G4VJK3_SCHMA Loading...

Putative cysteine-rich hydrophobic domain 2 (Chic1)

AlphaFold DB , UniProt , Accession G4VJK3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 161 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.5	Very low	61.9	Low	245 Å²	245	121.3 Å²	121.3	100%	1.207	62%	0.621	S	S	*	*				0	102.6	0	-77	163.4	170.5	0	0	104.2
2	N	53.8	Low	61.6	Low	104 Å²	104	122 Å²	122	56%	0.556	61%	0.612	S	S	*	*			trans	-97.5	128.7	-158.4	-159.7	33.7	0	0	0	108.4	T4 D5	N2-T4 PolarHBondContact ND2-OG1 3.16Å; N2-T4 PolarHBondContact O-N 2.94Å; N2-D5 PolarHBondContact O-N 3.38Å
3	D	66.3	Low	61.4	Low	120 Å²	120	119.3 Å²	119.3	64%	0.642	61%	0.605	S	S	*	*	H	α-helix	trans	-54	-21.3	-178.3	-66.5	-57.5	0	0	0	113.1	D5 E6 I7	D3-D5 VanDerWaalsContact C-N 3.34Å; D3-D5 PolarHBondContact O-N 3.47Å; D3-E6 PolarHBondContact O-N 2.93Å; D3-I7 WeakPolarHBondContact O-CG1 3.34Å; D3-I7 PolarHBondContact O-N 3.24Å; D3-I7 VanDerWaalsContact O-N 3.16Å
4	T	67.5	Low	61	Low	76 Å²	76	116.1 Å²	116.1	47%	0.466	60%	0.599	S	S	.	*	H	α-helix	trans	-60.4	-38.8	174.1	-43.3	0	0	0	0	113	N2 E6 I7 D8	N2-T4 PolarHBondContact ND2-OG1 3.16Å; N2-T4 PolarHBondContact O-N 2.94Å; T4-E6 VanDerWaalsContact C-N 3.34Å; T4-E6 PolarHBondContact O-N 3.49Å; T4-I7 PolarHBondContact O-N 2.94Å; T4-D8 PolarHBondContact O-N 2.85Å
5	D	63.2	Low	60.4	Low	109 Å²	109	114 Å²	114	58%	0.583	60%	0.599	S	S	*	*	H	α-helix	trans	-70.3	-33.1	-179	-63.2	-50.8	0	0	0	111.5	N2 D3 F9	N2-D5 PolarHBondContact O-N 3.38Å; D3-D5 VanDerWaalsContact C-N 3.34Å; D3-D5 PolarHBondContact O-N 3.47Å; D5-F9 WeakPolarHBondContact O-CB 3.36Å; D5-F9 PolarHBondContact O-N 3.47Å
6	E	67.7	Low	59.4	Low	131 Å²	131	110.4 Å²	110.4	61%	0.612	60%	0.597	S	S	*	*	H	α-helix	trans	-75.1	-36.3	178.9	-158.3	173.1	-162.3	0	0	111.5	D3 T4 F9 L10	D3-E6 PolarHBondContact O-N 2.93Å; T4-E6 VanDerWaalsContact C-N 3.34Å; T4-E6 PolarHBondContact O-N 3.49Å; E6-F9 PolarHBondContact O-N 2.86Å; E6-L10 HydrophobicContact CG-CD1 4.45Å; E6-L10 WeakPolarHBondContact O-CB 3.43Å; E6-L10 PolarHBondContact O-N 3.4Å
7	I	63.7	Low	58.7	Low	100 Å²	100	110.4 Å²	110.4	51%	0.513	59%	0.593	S	S	.	*	H	α-helix	trans	-65.5	-42.7	172.7	-65.7	167.2	0	0	0	110.7	D3 T4 L10 N11	D3-I7 WeakPolarHBondContact O-CG1 3.34Å; D3-I7 PolarHBondContact O-N 3.24Å; D3-I7 VanDerWaalsContact O-N 3.16Å; T4-I7 PolarHBondContact O-N 2.94Å; I7-L10 PolarHBondContact O-N 3.03Å; I7-N11 VanDerWaalsContact O-CB 3.3Å; I7-N11 WeakPolarHBondContact O-CB 3.3Å; I7-N11 VanDerWaalsContact O-CG 3.3Å; I7-N11 PolarHBondContact O-N 3.45Å; I7-N11 PolarHBondContact O-ND2 3.22Å
8	D	64.1	Low	58.1	Low	98 Å²	98	110.5 Å²	110.5	52%	0.524	60%	0.602	S	S	.	*	H	α-helix	trans	-67.4	-37.1	176.1	-83.3	-13.3	0	0	0	111.7	T4 N11 Y12	T4-D8 PolarHBondContact O-N 2.85Å; D8-N11 PolarHBondContact O-N 3.3Å; D8-Y12 WeakPolarHBondContact O-CB 3.16Å; D8-Y12 PolarHBondContact O-N 2.81Å
9	F	64.3	Low	57.8	Low	139 Å²	139	109.3 Å²	109.3	61%	0.61	59%	0.592	S	S	*	*	H	α-helix	trans	-68.9	-39.7	175.2	-158.6	-98.1	0	0	0	112.4	D5 E6 Y12 V13	D5-F9 WeakPolarHBondContact O-CB 3.36Å; D5-F9 PolarHBondContact O-N 3.47Å; E6-F9 PolarHBondContact O-N 2.86Å; F9-Y12 PolarHBondContact O-N 3.48Å; F9-V13 HydrophobicContact CD1-CG2 3.85Å; F9-V13 HydrophobicContact CE1-CG2 3.65Å; F9-V13 HydrophobicContact CZ-CG2 4.25Å; F9-V13 WeakPolarHBondContact O-CB 3.34Å; F9-V13 VanDerWaalsContact O-CG2 3.28Å; F9-V13 WeakPolarHBondContact O-CG2 3.28Å; F9-V13 PolarHBondContact O-N 2.8Å
10	L	65.8	Low	57.7	Low	113 Å²	113	113.6 Å²	113.6	59%	0.592	60%	0.599	S	S	*	*	H	α-helix	trans	-66.7	-40.7	173.7	-96.8	149.7	0	0	0	112	E6 I7 Y12 S14	E6-L10 HydrophobicContact CG-CD1 4.45Å; E6-L10 WeakPolarHBondContact O-CB 3.43Å; E6-L10 PolarHBondContact O-N 3.4Å; I7-L10 PolarHBondContact O-N 3.03Å; L10-Y12 VanDerWaalsContact C-N 3.31Å; L10-S14 WeakPolarHBondContact O-CB 3.26Å; L10-S14 PolarHBondContact O-N 2.74Å
11	N	59.1	Low	57.8	Low	99 Å²	99	114.3 Å²	114.3	53%	0.529	61%	0.61	S	S	.	*	H	α-helix	trans	-65.7	-36.3	172.9	-76.9	-31.9	0	0	0	111.4	I7 D8 S14 S15	I7-N11 VanDerWaalsContact O-CB 3.3Å; I7-N11 WeakPolarHBondContact O-CB 3.3Å; I7-N11 VanDerWaalsContact O-CG 3.3Å; I7-N11 PolarHBondContact O-N 3.45Å; I7-N11 PolarHBondContact O-ND2 3.22Å; D8-N11 PolarHBondContact O-N 3.3Å; N11-S14 CarbonylContact O-C 3.57Å; N11-S15 VanDerWaalsContact O-CB 3.26Å; N11-S15 WeakPolarHBondContact O-CB 3.07Å; N11-S15 PolarHBondContact O-N 3.26Å; N11-S15 PolarHBondContact O-OG 3.05Å
12	Y	58.4	Low	59.1	Low	130 Å²	130	108 Å²	108	51%	0.51	57%	0.573	S	S	.	*	H	α-helix	trans	-69.1	-48.9	176.6	-175	-100.2	0	0	0	112.1	D8 F9 L10 S14 S15 G16	D8-Y12 WeakPolarHBondContact O-CB 3.16Å; D8-Y12 PolarHBondContact O-N 2.81Å; F9-Y12 PolarHBondContact O-N 3.48Å; L10-Y12 VanDerWaalsContact C-N 3.31Å; Y12-S14 VanDerWaalsContact C-N 3.28Å; Y12-S14 PolarHBondContact O-N 2.79Å; Y12-S15 WeakPolarHBondContact CA-OG 3.48Å; Y12-S15 CarbonylContact O-C 3.6Å; Y12-S15 WeakPolarHBondContact O-CA 3.38Å; Y12-S15 PolarHBondContact O-N 2.75Å; Y12-S15 PolarHBondContact O-OG 2.82Å; Y12-G16 PolarHBondContact O-N 3.41Å
13	V	59.1	Low	60.6	Low	87 Å²	87	111.4 Å²	111.4	53%	0.527	59%	0.586	S	S	.	*	H	α-helix	trans	-64	-35.1	174.6	174.8	0	0	0	0	110.9	F9 S15 G16	F9-V13 HydrophobicContact CD1-CG2 3.85Å; F9-V13 HydrophobicContact CE1-CG2 3.65Å; F9-V13 HydrophobicContact CZ-CG2 4.25Å; F9-V13 WeakPolarHBondContact O-CB 3.34Å; F9-V13 VanDerWaalsContact O-CG2 3.28Å; F9-V13 WeakPolarHBondContact O-CG2 3.28Å; F9-V13 PolarHBondContact O-N 2.8Å; V13-S15 VanDerWaalsContact C-N 3.33Å; V13-G16 PolarHBondContact O-N 2.78Å
14	S	55.8	Low	61.7	Low	74 Å²	74	107.5 Å²	107.5	52%	0.517	57%	0.567	S	S	.	*	H	α-helix	trans	-71.6	-26.3	172.7	-171.7	0	0	0	0	112.9	L10 N11 Y12 Q17	L10-S14 WeakPolarHBondContact O-CB 3.26Å; L10-S14 PolarHBondContact O-N 2.74Å; N11-S14 CarbonylContact O-C 3.57Å; Y12-S14 VanDerWaalsContact C-N 3.28Å; Y12-S14 PolarHBondContact O-N 2.79Å; S14-Q17 WeakPolarHBondContact O-CG 3.04Å
15	S	51.7	Low	62.8	Low	85 Å²	85	104.5 Å²	104.5	59%	0.594	55%	0.548	S	S	*	.	H	α-helix	trans	-83.5	-21.2	172	73	0	0	0	0	112.7	N11 Y12 V13 Q17	N11-S15 VanDerWaalsContact O-CB 3.26Å; N11-S15 WeakPolarHBondContact O-CB 3.07Å; N11-S15 PolarHBondContact O-N 3.26Å; N11-S15 PolarHBondContact O-OG 3.05Å; Y12-S15 WeakPolarHBondContact CA-OG 3.48Å; Y12-S15 CarbonylContact O-C 3.6Å; Y12-S15 WeakPolarHBondContact O-CA 3.38Å; Y12-S15 PolarHBondContact O-N 2.75Å; Y12-S15 PolarHBondContact O-OG 2.82Å; V13-S15 VanDerWaalsContact C-N 3.33Å; S15-Q17 PolarHBondContact O-N 2.8Å
16	G	44.7	Very low	64.2	Low	56 Å²	56	102.3 Å²	102.3	58%	0.577	54%	0.536	S	S	*	.			trans	-70.6	27.8	165.6	0	0	0	0	0	113.2	Y12 V13 C18	Y12-G16 PolarHBondContact O-N 3.41Å; V13-G16 PolarHBondContact O-N 2.78Å; G16-C18 PolarHBondContact O-N 3.32Å
17	Q	48.1	Very low	65.4	Low	110 Å²	110	96.6 Å²	96.6	51%	0.514	51%	0.509	S	S	.	.			trans	-56.9	95.9	161.5	-65.5	-112.9	-17.8	0	0	106.5	S14 S15 E19	S14-Q17 WeakPolarHBondContact O-CG 3.04Å; S15-Q17 PolarHBondContact O-N 2.8Å; Q17-E19 VanDerWaalsContact C-N 3.26Å; Q17-E19 WeakPolarHBondContact O-CA 3.37Å; Q17-E19 PolarHBondContact O-N 2.93Å
18	C	46.4	Very low	66.6	Low	113 Å²	113	95.8 Å²	95.8	76%	0.764	50%	0.502	S	S	*	.			trans	-36.7	102.6	150.5	-172.2	0	0	0	0	105.7	G16 R20	G16-C18 PolarHBondContact O-N 3.32Å; C18-R20 PolarHBondContact O-N 2.73Å
19	E	53.3	Low	67.7	Low	88 Å²	88	91.9 Å²	91.9	41%	0.411	49%	0.485	S	S	.	.			trans	-50.6	111.8	-160	-163.5	172.7	-177.1	0	0	107.7	Q17 P21 R22	Q17-E19 VanDerWaalsContact C-N 3.26Å; Q17-E19 WeakPolarHBondContact O-CA 3.37Å; Q17-E19 PolarHBondContact O-N 2.93Å; E19-P21 VanDerWaalsContact O-N 3.09Å; E19-R22 IonicContact OE1-CZ 3.43Å; E19-R22 IonicContact OE1-NE 3.67Å; E19-R22 IonicContact OE1-NH2 2.73Å; E19-R22 PolarHBondContact OE1-NH2 3.02Å
20	R	55.1	Low	68.9	Low	195 Å²	195	88.3 Å²	88.3	74%	0.736	48%	0.476	S	S	*	.			trans	-48	125.5	-176.3	-77.6	-170	-76	157.6	-2.7	107.2	C18 R22	C18-R20 PolarHBondContact O-N 2.73Å; R20-R22 PolarHBondContact O-N 2.91Å
21	P	59.7	Low	69.7	Low	128 Å²	128	83.8 Å²	83.8	83%	0.831	46%	0.457	S	S	*	.			trans	-50.5	114.9	-176.1	-25.7	31.5	0	0	0	108.2	E19	E19-P21 VanDerWaalsContact O-N 3.09Å
22	R	74	Confident	70.7	Confident	113 Å²	113	86.8 Å²	86.8	43%	0.426	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-59.3	146.8	-179.7	-58.2	-148.8	-170.6	123.7	-8.8	108.2	E19 R20 Q151	E19-R22 IonicContact OE1-CZ 3.43Å; E19-R22 IonicContact OE1-NE 3.67Å; E19-R22 IonicContact OE1-NH2 2.73Å; E19-R22 PolarHBondContact OE1-NH2 3.02Å; R20-R22 PolarHBondContact O-N 2.91Å; R22-Q151 HydrophobicContact CB-CG 4.39Å
23	E	84.5	Confident	71.8	Confident	175 Å²	175	83.7 Å²	83.7	82%	0.818	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-54.8	128.2	-177.8	-168.2	170.9	-171.4	0	0	109.9
24	P	88.9	Confident	72.8	Confident	38 Å²	38	83.4 Å²	83.4	25%	0.247	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-72.3	143.3	-176.5	30.3	-36.2	0	0	0	110.7	R148 I149	P24-R148 HydrophobicContact CB-CG 3.83Å; P24-R148 VanDerWaalsContact CB-NE 3.28Å; P24-I149 WeakPolarHBondContact CA-O 3.48Å
25	I	91.6	Very high	74	Confident	13 Å²	13	81.1 Å²	81.1	7%	0.067	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	130.4	178.5	-56.9	158.8	0	0	0	108.1	P47 E49 L50 R148 I149	I25-P47 HydrophobicContact CG2-CB 3.78Å; I25-P47 HydrophobicContact CG2-CG 4.07Å; I25-E49 HydrophobicContact CD1-CB 3.51Å; I25-E49 HydrophobicContact CG1-CB 3.78Å; I25-E49 HydrophobicContact CG1-CG 4.37Å; I25-L50 HydrophobicContact CD1-CD2 3.38Å; I25-L50 HydrophobicContact CD1-CG 3.73Å; I25-R148 CarbonylContact O-C 3.47Å; I25-R148 WeakPolarHBondContact O-CA 3.46Å; I25-I149 HydrophobicContact CB-CB 4.24Å; I25-I149 PolarHBondContact N-O 3.21Å; I25-I149 PolarHBondContact O-N 2.94Å
26	L	92.2	Very high	75.3	Confident	64 Å²	64	82.4 Å²	82.4	34%	0.335	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	120.2	-173.1	-58.9	174.6	0	0	0	110.7	V146 L147 R148	L26-V146 HydrophobicContact CD2-CG2 4.29Å; L26-L147 WeakPolarHBondContact CA-O 3.15Å; L26-R148 HydrophobicContact CD2-CB 3.76Å; L26-R148 HydrophobicContact CD2-CG 3.72Å
27	I	92.2	Very high	77.2	Confident	10 Å²	10	80.3 Å²	80.3	5%	0.051	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	110.3	178.3	-55.4	154.8	0	0	0	107.5	F42 K43 F59 I63 L147 I149	I27-F42 HydrophobicContact CG2-CB 4.45Å; I27-K43 HydrophobicContact CG2-CB 4.12Å; I27-K43 WeakPolarHBondContact CG2-O 3.3Å; I27-F59 HydrophobicContact CD1-CE2 3.52Å; I27-F59 HydrophobicContact CD1-CZ 3.63Å; I27-F59 HydrophobicContact CG1-CZ 4.37Å; I27-I63 HydrophobicContact CD1-CD1 4.26Å; I27-L147 HydrophobicContact CB-CB 4.14Å; I27-L147 HydrophobicContact CD1-CB 4.35Å; I27-L147 PolarHBondContact N-O 3.44Å; I27-L147 PolarHBondContact O-N 2.9Å; I27-I149 HydrophobicContact CD1-CD1 3.82Å; I27-I149 HydrophobicContact CD1-CG1 4.43Å
28	K	90.2	Very high	79.1	Confident	84 Å²	84	75.5 Å²	75.5	37%	0.365	40%	0.399	S	S	.	.			trans	-75.9	158	-179.2	-64	-166.1	176.5	-165.2	0	111.8	K43 S136 V146	K28-K43 PolarHBondContact O-N 3.14Å; K28-K43 VanDerWaalsContact O-N 3.17Å; K28-S136 PolarHBondContact NZ-O 3.1Å; K28-S136 VanDerWaalsContact NZ-O 3.16Å; K28-V146 HydrophobicContact CG-CG1 4.4Å
29	G	87.6	Confident	81	Confident	15 Å²	15	70.5 Å²	70.5	16%	0.155	37%	0.365	C	S	.	.	B	Isolated β-bridge	trans	-69.8	151.6	165.9	0	0	0	0	0	111.6	N39 K41	G29-N39 WeakPolarHBondContact CA-ND2 3.47Å; G29-K41 CarbonylContact C-O 3.53Å; G29-K41 VanDerWaalsContact CA-O 3.24Å; G29-K41 WeakPolarHBondContact CA-O 3.43Å
30	C	88.2	Confident	82.5	Confident	64 Å²	64	67.5 Å²	67.5	43%	0.432	35%	0.351	S	S	.	.			trans	-137.7	17.4	176.1	67.5	0	0	0	0	112.8	K41 K43	C30-K41 PolarHBondContact N-O 3.31Å; C30-K43 HydrophobicContact CB-CG 3.72Å
31	G	81.9	Confident	84.2	Confident	19 Å²	19	61.3 Å²	61.3	20%	0.196	33%	0.33	C	S	.	.			trans	-87.6	161.6	-179.1	0	0	0	0	0	113.4	V33 N40 K41	G31-V33 VanDerWaalsContact C-N 3.27Å; G31-V33 PolarHBondContact O-N 3.44Å; G31-N40 VanDerWaalsContact C-OD1 3.32Å; G31-N40 WeakPolarHBondContact CA-OD1 3.44Å; G31-K41 PolarHBondContact N-O 3.06Å
32	D	81.3	Confident	85.8	Confident	162 Å²	162	55.2 Å²	55.2	87%	0.866	29%	0.29	S	S	*	.	S	Bend	trans	-74.6	-16.2	-177	-55.6	-50.8	0	0	0	113.7	N40	D32-N40 PolarHBondContact N-OD1 3.16Å
33	V	81	Confident	86.7	Confident	64 Å²	64	54.1 Å²	54.1	39%	0.388	29%	0.289	S	S	.	.			trans	-125.4	123	-172.8	-176.7	0	0	0	0	110.7	G31 I35 N40	G31-V33 VanDerWaalsContact C-N 3.27Å; G31-V33 PolarHBondContact O-N 3.44Å; V33-I35 HydrophobicContact CG1-CD1 4.08Å; V33-I35 HydrophobicContact CG1-CG1 4.06Å; V33-N40 HydrophobicContact CB-CB 4.48Å; V33-N40 PolarHBondContact N-OD1 2.93Å; V33-N40 PolarHBondContact O-N 3.31Å; V33-N40 VanDerWaalsContact O-N 3.08Å; V33-N40 PolarHBondContact O-OD1 2.84Å; V33-N40 VanDerWaalsContact O-OD1 3.09Å
34	T	81	Confident	87	Confident	81 Å²	81	49.5 Å²	49.5	50%	0.497	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	119.1	174.4	-44.6	0	0	0	0	110.6	M38 N39	T34-M38 CarbonylContact C-O 3.57Å; T34-M38 WeakPolarHBondContact CA-O 3.21Å; T34-N39 WeakPolarHBondContact CB-OD1 3.32Å; T34-N39 WeakPolarHBondContact CG2-OD1 3.26Å; T34-N39 PolarHBondContact OG1-OD1 2.81Å
35	I	80.6	Confident	87.1	Confident	27 Å²	27	54.7 Å²	54.7	14%	0.138	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	114.9	178	-64.5	162.5	0	0	0	109.7	V33 G37 M38 H77 F81 V99	V33-I35 HydrophobicContact CG1-CD1 4.08Å; V33-I35 HydrophobicContact CG1-CG1 4.06Å; I35-G37 PolarHBondContact O-N 3.25Å; I35-M38 PolarHBondContact N-O 3.26Å; I35-M38 VanDerWaalsContact O-CB 3.27Å; I35-M38 WeakPolarHBondContact O-CB 3.4Å; I35-M38 PolarHBondContact O-N 3.16Å; I35-H77 HydrophobicContact CD1-CB 4.26Å; I35-H77 WeakPolarHBondContact CD1-ND1 3.45Å; I35-F81 HydrophobicContact CD1-CE2 3.97Å; I35-F81 HydrophobicContact CD1-CZ 4.4Å; I35-V99 HydrophobicContact CG2-CG1 4.43Å
36	F	79.6	Confident	87.2	Confident	111 Å²	111	56.1 Å²	56.1	49%	0.487	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	40	-174.1	-68.9	-71.6	0	0	0	113.4	M38 V99 I100	F36-M38 VanDerWaalsContact C-N 3.26Å; F36-M38 PolarHBondContact O-N 3.17Å; F36-V99 HydrophobicContact CD2-CG1 4.17Å; F36-V99 HydrophobicContact CE2-CB 3.76Å; F36-V99 HydrophobicContact CE2-CG1 3.4Å; F36-V99 HydrophobicContact CZ-CB 4.31Å; F36-V99 HydrophobicContact CZ-CG1 4.22Å; F36-I100 HydrophobicContact CE1-CG1 4.47Å; F36-I100 HydrophobicContact CE2-CG1 4.23Å; F36-I100 HydrophobicContact CZ-CG1 3.84Å
37	G	84.7	Confident	87.1	Confident	12 Å²	12	53.9 Å²	53.9	12%	0.124	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	-5.5	-176.3	0	0	0	0	0	114.9	I35 N39 M143 E144 Y145	I35-G37 PolarHBondContact O-N 3.25Å; G37-N39 PolarHBondContact O-N 2.98Å; G37-M143 VanDerWaalsContact CA-O 3.22Å; G37-M143 WeakPolarHBondContact CA-O 3.4Å; G37-E144 CarbonylContact O-C 3.47Å; G37-E144 VanDerWaalsContact O-CA 3.24Å; G37-E144 WeakPolarHBondContact O-CA 3.3Å; G37-Y145 PolarHBondContact O-N 3.39Å
38	M	86.1	Confident	87	Confident	9 Å²	9	60 Å²	60	4%	0.044	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	114.3	176.1	-164.8	72	70.2	0	0	109.4	T34 I35 F36 L70 T106 K107 L110 L131 Y145	T34-M38 CarbonylContact C-O 3.57Å; T34-M38 WeakPolarHBondContact CA-O 3.21Å; I35-M38 PolarHBondContact N-O 3.26Å; I35-M38 VanDerWaalsContact O-CB 3.27Å; I35-M38 WeakPolarHBondContact O-CB 3.4Å; I35-M38 PolarHBondContact O-N 3.16Å; F36-M38 VanDerWaalsContact C-N 3.26Å; F36-M38 PolarHBondContact O-N 3.17Å; M38-L70 HydrophobicContact CG-CD2 4.27Å; M38-T106 HydrophobicContact CG-CG2 4.26Å; M38-K107 HydrophobicContact CE-CB 3.95Å; M38-K107 HydrophobicContact CE-CG 4.39Å; M38-L110 HydrophobicContact CE-CD1 3.96Å; M38-L110 HydrophobicContact CG-CD1 4.48Å; M38-L110 HydrophobicContact SD-CD1 3.48Å; M38-L110 WeakPolarHBondContact SD-CD1 3.4Å; M38-L131 HydrophobicContact CE-CD2 3.97Å; M38-L131 HydrophobicContact SD-CD2 4.26Å; M38-Y145 HydrophobicContact CB-CD2 4.01Å; M38-Y145 HydrophobicContact CB-CE2 4.49Å; M38-Y145 HydrophobicContact CE-CD1 4.13Å; M38-Y145 HydrophobicContact CE-CD2 3.46Å; M38-Y145 VanDerWaalsContact CE-CD2 3.46Å; M38-Y145 HydrophobicContact CE-CE1 4.24Å; M38-Y145 HydrophobicContact CE-CE2 3.6Å; M38-Y145 HydrophobicContact CE-CG 3.71Å; M38-Y145 HydrophobicContact SD-CD2 3.75Å; M38-Y145 HydrophobicContact SD-CE2 4.48Å; M38-Y145 HydrophobicContact SD-CG 3.8Å
39	N	86.6	Confident	87	Confident	8 Å²	8	61.8 Å²	61.8	4%	0.043	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	148.4	171.9	-68.9	-49.7	0	0	0	110.3	G29 T34 G37 K41 E144	G29-N39 WeakPolarHBondContact CA-ND2 3.47Å; T34-N39 WeakPolarHBondContact CB-OD1 3.32Å; T34-N39 WeakPolarHBondContact CG2-OD1 3.26Å; T34-N39 PolarHBondContact OG1-OD1 2.81Å; G37-N39 PolarHBondContact O-N 2.98Å; N39-K41 VanDerWaalsContact C-N 3.3Å; N39-E144 PolarHBondContact ND2-OE2 3.23Å; N39-E144 VanDerWaalsContact ND2-OE2 3.11Å
40	N	85.7	Confident	87	Confident	25 Å²	25	61.1 Å²	61.1	13%	0.134	32%	0.319	C	S	.	.	S	Bend	trans	-81.6	-7.5	176.8	66.1	-37.3	0	0	0	113.9	G31 D32 V33 L70 L74	G31-N40 VanDerWaalsContact C-OD1 3.32Å; G31-N40 WeakPolarHBondContact CA-OD1 3.44Å; D32-N40 PolarHBondContact N-OD1 3.16Å; V33-N40 HydrophobicContact CB-CB 4.48Å; V33-N40 PolarHBondContact N-OD1 2.93Å; V33-N40 PolarHBondContact O-N 3.31Å; V33-N40 VanDerWaalsContact O-N 3.08Å; V33-N40 PolarHBondContact O-OD1 2.84Å; V33-N40 VanDerWaalsContact O-OD1 3.09Å; N40-L70 VanDerWaalsContact O-CB 3.23Å; N40-L70 WeakPolarHBondContact O-CB 3.33Å; N40-L74 HydrophobicContact CB-CD1 4.28Å; N40-L74 HydrophobicContact CB-CD2 3.86Å; N40-L74 HydrophobicContact CB-CG 4.43Å
41	K	91.3	Very high	87	Confident	65 Å²	65	65.1 Å²	65.1	28%	0.283	33%	0.331	S	S	.	.			trans	-150.5	137.8	177.2	-172.2	167.8	179.2	157.7	0	111.2	G29 C30 G31 N39 E44	G29-K41 CarbonylContact C-O 3.53Å; G29-K41 VanDerWaalsContact CA-O 3.24Å; G29-K41 WeakPolarHBondContact CA-O 3.43Å; C30-K41 PolarHBondContact N-O 3.31Å; G31-K41 PolarHBondContact N-O 3.06Å; N39-K41 VanDerWaalsContact C-N 3.3Å; K41-E44 WeakPolarHBondContact CE-OE1 3.48Å; K41-E44 IonicContact NZ-OE1 3.15Å; K41-E44 PolarHBondContact NZ-OE1 3.02Å
42	F	92.9	Very high	87.4	Confident	0 Å²	0	68 Å²	68	0%	0	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-99.4	153.3	169.3	-66	-71.6	0	0	0	111.3	I27 E44 I63 I66 N67 L70 L131 Y145 L147	I27-F42 HydrophobicContact CG2-CB 4.45Å; F42-E44 PolarHBondContact O-N 2.83Å; F42-I63 HydrophobicContact CB-CG2 4.44Å; F42-I66 HydrophobicContact CD2-CG2 3.7Å; F42-I66 HydrophobicContact CE2-CG2 3.83Å; F42-N67 PolarHBondContact N-OD1 2.83Å; F42-N67 PolarHBondContact O-ND2 3.45Å; F42-L70 HydrophobicContact CD2-CD1 3.65Å; F42-L70 HydrophobicContact CE2-CD1 3.52Å; F42-L70 HydrophobicContact CZ-CD1 4.47Å; F42-L131 HydrophobicContact CZ-CD1 3.88Å; F42-Y145 WeakPolarHBondContact CE1-O 3.3Å; F42-L147 HydrophobicContact CB-CD1 4.14Å; F42-L147 HydrophobicContact CD1-CD1 4.19Å; F42-L147 HydrophobicContact CD1-CG 3.97Å; F42-L147 HydrophobicContact CD2-CD1 3.77Å; F42-L147 HydrophobicContact CD2-CD2 4.49Å; F42-L147 HydrophobicContact CD2-CG 4.04Å; F42-L147 HydrophobicContact CE1-CG 3.95Å; F42-L147 HydrophobicContact CE2-CD1 4.17Å; F42-L147 HydrophobicContact CE2-CD2 4.05Å; F42-L147 HydrophobicContact CE2-CG 3.97Å; F42-L147 HydrophobicContact CG-CD1 3.77Å; F42-L147 HydrophobicContact CG-CG 4.02Å; F42-L147 HydrophobicContact CZ-CD2 4.11Å; F42-L147 HydrophobicContact CZ-CG 3.95Å
43	K	92.3	Very high	87.8	Confident	90 Å²	90	64.4 Å²	64.4	39%	0.391	34%	0.337	S	S	.	.			trans	-60.7	133.7	174.8	-69.5	-176.7	176	-165.4	0	110.9	I27 K28 C30	I27-K43 HydrophobicContact CG2-CB 4.12Å; I27-K43 WeakPolarHBondContact CG2-O 3.3Å; K28-K43 PolarHBondContact O-N 3.14Å; K28-K43 VanDerWaalsContact O-N 3.17Å; C30-K43 HydrophobicContact CB-CG 3.72Å
44	E	90.3	Very high	88.3	Confident	79 Å²	79	61.7 Å²	61.7	37%	0.369	32%	0.32	S	S	.	.			trans	-94.3	-3.5	177.1	-69.6	163.8	-148.9	0	0	112.3	K41 F42 F46 I63 N67	K41-E44 WeakPolarHBondContact CE-OE1 3.48Å; K41-E44 IonicContact NZ-OE1 3.15Å; K41-E44 PolarHBondContact NZ-OE1 3.02Å; F42-E44 PolarHBondContact O-N 2.83Å; E44-F46 PolarHBondContact O-N 3.19Å; E44-I63 HydrophobicContact CG-CG2 3.81Å; E44-N67 PolarHBondContact OE1-ND2 3.35Å; E44-N67 VanDerWaalsContact OE1-ND2 3.09Å
45	E	92.4	Very high	88.9	Confident	147 Å²	147	59 Å²	59	69%	0.687	31%	0.307	S	S	*	.	P	Polyproline II helix	trans	-63.2	126.9	176.8	-175.5	177.1	-161.7	0	0	111.1	P47 F59	E45-P47 WeakPolarHBondContact O-CD 3.47Å; E45-F59 WeakPolarHBondContact O-CE1 3.45Å
46	F	92.8	Very high	89.5	Confident	42 Å²	42	60.9 Å²	60.9	18%	0.184	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-70	120.8	179.5	-177.1	-100.6	0	0	0	110.8	E44 L50 H51 L54 P56 F59	E44-F46 PolarHBondContact O-N 3.19Å; F46-L50 HydrophobicContact CE1-CB 4.33Å; F46-L50 HydrophobicContact CE2-CB 4.06Å; F46-L50 HydrophobicContact CZ-CB 3.68Å; F46-H51 HydrophobicContact CE1-CB 4.31Å; F46-L54 VanDerWaalsContact CZ-O 3.3Å; F46-L54 WeakPolarHBondContact CZ-O 3.37Å; F46-P56 HydrophobicContact CD1-CG 4.35Å; F46-P56 HydrophobicContact CD2-CB 4Å; F46-P56 HydrophobicContact CD2-CG 4.29Å; F46-P56 HydrophobicContact CE1-CG 4.3Å; F46-P56 HydrophobicContact CE2-CB 4.31Å; F46-P56 HydrophobicContact CE2-CG 4.23Å; F46-P56 HydrophobicContact CG-CB 4.18Å; F46-P56 HydrophobicContact CG-CG 4.34Å; F46-P56 HydrophobicContact CZ-CG 4.23Å; F46-F59 HydrophobicContact CB-CD1 4.38Å; F46-F59 HydrophobicContact CD2-CB 3.77Å; F46-F59 AromaticContact CD2-CD1 3.76Å; F46-F59 HydrophobicContact CD2-CD1 3.76Å; F46-F59 AromaticContact CD2-CG 3.8Å; F46-F59 HydrophobicContact CD2-CG 3.8Å; F46-F59 HydrophobicContact CE2-CB 3.94Å; F46-F59 HydrophobicContact CE2-CG 4.27Å
47	P	91.2	Very high	90.2	Very high	18 Å²	18	61.4 Å²	61.4	12%	0.117	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-71.8	131.3	-179.8	28.4	-34.6	0	0	0	111.5	I25 E45 E49 L50 F59	I25-P47 HydrophobicContact CG2-CB 3.78Å; I25-P47 HydrophobicContact CG2-CG 4.07Å; E45-P47 WeakPolarHBondContact O-CD 3.47Å; P47-E49 WeakPolarHBondContact CB-OE2 3.45Å; P47-E49 PolarHBondContact O-N 3.33Å; P47-E49 VanDerWaalsContact O-N 3.14Å; P47-L50 HydrophobicContact CG-CB 4.2Å; P47-L50 HydrophobicContact CG-CD1 3.4Å; P47-L50 VanDerWaalsContact CG-CD1 3.4Å; P47-L50 HydrophobicContact CG-CG 3.7Å; P47-L50 PolarHBondContact O-N 3.38Å; P47-F59 HydrophobicContact CG-CE2 4.37Å; P47-F59 HydrophobicContact CG-CZ 4.34Å
48	N	90.1	Very high	90.7	Very high	138 Å²	138	64 Å²	64	74%	0.738	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-60.2	-27.2	-177.7	-67.5	-50.6	0	0	0	112.9	L50 H51	N48-L50 PolarHBondContact O-N 3.1Å; N48-H51 WeakPolarHBondContact O-CB 3.18Å; N48-H51 PolarHBondContact O-N 2.87Å; N48-H51 VanDerWaalsContact O-N 3.1Å
49	E	88.5	Confident	91.1	Very high	121 Å²	121	63.6 Å²	63.6	57%	0.565	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-69.2	-17.5	179.3	-55.6	93.5	145.8	0	0	113.3	I25 P47	I25-E49 HydrophobicContact CD1-CB 3.51Å; I25-E49 HydrophobicContact CG1-CB 3.78Å; I25-E49 HydrophobicContact CG1-CG 4.37Å; P47-E49 WeakPolarHBondContact CB-OE2 3.45Å; P47-E49 PolarHBondContact O-N 3.33Å; P47-E49 VanDerWaalsContact O-N 3.14Å
50	L	88.9	Confident	91.5	Very high	1 Å²	1	68.3 Å²	68.3	1%	0.005	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-91.2	-6	173	-65.4	-177.9	0	0	0	113.3	I25 F46 P47 N48 G52 K53 L54 F59 L127 I149	I25-L50 HydrophobicContact CD1-CD2 3.38Å; I25-L50 HydrophobicContact CD1-CG 3.73Å; F46-L50 HydrophobicContact CE1-CB 4.33Å; F46-L50 HydrophobicContact CE2-CB 4.06Å; F46-L50 HydrophobicContact CZ-CB 3.68Å; P47-L50 HydrophobicContact CG-CB 4.2Å; P47-L50 HydrophobicContact CG-CD1 3.4Å; P47-L50 VanDerWaalsContact CG-CD1 3.4Å; P47-L50 HydrophobicContact CG-CG 3.7Å; P47-L50 PolarHBondContact O-N 3.38Å; N48-L50 PolarHBondContact O-N 3.1Å; L50-G52 PolarHBondContact O-N 3.13Å; L50-K53 PolarHBondContact O-N 2.9Å; L50-L54 HydrophobicContact CB-CB 4.42Å; L50-L54 HydrophobicContact CD1-CD2 4.02Å; L50-L54 PolarHBondContact O-N 3.23Å; L50-L54 VanDerWaalsContact O-N 3.17Å; L50-F59 HydrophobicContact CD1-CD2 4.1Å; L50-F59 HydrophobicContact CD1-CE2 4.3Å; L50-L127 HydrophobicContact CD2-CD1 3.81Å; L50-I149 HydrophobicContact CD1-CD1 3.59Å; L50-I149 HydrophobicContact CD2-CG2 4.22Å
51	H	88.3	Confident	91.9	Very high	149 Å²	149	70.4 Å²	70.4	69%	0.69	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	126.7	-178.3	-168.7	-88.8	0	0	0	111	F46 N48 K53	F46-H51 HydrophobicContact CE1-CB 4.31Å; N48-H51 WeakPolarHBondContact O-CB 3.18Å; N48-H51 PolarHBondContact O-N 2.87Å; N48-H51 VanDerWaalsContact O-N 3.1Å; H51-K53 VanDerWaalsContact C-N 3.3Å; H51-K53 PolarHBondContact O-N 3.34Å
52	G	89	Confident	92.1	Very high	79 Å²	79	67.3 Å²	67.3	81%	0.814	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.8	-2.2	-176.2	0	0	0	0	0	115.8	L50	L50-G52 PolarHBondContact O-N 3.13Å
53	K	89.3	Confident	92.2	Very high	86 Å²	86	67.3 Å²	67.3	37%	0.374	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-39.4	174	-65.7	-178.3	-178.4	171.5	0	113.2	L50 H51	L50-K53 PolarHBondContact O-N 2.9Å; H51-K53 VanDerWaalsContact C-N 3.3Å; H51-K53 PolarHBondContact O-N 3.34Å
54	L	92.8	Very high	92.3	Very high	7 Å²	7	69 Å²	69	4%	0.037	35%	0.352	C	S	.	.	S	Bend	trans	-130	139.3	-179.2	178.4	63.3	0	0	0	108.8	F46 L50 E58 F59 L121 Y122 I125	F46-L54 VanDerWaalsContact CZ-O 3.3Å; F46-L54 WeakPolarHBondContact CZ-O 3.37Å; L50-L54 HydrophobicContact CB-CB 4.42Å; L50-L54 HydrophobicContact CD1-CD2 4.02Å; L50-L54 PolarHBondContact O-N 3.23Å; L50-L54 VanDerWaalsContact O-N 3.17Å; L54-E58 HydrophobicContact CD1-CB 3.92Å; L54-E58 WeakPolarHBondContact CD1-OE2 3.43Å; L54-F59 HydrophobicContact CD2-CB 3.81Å; L54-F59 HydrophobicContact CD2-CD2 4.03Å; L54-F59 HydrophobicContact CD2-CG 4.41Å; L54-F59 HydrophobicContact CG-CB 4.34Å; L54-L121 HydrophobicContact CD1-CD1 3.85Å; L54-L121 HydrophobicContact CD1-CD2 3.79Å; L54-L121 HydrophobicContact CD1-CG 3.97Å; L54-Y122 HydrophobicContact CD2-CE1 3.94Å; L54-I125 HydrophobicContact CB-CD1 4.03Å; L54-I125 HydrophobicContact CD1-CD1 3.7Å; L54-I125 HydrophobicContact CG-CD1 4.36Å
55	A	93.1	Very high	92.4	Very high	26 Å²	26	67.9 Å²	67.9	22%	0.215	35%	0.346	C	S	.	.			trans	-75.6	137.7	178.3	0	0	0	0	0	110.5	E57 E58 F59	A55-E57 HydrophobicContact CB-CG 4.39Å; A55-E57 VanDerWaalsContact CB-OE1 3.26Å; A55-E57 WeakPolarHBondContact CB-OE1 3.48Å; A55-E57 VanDerWaalsContact CB-OE2 3.32Å; A55-E57 WeakPolarHBondContact CB-OE2 3.44Å; A55-E57 PolarHBondContact O-N 2.66Å; A55-E58 HydrophobicContact CB-CB 4.46Å; A55-E58 HydrophobicContact CB-CG 4.07Å; A55-E58 WeakPolarHBondContact CB-OE2 3.5Å; A55-E58 PolarHBondContact O-N 2.7Å; A55-E58 VanDerWaalsContact O-N 3.13Å; A55-F59 PolarHBondContact O-N 2.83Å; A55-F59 VanDerWaalsContact O-N 3.1Å
56	P	94	Very high	92.5	Very high	65 Å²	65	60.9 Å²	60.9	42%	0.422	31%	0.314	S	S	.	.	H	α-helix	trans	-55.8	-36.1	-178.7	-26.4	35	0	0	0	113.9	F46 F59 E60	F46-P56 HydrophobicContact CD1-CG 4.35Å; F46-P56 HydrophobicContact CD2-CB 4Å; F46-P56 HydrophobicContact CD2-CG 4.29Å; F46-P56 HydrophobicContact CE1-CG 4.3Å; F46-P56 HydrophobicContact CE2-CB 4.31Å; F46-P56 HydrophobicContact CE2-CG 4.23Å; F46-P56 HydrophobicContact CG-CB 4.18Å; F46-P56 HydrophobicContact CG-CG 4.34Å; F46-P56 HydrophobicContact CZ-CG 4.23Å; P56-F59 WeakPolarHBondContact O-CB 3.41Å; P56-F59 PolarHBondContact O-N 3.17Å; P56-E60 WeakPolarHBondContact O-CB 3.22Å; P56-E60 PolarHBondContact O-N 3.43Å
57	E	94.4	Very high	92.6	Very high	123 Å²	123	59.1 Å²	59.1	58%	0.575	31%	0.306	S	S	*	.	H	α-helix	trans	-67	-37.9	178.3	67.4	-81.4	-164.3	0	0	112.8	A55 E61	A55-E57 HydrophobicContact CB-CG 4.39Å; A55-E57 VanDerWaalsContact CB-OE1 3.26Å; A55-E57 WeakPolarHBondContact CB-OE1 3.48Å; A55-E57 VanDerWaalsContact CB-OE2 3.32Å; A55-E57 WeakPolarHBondContact CB-OE2 3.44Å; A55-E57 PolarHBondContact O-N 2.66Å; E57-E61 WeakPolarHBondContact O-CB 3.39Å; E57-E61 PolarHBondContact O-N 3.48Å
58	E	93.6	Very high	92.6	Very high	65 Å²	65	62.5 Å²	62.5	30%	0.304	32%	0.32	S	S	.	.	H	α-helix	trans	-71.4	-36.5	177.8	-65.9	-178.9	123.8	0	0	111	L54 A55 S62 L121	L54-E58 HydrophobicContact CD1-CB 3.92Å; L54-E58 WeakPolarHBondContact CD1-OE2 3.43Å; A55-E58 HydrophobicContact CB-CB 4.46Å; A55-E58 HydrophobicContact CB-CG 4.07Å; A55-E58 WeakPolarHBondContact CB-OE2 3.5Å; A55-E58 PolarHBondContact O-N 2.7Å; A55-E58 VanDerWaalsContact O-N 3.13Å; E58-S62 WeakPolarHBondContact O-CB 3.49Å; E58-S62 PolarHBondContact O-N 3.26Å; E58-S62 VanDerWaalsContact O-N 3.09Å; E58-S62 PolarHBondContact O-OG 3.11Å; E58-L121 HydrophobicContact CB-CD1 4.41Å; E58-L121 HydrophobicContact CB-CD2 3.86Å; E58-L121 WeakPolarHBondContact OE1-CD1 3.28Å
59	F	94.8	Very high	92.6	Very high	1 Å²	1	61 Å²	61	0%	0.004	30%	0.304	C	S	.	.	H	α-helix	trans	-63.6	-52.7	172.2	177.2	-99.5	0	0	0	111	I27 E45 F46 P47 L50 L54 A55 P56 E61 S62 I63 I149	I27-F59 HydrophobicContact CD1-CE2 3.52Å; I27-F59 HydrophobicContact CD1-CZ 3.63Å; I27-F59 HydrophobicContact CG1-CZ 4.37Å; E45-F59 WeakPolarHBondContact O-CE1 3.45Å; F46-F59 HydrophobicContact CB-CD1 4.38Å; F46-F59 HydrophobicContact CD2-CB 3.77Å; F46-F59 AromaticContact CD2-CD1 3.76Å; F46-F59 HydrophobicContact CD2-CD1 3.76Å; F46-F59 AromaticContact CD2-CG 3.8Å; F46-F59 HydrophobicContact CD2-CG 3.8Å; F46-F59 HydrophobicContact CE2-CB 3.94Å; F46-F59 HydrophobicContact CE2-CG 4.27Å; P47-F59 HydrophobicContact CG-CE2 4.37Å; P47-F59 HydrophobicContact CG-CZ 4.34Å; L50-F59 HydrophobicContact CD1-CD2 4.1Å; L50-F59 HydrophobicContact CD1-CE2 4.3Å; L54-F59 HydrophobicContact CD2-CB 3.81Å; L54-F59 HydrophobicContact CD2-CD2 4.03Å; L54-F59 HydrophobicContact CD2-CG 4.41Å; L54-F59 HydrophobicContact CG-CB 4.34Å; A55-F59 PolarHBondContact O-N 2.83Å; A55-F59 VanDerWaalsContact O-N 3.1Å; P56-F59 WeakPolarHBondContact O-CB 3.41Å; P56-F59 PolarHBondContact O-N 3.17Å; F59-E61 VanDerWaalsContact C-N 3.33Å; F59-E61 PolarHBondContact O-N 2.82Å; F59-S62 WeakPolarHBondContact O-CB 3.42Å; F59-S62 PolarHBondContact O-N 3.28Å; F59-S62 VanDerWaalsContact O-N 3.11Å; F59-I63 HydrophobicContact CD1-CG1 4.22Å; F59-I63 HydrophobicContact CD2-CG1 4.25Å; F59-I63 HydrophobicContact CE1-CG1 3.78Å; F59-I63 HydrophobicContact CE2-CD1 3.97Å; F59-I63 HydrophobicContact CE2-CG1 3.8Å; F59-I63 HydrophobicContact CG-CG1 4.45Å; F59-I63 HydrophobicContact CZ-CD1 4Å; F59-I63 HydrophobicContact CZ-CG1 3.56Å; F59-I63 WeakPolarHBondContact O-CG1 3.46Å; F59-I63 PolarHBondContact O-N 3.4Å; F59-I149 HydrophobicContact CE2-CD1 4.28Å
60	E	95.1	Very high	92.6	Very high	108 Å²	108	55.3 Å²	55.3	51%	0.505	28%	0.278	S	S	.	.	H	α-helix	trans	-57.6	-45.6	179.3	-172.9	-175.3	161.5	0	0	111.1	P56 S62 I63 R64	P56-E60 WeakPolarHBondContact O-CB 3.22Å; P56-E60 PolarHBondContact O-N 3.43Å; E60-S62 VanDerWaalsContact C-N 3.32Å; E60-S62 PolarHBondContact O-N 3.05Å; E60-I63 PolarHBondContact O-N 2.85Å; E60-R64 WeakPolarHBondContact O-CB 3.42Å; E60-R64 PolarHBondContact O-N 3.36Å
61	E	94.4	Very high	92.5	Very high	69 Å²	69	59.6 Å²	59.6	32%	0.322	30%	0.298	S	S	.	.	H	α-helix	trans	-59.7	-42.7	176.7	-164.9	-160.2	165	0	0	111.8	E57 F59 R64 K65 R120	E57-E61 WeakPolarHBondContact O-CB 3.39Å; E57-E61 PolarHBondContact O-N 3.48Å; F59-E61 VanDerWaalsContact C-N 3.33Å; F59-E61 PolarHBondContact O-N 2.82Å; E61-R64 PolarHBondContact O-N 3.18Å; E61-K65 WeakPolarHBondContact O-CG 3.22Å; E61-K65 PolarHBondContact O-N 3.15Å; E61-K65 WeakPolarHBondContact OE1-CE 3.19Å; E61-K65 IonicContact OE1-NZ 3.84Å; E61-K65 PolarHBondContact OE1-NZ 2.88Å; E61-R120 IonicContact OE2-NH1 3.98Å; E61-R120 IonicContact OE2-NH2 2.68Å
62	S	94.7	Very high	92.4	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-64.4	-47.9	179.1	-58.3	0	0	0	0	111.6	E58 F59 E60 K65 I66 E117 R120	E58-S62 WeakPolarHBondContact O-CB 3.49Å; E58-S62 PolarHBondContact O-N 3.26Å; E58-S62 VanDerWaalsContact O-N 3.09Å; E58-S62 PolarHBondContact O-OG 3.11Å; F59-S62 WeakPolarHBondContact O-CB 3.42Å; F59-S62 PolarHBondContact O-N 3.28Å; F59-S62 VanDerWaalsContact O-N 3.11Å; E60-S62 VanDerWaalsContact C-N 3.32Å; E60-S62 PolarHBondContact O-N 3.05Å; S62-K65 PolarHBondContact O-N 2.78Å; S62-I66 WeakPolarHBondContact O-CG1 3.49Å; S62-I66 PolarHBondContact O-N 2.82Å; S62-E117 PolarHBondContact OG-OE2 3.14Å; S62-R120 PolarHBondContact OG-NH2 2.97Å
63	I	95.4	Very high	92	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-66.6	-39.3	178.6	-60.5	-55.3	0	0	0	110.8	I27 F42 E44 F59 E60 K65 I66 N67 L147	I27-I63 HydrophobicContact CD1-CD1 4.26Å; F42-I63 HydrophobicContact CB-CG2 4.44Å; E44-I63 HydrophobicContact CG-CG2 3.81Å; F59-I63 HydrophobicContact CD1-CG1 4.22Å; F59-I63 HydrophobicContact CD2-CG1 4.25Å; F59-I63 HydrophobicContact CE1-CG1 3.78Å; F59-I63 HydrophobicContact CE2-CD1 3.97Å; F59-I63 HydrophobicContact CE2-CG1 3.8Å; F59-I63 HydrophobicContact CG-CG1 4.45Å; F59-I63 HydrophobicContact CZ-CD1 4Å; F59-I63 HydrophobicContact CZ-CG1 3.56Å; F59-I63 WeakPolarHBondContact O-CG1 3.46Å; F59-I63 PolarHBondContact O-N 3.4Å; E60-I63 PolarHBondContact O-N 2.85Å; I63-K65 PolarHBondContact O-N 2.81Å; I63-I66 HydrophobicContact CD1-CD1 4.4Å; I63-I66 WeakPolarHBondContact O-CB 3.42Å; I63-I66 PolarHBondContact O-N 2.77Å; I63-I66 VanDerWaalsContact O-N 3.17Å; I63-N67 WeakPolarHBondContact O-CB 3.45Å; I63-N67 PolarHBondContact O-N 3.27Å; I63-L147 HydrophobicContact CD1-CD1 3.61Å
64	R	94.4	Very high	91.5	Very high	124 Å²	124	52.8 Å²	52.8	47%	0.468	25%	0.253	S	S	.	.	H	α-helix	trans	-58.8	-47.6	175.8	-169.6	-176.5	74.1	-162.4	-5.8	111.4	E60 E61 I66 N67 E68	E60-R64 WeakPolarHBondContact O-CB 3.42Å; E60-R64 PolarHBondContact O-N 3.36Å; E61-R64 PolarHBondContact O-N 3.18Å; R64-I66 VanDerWaalsContact C-N 3.27Å; R64-I66 PolarHBondContact O-N 3.35Å; R64-N67 PolarHBondContact O-N 3.17Å; R64-E68 HydrophobicContact CG-CG 4.35Å; R64-E68 IonicContact NE-OE1 2.79Å; R64-E68 PolarHBondContact NE-OE1 3.29Å; R64-E68 WeakPolarHBondContact O-CB 3.39Å; R64-E68 WeakPolarHBondContact O-CG 3.42Å; R64-E68 PolarHBondContact O-N 3.13Å
65	K	94	Very high	90.9	Very high	57 Å²	57	56.7 Å²	56.7	25%	0.248	28%	0.278	C	S	.	.	H	α-helix	trans	-58.6	-39	176	-74.1	171.6	-174.7	165.3	0	112.6	E61 S62 I63 R69 E117	E61-K65 WeakPolarHBondContact O-CG 3.22Å; E61-K65 PolarHBondContact O-N 3.15Å; E61-K65 WeakPolarHBondContact OE1-CE 3.19Å; E61-K65 IonicContact OE1-NZ 3.84Å; E61-K65 PolarHBondContact OE1-NZ 2.88Å; S62-K65 PolarHBondContact O-N 2.78Å; I63-K65 PolarHBondContact O-N 2.81Å; K65-R69 PolarHBondContact O-N 2.92Å; K65-E117 WeakPolarHBondContact CD-OE1 3.29Å; K65-E117 IonicContact NZ-OE1 2.96Å; K65-E117 PolarHBondContact NZ-OE1 2.67Å
66	I	94.5	Very high	90.1	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-66.9	-47.6	176.9	-67.2	164.6	0	0	0	110.5	F42 S62 I63 R64 R69 L70 L110 I113 L114 L129 L147	F42-I66 HydrophobicContact CD2-CG2 3.7Å; F42-I66 HydrophobicContact CE2-CG2 3.83Å; S62-I66 WeakPolarHBondContact O-CG1 3.49Å; S62-I66 PolarHBondContact O-N 2.82Å; I63-I66 HydrophobicContact CD1-CD1 4.4Å; I63-I66 WeakPolarHBondContact O-CB 3.42Å; I63-I66 PolarHBondContact O-N 2.77Å; I63-I66 VanDerWaalsContact O-N 3.17Å; R64-I66 VanDerWaalsContact C-N 3.27Å; R64-I66 PolarHBondContact O-N 3.35Å; I66-R69 PolarHBondContact O-N 3.11Å; I66-L70 HydrophobicContact CG2-CD1 4.37Å; I66-L70 PolarHBondContact O-N 3.41Å; I66-L110 HydrophobicContact CG2-CD2 3.83Å; I66-I113 HydrophobicContact CG1-CG2 3.86Å; I66-L114 HydrophobicContact CD1-CD2 3.63Å; I66-L114 HydrophobicContact CG1-CD2 4.38Å; I66-L129 HydrophobicContact CD1-CD2 3.95Å; I66-L147 HydrophobicContact CD1-CD1 4.04Å
67	N	93.5	Very high	89.3	Confident	4 Å²	4	55.6 Å²	55.6	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-63.8	-44.9	179.4	-76.6	-13.4	0	0	0	111.6	F42 E44 I63 R64 R69 L70 E71	F42-N67 PolarHBondContact N-OD1 2.83Å; F42-N67 PolarHBondContact O-ND2 3.45Å; E44-N67 PolarHBondContact OE1-ND2 3.35Å; E44-N67 VanDerWaalsContact OE1-ND2 3.09Å; I63-N67 WeakPolarHBondContact O-CB 3.45Å; I63-N67 PolarHBondContact O-N 3.27Å; R64-N67 PolarHBondContact O-N 3.17Å; N67-R69 PolarHBondContact O-N 3.4Å; N67-L70 WeakPolarHBondContact O-CB 3.33Å; N67-L70 PolarHBondContact O-N 2.69Å; N67-E71 WeakPolarHBondContact O-CG 3.29Å; N67-E71 PolarHBondContact O-N 3.05Å
68	E	92.3	Very high	88.4	Confident	89 Å²	89	53.8 Å²	53.8	42%	0.416	27%	0.267	S	S	.	.	H	α-helix	trans	-55.2	-39.8	173.4	-76.7	173.8	-170.4	0	0	111.2	R64 N72	R64-E68 HydrophobicContact CG-CG 4.35Å; R64-E68 IonicContact NE-OE1 2.79Å; R64-E68 PolarHBondContact NE-OE1 3.29Å; R64-E68 WeakPolarHBondContact O-CB 3.39Å; R64-E68 WeakPolarHBondContact O-CG 3.42Å; R64-E68 PolarHBondContact O-N 3.13Å; E68-N72 VanDerWaalsContact O-CB 3.23Å; E68-N72 WeakPolarHBondContact O-CB 3.41Å; E68-N72 PolarHBondContact O-N 2.92Å; E68-N72 PolarHBondContact O-ND2 3.48Å
69	R	89.1	Confident	87.9	Confident	106 Å²	106	60.1 Å²	60.1	40%	0.4	29%	0.288	S	S	.	.	H	α-helix	trans	-69.8	-39.1	177.1	-168	69.5	-176.2	150.1	3.4	112.7	K65 I66 N67 S73 D109 I113	K65-R69 PolarHBondContact O-N 2.92Å; I66-R69 PolarHBondContact O-N 3.11Å; N67-R69 PolarHBondContact O-N 3.4Å; R69-S73 PolarHBondContact O-N 2.82Å; R69-S73 VanDerWaalsContact O-N 3.17Å; R69-D109 IonicContact CZ-OD2 3.7Å; R69-D109 IonicContact NE-OD2 3.73Å; R69-D109 IonicContact NH2-OD2 2.85Å; R69-D109 PolarHBondContact NH2-OD2 3.23Å; R69-I113 HydrophobicContact CB-CD1 3.36Å; R69-I113 HydrophobicContact CG-CD1 3.38Å
70	L	88.3	Confident	87	Confident	3 Å²	3	65 Å²	65	2%	0.016	31%	0.307	C	S	.	.	H	α-helix	trans	-62.8	-49.3	175.9	-79.2	169.9	0	0	0	111.4	M38 N40 F42 I66 N67 N72 S73 L74 T106 L110	M38-L70 HydrophobicContact CG-CD2 4.27Å; N40-L70 VanDerWaalsContact O-CB 3.23Å; N40-L70 WeakPolarHBondContact O-CB 3.33Å; F42-L70 HydrophobicContact CD2-CD1 3.65Å; F42-L70 HydrophobicContact CE2-CD1 3.52Å; F42-L70 HydrophobicContact CZ-CD1 4.47Å; I66-L70 HydrophobicContact CG2-CD1 4.37Å; I66-L70 PolarHBondContact O-N 3.41Å; N67-L70 WeakPolarHBondContact O-CB 3.33Å; N67-L70 PolarHBondContact O-N 2.69Å; L70-N72 PolarHBondContact O-N 3.09Å; L70-S73 WeakPolarHBondContact O-CA 3.29Å; L70-S73 WeakPolarHBondContact O-CB 3.45Å; L70-S73 PolarHBondContact O-N 3.13Å; L70-S73 PolarHBondContact O-OG 2.75Å; L70-L74 PolarHBondContact O-N 2.89Å; L70-T106 HydrophobicContact CD2-CG2 3.88Å; L70-L110 HydrophobicContact CD2-CD1 3.89Å; L70-L110 HydrophobicContact CD2-CD2 4.13Å; L70-L110 HydrophobicContact CD2-CG 4.33Å; L70-L110 HydrophobicContact CG-CD2 4.01Å
71	E	87.3	Confident	86.2	Confident	90 Å²	90	64.3 Å²	64.3	42%	0.421	30%	0.302	S	S	.	.	H	α-helix	trans	-61.2	-44.9	179.1	-71	177.4	-176.6	0	0	111.3	N67 S73 L74 P75	N67-E71 WeakPolarHBondContact O-CG 3.29Å; N67-E71 PolarHBondContact O-N 3.05Å; E71-S73 PolarHBondContact O-N 2.78Å; E71-S73 VanDerWaalsContact O-N 3.14Å; E71-L74 VanDerWaalsContact O-CB 3.29Å; E71-L74 WeakPolarHBondContact O-CB 3.28Å; E71-L74 WeakPolarHBondContact O-CG 3.41Å; E71-L74 PolarHBondContact O-N 2.98Å; E71-P75 WeakPolarHBondContact O-CD 3.24Å
72	N	85.4	Confident	85.5	Confident	108 Å²	108	66.1 Å²	66.1	58%	0.578	31%	0.313	S	S	*	.	H	α-helix	trans	-63.8	-18.3	174.7	-77.1	-47.9	0	0	0	113.7	E68 L70 P75	E68-N72 VanDerWaalsContact O-CB 3.23Å; E68-N72 WeakPolarHBondContact O-CB 3.41Å; E68-N72 PolarHBondContact O-N 2.92Å; E68-N72 PolarHBondContact O-ND2 3.48Å; L70-N72 PolarHBondContact O-N 3.09Å; N72-P75 WeakPolarHBondContact O-CD 3.47Å
73	S	81.3	Confident	84.6	Confident	16 Å²	16	69.2 Å²	69.2	11%	0.112	33%	0.333	C	S	.	.	H	α-helix	trans	-81.5	-19	174.6	82	0	0	0	0	113.1	R69 L70 E71 S76 H77	R69-S73 PolarHBondContact O-N 2.82Å; R69-S73 VanDerWaalsContact O-N 3.17Å; L70-S73 WeakPolarHBondContact O-CA 3.29Å; L70-S73 WeakPolarHBondContact O-CB 3.45Å; L70-S73 PolarHBondContact O-N 3.13Å; L70-S73 PolarHBondContact O-OG 2.75Å; E71-S73 PolarHBondContact O-N 2.78Å; E71-S73 VanDerWaalsContact O-N 3.14Å; S73-S76 VanDerWaalsContact O-CB 3.3Å; S73-S76 WeakPolarHBondContact O-CB 3.47Å; S73-S76 PolarHBondContact O-N 3.25Å; S73-S76 VanDerWaalsContact O-N 3.14Å; S73-H77 PolarHBondContact O-CD2 3.02Å; S73-H77 PolarHBondContact O-N 3.13Å
74	L	79.5	Confident	83.4	Confident	48 Å²	48	70 Å²	70	25%	0.251	34%	0.341	S	S	.	.	H	α-helix	trans	-60.7	-44.5	-178.3	-64.5	173.6	0	0	0	114.1	N40 L70 E71 S76 H77 V78	N40-L74 HydrophobicContact CB-CD1 4.28Å; N40-L74 HydrophobicContact CB-CD2 3.86Å; N40-L74 HydrophobicContact CB-CG 4.43Å; L70-L74 PolarHBondContact O-N 2.89Å; E71-L74 VanDerWaalsContact O-CB 3.29Å; E71-L74 WeakPolarHBondContact O-CB 3.28Å; E71-L74 WeakPolarHBondContact O-CG 3.41Å; E71-L74 PolarHBondContact O-N 2.98Å; L74-S76 PolarHBondContact O-N 2.79Å; L74-H77 CarbonylContact O-C 3.58Å; L74-H77 WeakPolarHBondContact O-CA 3.5Å; L74-H77 VanDerWaalsContact O-CB 3.3Å; L74-H77 WeakPolarHBondContact O-CB 3.24Å; L74-H77 PolarHBondContact O-N 3.45Å; L74-V78 WeakPolarHBondContact O-CG2 3.24Å; L74-V78 PolarHBondContact O-N 3.36Å
75	P	79	Confident	82.3	Confident	88 Å²	88	70.2 Å²	70.2	57%	0.571	35%	0.351	S	S	*	.	H	α-helix	trans	-61.7	-34.6	175.8	-23	34	0	0	0	112.4	E71 N72 H77 V78 R79	E71-P75 WeakPolarHBondContact O-CD 3.24Å; N72-P75 WeakPolarHBondContact O-CD 3.47Å; P75-H77 VanDerWaalsContact C-N 3.31Å; P75-V78 PolarHBondContact O-N 3.11Å; P75-R79 WeakPolarHBondContact O-CB 3.16Å; P75-R79 PolarHBondContact O-N 2.67Å
76	S	77.3	Confident	81.3	Confident	57 Å²	57	73.8 Å²	73.8	40%	0.399	37%	0.373	S	S	.	.	H	α-helix	trans	-64.3	-40.7	172.6	-64.1	0	0	0	0	110.3	S73 L74 R79 W80	S73-S76 VanDerWaalsContact O-CB 3.3Å; S73-S76 WeakPolarHBondContact O-CB 3.47Å; S73-S76 PolarHBondContact O-N 3.25Å; S73-S76 VanDerWaalsContact O-N 3.14Å; L74-S76 PolarHBondContact O-N 2.79Å; S76-R79 PolarHBondContact O-N 2.92Å; S76-W80 PolarHBondContact O-N 2.93Å
77	H	76.4	Confident	80	Confident	11 Å²	11	76.5 Å²	76.5	5%	0.051	39%	0.391	C	S	.	.	H	α-helix	trans	-58.4	-53.6	174.2	-65.2	-163.7	0	0	0	112.2	I35 S73 L74 P75 R79 W80 F81 L102 T106	I35-H77 HydrophobicContact CD1-CB 4.26Å; I35-H77 WeakPolarHBondContact CD1-ND1 3.45Å; S73-H77 PolarHBondContact O-CD2 3.02Å; S73-H77 PolarHBondContact O-N 3.13Å; L74-H77 CarbonylContact O-C 3.58Å; L74-H77 WeakPolarHBondContact O-CA 3.5Å; L74-H77 VanDerWaalsContact O-CB 3.3Å; L74-H77 WeakPolarHBondContact O-CB 3.24Å; L74-H77 PolarHBondContact O-N 3.45Å; P75-H77 VanDerWaalsContact C-N 3.31Å; H77-R79 VanDerWaalsContact C-N 3.34Å; H77-R79 PolarHBondContact O-N 2.83Å; H77-W80 PolarHBondContact O-N 3.41Å; H77-F81 HydrophobicContact CB-CD2 4.39Å; H77-F81 HydrophobicContact CB-CE2 4.28Å; H77-F81 WeakPolarHBondContact O-CD2 3.45Å; H77-F81 PolarHBondContact O-N 3.45Å; H77-L102 HydrophobicContact CB-CD2 3.92Å; H77-L102 WeakPolarHBondContact CD2-CD2 3.27Å; H77-L102 WeakPolarHBondContact CD2-CG 3.48Å; H77-T106 PolarHBondContact NE2-OG1 3.05Å
78	V	77	Confident	78.3	Confident	85 Å²	85	79.9 Å²	79.9	52%	0.515	41%	0.414	S	S	.	.	H	α-helix	trans	-58.2	-45.1	178.3	176.5	0	0	0	0	111.4	L74 P75 W80 F81 I82	L74-V78 WeakPolarHBondContact O-CG2 3.24Å; L74-V78 PolarHBondContact O-N 3.36Å; P75-V78 PolarHBondContact O-N 3.11Å; V78-W80 VanDerWaalsContact C-N 3.35Å; V78-W80 PolarHBondContact O-N 3.4Å; V78-F81 PolarHBondContact O-N 3.06Å; V78-I82 HydrophobicContact CG1-CD1 3.74Å; V78-I82 HydrophobicContact CG1-CG1 4.37Å; V78-I82 VanDerWaalsContact O-CG1 3.3Å; V78-I82 WeakPolarHBondContact O-CG1 3.49Å; V78-I82 PolarHBondContact O-N 3.47Å
79	R	81.7	Confident	76.7	Confident	198 Å²	198	81 Å²	81	75%	0.747	43%	0.43	S	S	*	.	H	α-helix	trans	-60.3	-42.4	178.1	-176.8	176.8	176.7	170.9	0.4	112.5	P75 S76 H77 C83	P75-R79 WeakPolarHBondContact O-CB 3.16Å; P75-R79 PolarHBondContact O-N 2.67Å; S76-R79 PolarHBondContact O-N 2.92Å; H77-R79 VanDerWaalsContact C-N 3.34Å; H77-R79 PolarHBondContact O-N 2.83Å; R79-C83 VanDerWaalsContact O-CB 3.3Å; R79-C83 WeakPolarHBondContact O-CB 3.48Å; R79-C83 PolarHBondContact O-N 3.41Å
80	W	76.9	Confident	75.2	Confident	105 Å²	105	80.7 Å²	80.7	40%	0.398	44%	0.443	S	S	.	.	H	α-helix	trans	-71.5	-34.8	177.5	-82.1	106	0	0	0	112.5	S76 H77 V78 C83 G84 P98 L102	S76-W80 PolarHBondContact O-N 2.93Å; H77-W80 PolarHBondContact O-N 3.41Å; V78-W80 VanDerWaalsContact C-N 3.35Å; V78-W80 PolarHBondContact O-N 3.4Å; W80-C83 PolarHBondContact O-N 3.38Å; W80-G84 PolarHBondContact O-N 2.87Å; W80-P98 HydrophobicContact CE3-CB 3.9Å; W80-P98 HydrophobicContact CZ3-CB 4.31Å; W80-L102 HydrophobicContact CB-CD2 3.77Å; W80-L102 HydrophobicContact CG-CD2 4.11Å
81	F	78.4	Confident	73.9	Confident	92 Å²	92	83.7 Å²	83.7	40%	0.404	46%	0.462	S	S	.	.	H	α-helix	trans	-62.9	-46.3	171.5	-80.4	-62.7	0	0	0	111.8	I35 H77 V78 G84 L85 V99	I35-F81 HydrophobicContact CD1-CE2 3.97Å; I35-F81 HydrophobicContact CD1-CZ 4.4Å; H77-F81 HydrophobicContact CB-CD2 4.39Å; H77-F81 HydrophobicContact CB-CE2 4.28Å; H77-F81 WeakPolarHBondContact O-CD2 3.45Å; H77-F81 PolarHBondContact O-N 3.45Å; V78-F81 PolarHBondContact O-N 3.06Å; F81-G84 PolarHBondContact O-N 2.84Å; F81-L85 WeakPolarHBondContact O-CB 3.34Å; F81-L85 PolarHBondContact O-N 3.47Å; F81-V99 HydrophobicContact CE1-CG1 3.75Å; F81-V99 HydrophobicContact CE1-CG2 4.09Å; F81-V99 HydrophobicContact CZ-CG1 3.78Å
82	I	78.1	Confident	72.4	Confident	107 Å²	107	85 Å²	85	55%	0.549	49%	0.488	S	S	.	.	H	α-helix	trans	-62.6	-44.9	177	-66.3	166.9	0	0	0	110.6	V78 G84 L85 L86	V78-I82 HydrophobicContact CG1-CD1 3.74Å; V78-I82 HydrophobicContact CG1-CG1 4.37Å; V78-I82 VanDerWaalsContact O-CG1 3.3Å; V78-I82 WeakPolarHBondContact O-CG1 3.49Å; V78-I82 PolarHBondContact O-N 3.47Å; I82-G84 VanDerWaalsContact C-N 3.34Å; I82-G84 PolarHBondContact O-N 3.17Å; I82-L85 PolarHBondContact O-N 3.36Å; I82-L86 WeakPolarHBondContact O-CB 3.22Å; I82-L86 PolarHBondContact O-N 3.21Å
83	C	75.9	Confident	70.9	Confident	65 Å²	65	83 Å²	83	44%	0.439	49%	0.493	S	S	.	.	H	α-helix	trans	-60.7	-44.4	175.4	-175.1	0	0	0	0	111.6	R79 W80 L86 C87	R79-C83 VanDerWaalsContact O-CB 3.3Å; R79-C83 WeakPolarHBondContact O-CB 3.48Å; R79-C83 PolarHBondContact O-N 3.41Å; W80-C83 PolarHBondContact O-N 3.38Å; C83-L86 PolarHBondContact O-N 2.85Å; C83-C87 WeakPolarHBondContact O-CB 2.95Å; C83-C87 PolarHBondContact O-N 3.44Å
84	G	71.2	Confident	69.9	Low	16 Å²	16	86.2 Å²	86.2	17%	0.165	52%	0.515	C	S	.	.	H	α-helix	trans	-62	-42.7	176.5	0	0	0	0	0	112.2	W80 F81 I82 C87 C88	W80-G84 PolarHBondContact O-N 2.87Å; F81-G84 PolarHBondContact O-N 2.84Å; I82-G84 VanDerWaalsContact C-N 3.34Å; I82-G84 PolarHBondContact O-N 3.17Å; G84-C87 PolarHBondContact O-N 3.38Å; G84-C88 WeakPolarHBondContact O-CA 3.21Å; G84-C88 WeakPolarHBondContact O-CB 3.37Å; G84-C88 PolarHBondContact O-N 3.3Å
85	L	71.9	Confident	69.2	Low	129 Å²	129	86.4 Å²	86.4	68%	0.675	52%	0.52	S	S	*	.	H	α-helix	trans	-64.7	-46.3	175.9	-177.7	62.7	0	0	0	111.6	F81 I82 C87 C88	F81-L85 WeakPolarHBondContact O-CB 3.34Å; F81-L85 PolarHBondContact O-N 3.47Å; I82-L85 PolarHBondContact O-N 3.36Å; L85-C87 VanDerWaalsContact C-N 3.34Å; L85-C87 PolarHBondContact O-N 2.68Å; L85-C88 PolarHBondContact O-N 3.29Å
86	L	72.8	Confident	68.6	Low	133 Å²	133	87.7 Å²	87.7	70%	0.696	52%	0.522	S	S	*	.	H	α-helix	trans	-64.8	-38.2	178.5	-167.8	68.2	0	0	0	111.9	I82 C83	I82-L86 WeakPolarHBondContact O-CB 3.22Å; I82-L86 PolarHBondContact O-N 3.21Å; C83-L86 PolarHBondContact O-N 2.85Å
87	C	65.7	Low	68.5	Low	56 Å²	56	92.8 Å²	92.8	38%	0.378	53%	0.532	S	S	.	.	H	α-helix	trans	-82.4	-22.9	179.4	-169.9	0	0	0	0	113.4	C83 G84 L85 C89 C90 T91	C83-C87 WeakPolarHBondContact O-CB 2.95Å; C83-C87 PolarHBondContact O-N 3.44Å; G84-C87 PolarHBondContact O-N 3.38Å; L85-C87 VanDerWaalsContact C-N 3.34Å; L85-C87 PolarHBondContact O-N 2.68Å; C87-C89 PolarHBondContact O-N 3.3Å; C87-C90 WeakPolarHBondContact O-CA 3.12Å; C87-C90 PolarHBondContact O-N 3.36Å; C87-T91 PolarHBondContact O-N 2.75Å; C87-T91 VanDerWaalsContact O-N 3.12Å
88	C	58.4	Low	68.3	Low	75 Å²	75	93.5 Å²	93.5	51%	0.507	54%	0.538	S	S	.	.	H	α-helix	trans	-61	-26.9	174.5	-172.7	0	0	0	0	111.6	G84 L85 C90	G84-C88 WeakPolarHBondContact O-CA 3.21Å; G84-C88 WeakPolarHBondContact O-CB 3.37Å; G84-C88 PolarHBondContact O-N 3.3Å; L85-C88 PolarHBondContact O-N 3.29Å; C88-C90 PolarHBondContact O-N 2.79Å
89	C	58.1	Low	68.1	Low	112 Å²	112	90.9 Å²	90.9	76%	0.757	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-10.8	171.4	-59.8	0	0	0	0	113.5	C87	C87-C89 PolarHBondContact O-N 3.3Å
90	C	59.1	Low	67.9	Low	101 Å²	101	84.4 Å²	84.4	68%	0.682	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.4	-27	-166.6	-56.1	0	0	0	0	115.5	C87 C88	C87-C90 WeakPolarHBondContact O-CA 3.12Å; C87-C90 PolarHBondContact O-N 3.36Å; C88-C90 PolarHBondContact O-N 2.79Å
91	T	59.9	Low	68.1	Low	66 Å²	66	82.7 Å²	82.7	41%	0.405	50%	0.498	S	S	.	.	S	Bend	trans	-131.9	110.5	-173.8	59.2	0	0	0	0	112.7	C87 G93	C87-T91 PolarHBondContact O-N 2.75Å; C87-T91 VanDerWaalsContact O-N 3.12Å; T91-G93 PolarHBondContact O-N 2.96Å
92	A	57	Low	68.1	Low	116 Å²	116	78.6 Å²	78.6	96%	0.959	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	89.7	-175.1	0	0	0	0	0	114
93	G	54.1	Low	68.3	Low	68 Å²	68	74 Å²	74	70%	0.701	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.9	1.4	162.1	0	0	0	0	0	117.3	T91 S95	T91-G93 PolarHBondContact O-N 2.96Å; G93-S95 VanDerWaalsContact C-N 3.25Å; G93-S95 PolarHBondContact O-N 3.09Å
94	C	60.2	Low	68.8	Low	83 Å²	83	77.5 Å²	77.5	56%	0.561	46%	0.461	S	S	*	.			trans	-78.3	-3.2	173.8	-69.8	0	0	0	0	114.1	L96 W97 P98	C94-L96 VanDerWaalsContact C-N 3.32Å; C94-L96 PolarHBondContact O-N 3.05Å; C94-W97 PolarHBondContact O-N 2.81Å; C94-W97 VanDerWaalsContact O-N 3.12Å; C94-P98 WeakPolarHBondContact O-CD 3.27Å
95	S	64.6	Low	69.6	Low	52 Å²	52	82.8 Å²	82.8	36%	0.364	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-27.8	-164.9	57.2	0	0	0	0	115.4	G93	G93-S95 VanDerWaalsContact C-N 3.25Å; G93-S95 PolarHBondContact O-N 3.09Å
96	L	66.2	Low	70.3	Confident	115 Å²	115	77 Å²	77	60%	0.602	45%	0.446	S	S	*	.	H	α-helix	trans	-80.5	-25.5	178.6	-63.4	179.6	0	0	0	113.1	C94 V99 I100	C94-L96 VanDerWaalsContact C-N 3.32Å; C94-L96 PolarHBondContact O-N 3.05Å; L96-V99 PolarHBondContact O-N 3.48Å; L96-I100 HydrophobicContact CB-CD1 4.2Å; L96-I100 VanDerWaalsContact O-CG1 3.28Å; L96-I100 WeakPolarHBondContact O-CG1 3.35Å; L96-I100 PolarHBondContact O-N 3.4Å
97	W	74.9	Confident	71.2	Confident	163 Å²	163	73.8 Å²	73.8	62%	0.617	43%	0.427	S	S	*	.	H	α-helix	trans	-60.6	-46	-176.5	178.1	-94.4	0	0	0	113	C94 V99 I100 H101	C94-W97 PolarHBondContact O-N 2.81Å; C94-W97 VanDerWaalsContact O-N 3.12Å; W97-V99 VanDerWaalsContact C-N 3.33Å; W97-V99 PolarHBondContact O-N 3.39Å; W97-I100 PolarHBondContact O-N 3.48Å; W97-H101 VanDerWaalsContact O-CB 3.23Å; W97-H101 WeakPolarHBondContact O-CB 2.95Å; W97-H101 PolarHBondContact O-N 3.49Å
98	P	71.5	Confident	72.4	Confident	27 Å²	27	76.8 Å²	76.8	18%	0.175	43%	0.43	C	S	.	.	H	α-helix	trans	-55.4	-44.7	174	-27.8	35	0	0	0	113.5	W80 C94 H101 L102	W80-P98 HydrophobicContact CE3-CB 3.9Å; W80-P98 HydrophobicContact CZ3-CB 4.31Å; C94-P98 WeakPolarHBondContact O-CD 3.27Å; P98-H101 PolarHBondContact O-N 3.31Å; P98-L102 VanDerWaalsContact O-CB 3.27Å; P98-L102 WeakPolarHBondContact O-CB 3.22Å; P98-L102 PolarHBondContact O-N 3.42Å
99	V	73	Confident	74	Confident	29 Å²	29	74.7 Å²	74.7	18%	0.176	41%	0.414	C	S	.	.	H	α-helix	trans	-69.3	-41.9	-177.5	-157.6	0	0	0	0	110.6	I35 F36 F81 L96 W97 L102 S103	I35-V99 HydrophobicContact CG2-CG1 4.43Å; F36-V99 HydrophobicContact CD2-CG1 4.17Å; F36-V99 HydrophobicContact CE2-CB 3.76Å; F36-V99 HydrophobicContact CE2-CG1 3.4Å; F36-V99 HydrophobicContact CZ-CB 4.31Å; F36-V99 HydrophobicContact CZ-CG1 4.22Å; F81-V99 HydrophobicContact CE1-CG1 3.75Å; F81-V99 HydrophobicContact CE1-CG2 4.09Å; F81-V99 HydrophobicContact CZ-CG1 3.78Å; L96-V99 PolarHBondContact O-N 3.48Å; W97-V99 VanDerWaalsContact C-N 3.33Å; W97-V99 PolarHBondContact O-N 3.39Å; V99-L102 PolarHBondContact O-N 3.5Å; V99-S103 PolarHBondContact O-N 3.24Å
100	I	78.8	Confident	75.7	Confident	62 Å²	62	69.5 Å²	69.5	32%	0.318	38%	0.379	S	S	.	.	H	α-helix	trans	-63.4	-45.5	175.1	-66.4	166.6	0	0	0	110.7	F36 L96 W97 L102 S103 R104	F36-I100 HydrophobicContact CE1-CG1 4.47Å; F36-I100 HydrophobicContact CE2-CG1 4.23Å; F36-I100 HydrophobicContact CZ-CG1 3.84Å; L96-I100 HydrophobicContact CB-CD1 4.2Å; L96-I100 VanDerWaalsContact O-CG1 3.28Å; L96-I100 WeakPolarHBondContact O-CG1 3.35Å; L96-I100 PolarHBondContact O-N 3.4Å; W97-I100 PolarHBondContact O-N 3.48Å; I100-L102 VanDerWaalsContact C-N 3.25Å; I100-L102 PolarHBondContact O-N 2.95Å; I100-S103 PolarHBondContact O-N 3.36Å; I100-R104 WeakPolarHBondContact O-CB 3.43Å; I100-R104 WeakPolarHBondContact O-CG 3.25Å; I100-R104 PolarHBondContact O-N 2.92Å
101	H	80.7	Confident	77.4	Confident	69 Å²	69	69 Å²	69	32%	0.319	37%	0.366	S	S	.	.	H	α-helix	trans	-59.6	-40.3	178.3	-177.6	90.1	0	0	0	111.2	W97 P98 R104 R105	W97-H101 VanDerWaalsContact O-CB 3.23Å; W97-H101 WeakPolarHBondContact O-CB 2.95Å; W97-H101 PolarHBondContact O-N 3.49Å; P98-H101 PolarHBondContact O-N 3.31Å; H101-R104 WeakPolarHBondContact O-CB 3.36Å; H101-R104 PolarHBondContact O-N 2.88Å; H101-R105 PolarHBondContact O-N 3.2Å
102	L	78.2	Confident	79.1	Confident	7 Å²	7	72.9 Å²	72.9	4%	0.037	38%	0.378	C	S	.	.	H	α-helix	trans	-70.1	-43.6	-179.8	-174.3	57.5	0	0	0	112.9	H77 W80 P98 V99 I100 R104 R105 T106	H77-L102 HydrophobicContact CB-CD2 3.92Å; H77-L102 WeakPolarHBondContact CD2-CD2 3.27Å; H77-L102 WeakPolarHBondContact CD2-CG 3.48Å; W80-L102 HydrophobicContact CB-CD2 3.77Å; W80-L102 HydrophobicContact CG-CD2 4.11Å; P98-L102 VanDerWaalsContact O-CB 3.27Å; P98-L102 WeakPolarHBondContact O-CB 3.22Å; P98-L102 PolarHBondContact O-N 3.42Å; V99-L102 PolarHBondContact O-N 3.5Å; I100-L102 VanDerWaalsContact C-N 3.25Å; I100-L102 PolarHBondContact O-N 2.95Å; L102-R104 VanDerWaalsContact C-N 3.27Å; L102-R104 PolarHBondContact O-N 3.1Å; L102-R105 WeakPolarHBondContact O-CA 3.23Å; L102-R105 WeakPolarHBondContact O-CB 3.35Å; L102-R105 PolarHBondContact O-N 2.86Å; L102-T106 PolarHBondContact O-N 3.2Å
103	S	81.3	Confident	80.9	Confident	11 Å²	11	69 Å²	69	8%	0.077	34%	0.341	C	S	.	.	H	α-helix	trans	-58	-42.4	171.5	178	0	0	0	0	111.4	V99 I100 R105 T106 K107	V99-S103 PolarHBondContact O-N 3.24Å; I100-S103 PolarHBondContact O-N 3.36Å; S103-R105 VanDerWaalsContact C-N 3.33Å; S103-R105 PolarHBondContact O-N 3.44Å; S103-T106 PolarHBondContact O-N 2.89Å; S103-K107 WeakPolarHBondContact O-CB 3.43Å; S103-K107 PolarHBondContact O-N 2.89Å
104	R	86.9	Confident	82.9	Confident	137 Å²	137	66.1 Å²	66.1	52%	0.517	31%	0.309	S	S	.	.	H	α-helix	trans	-62.1	-37.8	173.2	-75.3	175.1	163.1	174.3	-5.2	112.5	I100 H101 L102 R108	I100-R104 WeakPolarHBondContact O-CB 3.43Å; I100-R104 WeakPolarHBondContact O-CG 3.25Å; I100-R104 PolarHBondContact O-N 2.92Å; H101-R104 WeakPolarHBondContact O-CB 3.36Å; H101-R104 PolarHBondContact O-N 2.88Å; L102-R104 VanDerWaalsContact C-N 3.27Å; L102-R104 PolarHBondContact O-N 3.1Å; R104-R108 WeakPolarHBondContact O-CG 3.41Å; R104-R108 PolarHBondContact O-N 3.35Å
105	R	87.8	Confident	84.6	Confident	127 Å²	127	67.5 Å²	67.5	48%	0.479	31%	0.307	S	S	.	.	H	α-helix	trans	-65.6	-51.5	176.3	-176.5	175	-177.9	148.5	-0.7	111.5	H101 L102 S103 K107 R108 D109	H101-R105 PolarHBondContact O-N 3.2Å; L102-R105 WeakPolarHBondContact O-CA 3.23Å; L102-R105 WeakPolarHBondContact O-CB 3.35Å; L102-R105 PolarHBondContact O-N 2.86Å; S103-R105 VanDerWaalsContact C-N 3.33Å; S103-R105 PolarHBondContact O-N 3.44Å; R105-K107 VanDerWaalsContact C-N 3.3Å; R105-K107 PolarHBondContact O-N 3.18Å; R105-R108 PolarHBondContact O-N 3.08Å; R105-R108 VanDerWaalsContact O-N 3.13Å; R105-D109 PolarHBondContact O-N 3.05Å
106	T	87.4	Confident	86	Confident	7 Å²	7	67.6 Å²	67.6	4%	0.043	31%	0.311	C	S	.	.	H	α-helix	trans	-58.1	-43.7	176.5	-64	0	0	0	0	111	M38 L70 H77 L102 S103 R108 D109 L110	M38-T106 HydrophobicContact CG-CG2 4.26Å; L70-T106 HydrophobicContact CD2-CG2 3.88Å; H77-T106 PolarHBondContact NE2-OG1 3.05Å; L102-T106 PolarHBondContact O-N 3.2Å; S103-T106 PolarHBondContact O-N 2.89Å; T106-R108 PolarHBondContact O-N 3.03Å; T106-D109 PolarHBondContact O-N 3.2Å; T106-L110 HydrophobicContact CG2-CD1 4.26Å; T106-L110 HydrophobicContact CG2-CG 4.43Å; T106-L110 WeakPolarHBondContact O-CG 3.4Å; T106-L110 PolarHBondContact O-N 3.2Å
107	K	91.1	Very high	87.4	Confident	67 Å²	67	62.6 Å²	62.6	29%	0.291	29%	0.285	S	S	.	.	H	α-helix	trans	-56.3	-47.8	174.7	-175.3	-171.1	176.5	-178	0	112.2	M38 S103 R105 D109 L110 Q111 L131 Y145	M38-K107 HydrophobicContact CE-CB 3.95Å; M38-K107 HydrophobicContact CE-CG 4.39Å; S103-K107 WeakPolarHBondContact O-CB 3.43Å; S103-K107 PolarHBondContact O-N 2.89Å; R105-K107 VanDerWaalsContact C-N 3.3Å; R105-K107 PolarHBondContact O-N 3.18Å; K107-D109 VanDerWaalsContact C-N 3.35Å; K107-L110 PolarHBondContact O-N 3.09Å; K107-Q111 VanDerWaalsContact O-CG 3.27Å; K107-Q111 WeakPolarHBondContact O-CG 3.4Å; K107-Q111 PolarHBondContact O-N 3.21Å; K107-L131 HydrophobicContact CG-CD2 4.25Å; K107-Y145 HydrophobicContact CD-CE1 4.18Å; K107-Y145 HydrophobicContact CG-CE1 4.46Å
108	R	91.8	Very high	88.4	Confident	119 Å²	119	55.3 Å²	55.3	45%	0.449	26%	0.258	S	S	.	.	H	α-helix	trans	-64	-40.5	179.1	-75.2	-176.9	-61.5	-138.4	-0.5	112.1	R104 R105 T106 Q111 K112	R104-R108 WeakPolarHBondContact O-CG 3.41Å; R104-R108 PolarHBondContact O-N 3.35Å; R105-R108 PolarHBondContact O-N 3.08Å; R105-R108 VanDerWaalsContact O-N 3.13Å; T106-R108 PolarHBondContact O-N 3.03Å; R108-Q111 PolarHBondContact O-N 3.32Å; R108-K112 WeakPolarHBondContact O-CG 3.41Å; R108-K112 PolarHBondContact O-N 3.44Å; R108-K112 VanDerWaalsContact O-N 3.08Å
109	D	91.8	Very high	89.5	Confident	31 Å²	31	59.4 Å²	59.4	17%	0.166	28%	0.277	C	S	.	.	H	α-helix	trans	-64.8	-42.4	178	-75.9	8.5	0	0	0	111	R69 R105 T106 K107 K112 I113	R69-D109 IonicContact CZ-OD2 3.7Å; R69-D109 IonicContact NE-OD2 3.73Å; R69-D109 IonicContact NH2-OD2 2.85Å; R69-D109 PolarHBondContact NH2-OD2 3.23Å; R105-D109 PolarHBondContact O-N 3.05Å; T106-D109 PolarHBondContact O-N 3.2Å; K107-D109 VanDerWaalsContact C-N 3.35Å; D109-K112 PolarHBondContact O-N 3.46Å; D109-I113 PolarHBondContact O-N 3.05Å
110	L	93.3	Very high	90.5	Very high	3 Å²	3	62.6 Å²	62.6	2%	0.016	29%	0.286	C	S	.	.	H	α-helix	trans	-60.6	-47.3	172.4	-73.3	177.2	0	0	0	112.1	M38 I66 L70 T106 K107 K112 I113 L114 L131	M38-L110 HydrophobicContact CE-CD1 3.96Å; M38-L110 HydrophobicContact CG-CD1 4.48Å; M38-L110 HydrophobicContact SD-CD1 3.48Å; M38-L110 WeakPolarHBondContact SD-CD1 3.4Å; I66-L110 HydrophobicContact CG2-CD2 3.83Å; L70-L110 HydrophobicContact CD2-CD1 3.89Å; L70-L110 HydrophobicContact CD2-CD2 4.13Å; L70-L110 HydrophobicContact CD2-CG 4.33Å; L70-L110 HydrophobicContact CG-CD2 4.01Å; T106-L110 HydrophobicContact CG2-CD1 4.26Å; T106-L110 HydrophobicContact CG2-CG 4.43Å; T106-L110 WeakPolarHBondContact O-CG 3.4Å; T106-L110 PolarHBondContact O-N 3.2Å; K107-L110 PolarHBondContact O-N 3.09Å; L110-K112 PolarHBondContact O-N 2.94Å; L110-I113 PolarHBondContact O-N 3.13Å; L110-I113 VanDerWaalsContact O-N 3.1Å; L110-L114 VanDerWaalsContact O-CG 3.25Å; L110-L114 WeakPolarHBondContact O-CG 3.11Å; L110-L114 PolarHBondContact O-N 3.4Å; L110-L131 HydrophobicContact CB-CD2 4.13Å; L110-L131 HydrophobicContact CD1-CD2 3.82Å
111	Q	94.8	Very high	91.2	Very high	90 Å²	90	60 Å²	60	42%	0.421	27%	0.273	S	S	.	.	H	α-helix	trans	-57.2	-37.2	178.2	-74.8	176.3	-53.8	0	0	112.2	K107 R108 L114 E115	K107-Q111 VanDerWaalsContact O-CG 3.27Å; K107-Q111 WeakPolarHBondContact O-CG 3.4Å; K107-Q111 PolarHBondContact O-N 3.21Å; R108-Q111 PolarHBondContact O-N 3.32Å; Q111-L114 PolarHBondContact O-N 2.8Å; Q111-E115 WeakPolarHBondContact O-CB 3.32Å; Q111-E115 PolarHBondContact O-N 2.86Å
112	K	95.2	Very high	91.9	Very high	148 Å²	148	56.8 Å²	56.8	64%	0.643	26%	0.258	S	S	*	.	H	α-helix	trans	-65.9	-42.7	175.6	-71.6	174.8	178.8	-177.4	0	112.8	R108 D109 L110 E115 A116	R108-K112 WeakPolarHBondContact O-CG 3.41Å; R108-K112 PolarHBondContact O-N 3.44Å; R108-K112 VanDerWaalsContact O-N 3.08Å; D109-K112 PolarHBondContact O-N 3.46Å; L110-K112 PolarHBondContact O-N 2.94Å; K112-E115 PolarHBondContact O-N 3.08Å; K112-A116 PolarHBondContact O-N 2.9Å
113	I	95.3	Very high	92.5	Very high	35 Å²	35	59.1 Å²	59.1	18%	0.179	27%	0.274	C	S	.	.	H	α-helix	trans	-65.4	-43.4	176.9	-68.4	178.3	0	0	0	110.2	I66 R69 D109 L110 E115 A116 E117	I66-I113 HydrophobicContact CG1-CG2 3.86Å; R69-I113 HydrophobicContact CB-CD1 3.36Å; R69-I113 HydrophobicContact CG-CD1 3.38Å; D109-I113 PolarHBondContact O-N 3.05Å; L110-I113 PolarHBondContact O-N 3.13Å; L110-I113 VanDerWaalsContact O-N 3.1Å; I113-E115 VanDerWaalsContact C-N 3.31Å; I113-E115 PolarHBondContact O-N 3.31Å; I113-A116 PolarHBondContact O-N 3.24Å; I113-E117 HydrophobicContact CG2-CG 4.3Å; I113-E117 WeakPolarHBondContact O-CB 3.48Å; I113-E117 WeakPolarHBondContact O-CG 3.49Å; I113-E117 PolarHBondContact O-N 2.95Å
114	L	95.8	Very high	93	Very high	6 Å²	6	64.5 Å²	64.5	3%	0.031	30%	0.302	C	S	.	.	H	α-helix	trans	-61.5	-40.4	177.4	-67.5	176.4	0	0	0	112.1	I66 L110 Q111 E117 N118 L129 L131 L147	I66-L114 HydrophobicContact CD1-CD2 3.63Å; I66-L114 HydrophobicContact CG1-CD2 4.38Å; L110-L114 VanDerWaalsContact O-CG 3.25Å; L110-L114 WeakPolarHBondContact O-CG 3.11Å; L110-L114 PolarHBondContact O-N 3.4Å; Q111-L114 PolarHBondContact O-N 2.8Å; L114-E117 PolarHBondContact O-N 3.39Å; L114-N118 VanDerWaalsContact O-CB 3.28Å; L114-N118 WeakPolarHBondContact O-CB 3.43Å; L114-N118 PolarHBondContact O-N 3.38Å; L114-N118 PolarHBondContact O-ND2 2.79Å; L114-N118 VanDerWaalsContact O-ND2 3.13Å; L114-L129 HydrophobicContact CD2-CD2 3.37Å; L114-L129 HydrophobicContact CD2-CG 3.67Å; L114-L131 HydrophobicContact CD1-CB 3.56Å; L114-L147 HydrophobicContact CD1-CD2 4.21Å; L114-L147 HydrophobicContact CD2-CD2 4.01Å
115	E	95.7	Very high	93.2	Very high	112 Å²	112	61.2 Å²	61.2	52%	0.523	29%	0.294	S	S	.	.	H	α-helix	trans	-62.7	-45	174.4	-170	62.5	-156.6	0	0	111.7	Q111 K112 I113 E117 N118 I119	Q111-E115 WeakPolarHBondContact O-CB 3.32Å; Q111-E115 PolarHBondContact O-N 2.86Å; K112-E115 PolarHBondContact O-N 3.08Å; I113-E115 VanDerWaalsContact C-N 3.31Å; I113-E115 PolarHBondContact O-N 3.31Å; E115-E117 PolarHBondContact O-N 3.25Å; E115-N118 PolarHBondContact O-N 2.91Å; E115-I119 HydrophobicContact CG-CD1 4.15Å; E115-I119 WeakPolarHBondContact O-CG1 3.38Å; E115-I119 PolarHBondContact O-N 3Å
116	A	95.2	Very high	93.3	Very high	55 Å²	55	56.6 Å²	56.6	46%	0.455	29%	0.286	S	S	.	.	H	α-helix	trans	-61.9	-44	177	0	0	0	0	0	112.1	K112 I113 I119 R120	K112-A116 PolarHBondContact O-N 2.9Å; I113-A116 PolarHBondContact O-N 3.24Å; A116-I119 PolarHBondContact O-N 3.41Å; A116-R120 VanDerWaalsContact O-CB 3.24Å; A116-R120 WeakPolarHBondContact O-CB 3.23Å; A116-R120 PolarHBondContact O-N 2.81Å
117	E	95.4	Very high	93.5	Very high	10 Å²	10	56.5 Å²	56.5	5%	0.047	29%	0.285	C	S	.	.	H	α-helix	trans	-68.5	-34.9	176.9	-72.5	-60	147.1	0	0	112.4	S62 K65 I113 L114 E115 R120 L121 Y122	S62-E117 PolarHBondContact OG-OE2 3.14Å; K65-E117 WeakPolarHBondContact CD-OE1 3.29Å; K65-E117 IonicContact NZ-OE1 2.96Å; K65-E117 PolarHBondContact NZ-OE1 2.67Å; I113-E117 HydrophobicContact CG2-CG 4.3Å; I113-E117 WeakPolarHBondContact O-CB 3.48Å; I113-E117 WeakPolarHBondContact O-CG 3.49Å; I113-E117 PolarHBondContact O-N 2.95Å; L114-E117 PolarHBondContact O-N 3.39Å; E115-E117 PolarHBondContact O-N 3.25Å; E117-R120 PolarHBondContact O-N 3.45Å; E117-R120 IonicContact OE1-NE 3.39Å; E117-R120 PolarHBondContact OE1-NE 3Å; E117-R120 IonicContact OE1-NH2 3.82Å; E117-R120 IonicContact OE2-CZ 2.75Å; E117-R120 IonicContact OE2-NE 3.79Å; E117-R120 PolarHBondContact OE2-NE 3.17Å; E117-R120 IonicContact OE2-NH2 3.26Å; E117-R120 PolarHBondContact OE2-NH2 3.41Å; E117-L121 PolarHBondContact O-N 3.01Å; E117-Y122 HydrophobicContact CB-CD2 4.47Å; E117-Y122 HydrophobicContact CB-CE2 4.44Å; E117-Y122 PolarHBondContact O-N 3.38Å
118	N	95.1	Very high	93.6	Very high	10 Å²	10	58.7 Å²	58.7	5%	0.053	29%	0.291	C	S	.	.	H	α-helix	trans	-61.2	-48.4	173.2	-79.7	-30.4	0	0	0	111.9	L114 E115 R120 Y122 C123 L129	L114-N118 VanDerWaalsContact O-CB 3.28Å; L114-N118 WeakPolarHBondContact O-CB 3.43Å; L114-N118 PolarHBondContact O-N 3.38Å; L114-N118 PolarHBondContact O-ND2 2.79Å; L114-N118 VanDerWaalsContact O-ND2 3.13Å; E115-N118 PolarHBondContact O-N 2.91Å; N118-R120 VanDerWaalsContact C-N 3.34Å; N118-Y122 PolarHBondContact O-N 3.48Å; N118-C123 VanDerWaalsContact O-CB 3.22Å; N118-C123 WeakPolarHBondContact O-CB 3.47Å; N118-C123 PolarHBondContact O-N 3.36Å; N118-C123 PolarHBondContact O-SG 3.01Å; N118-C123 VanDerWaalsContact O-SG 3.41Å; N118-L129 PolarHBondContact ND2-O 3.19Å; N118-L129 WeakPolarHBondContact OD1-CA 3.3Å; N118-L129 WeakPolarHBondContact OD1-CB 3.35Å; N118-L129 PolarHBondContact OD1-N 2.89Å; N118-L129 PolarHBondContact OD1-O 3.37Å
119	I	95	Very high	93.8	Very high	112 Å²	112	53 Å²	53	57%	0.574	27%	0.27	S	S	*	.	H	α-helix	trans	-65.8	-40.1	178.2	-66.3	166.2	0	0	0	110.9	E115 A116	E115-I119 HydrophobicContact CG-CD1 4.15Å; E115-I119 WeakPolarHBondContact O-CG1 3.38Å; E115-I119 PolarHBondContact O-N 3Å; A116-I119 PolarHBondContact O-N 3.41Å
120	R	94.1	Very high	93.9	Very high	96 Å²	96	52.7 Å²	52.7	36%	0.362	27%	0.27	S	S	.	.	H	α-helix	trans	-67.3	-42.8	-178.5	-172.6	-174.9	73.3	88.1	-3.2	112.7	E61 S62 A116 E117 N118 N124	E61-R120 IonicContact OE2-NH1 3.98Å; E61-R120 IonicContact OE2-NH2 2.68Å; S62-R120 PolarHBondContact OG-NH2 2.97Å; A116-R120 VanDerWaalsContact O-CB 3.24Å; A116-R120 WeakPolarHBondContact O-CB 3.23Å; A116-R120 PolarHBondContact O-N 2.81Å; E117-R120 PolarHBondContact O-N 3.45Å; E117-R120 IonicContact OE1-NE 3.39Å; E117-R120 PolarHBondContact OE1-NE 3Å; E117-R120 IonicContact OE1-NH2 3.82Å; E117-R120 IonicContact OE2-CZ 2.75Å; E117-R120 IonicContact OE2-NE 3.79Å; E117-R120 PolarHBondContact OE2-NE 3.17Å; E117-R120 IonicContact OE2-NH2 3.26Å; E117-R120 PolarHBondContact OE2-NH2 3.41Å; N118-R120 VanDerWaalsContact C-N 3.34Å; R120-N124 PolarHBondContact O-ND2 3.04Å; R120-N124 VanDerWaalsContact O-ND2 3.13Å
121	L	94.1	Very high	94	Very high	9 Å²	9	53.6 Å²	53.6	5%	0.047	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-136.1	-64.9	-163	176.3	63	0	0	0	112.6	L54 E58 E117 C123 N124	L54-L121 HydrophobicContact CD1-CD1 3.85Å; L54-L121 HydrophobicContact CD1-CD2 3.79Å; L54-L121 HydrophobicContact CD1-CG 3.97Å; E58-L121 HydrophobicContact CB-CD1 4.41Å; E58-L121 HydrophobicContact CB-CD2 3.86Å; E58-L121 WeakPolarHBondContact OE1-CD1 3.28Å; E117-L121 PolarHBondContact O-N 3.01Å; L121-C123 PolarHBondContact O-N 2.96Å; L121-N124 WeakPolarHBondContact O-CB 3.45Å; L121-N124 PolarHBondContact O-N 3.35Å; L121-N124 VanDerWaalsContact O-N 3.15Å
122	Y	93.9	Very high	93.9	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-63.1	-44	-164.2	-69.9	-94.1	0	0	0	113	L54 E117 N118 N124 I125 G126 L127 L129 I149	L54-Y122 HydrophobicContact CD2-CE1 3.94Å; E117-Y122 HydrophobicContact CB-CD2 4.47Å; E117-Y122 HydrophobicContact CB-CE2 4.44Å; E117-Y122 PolarHBondContact O-N 3.38Å; N118-Y122 PolarHBondContact O-N 3.48Å; Y122-N124 PolarHBondContact O-N 2.86Å; Y122-I125 WeakPolarHBondContact O-CG1 3.35Å; Y122-I125 PolarHBondContact O-N 3.37Å; Y122-G126 PolarHBondContact O-N 2.94Å; Y122-L127 CarbonylContact C-O 3.57Å; Y122-L127 HydrophobicContact CD1-CB 3.93Å; Y122-L127 HydrophobicContact CD1-CD1 4.38Å; Y122-L127 CarbonylContact O-C 3.45Å; Y122-L127 WeakPolarHBondContact O-CA 3.37Å; Y122-L127 PolarHBondContact O-N 2.85Å; Y122-L129 HydrophobicContact CD1-CB 4.04Å; Y122-L129 HydrophobicContact CD2-CB 3.91Å; Y122-L129 HydrophobicContact CD2-CD2 4.39Å; Y122-L129 HydrophobicContact CE1-CB 4.09Å; Y122-L129 HydrophobicContact CE1-CD1 4.46Å; Y122-L129 HydrophobicContact CE2-CB 3.99Å; Y122-L129 HydrophobicContact CE2-CD2 3.73Å; Y122-L129 HydrophobicContact CE2-CG 4.41Å; Y122-L129 HydrophobicContact CG-CB 3.96Å; Y122-I149 HydrophobicContact CE1-CD1 4.11Å; Y122-I149 HydrophobicContact CE1-CG1 4.36Å
123	C	91.8	Very high	93.7	Very high	56 Å²	56	49.9 Å²	49.9	38%	0.378	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-63.1	-33.2	-179.2	-71.2	0	0	0	0	112.1	N118 L121 I125 G126 L127	N118-C123 VanDerWaalsContact O-CB 3.22Å; N118-C123 WeakPolarHBondContact O-CB 3.47Å; N118-C123 PolarHBondContact O-N 3.36Å; N118-C123 PolarHBondContact O-SG 3.01Å; N118-C123 VanDerWaalsContact O-SG 3.41Å; L121-C123 PolarHBondContact O-N 2.96Å; C123-I125 VanDerWaalsContact C-N 3.25Å; C123-I125 PolarHBondContact O-N 3.38Å; C123-G126 PolarHBondContact O-N 2.9Å; C123-L127 WeakPolarHBondContact CA-O 3.48Å; C123-L127 PolarHBondContact N-O 2.89Å
124	N	90.9	Very high	93.3	Very high	125 Å²	125	51.5 Å²	51.5	67%	0.668	27%	0.267	S	S	*	.	G	3₁₀ helix	trans	-66.9	-29	-179.5	-63.4	-30.2	0	0	0	112.2	R120 L121 Y122	R120-N124 PolarHBondContact O-ND2 3.04Å; R120-N124 VanDerWaalsContact O-ND2 3.13Å; L121-N124 WeakPolarHBondContact O-CB 3.45Å; L121-N124 PolarHBondContact O-N 3.35Å; L121-N124 VanDerWaalsContact O-N 3.15Å; Y122-N124 PolarHBondContact O-N 2.86Å
125	I	90.9	Very high	92.6	Very high	68 Å²	68	57 Å²	57	35%	0.349	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-99.6	13.5	178.1	61	172.7	0	0	0	112.8	L54 Y122 C123 L127	L54-I125 HydrophobicContact CB-CD1 4.03Å; L54-I125 HydrophobicContact CD1-CD1 3.7Å; L54-I125 HydrophobicContact CG-CD1 4.36Å; Y122-I125 WeakPolarHBondContact O-CG1 3.35Å; Y122-I125 PolarHBondContact O-N 3.37Å; C123-I125 VanDerWaalsContact C-N 3.25Å; C123-I125 PolarHBondContact O-N 3.38Å; I125-L127 VanDerWaalsContact C-N 3.3Å; I125-L127 HydrophobicContact CD1-CD1 3.64Å; I125-L127 HydrophobicContact CD1-CG 4.13Å; I125-L127 HydrophobicContact CG1-CB 4.19Å; I125-L127 HydrophobicContact CG1-CD1 4.1Å; I125-L127 HydrophobicContact CG1-CG 4.01Å; I125-L127 PolarHBondContact O-N 3.49Å
126	G	89.9	Confident	91.5	Very high	30 Å²	30	53.6 Å²	53.6	31%	0.309	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.4	27.8	179.5	0	0	0	0	0	113.4	Y122 C123 L152	Y122-G126 PolarHBondContact O-N 2.94Å; C123-G126 PolarHBondContact O-N 2.9Å; G126-L152 WeakPolarHBondContact O-CB 3.36Å; G126-L152 PolarHBondContact O-N 3.47Å
127	L	92.5	Very high	90.2	Very high	4 Å²	4	53 Å²	53	2%	0.021	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	164.4	173.5	-60.9	-176.9	0	0	0	110.5	L50 Y122 C123 I125 I149 D150 Q151	L50-L127 HydrophobicContact CD2-CD1 3.81Å; Y122-L127 CarbonylContact C-O 3.57Å; Y122-L127 HydrophobicContact CD1-CB 3.93Å; Y122-L127 HydrophobicContact CD1-CD1 4.38Å; Y122-L127 CarbonylContact O-C 3.45Å; Y122-L127 WeakPolarHBondContact O-CA 3.37Å; Y122-L127 PolarHBondContact O-N 2.85Å; C123-L127 WeakPolarHBondContact CA-O 3.48Å; C123-L127 PolarHBondContact N-O 2.89Å; I125-L127 VanDerWaalsContact C-N 3.3Å; I125-L127 HydrophobicContact CD1-CD1 3.64Å; I125-L127 HydrophobicContact CD1-CG 4.13Å; I125-L127 HydrophobicContact CG1-CB 4.19Å; I125-L127 HydrophobicContact CG1-CD1 4.1Å; I125-L127 HydrophobicContact CG1-CG 4.01Å; I125-L127 PolarHBondContact O-N 3.49Å; L127-I149 HydrophobicContact CB-CG2 4.22Å; L127-I149 HydrophobicContact CD1-CG2 4.13Å; L127-I149 HydrophobicContact CD2-CG2 4.32Å; L127-I149 HydrophobicContact CG-CG2 4.47Å; L127-D150 CarbonylContact C-O 3.6Å; L127-D150 WeakPolarHBondContact CA-O 3.13Å; L127-Q151 HydrophobicContact CD2-CB 4.42Å; L127-Q151 HydrophobicContact CD2-CG 3.8Å
128	R	93.5	Very high	88.8	Confident	113 Å²	113	61.8 Å²	61.8	43%	0.426	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	119.7	170	-175	-179.6	69.3	176.1	-0.1	110.5	I149 D150 L152	R128-I149 WeakPolarHBondContact O-CA 3.46Å; R128-D150 HydrophobicContact CB-CB 4.3Å; R128-D150 PolarHBondContact N-O 3.48Å; R128-D150 IonicContact NE-OD2 3.36Å; R128-D150 IonicContact NH2-OD2 3.3Å; R128-D150 PolarHBondContact NH2-OD2 2.86Å; R128-D150 PolarHBondContact O-N 2.77Å; R128-L152 HydrophobicContact CB-CD2 3.94Å; R128-L152 HydrophobicContact CB-CG 4.3Å
129	L	94.8	Very high	87.4	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.005	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	129.9	173.1	-172.4	69.7	0	0	0	109.9	I66 L114 N118 Y122 L147 R148 I149	I66-L129 HydrophobicContact CD1-CD2 3.95Å; L114-L129 HydrophobicContact CD2-CD2 3.37Å; L114-L129 HydrophobicContact CD2-CG 3.67Å; N118-L129 PolarHBondContact ND2-O 3.19Å; N118-L129 WeakPolarHBondContact OD1-CA 3.3Å; N118-L129 WeakPolarHBondContact OD1-CB 3.35Å; N118-L129 PolarHBondContact OD1-N 2.89Å; N118-L129 PolarHBondContact OD1-O 3.37Å; Y122-L129 HydrophobicContact CD1-CB 4.04Å; Y122-L129 HydrophobicContact CD2-CB 3.91Å; Y122-L129 HydrophobicContact CD2-CD2 4.39Å; Y122-L129 HydrophobicContact CE1-CB 4.09Å; Y122-L129 HydrophobicContact CE1-CD1 4.46Å; Y122-L129 HydrophobicContact CE2-CB 3.99Å; Y122-L129 HydrophobicContact CE2-CD2 3.73Å; Y122-L129 HydrophobicContact CE2-CG 4.41Å; Y122-L129 HydrophobicContact CG-CB 3.96Å; L129-L147 HydrophobicContact CD1-CB 4.12Å; L129-R148 CarbonylContact C-O 3.43Å; L129-I149 HydrophobicContact CD1-CD1 4.04Å; L129-I149 HydrophobicContact CD1-CG1 3.39Å
130	S	95.2	Very high	86.1	Confident	23 Å²	23	64.6 Å²	64.6	16%	0.161	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	154.9	-177.2	63.3	0	0	0	0	111.9	L147 R148	S130-L147 CarbonylContact O-C 3.01Å; S130-L147 WeakPolarHBondContact O-CA 3.11Å; S130-R148 PolarHBondContact N-O 2.9Å; S130-R148 PolarHBondContact O-N 2.94Å; S130-R148 PolarHBondContact OG-O 2.96Å; S130-R148 VanDerWaalsContact OG-O 3.13Å
131	L	94.7	Very high	85.1	Confident	23 Å²	23	65 Å²	65	12%	0.12	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	114.7	173.7	-168.1	69.8	0	0	0	109.4	M38 F42 K107 L110 L114 Y145 L147	M38-L131 HydrophobicContact CE-CD2 3.97Å; M38-L131 HydrophobicContact SD-CD2 4.26Å; F42-L131 HydrophobicContact CZ-CD1 3.88Å; K107-L131 HydrophobicContact CG-CD2 4.25Å; L110-L131 HydrophobicContact CB-CD2 4.13Å; L110-L131 HydrophobicContact CD1-CD2 3.82Å; L114-L131 HydrophobicContact CD1-CB 3.56Å; L131-Y145 HydrophobicContact CD1-CD1 4.49Å; L131-Y145 HydrophobicContact CD2-CD1 3.93Å; L131-Y145 HydrophobicContact CD2-CE1 4.43Å; L131-Y145 HydrophobicContact CD2-CG 4.45Å; L131-Y145 HydrophobicContact CG-CD1 3.85Å; L131-Y145 HydrophobicContact CG-CG 4.43Å; L131-L147 HydrophobicContact CD1-CD2 3.84Å
132	V	92.5	Very high	84.4	Confident	40 Å²	40	70.5 Å²	70.5	24%	0.242	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	157.4	179.9	-59.3	0	0	0	0	111.1	Y145 V146 R148	V132-Y145 CarbonylContact O-C 3.58Å; V132-Y145 VanDerWaalsContact O-CA 3.29Å; V132-Y145 WeakPolarHBondContact O-CA 3.35Å; V132-V146 HydrophobicContact CG2-CG2 3.53Å; V132-V146 PolarHBondContact N-O 2.96Å; V132-V146 PolarHBondContact O-N 3.03Å; V132-R148 HydrophobicContact CB-CB 4.46Å; V132-R148 HydrophobicContact CG1-CB 4.01Å; V132-R148 HydrophobicContact CG2-CB 3.63Å; V132-R148 HydrophobicContact CG2-CG 4.42Å
133	K	90.7	Very high	84	Confident	120 Å²	120	74.6 Å²	74.6	52%	0.522	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	127.2	170	-72.8	-172.6	176.1	-173.8	0	109.3	M143 E144 Y145	K133-M143 HydrophobicContact CB-CE 3.76Å; K133-E144 CarbonylContact C-O 3.52Å; K133-E144 VanDerWaalsContact CA-O 3.29Å; K133-E144 WeakPolarHBondContact CA-O 3.39Å; K133-Y145 HydrophobicContact CD-CE1 4.14Å; K133-Y145 WeakPolarHBondContact CE-OH 3.08Å; K133-Y145 HydrophobicContact CG-CD1 3.68Å; K133-Y145 HydrophobicContact CG-CE1 3.48Å; K133-Y145 VanDerWaalsContact CG-CE1 3.48Å; K133-Y145 HydrophobicContact CG-CE2 4.45Å; K133-Y145 HydrophobicContact CG-CG 4.29Å
134	Q	86.8	Confident	83.9	Confident	68 Å²	68	72.6 Å²	72.6	32%	0.318	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	157.7	174	-166.7	179.3	28.1	0	0	109.9	M143 E144 V146	Q134-M143 CarbonylContact O-C 3.49Å; Q134-M143 WeakPolarHBondContact O-CA 3.23Å; Q134-E144 PolarHBondContact N-O 2.99Å; Q134-E144 PolarHBondContact O-N 2.89Å; Q134-E144 VanDerWaalsContact O-O 3.11Å; Q134-V146 HydrophobicContact CB-CG1 4.42Å; Q134-V146 HydrophobicContact CB-CG2 3.86Å
135	R	82.6	Confident	83.9	Confident	122 Å²	122	67.3 Å²	67.3	46%	0.46	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	130.9	169.7	-156.4	-178.1	-162.4	96.6	-11.3	109.8	S137 T140 M143	R135-S137 VanDerWaalsContact C-N 3.34Å; R135-S137 WeakPolarHBondContact CD-O 3.35Å; R135-S137 WeakPolarHBondContact CG-O 3.3Å; R135-S137 PolarHBondContact O-N 3.29Å; R135-T140 WeakPolarHBondContact CD-O 3.09Å; R135-T140 WeakPolarHBondContact CG-O 3.49Å; R135-T140 PolarHBondContact NE-O 3.39Å; R135-M143 HydrophobicContact CB-SD 4.47Å
136	S	71.9	Confident	84	Confident	40 Å²	40	64.1 Å²	64.1	28%	0.28	33%	0.334	S	S	.	.	S	Bend	trans	-64.3	-38.3	-172.2	174.4	0	0	0	0	113.6	K28 L142 E144	K28-S136 PolarHBondContact NZ-O 3.1Å; K28-S136 VanDerWaalsContact NZ-O 3.16Å; S136-L142 PolarHBondContact N-O 3.04Å; S136-E144 WeakPolarHBondContact CA-OE1 3.3Å; S136-E144 PolarHBondContact OG-OE1 3.14Å
137	S	68.4	Low	84.2	Confident	43 Å²	43	62.7 Å²	62.7	30%	0.301	32%	0.32	S	S	.	.			trans	-152.5	169.4	173.8	65.4	0	0	0	0	110.1	R135 T139 T140	R135-S137 VanDerWaalsContact C-N 3.34Å; R135-S137 WeakPolarHBondContact CD-O 3.35Å; R135-S137 WeakPolarHBondContact CG-O 3.3Å; R135-S137 PolarHBondContact O-N 3.29Å; S137-T139 PolarHBondContact O-N 3.12Å; S137-T139 PolarHBondContact OG-OG1 3.24Å; S137-T140 PolarHBondContact N-OG1 3.5Å; S137-T140 WeakPolarHBondContact OG-CB 3.49Å; S137-T140 WeakPolarHBondContact OG-CG2 3.27Å; S137-T140 PolarHBondContact OG-N 3.18Å; S137-T140 VanDerWaalsContact OG-N 3.11Å; S137-T140 PolarHBondContact OG-OG1 2.82Å
138	E	65.9	Low	84.3	Confident	195 Å²	195	65.9 Å²	65.9	91%	0.911	33%	0.332	S	S	*	.	S	Bend	trans	-60.4	-31	173.9	-68.5	176.3	-167.9	0	0	112.1
139	T	64.5	Low	84.4	Confident	131 Å²	131	60.6 Å²	60.6	80%	0.804	31%	0.312	S	S	*	.	S	Bend	trans	-88.8	-25.5	-174.8	56.1	0	0	0	0	113.7	S137	S137-T139 PolarHBondContact O-N 3.12Å; S137-T139 PolarHBondContact OG-OG1 3.24Å
140	T	68.2	Low	84.2	Confident	49 Å²	49	61.2 Å²	61.2	30%	0.301	32%	0.315	S	S	.	.			trans	-95.1	132.7	-179.8	59.6	0	0	0	0	111.3	R135 S137 L142	R135-T140 WeakPolarHBondContact CD-O 3.09Å; R135-T140 WeakPolarHBondContact CG-O 3.49Å; R135-T140 PolarHBondContact NE-O 3.39Å; S137-T140 PolarHBondContact N-OG1 3.5Å; S137-T140 WeakPolarHBondContact OG-CB 3.49Å; S137-T140 WeakPolarHBondContact OG-CG2 3.27Å; S137-T140 PolarHBondContact OG-N 3.18Å; S137-T140 VanDerWaalsContact OG-N 3.11Å; S137-T140 PolarHBondContact OG-OG1 2.82Å; T140-L142 PolarHBondContact O-N 2.8Å
141	T	72.6	Confident	83.9	Confident	106 Å²	106	62.5 Å²	62.5	65%	0.65	32%	0.319	S	S	*	.			trans	-76.1	-5.2	173.1	55.4	0	0	0	0	113.1	M143	T141-M143 PolarHBondContact O-N 3.34Å
142	L	80.3	Confident	83.4	Confident	123 Å²	123	64.4 Å²	64.4	64%	0.644	33%	0.329	S	S	*	.			trans	-76.1	126.2	-173.7	-62.9	178.4	0	0	0	110.8	S136 T140	S136-L142 PolarHBondContact N-O 3.04Å; T140-L142 PolarHBondContact O-N 2.8Å
143	M	85.4	Confident	82.7	Confident	86 Å²	86	67.8 Å²	67.8	42%	0.424	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	125.5	169.3	-60.9	-64.2	-66.7	0	0	108.5	G37 K133 Q134 R135 T141	G37-M143 VanDerWaalsContact CA-O 3.22Å; G37-M143 WeakPolarHBondContact CA-O 3.4Å; K133-M143 HydrophobicContact CB-CE 3.76Å; Q134-M143 CarbonylContact O-C 3.49Å; Q134-M143 WeakPolarHBondContact O-CA 3.23Å; R135-M143 HydrophobicContact CB-SD 4.47Å; T141-M143 PolarHBondContact O-N 3.34Å
144	E	89.3	Confident	81.4	Confident	15 Å²	15	69.5 Å²	69.5	7%	0.07	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	154.3	169.7	64.8	174.1	165.7	0	0	111.1	G37 N39 K133 Q134 S136 V146	G37-E144 CarbonylContact O-C 3.47Å; G37-E144 VanDerWaalsContact O-CA 3.24Å; G37-E144 WeakPolarHBondContact O-CA 3.3Å; N39-E144 PolarHBondContact ND2-OE2 3.23Å; N39-E144 VanDerWaalsContact ND2-OE2 3.11Å; K133-E144 CarbonylContact C-O 3.52Å; K133-E144 VanDerWaalsContact CA-O 3.29Å; K133-E144 WeakPolarHBondContact CA-O 3.39Å; Q134-E144 PolarHBondContact N-O 2.99Å; Q134-E144 PolarHBondContact O-N 2.89Å; Q134-E144 VanDerWaalsContact O-O 3.11Å; S136-E144 WeakPolarHBondContact CA-OE1 3.3Å; S136-E144 PolarHBondContact OG-OE1 3.14Å; E144-V146 HydrophobicContact CG-CG1 3.89Å
145	Y	91.7	Very high	80.2	Confident	14 Å²	14	70.3 Å²	70.3	6%	0.055	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	128	168.6	-71.4	-84.7	0	0	0	109.1	G37 M38 F42 K107 L131 V132 K133	G37-Y145 PolarHBondContact O-N 3.39Å; M38-Y145 HydrophobicContact CB-CD2 4.01Å; M38-Y145 HydrophobicContact CB-CE2 4.49Å; M38-Y145 HydrophobicContact CE-CD1 4.13Å; M38-Y145 HydrophobicContact CE-CD2 3.46Å; M38-Y145 VanDerWaalsContact CE-CD2 3.46Å; M38-Y145 HydrophobicContact CE-CE1 4.24Å; M38-Y145 HydrophobicContact CE-CE2 3.6Å; M38-Y145 HydrophobicContact CE-CG 3.71Å; M38-Y145 HydrophobicContact SD-CD2 3.75Å; M38-Y145 HydrophobicContact SD-CE2 4.48Å; M38-Y145 HydrophobicContact SD-CG 3.8Å; F42-Y145 WeakPolarHBondContact CE1-O 3.3Å; K107-Y145 HydrophobicContact CD-CE1 4.18Å; K107-Y145 HydrophobicContact CG-CE1 4.46Å; L131-Y145 HydrophobicContact CD1-CD1 4.49Å; L131-Y145 HydrophobicContact CD2-CD1 3.93Å; L131-Y145 HydrophobicContact CD2-CE1 4.43Å; L131-Y145 HydrophobicContact CD2-CG 4.45Å; L131-Y145 HydrophobicContact CG-CD1 3.85Å; L131-Y145 HydrophobicContact CG-CG 4.43Å; V132-Y145 CarbonylContact O-C 3.58Å; V132-Y145 VanDerWaalsContact O-CA 3.29Å; V132-Y145 WeakPolarHBondContact O-CA 3.35Å; K133-Y145 HydrophobicContact CD-CE1 4.14Å; K133-Y145 WeakPolarHBondContact CE-OH 3.08Å; K133-Y145 HydrophobicContact CG-CD1 3.68Å; K133-Y145 HydrophobicContact CG-CE1 3.48Å; K133-Y145 VanDerWaalsContact CG-CE1 3.48Å; K133-Y145 HydrophobicContact CG-CE2 4.45Å; K133-Y145 HydrophobicContact CG-CG 4.29Å
146	V	92.8	Very high	78.8	Confident	0 Å²	0	68.9 Å²	68.9	0%	0	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	152.1	175.9	-58.8	0	0	0	0	109.3	L26 K28 V132 Q134 E144	L26-V146 HydrophobicContact CD2-CG2 4.29Å; K28-V146 HydrophobicContact CG-CG1 4.4Å; V132-V146 HydrophobicContact CG2-CG2 3.53Å; V132-V146 PolarHBondContact N-O 2.96Å; V132-V146 PolarHBondContact O-N 3.03Å; Q134-V146 HydrophobicContact CB-CG1 4.42Å; Q134-V146 HydrophobicContact CB-CG2 3.86Å; E144-V146 HydrophobicContact CG-CG1 3.89Å
147	L	95	Very high	78	Confident	1 Å²	1	74.3 Å²	74.3	1%	0.005	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	132.8	169.3	-57.5	173	0	0	0	108.3	L26 I27 F42 I63 I66 L114 L129 S130 L131	L26-L147 WeakPolarHBondContact CA-O 3.15Å; I27-L147 HydrophobicContact CB-CB 4.14Å; I27-L147 HydrophobicContact CD1-CB 4.35Å; I27-L147 PolarHBondContact N-O 3.44Å; I27-L147 PolarHBondContact O-N 2.9Å; F42-L147 HydrophobicContact CB-CD1 4.14Å; F42-L147 HydrophobicContact CD1-CD1 4.19Å; F42-L147 HydrophobicContact CD1-CG 3.97Å; F42-L147 HydrophobicContact CD2-CD1 3.77Å; F42-L147 HydrophobicContact CD2-CD2 4.49Å; F42-L147 HydrophobicContact CD2-CG 4.04Å; F42-L147 HydrophobicContact CE1-CG 3.95Å; F42-L147 HydrophobicContact CE2-CD1 4.17Å; F42-L147 HydrophobicContact CE2-CD2 4.05Å; F42-L147 HydrophobicContact CE2-CG 3.97Å; F42-L147 HydrophobicContact CG-CD1 3.77Å; F42-L147 HydrophobicContact CG-CG 4.02Å; F42-L147 HydrophobicContact CZ-CD2 4.11Å; F42-L147 HydrophobicContact CZ-CG 3.95Å; I63-L147 HydrophobicContact CD1-CD1 3.61Å; I66-L147 HydrophobicContact CD1-CD1 4.04Å; L114-L147 HydrophobicContact CD1-CD2 4.21Å; L114-L147 HydrophobicContact CD2-CD2 4.01Å; L129-L147 HydrophobicContact CD1-CB 4.12Å; S130-L147 CarbonylContact O-C 3.01Å; S130-L147 WeakPolarHBondContact O-CA 3.11Å; L131-L147 HydrophobicContact CD1-CD2 3.84Å
148	R	94.2	Very high	77.1	Confident	70 Å²	70	81.6 Å²	81.6	26%	0.264	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	123.8	-179.1	176.1	174.8	-176.5	-105.7	-1.6	109.4	P24 I25 L26 L129 S130 V132 D150	P24-R148 HydrophobicContact CB-CG 3.83Å; P24-R148 VanDerWaalsContact CB-NE 3.28Å; I25-R148 CarbonylContact O-C 3.47Å; I25-R148 WeakPolarHBondContact O-CA 3.46Å; L26-R148 HydrophobicContact CD2-CB 3.76Å; L26-R148 HydrophobicContact CD2-CG 3.72Å; L129-R148 CarbonylContact C-O 3.43Å; S130-R148 PolarHBondContact N-O 2.9Å; S130-R148 PolarHBondContact O-N 2.94Å; S130-R148 PolarHBondContact OG-O 2.96Å; S130-R148 VanDerWaalsContact OG-O 3.13Å; V132-R148 HydrophobicContact CB-CB 4.46Å; V132-R148 HydrophobicContact CG1-CB 4.01Å; V132-R148 HydrophobicContact CG2-CB 3.63Å; V132-R148 HydrophobicContact CG2-CG 4.42Å; R148-D150 VanDerWaalsContact CZ-CG 3.46Å; R148-D150 IonicContact CZ-OD1 2.73Å; R148-D150 IonicContact CZ-OD2 3.47Å; R148-D150 IonicContact NE-OD1 3.43Å; R148-D150 PolarHBondContact NE-OD1 3.39Å; R148-D150 IonicContact NH1-OD1 2.83Å; R148-D150 PolarHBondContact NH1-OD1 3.25Å; R148-D150 IonicContact NH1-OD2 2.7Å; R148-D150 PolarHBondContact NH1-OD2 3.25Å; R148-D150 IonicContact NH2-OD1 2.66Å; R148-D150 PolarHBondContact NH2-OD1 3.4Å; R148-D150 IonicContact NH2-OD2 3.99Å
149	I	94.1	Very high	76.5	Confident	2 Å²	2	80.8 Å²	80.8	1%	0.01	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	113.8	174.2	-59.5	171.1	0	0	0	108.4	P24 I25 I27 L50 F59 Y122 L127 R128 L129	P24-I149 WeakPolarHBondContact CA-O 3.48Å; I25-I149 HydrophobicContact CB-CB 4.24Å; I25-I149 PolarHBondContact N-O 3.21Å; I25-I149 PolarHBondContact O-N 2.94Å; I27-I149 HydrophobicContact CD1-CD1 3.82Å; I27-I149 HydrophobicContact CD1-CG1 4.43Å; L50-I149 HydrophobicContact CD1-CD1 3.59Å; L50-I149 HydrophobicContact CD2-CG2 4.22Å; F59-I149 HydrophobicContact CE2-CD1 4.28Å; Y122-I149 HydrophobicContact CE1-CD1 4.11Å; Y122-I149 HydrophobicContact CE1-CG1 4.36Å; L127-I149 HydrophobicContact CB-CG2 4.22Å; L127-I149 HydrophobicContact CD1-CG2 4.13Å; L127-I149 HydrophobicContact CD2-CG2 4.32Å; L127-I149 HydrophobicContact CG-CG2 4.47Å; R128-I149 WeakPolarHBondContact O-CA 3.46Å; L129-I149 HydrophobicContact CD1-CD1 4.04Å; L129-I149 HydrophobicContact CD1-CG1 3.39Å
150	D	91.9	Very high	75.7	Confident	15 Å²	15	80.2 Å²	80.2	8%	0.08	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	148.5	173.3	-74.5	-51.9	0	0	0	111	L127 R128 R148	L127-D150 CarbonylContact C-O 3.6Å; L127-D150 WeakPolarHBondContact CA-O 3.13Å; R128-D150 HydrophobicContact CB-CB 4.3Å; R128-D150 PolarHBondContact N-O 3.48Å; R128-D150 IonicContact NE-OD2 3.36Å; R128-D150 IonicContact NH2-OD2 3.3Å; R128-D150 PolarHBondContact NH2-OD2 2.86Å; R128-D150 PolarHBondContact O-N 2.77Å; R148-D150 VanDerWaalsContact CZ-CG 3.46Å; R148-D150 IonicContact CZ-OD1 2.73Å; R148-D150 IonicContact CZ-OD2 3.47Å; R148-D150 IonicContact NE-OD1 3.43Å; R148-D150 PolarHBondContact NE-OD1 3.39Å; R148-D150 IonicContact NH1-OD1 2.83Å; R148-D150 PolarHBondContact NH1-OD1 3.25Å; R148-D150 IonicContact NH1-OD2 2.7Å; R148-D150 PolarHBondContact NH1-OD2 3.25Å; R148-D150 IonicContact NH2-OD1 2.66Å; R148-D150 PolarHBondContact NH2-OD1 3.4Å; R148-D150 IonicContact NH2-OD2 3.99Å
151	Q	89	Confident	75	Confident	50 Å²	50	89.3 Å²	89.3	23%	0.234	47%	0.47	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	125.5	162.3	-59.4	-175.3	24.8	0	0	108.1	R22 L127	R22-Q151 HydrophobicContact CB-CG 4.39Å; L127-Q151 HydrophobicContact CD2-CB 4.42Å; L127-Q151 HydrophobicContact CD2-CG 3.8Å
152	L	84.1	Confident	75.2	Confident	62 Å²	62	88.5 Å²	88.5	33%	0.325	46%	0.461	S	S	.	.	P	Polyproline II helix	trans	-70.3	136.5	173.8	-66.4	177.4	0	0	0	108.7	G126 R128 K154	G126-L152 WeakPolarHBondContact O-CB 3.36Å; G126-L152 PolarHBondContact O-N 3.47Å; R128-L152 HydrophobicContact CB-CD2 3.94Å; R128-L152 HydrophobicContact CB-CG 4.3Å; L152-K154 PolarHBondContact O-N 3.49Å
153	P	76.5	Confident	74.9	Confident	112 Å²	112	86.6 Å²	86.6	73%	0.727	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-61.1	128.6	175.8	26.1	-32.3	0	0	0	108.2	A155	P153-A155 PolarHBondContact O-N 3.27Å; P153-A155 VanDerWaalsContact O-N 3.16Å
154	K	63.9	Low	74.3	Confident	156 Å²	156	86.7 Å²	86.7	68%	0.678	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-61.5	122.1	166.4	-66.4	179.5	-179.6	-178.6	0	106	L152 C156	L152-K154 PolarHBondContact O-N 3.49Å; K154-C156 PolarHBondContact O-N 3.4Å
155	A	61.7	Low	73.4	Confident	85 Å²	85	90.9 Å²	90.9	70%	0.702	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-51.9	118.1	169.5	0	0	0	0	0	106.9	P153 I157	P153-A155 PolarHBondContact O-N 3.27Å; P153-A155 VanDerWaalsContact O-N 3.16Å; A155-I157 VanDerWaalsContact C-N 3.34Å; A155-I157 WeakPolarHBondContact O-CG1 3.47Å; A155-I157 PolarHBondContact O-N 2.9Å
156	C	52.7	Low	72.3	Confident	91 Å²	91	95.7 Å²	95.7	62%	0.615	50%	0.502	S	S	*	.			trans	-65.3	103	170.2	-80.8	0	0	0	0	106.1	K154 Y158	K154-C156 PolarHBondContact O-N 3.4Å; C156-Y158 PolarHBondContact O-N 3.12Å
157	I	56.3	Low	70.9	Confident	155 Å²	155	102.1 Å²	102.1	80%	0.795	54%	0.536	S	S	*	.			trans	-70.1	-6.2	176.8	-48.6	177.1	0	0	0	110.4	A155 F159	A155-I157 VanDerWaalsContact C-N 3.34Å; A155-I157 WeakPolarHBondContact O-CG1 3.47Å; A155-I157 PolarHBondContact O-N 2.9Å; I157-F159 VanDerWaalsContact C-N 3.29Å; I157-F159 PolarHBondContact O-N 2.86Å
158	Y	49.3	Very low	69.2	Low	195 Å²	195	109.3 Å²	109.3	77%	0.765	57%	0.574	S	S	*	*			trans	-82.9	70	173.9	-69.2	-80.7	0	0	0	111.7	C156	C156-Y158 PolarHBondContact O-N 3.12Å
159	F	53	Low	67.3	Low	179 Å²	179	112.3 Å²	112.3	79%	0.785	60%	0.597	S	S	*	*			trans	-115.2	112.7	144	-88.8	-86.9	0	0	0	106	I157	I157-F159 VanDerWaalsContact C-N 3.29Å; I157-F159 PolarHBondContact O-N 2.86Å
160	P	48	Very low	65.1	Low	118 Å²	118	121.5 Å²	121.5	77%	0.766	65%	0.646	S	S	*	*			trans	-65.4	132.8	165.8	27.1	-29.7	0	0	0	108.6
161	D	54.4	Low	62.6	Low	240 Å²	240	131.2 Å²	131.2	100%	1.283	70%	0.698	S	S	*	*			trans	-57.5	0	170	-70	-49.6	0	0	0	112.2

Retrieved 161 of 161 residues in 67.1 ms (Link to these results)

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