 HydrophobicContact CG-CG1 4.38Å; F65-F101 CarbonylContact C-O 3.54Å; F65-F101 VanDerWaalsContact CA-O 3.28Å; F65-F101 WeakPolarHBondContact CA-O 3.21Å; F65-F102 HydrophobicContact CD1-CD1 4.3Å; F65-F102 HydrophobicContact CD1-CE1 4.28Å; F65-F102 AromaticContact CE1-CD1 3.93Å; F65-F102 HydrophobicContact CE1-CD1 3.93Å; F65-F102 AromaticContact CE1-CE1 3.48Å; F65-F102 HydrophobicContact CE1-CE1 3.48Å; F65-F102 VanDerWaalsContact CE1-CE1 3.48Å; F65-F102 HydrophobicContact CE1-CE2 4.42Å; F65-F102 AromaticContact CE1-CZ 3.76Å; F65-F102 HydrophobicContact CE1-CZ 3.76Å; F65-F102 HydrophobicContact CE2-CE1 4.08Å; F65-F102 HydrophobicContact CZ-CD1 4.12Å; F65-F102 AromaticContact CZ-CE1 3.36Å; F65-F102 HydrophobicContact CZ-CE1 3.36Å; F65-F102 AromaticContact CZ-CZ 3.81Å; F65-F102 HydrophobicContact CZ-CZ 3.81Å
66	G	93.2	Very high	90.4	Very high	8 Å²	8	78.5 Å²	78.5	8%	0.082	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	161.5	171.8	0	0	0	0	0	110.2	F101	G66-F101 PolarHBondContact N-O 3.15Å; G66-F101 PolarHBondContact O-N 3.11Å
67	L	94.3	Very high	90.4	Very high	3 Å²	3	78.7 Å²	78.7	2%	0.016	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	139.7	-179.7	-62.3	-178.5	0	0	0	109.8	L49 L50 L79 I98 Y99 I100	L49-L67 HydrophobicContact CB-CD1 4.12Å; L49-L67 HydrophobicContact CD2-CD1 3.96Å; L49-L67 HydrophobicContact CG-CD1 3.78Å; L50-L67 HydrophobicContact CB-CD1 4.1Å; L50-L67 HydrophobicContact CB-CG 4.21Å; L50-L67 HydrophobicContact CD1-CD2 3.99Å; L50-L67 HydrophobicContact CD1-CG 3.98Å; L67-L79 HydrophobicContact CB-CB 3.94Å; L67-L79 HydrophobicContact CB-CD2 3.95Å; L67-L79 HydrophobicContact CD1-CD2 3.87Å; L67-L79 WeakPolarHBondContact O-CB 3.47Å; L67-L79 PolarHBondContact O-N 2.94Å; L67-I98 HydrophobicContact CB-CG2 3.62Å; L67-I98 HydrophobicContact CD1-CG2 4.11Å; L67-I98 HydrophobicContact CD2-CG2 3.69Å; L67-I98 HydrophobicContact CG-CG2 3.97Å; L67-Y99 CarbonylContact C-O 3.42Å; L67-Y99 WeakPolarHBondContact CA-O 3.33Å; L67-I100 HydrophobicContact CD2-CB 4.3Å; L67-I100 HydrophobicContact CD2-CG1 4.32Å
68	R	93.1	Very high	90.5	Very high	57 Å²	57	81.5 Å²	81.5	22%	0.215	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	147.8	169	-65.1	-174.4	73.9	148.5	0.2	110.9	R76 Y77 W78 I98 Y99 F101	R68-R76 VanDerWaalsContact NH2-CB 3.31Å; R68-R76 PolarHBondContact NH2-O 2.82Å; R68-Y77 CarbonylContact C-O 3.51Å; R68-Y77 WeakPolarHBondContact CA-O 3.16Å; R68-Y77 VanDerWaalsContact CB-O 3.28Å; R68-Y77 WeakPolarHBondContact CB-O 3.41Å; R68-W78 HydrophobicContact CG-CD2 3.47Å; R68-W78 VanDerWaalsContact CG-CD2 3.47Å; R68-W78 HydrophobicContact CG-CE3 3.33Å; R68-W78 HydrophobicContact CG-CG 4.09Å; R68-W78 HydrophobicContact CG-CH2 4.1Å; R68-W78 HydrophobicContact CG-CZ2 4.19Å; R68-W78 HydrophobicContact CG-CZ3 3.66Å; R68-I98 CarbonylContact O-C 3.47Å; R68-I98 WeakPolarHBondContact O-CA 3.46Å; R68-Y99 PolarHBondContact N-O 2.93Å; R68-Y99 PolarHBondContact O-N 3.28Å; R68-F101 HydrophobicContact CB-CD2 3.86Å; R68-F101 HydrophobicContact CB-CE2 3.84Å; R68-F101 VanDerWaalsContact CD-CD2 3.42Å; R68-F101 VanDerWaalsContact CD-CE2 3.47Å; R68-F101 HydrophobicContact CG-CD2 3.58Å; R68-F101 HydrophobicContact CG-CE2 3.9Å; R68-F101 HydrophobicContact CG-CG 4.43Å
69	F	92	Very high	90.5	Very high	15 Å²	15	75.2 Å²	75.2	7%	0.066	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	161.4	170.4	70.4	-86.7	0	0	0	110.2	D71 R76 Y77 L79 Q88 V89	F69-D71 HydrophobicContact CE2-CB 4.44Å; F69-R76 WeakPolarHBondContact O-CA 3.36Å; F69-Y77 AromaticContact CE2-CD2 3.94Å; F69-Y77 HydrophobicContact CE2-CD2 3.94Å; F69-Y77 HydrophobicContact CE2-CG 4.36Å; F69-Y77 HydrophobicContact CZ-CD2 4.07Å; F69-Y77 HydrophobicContact CZ-CG 4.04Å; F69-Y77 PolarHBondContact N-O 2.9Å; F69-Y77 PolarHBondContact O-N 2.99Å; F69-L79 HydrophobicContact CD1-CD1 4.15Å; F69-L79 HydrophobicContact CE1-CD1 4.32Å; F69-Q88 HydrophobicContact CE1-CB 4.32Å; F69-Q88 HydrophobicContact CZ-CB 4.5Å; F69-V89 HydrophobicContact CB-CG2 4.36Å; F69-V89 HydrophobicContact CD1-CG2 4.02Å; F69-V89 HydrophobicContact CD2-CG2 4.06Å; F69-V89 HydrophobicContact CE1-CG2 4.3Å; F69-V89 HydrophobicContact CE2-CG2 4.34Å; F69-V89 HydrophobicContact CG-CG2 3.89Å; F69-V89 HydrophobicContact CZ-CG2 4.44Å
70	V	88.4	Confident	90.6	Very high	51 Å²	51	75.6 Å²	75.6	31%	0.309	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	127.2	175.1	-174.6	0	0	0	0	108	H74 V75 R76 Y99	V70-H74 HydrophobicContact CG1-CB 4.45Å; V70-V75 WeakPolarHBondContact CA-O 3.21Å; V70-R76 HydrophobicContact CG2-CG 4.18Å; V70-Y99 HydrophobicContact CG2-CE2 3.91Å
71	D	87.5	Confident	90.8	Very high	37 Å²	37	72.2 Å²	72.2	20%	0.198	35%	0.352	C	S	.	.			trans	-80.3	-179.1	176.9	85.7	-20.9	0	0	0	112.4	F69 N73 H74 V75 Y77	F69-D71 HydrophobicContact CE2-CB 4.44Å; D71-N73 PolarHBondContact O-N 3.41Å; D71-N73 VanDerWaalsContact OD1-C 3.3Å; D71-N73 WeakPolarHBondContact OD1-CA 3.46Å; D71-N73 WeakPolarHBondContact OD1-CB 3.5Å; D71-N73 PolarHBondContact OD1-N 2.84Å; D71-N73 PolarHBondContact OD2-ND2 2.73Å; D71-H74 PolarHBondContact O-N 3.44Å; D71-H74 VanDerWaalsContact O-N 3.11Å; D71-H74 PolarHBondContact OD1-N 2.72Å; D71-H74 VanDerWaalsContact OD1-N 3.15Å; D71-V75 PolarHBondContact N-O 3.01Å; D71-V75 WeakPolarHBondContact OD1-CB 3.35Å; D71-V75 PolarHBondContact OD1-N 3.32Å; D71-Y77 HydrophobicContact CB-CD2 4.09Å; D71-Y77 HydrophobicContact CB-CE2 3.83Å
72	S	86.1	Confident	91	Very high	107 Å²	107	71.3 Å²	71.3	75%	0.748	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-16.4	177.7	55.2	0	0	0	0	114.3
73	N	88.9	Confident	91.3	Very high	115 Å²	115	74.5 Å²	74.5	62%	0.615	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	13.4	177.8	-52.1	-61.1	0	0	0	111.7	D71 V75	D71-N73 PolarHBondContact O-N 3.41Å; D71-N73 VanDerWaalsContact OD1-C 3.3Å; D71-N73 WeakPolarHBondContact OD1-CA 3.46Å; D71-N73 WeakPolarHBondContact OD1-CB 3.5Å; D71-N73 PolarHBondContact OD1-N 2.84Å; D71-N73 PolarHBondContact OD2-ND2 2.73Å; N73-V75 HydrophobicContact CB-CG2 4.17Å; N73-V75 PolarHBondContact O-N 2.74Å
74	H	86.9	Confident	91.7	Very high	163 Å²	163	71.5 Å²	71.5	76%	0.755	35%	0.353	S	S	*	.	S	Bend	trans	62.6	19.8	-176.1	-53.8	-73.6	0	0	0	114.7	V70 D71	V70-H74 HydrophobicContact CG1-CB 4.45Å; D71-H74 PolarHBondContact O-N 3.44Å; D71-H74 VanDerWaalsContact O-N 3.11Å; D71-H74 PolarHBondContact OD1-N 2.72Å; D71-H74 VanDerWaalsContact OD1-N 3.15Å
75	V	90	Very high	91.8	Very high	64 Å²	64	67.9 Å²	67.9	39%	0.388	34%	0.338	S	S	.	.			trans	-86.3	131.9	177	-176.4	0	0	0	0	109.7	V70 D71 N73 Y77	V70-V75 WeakPolarHBondContact CA-O 3.21Å; D71-V75 PolarHBondContact N-O 3.01Å; D71-V75 WeakPolarHBondContact OD1-CB 3.35Å; D71-V75 PolarHBondContact OD1-N 3.32Å; N73-V75 HydrophobicContact CB-CG2 4.17Å; N73-V75 PolarHBondContact O-N 2.74Å; V75-Y77 HydrophobicContact CB-CD2 4.39Å; V75-Y77 HydrophobicContact CB-CE2 3.61Å; V75-Y77 HydrophobicContact CG1-CD2 4.23Å; V75-Y77 HydrophobicContact CG1-CE1 4.08Å; V75-Y77 HydrophobicContact CG1-CE2 3.55Å; V75-Y77 VanDerWaalsContact CG1-CZ 3.45Å; V75-Y77 WeakPolarHBondContact O-CD2 3.44Å
76	R	90.2	Very high	91.8	Very high	178 Å²	178	69.3 Å²	69.3	67%	0.672	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	112.7	-178.6	-62.4	-179	-178.8	118.6	-2.2	111.2	R68 F69 V70	R68-R76 VanDerWaalsContact NH2-CB 3.31Å; R68-R76 PolarHBondContact NH2-O 2.82Å; F69-R76 WeakPolarHBondContact O-CA 3.36Å; V70-R76 HydrophobicContact CG2-CG 4.18Å
77	Y	92.4	Very high	91.7	Very high	105 Å²	105	78.3 Å²	78.3	41%	0.412	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	147.8	177.3	-66.2	-78.9	0	0	0	111.8	R68 F69 D71 V75	R68-Y77 CarbonylContact C-O 3.51Å; R68-Y77 WeakPolarHBondContact CA-O 3.16Å; R68-Y77 VanDerWaalsContact CB-O 3.28Å; R68-Y77 WeakPolarHBondContact CB-O 3.41Å; F69-Y77 AromaticContact CE2-CD2 3.94Å; F69-Y77 HydrophobicContact CE2-CD2 3.94Å; F69-Y77 HydrophobicContact CE2-CG 4.36Å; F69-Y77 HydrophobicContact CZ-CD2 4.07Å; F69-Y77 HydrophobicContact CZ-CG 4.04Å; F69-Y77 PolarHBondContact N-O 2.9Å; F69-Y77 PolarHBondContact O-N 2.99Å; D71-Y77 HydrophobicContact CB-CD2 4.09Å; D71-Y77 HydrophobicContact CB-CE2 3.83Å; V75-Y77 HydrophobicContact CB-CD2 4.39Å; V75-Y77 HydrophobicContact CB-CE2 3.61Å; V75-Y77 HydrophobicContact CG1-CD2 4.23Å; V75-Y77 HydrophobicContact CG1-CE1 4.08Å; V75-Y77 HydrophobicContact CG1-CE2 3.55Å; V75-Y77 VanDerWaalsContact CG1-CZ 3.45Å; V75-Y77 WeakPolarHBondContact O-CD2 3.44Å
78	W	93.7	Very high	91.6	Very high	110 Å²	110	79.8 Å²	79.8	42%	0.417	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	139.1	163.4	-71.3	100.4	0	0	0	109.6	R68 D80 F101 V103	R68-W78 HydrophobicContact CG-CD2 3.47Å; R68-W78 VanDerWaalsContact CG-CD2 3.47Å; R68-W78 HydrophobicContact CG-CE3 3.33Å; R68-W78 HydrophobicContact CG-CG 4.09Å; R68-W78 HydrophobicContact CG-CH2 4.1Å; R68-W78 HydrophobicContact CG-CZ2 4.19Å; R68-W78 HydrophobicContact CG-CZ3 3.66Å; W78-D80 PolarHBondContact O-N 2.99Å; W78-F101 HydrophobicContact CH2-CB 3.34Å; W78-F101 HydrophobicContact CH2-CG 4.05Å; W78-F101 HydrophobicContact CZ2-CB 4.39Å; W78-F101 HydrophobicContact CZ3-CB 3.66Å; W78-F101 HydrophobicContact CZ3-CG 4.44Å; W78-V103 HydrophobicContact CE3-CG2 4.19Å; W78-V103 HydrophobicContact CH2-CG2 3.65Å; W78-V103 HydrophobicContact CZ3-CG2 3.45Å; W78-V103 VanDerWaalsContact CZ3-CG2 3.45Å
79	L	94	Very high	91.4	Very high	14 Å²	14	77.8 Å²	77.8	7%	0.073	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-74.4	120.4	169.2	-163.3	71.8	0	0	0	108.2	L49 L67 F69 P81 V85 Q88 V89	L49-L79 HydrophobicContact CD2-CD2 4.13Å; L67-L79 HydrophobicContact CB-CB 3.94Å; L67-L79 HydrophobicContact CB-CD2 3.95Å; L67-L79 HydrophobicContact CD1-CD2 3.87Å; L67-L79 WeakPolarHBondContact O-CB 3.47Å; L67-L79 PolarHBondContact O-N 2.94Å; F69-L79 HydrophobicContact CD1-CD1 4.15Å; F69-L79 HydrophobicContact CE1-CD1 4.32Å; L79-P81 WeakPolarHBondContact O-CD 3.47Å; L79-V85 HydrophobicContact CD1-CG1 4.3Å; L79-V85 HydrophobicContact CD2-CG2 4.16Å; L79-Q88 HydrophobicContact CD1-CB 4.06Å; L79-Q88 HydrophobicContact CD1-CG 4.47Å; L79-V89 HydrophobicContact CD1-CG2 4.36Å
80	D	93.6	Very high	90.6	Very high	43 Å²	43	86.3 Å²	86.3	23%	0.23	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-67.5	120.2	173.1	-173.5	-33.1	0	0	0	108.8	W78 T82 K83 Q88	W78-D80 PolarHBondContact O-N 2.99Å; D80-T82 PolarHBondContact O-N 3.27Å; D80-T82 WeakPolarHBondContact OD1-CB 3.19Å; D80-T82 PolarHBondContact OD1-N 3.39Å; D80-T82 PolarHBondContact OD1-OG1 2.82Å; D80-K83 HydrophobicContact CB-CB 4.21Å; D80-K83 HydrophobicContact CB-CD 4.11Å; D80-K83 HydrophobicContact CB-CG 4.27Å; D80-K83 PolarHBondContact O-N 2.84Å; D80-K83 WeakPolarHBondContact OD2-CD 3.37Å; D80-K83 WeakPolarHBondContact OD2-CE 3.28Å; D80-K83 IonicContact OD2-NZ 3.15Å; D80-K83 PolarHBondContact OD2-NZ 2.8Å; D80-Q88 VanDerWaalsContact CB-OE1 3.25Å; D80-Q88 PolarHBondContact O-NE2 2.78Å
81	P	93.7	Very high	89.7	Confident	66 Å²	66	86.4 Å²	86.4	43%	0.429	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-25.8	-176.8	24.1	-32.3	0	0	0	112.6	T45 G46 E47 L79	T45-P81 VanDerWaalsContact CB-O 3.32Å; T45-P81 WeakPolarHBondContact CB-O 3.37Å; T45-P81 PolarHBondContact OG1-O 3.35Å; G46-P81 PolarHBondContact N-O 3.07Å; E47-P81 HydrophobicContact CB-CB 4Å; E47-P81 WeakPolarHBondContact CB-O 3.28Å; E47-P81 PolarHBondContact N-O 2.78Å; L79-P81 WeakPolarHBondContact O-CD 3.47Å
82	T	95.5	Very high	88.4	Confident	104 Å²	104	94.4 Å²	94.4	64%	0.638	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-15.1	-173.9	70	0	0	0	0	113.9	D80	D80-T82 PolarHBondContact O-N 3.27Å; D80-T82 WeakPolarHBondContact OD1-CB 3.19Å; D80-T82 PolarHBondContact OD1-N 3.39Å; D80-T82 PolarHBondContact OD1-OG1 2.82Å
83	K	95.5	Very high	87.3	Confident	115 Å²	115	93.8 Å²	93.8	50%	0.5	45%	0.446	S	S	.	.	S	Bend	trans	-104.7	149.5	-174.8	-67.5	177.2	-174.2	134.8	0	111.6	T45 G46 D80 V85 Q88	T45-K83 WeakPolarHBondContact CA-O 3.39Å; G46-K83 PolarHBondContact N-O 2.85Å; D80-K83 HydrophobicContact CB-CB 4.21Å; D80-K83 HydrophobicContact CB-CD 4.11Å; D80-K83 HydrophobicContact CB-CG 4.27Å; D80-K83 PolarHBondContact O-N 2.84Å; D80-K83 WeakPolarHBondContact OD2-CD 3.37Å; D80-K83 WeakPolarHBondContact OD2-CE 3.28Å; D80-K83 IonicContact OD2-NZ 3.15Å; D80-K83 PolarHBondContact OD2-NZ 2.8Å; K83-V85 PolarHBondContact O-N 2.95Å; K83-Q88 HydrophobicContact CB-CG 4.05Å; K83-Q88 PolarHBondContact O-NE2 3.38Å
84	L	94.6	Very high	86	Confident	44 Å²	44	94.9 Å²	94.9	23%	0.23	45%	0.447	C	S	.	.	B	Isolated β-bridge	trans	-57.6	131.7	173.7	-65.5	-179.6	0	0	0	111.3	N43 Y44 T45 V86 R87 Q88	N43-L84 WeakPolarHBondContact O-CD2 3.33Å; Y44-L84 WeakPolarHBondContact O-CA 3.09Å; T45-L84 HydrophobicContact CG2-CD2 4.36Å; L84-V86 VanDerWaalsContact C-N 3.26Å; L84-V86 HydrophobicContact CB-CG2 4.09Å; L84-V86 PolarHBondContact O-N 2.76Å; L84-R87 HydrophobicContact CB-CB 4.3Å; L84-R87 HydrophobicContact CB-CG 4.02Å; L84-R87 HydrophobicContact CD1-CG 4.44Å; L84-R87 WeakPolarHBondContact O-CB 3.21Å; L84-R87 PolarHBondContact O-N 3.18Å; L84-Q88 PolarHBondContact O-N 2.9Å
85	V	93.2	Very high	85.3	Confident	0 Å²	0	90.9 Å²	90.9	0%	0	43%	0.428	C	S	.	.	H	α-helix	trans	-56.5	-44	-179.2	-178.9	0	0	0	0	110.9	Y40 Y44 T45 L49 L79 K83 R87 Q88 V89 F96	Y40-V85 HydrophobicContact CE2-CB 4.13Å; Y40-V85 HydrophobicContact CE2-CG1 4.08Å; Y44-V85 PolarHBondContact O-N 3.02Å; T45-V85 WeakPolarHBondContact O-CG2 3.32Å; L49-V85 HydrophobicContact CB-CG2 4.11Å; L49-V85 HydrophobicContact CD2-CG1 4.05Å; L49-V85 HydrophobicContact CD2-CG2 3.93Å; L79-V85 HydrophobicContact CD1-CG1 4.3Å; L79-V85 HydrophobicContact CD2-CG2 4.16Å; K83-V85 PolarHBondContact O-N 2.95Å; V85-R87 PolarHBondContact O-N 3.38Å; V85-R87 VanDerWaalsContact O-N 3.14Å; V85-Q88 PolarHBondContact O-N 3.44Å; V85-V89 HydrophobicContact CG1-CG2 4.32Å; V85-V89 PolarHBondContact O-N 2.89Å; V85-F96 HydrophobicContact CG1-CE2 4.42Å; V85-F96 HydrophobicContact CG1-CZ 3.74Å
86	V	91	Very high	84.8	Confident	57 Å²	57	88.7 Å²	88.7	35%	0.345	41%	0.413	S	S	.	.	H	α-helix	trans	-62.6	-20.3	178.9	-61.6	0	0	0	0	114.2	L23 Y40 K42 L84	L23-V86 HydrophobicContact CD1-CG1 3.41Å; L23-V86 VanDerWaalsContact CD1-CG1 3.41Å; Y40-V86 HydrophobicContact CE2-CG1 4.25Å; K42-V86 HydrophobicContact CB-CG1 4.42Å; K42-V86 WeakPolarHBondContact O-CG2 3.37Å; L84-V86 VanDerWaalsContact C-N 3.26Å; L84-V86 HydrophobicContact CB-CG2 4.09Å; L84-V86 PolarHBondContact O-N 2.76Å
87	R	91.3	Very high	84.5	Confident	197 Å²	197	83.1 Å²	83.1	74%	0.743	40%	0.397	S	S	*	.	H	α-helix	trans	-88	-20	176.4	-68.9	-174.1	177.3	179.1	2	112.6	L84 V85	L84-R87 HydrophobicContact CB-CB 4.3Å; L84-R87 HydrophobicContact CB-CG 4.02Å; L84-R87 HydrophobicContact CD1-CG 4.44Å; L84-R87 WeakPolarHBondContact O-CB 3.21Å; L84-R87 PolarHBondContact O-N 3.18Å; V85-R87 PolarHBondContact O-N 3.38Å; V85-R87 VanDerWaalsContact O-N 3.14Å
88	Q	92	Very high	83.9	Confident	33 Å²	33	78.1 Å²	78.1	15%	0.154	38%	0.377	C	S	.	.	H	α-helix	trans	-93	-43.1	-178.3	-60.1	-172.9	65.2	0	0	111.1	F69 L79 D80 K83 L84 V85 K90	F69-Q88 HydrophobicContact CE1-CB 4.32Å; F69-Q88 HydrophobicContact CZ-CB 4.5Å; L79-Q88 HydrophobicContact CD1-CB 4.06Å; L79-Q88 HydrophobicContact CD1-CG 4.47Å; D80-Q88 VanDerWaalsContact CB-OE1 3.25Å; D80-Q88 PolarHBondContact O-NE2 2.78Å; K83-Q88 HydrophobicContact CB-CG 4.05Å; K83-Q88 PolarHBondContact O-NE2 3.38Å; L84-Q88 PolarHBondContact O-N 2.9Å; V85-Q88 PolarHBondContact O-N 3.44Å; Q88-K90 PolarHBondContact O-N 2.76Å
89	V	88.3	Confident	83.7	Confident	15 Å²	15	75.8 Å²	75.8	9%	0.091	37%	0.369	C	S	.	.			trans	-92.8	96.6	-178.9	-174.9	0	0	0	0	108.3	F69 L79 V85 S91 F96	F69-V89 HydrophobicContact CB-CG2 4.36Å; F69-V89 HydrophobicContact CD1-CG2 4.02Å; F69-V89 HydrophobicContact CD2-CG2 4.06Å; F69-V89 HydrophobicContact CE1-CG2 4.3Å; F69-V89 HydrophobicContact CE2-CG2 4.34Å; F69-V89 HydrophobicContact CG-CG2 3.89Å; F69-V89 HydrophobicContact CZ-CG2 4.44Å; L79-V89 HydrophobicContact CD1-CG2 4.36Å; V85-V89 HydrophobicContact CG1-CG2 4.32Å; V85-V89 PolarHBondContact O-N 2.89Å; V89-S91 PolarHBondContact O-N 3.02Å; V89-F96 HydrophobicContact CB-CD2 4.43Å; V89-F96 HydrophobicContact CB-CE2 4.26Å; V89-F96 HydrophobicContact CG1-CB 4.23Å; V89-F96 HydrophobicContact CG1-CD1 4.14Å; V89-F96 HydrophobicContact CG1-CD2 3.69Å; V89-F96 HydrophobicContact CG1-CE2 4.01Å; V89-F96 HydrophobicContact CG1-CG 3.75Å; V89-F96 HydrophobicContact CG1-CZ 4.44Å; V89-F96 HydrophobicContact CG2-CD2 4.09Å; V89-F96 HydrophobicContact CG2-CE2 3.65Å; V89-F96 HydrophobicContact CG2-CZ 4.16Å
90	K	76.9	Confident	83.3	Confident	194 Å²	194	75.4 Å²	75.4	84%	0.843	37%	0.367	S	S	*	.			trans	-72.1	18.5	177.5	-63.8	-178.4	-179.4	175.1	0	113.5	Q88 K92	Q88-K90 PolarHBondContact O-N 2.76Å; K90-K92 PolarHBondContact O-N 3.1Å
91	S	68	Low	82.8	Confident	53 Å²	53	76.9 Å²	76.9	37%	0.371	37%	0.371	S	S	.	.			trans	-64.8	124.9	-179.1	-172.4	0	0	0	0	109.4	V89 V93	V89-S91 PolarHBondContact O-N 3.02Å; S91-V93 PolarHBondContact O-N 3.12Å; S91-V93 WeakPolarHBondContact OG-CB 3.46Å; S91-V93 PolarHBondContact OG-N 3.27Å; S91-V93 VanDerWaalsContact OG-N 3.1Å; S91-V93 PolarHBondContact OG-O 2.99Å
92	K	61.6	Low	82.3	Confident	206 Å²	206	79.5 Å²	79.5	90%	0.896	38%	0.376	S	S	*	.	S	Bend	trans	-70.1	-14.1	166.9	-66.8	-177	179.7	177.9	0	111.6	K90	K90-K92 PolarHBondContact O-N 3.1Å
93	V	61.4	Low	81.5	Confident	93 Å²	93	76.2 Å²	76.2	56%	0.564	36%	0.356	S	S	*	.	S	Bend	trans	-86.7	129.5	-179.4	-167.1	0	0	0	0	108	S91 F95	S91-V93 PolarHBondContact O-N 3.12Å; S91-V93 WeakPolarHBondContact OG-CB 3.46Å; S91-V93 PolarHBondContact OG-N 3.27Å; S91-V93 VanDerWaalsContact OG-N 3.1Å; S91-V93 PolarHBondContact OG-O 2.99Å; V93-F95 WeakPolarHBondContact CB-O 3.44Å; V93-F95 HydrophobicContact CG1-CB 4.3Å; V93-F95 VanDerWaalsContact CG1-O 3.27Å; V93-F95 WeakPolarHBondContact CG1-O 3.39Å; V93-F95 PolarHBondContact O-N 2.85Å
94	H	62.7	Low	80	Confident	138 Å²	138	78 Å²	78	64%	0.639	37%	0.37	S	S	*	.	S	Bend	trans	-64	-0.1	176.5	-63.1	86.1	0	0	0	113.6	R24	R24-H94 PolarHBondContact N-O 3.49Å
95	F	72.6	Confident	78.2	Confident	79 Å²	79	86.6 Å²	86.6	35%	0.346	40%	0.399	S	S	.	.			trans	-139.4	128	-176.8	-168.3	-101.1	0	0	0	108.9	R24 K26 D37 V93	R24-F95 HydrophobicContact CB-CD2 4.07Å; R24-F95 WeakPolarHBondContact O-CA 3.27Å; K26-F95 HydrophobicContact CB-CE1 3.9Å; K26-F95 HydrophobicContact CB-CE2 4.13Å; K26-F95 HydrophobicContact CB-CZ 3.48Å; K26-F95 VanDerWaalsContact CB-CZ 3.48Å; K26-F95 HydrophobicContact CD-CZ 4.22Å; K26-F95 HydrophobicContact CG-CZ 4.37Å; D37-F95 WeakPolarHBondContact OD1-CE2 3.41Å; D37-F95 WeakPolarHBondContact OD1-CZ 3.5Å; V93-F95 WeakPolarHBondContact CB-O 3.44Å; V93-F95 HydrophobicContact CG1-CB 4.3Å; V93-F95 VanDerWaalsContact CG1-O 3.27Å; V93-F95 WeakPolarHBondContact CG1-O 3.39Å; V93-F95 PolarHBondContact O-N 2.85Å
96	F	79.4	Confident	76.1	Confident	18 Å²	18	92.8 Å²	92.8	8%	0.079	43%	0.426	C	S	.	.			trans	-144.4	160.9	178.3	64	-76.5	0	0	0	109.7	C25 K26 Y40 V85 V89 I98	C25-F96 WeakPolarHBondContact CA-O 3.46Å; C25-F96 HydrophobicContact CB-CD1 3.94Å; C25-F96 HydrophobicContact CB-CD2 4.45Å; C25-F96 HydrophobicContact CB-CE1 3.52Å; C25-F96 HydrophobicContact CB-CE2 4.15Å; C25-F96 HydrophobicContact CB-CG 4.36Å; C25-F96 HydrophobicContact CB-CZ 3.65Å; C25-F96 WeakPolarHBondContact CB-O 3.39Å; K26-F96 PolarHBondContact N-O 3Å; Y40-F96 AromaticContact CE1-CE1 3.82Å; Y40-F96 HydrophobicContact CE1-CE1 3.82Å; Y40-F96 HydrophobicContact CE1-CZ 4.25Å; Y40-F96 AromaticContact CZ-CE1 3.79Å; Y40-F96 WeakPolarHBondContact OH-CE1 3.41Å; V85-F96 HydrophobicContact CG1-CE2 4.42Å; V85-F96 HydrophobicContact CG1-CZ 3.74Å; V89-F96 HydrophobicContact CB-CD2 4.43Å; V89-F96 HydrophobicContact CB-CE2 4.26Å; V89-F96 HydrophobicContact CG1-CB 4.23Å; V89-F96 HydrophobicContact CG1-CD1 4.14Å; V89-F96 HydrophobicContact CG1-CD2 3.69Å; V89-F96 HydrophobicContact CG1-CE2 4.01Å; V89-F96 HydrophobicContact CG1-CG 3.75Å; V89-F96 HydrophobicContact CG1-CZ 4.44Å; V89-F96 HydrophobicContact CG2-CD2 4.09Å; V89-F96 HydrophobicContact CG2-CE2 3.65Å; V89-F96 HydrophobicContact CG2-CZ 4.16Å; F96-I98 HydrophobicContact CD2-CD1 4.25Å; F96-I98 HydrophobicContact CD2-CG1 3.69Å; F96-I98 HydrophobicContact CE2-CD1 3.32Å; F96-I98 HydrophobicContact CE2-CG1 3.23Å; F96-I98 HydrophobicContact CZ-CD1 3.72Å; F96-I98 HydrophobicContact CZ-CG1 4.1Å
97	N	82.4	Confident	73.7	Confident	61 Å²	61	98.5 Å²	98.5	33%	0.326	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	128.4	-177.3	-62	-20.1	0	0	0	109.9	K26 Y28 Y99	K26-N97 CarbonylContact O-C 3.48Å; K26-N97 WeakPolarHBondContact O-CA 3.41Å; Y28-N97 HydrophobicContact CD2-CB 4.17Å; Y28-N97 HydrophobicContact CE2-CB 3.72Å; N97-Y99 HydrophobicContact CB-CE2 4.27Å
98	I	81.6	Confident	71.3	Confident	1 Å²	1	100.6 Å²	100.6	1%	0.005	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	151.6	171.4	-62.9	-179.3	0	0	0	108	C25 K26 V27 Y28 L49 L67 R68 F96	C25-I98 HydrophobicContact CB-CD1 4.15Å; C25-I98 HydrophobicContact CB-CG1 4.47Å; K26-I98 PolarHBondContact O-N 2.84Å; V27-I98 CarbonylContact C-O 3.55Å; V27-I98 VanDerWaalsContact CA-O 3.28Å; V27-I98 WeakPolarHBondContact CA-O 3.2Å; V27-I98 HydrophobicContact CG1-CG2 4.43Å; V27-I98 HydrophobicContact CG2-CB 4.1Å; V27-I98 HydrophobicContact CG2-CG2 4.34Å; Y28-I98 PolarHBondContact N-O 3.38Å; L49-I98 HydrophobicContact CD2-CD1 3.36Å; L49-I98 HydrophobicContact CG-CD1 4.47Å; L67-I98 HydrophobicContact CB-CG2 3.62Å; L67-I98 HydrophobicContact CD1-CG2 4.11Å; L67-I98 HydrophobicContact CD2-CG2 3.69Å; L67-I98 HydrophobicContact CG-CG2 3.97Å; R68-I98 CarbonylContact O-C 3.47Å; R68-I98 WeakPolarHBondContact O-CA 3.46Å; F96-I98 HydrophobicContact CD2-CD1 4.25Å; F96-I98 HydrophobicContact CD2-CG1 3.69Å; F96-I98 HydrophobicContact CE2-CD1 3.32Å; F96-I98 HydrophobicContact CE2-CG1 3.23Å; F96-I98 HydrophobicContact CZ-CD1 3.72Å; F96-I98 HydrophobicContact CZ-CG1 4.1Å
99	Y	88.2	Confident	68.8	Low	61 Å²	61	110.6 Å²	110.6	24%	0.239	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	130.1	176.3	-62.3	-97.2	0	0	0	108.4	Y28 L67 R68 V70 N97 F101	Y28-Y99 HydrophobicContact CD2-CD1 4.49Å; Y28-Y99 HydrophobicContact CD2-CE1 4.09Å; Y28-Y99 HydrophobicContact CG-CD1 4.21Å; Y28-Y99 AromaticContact CG-CE1 3.9Å; Y28-Y99 HydrophobicContact CG-CE1 3.9Å; L67-Y99 CarbonylContact C-O 3.42Å; L67-Y99 WeakPolarHBondContact CA-O 3.33Å; R68-Y99 PolarHBondContact N-O 2.93Å; R68-Y99 PolarHBondContact O-N 3.28Å; V70-Y99 HydrophobicContact CG2-CE2 3.91Å; N97-Y99 HydrophobicContact CB-CE2 4.27Å; Y99-F101 HydrophobicContact CG-CE2 4.14Å
100	I	85	Confident	67.9	Low	6 Å²	6	115.4 Å²	115.4	3%	0.031	53%	0.533	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	136.6	170.2	-163.5	177.9	0	0	0	109.1	V27 Y28 L29 L30 V53 L57 I59 F65 L67	V27-I100 HydrophobicContact CG1-CB 4.37Å; Y28-I100 PolarHBondContact O-N 3.1Å; L29-I100 HydrophobicContact CD2-CG2 4.4Å; L30-I100 HydrophobicContact CD2-CG2 4.32Å; L30-I100 WeakPolarHBondContact CD2-O 3.45Å; L30-I100 HydrophobicContact CG-CG2 4.11Å; V53-I100 HydrophobicContact CG1-CD1 3.97Å; L57-I100 HydrophobicContact CD1-CD1 4.24Å; I59-I100 HydrophobicContact CD1-CD1 3.97Å; F65-I100 HydrophobicContact CB-CD1 4.22Å; F65-I100 HydrophobicContact CB-CG1 4.19Å; F65-I100 HydrophobicContact CD1-CD1 3.61Å; F65-I100 HydrophobicContact CD1-CG1 3.81Å; F65-I100 HydrophobicContact CE1-CD1 4.27Å; F65-I100 HydrophobicContact CG-CD1 4.1Å; F65-I100 HydrophobicContact CG-CG1 4.38Å; L67-I100 HydrophobicContact CD2-CB 4.3Å; L67-I100 HydrophobicContact CD2-CG1 4.32Å
101	F	84	Confident	67.4	Low	73 Å²	73	111.2 Å²	111.2	32%	0.32	52%	0.516	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	150.7	-179.1	-80.6	-86.1	0	0	0	110.8	F65 G66 R68 W78 Y99 V103	F65-F101 CarbonylContact C-O 3.54Å; F65-F101 VanDerWaalsContact CA-O 3.28Å; F65-F101 WeakPolarHBondContact CA-O 3.21Å; G66-F101 PolarHBondContact N-O 3.15Å; G66-F101 PolarHBondContact O-N 3.11Å; R68-F101 HydrophobicContact CB-CD2 3.86Å; R68-F101 HydrophobicContact CB-CE2 3.84Å; R68-F101 VanDerWaalsContact CD-CD2 3.42Å; R68-F101 VanDerWaalsContact CD-CE2 3.47Å; R68-F101 HydrophobicContact CG-CD2 3.58Å; R68-F101 HydrophobicContact CG-CE2 3.9Å; R68-F101 HydrophobicContact CG-CG 4.43Å; W78-F101 HydrophobicContact CH2-CB 3.34Å; W78-F101 HydrophobicContact CH2-CG 4.05Å; W78-F101 HydrophobicContact CZ2-CB 4.39Å; W78-F101 HydrophobicContact CZ3-CB 3.66Å; W78-F101 HydrophobicContact CZ3-CG 4.44Å; Y99-F101 HydrophobicContact CG-CE2 4.14Å; F101-V103 PolarHBondContact O-N 3.26Å
102	F	83	Confident	67.4	Low	121 Å²	121	114.4 Å²	114.4	53%	0.531	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	118.6	166.6	-75.3	-72.3	0	0	0	110.8	L30 Y64 F65	L30-F102 HydrophobicContact CD1-CD2 3.94Å; L30-F102 HydrophobicContact CD1-CE2 3.28Å; L30-F102 HydrophobicContact CD1-CZ 3.82Å; L30-F102 HydrophobicContact CD2-CD2 4.02Å; L30-F102 HydrophobicContact CD2-CE2 4.23Å; L30-F102 HydrophobicContact CG-CE2 4.4Å; Y64-F102 CarbonylContact O-C 3.54Å; Y64-F102 WeakPolarHBondContact O-CA 3.39Å; F65-F102 HydrophobicContact CD1-CD1 4.3Å; F65-F102 HydrophobicContact CD1-CE1 4.28Å; F65-F102 AromaticContact CE1-CD1 3.93Å; F65-F102 HydrophobicContact CE1-CD1 3.93Å; F65-F102 AromaticContact CE1-CE1 3.48Å; F65-F102 HydrophobicContact CE1-CE1 3.48Å; F65-F102 VanDerWaalsContact CE1-CE1 3.48Å; F65-F102 HydrophobicContact CE1-CE2 4.42Å; F65-F102 AromaticContact CE1-CZ 3.76Å; F65-F102 HydrophobicContact CE1-CZ 3.76Å; F65-F102 HydrophobicContact CE2-CE1 4.08Å; F65-F102 HydrophobicContact CZ-CD1 4.12Å; F65-F102 AromaticContact CZ-CE1 3.36Å; F65-F102 HydrophobicContact CZ-CE1 3.36Å; F65-F102 AromaticContact CZ-CZ 3.81Å; F65-F102 HydrophobicContact CZ-CZ 3.81Å
103	V	78.1	Confident	67.7	Low	35 Å²	35	109.1 Å²	109.1	21%	0.212	50%	0.502	C	S	.	.			trans	-96.6	91.5	168.1	-174.4	0	0	0	0	106.2	Y64 W78 F101 R105	Y64-V103 PolarHBondContact O-N 3.19Å; W78-V103 HydrophobicContact CE3-CG2 4.19Å; W78-V103 HydrophobicContact CH2-CG2 3.65Å; W78-V103 HydrophobicContact CZ3-CG2 3.45Å; W78-V103 VanDerWaalsContact CZ3-CG2 3.45Å; F101-V103 PolarHBondContact O-N 3.26Å; V103-R105 HydrophobicContact CG1-CB 4Å; V103-R105 HydrophobicContact CG1-CG 4.14Å; V103-R105 PolarHBondContact O-N 2.87Å
104	L	64.3	Low	68.1	Low	154 Å²	154	110.1 Å²	110.1	81%	0.806	50%	0.499	S	S	*	.			trans	-65.5	84.8	168.9	-69.1	172.3	0	0	0	108.8
105	R	57	Low	68.4	Low	223 Å²	223	108.2 Å²	108.2	84%	0.842	49%	0.489	S	S	*	.			trans	-119.1	2.5	173.4	-107	-168.8	166.3	133.7	-0.4	115	V103	V103-R105 HydrophobicContact CG1-CB 4Å; V103-R105 HydrophobicContact CG1-CG 4.14Å; V103-R105 PolarHBondContact O-N 2.87Å
106	K	49.7	Very low	68.1	Low	130 Å²	130	110.3 Å²	110.3	57%	0.565	50%	0.499	S	S	*	.			trans	-118.5	53.1	-179.9	-143	170.7	-172.4	173.8	0	113.1	D63 Y64	D63-K106 IonicContact OD2-NZ 2.84Å; D63-K106 PolarHBondContact OD2-NZ 2.82Å; Y64-K106 HydrophobicContact CE1-CB 4.18Å
107	Q	39.9	Very low	67.3	Low	178 Å²	178	117.4 Å²	117.4	83%	0.832	53%	0.532	S	S	*	.			trans	-129.2	73.1	164.2	-81.6	-80.2	-3.1	0	0	107.1
108	R	41	Very low	66	Low	241 Å²	241	122.1 Å²	122.1	91%	0.909	55%	0.549	S	S	*	.			trans	-179.6	77.7	164.2	-102.1	175.1	-159.8	160.3	5.7	109.6
109	N	40.5	Very low	64.6	Low	242 Å²	242	133.1 Å²	133.1	100%	1.294	60%	0.598	S	S	*	*				-168.5	0	129.1	-119.5	-5.8	0	0	0	108.3

Retrieved 109 of 109 residues in 70 ms (Link to these results)

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