A0A077Z750_TRITR Loading...

Large ribosomal subunit protein mL50

AlphaFold DB , UniProt , Accession A0A077Z750, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 195 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	45.7	Very low	62.5	Low	227 Å²	227	136.6 Å²	136.6	100%	1.118	64%	0.641	S	S	*	*				0	109.3	0	-80.2	-69.5	-165	0	0	109.6	R3	M1-R3 PolarHBondContact O-N 3.15Å
2	D	53.5	Low	63.8	Low	89 Å²	89	134.8 Å²	134.8	48%	0.476	62%	0.623	S	S	.	*			trans	-55.2	129.4	-175.8	-71.7	-22.9	0	0	0	112.4	I4 R5	D2-I4 PolarHBondContact O-N 3.04Å; D2-R5 HydrophobicContact CB-CB 4.25Å; D2-R5 HydrophobicContact CB-CG 3.85Å; D2-R5 PolarHBondContact O-N 3.15Å; D2-R5 IonicContact OD2-CZ 2.96Å; D2-R5 IonicContact OD2-NE 2.74Å; D2-R5 PolarHBondContact OD2-NE 3.21Å; D2-R5 IonicContact OD2-NH2 3.22Å; D2-R5 PolarHBondContact OD2-NH2 3.25Å
3	R	58.5	Low	65.3	Low	181 Å²	181	129.4 Å²	129.4	68%	0.683	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	-25.1	179.5	-70	-175.5	97	170.6	4.1	113.4	M1 R12	M1-R3 PolarHBondContact O-N 3.15Å; R3-R12 VanDerWaalsContact C-NH1 3.34Å; R3-R12 PolarHBondContact O-NH1 3.36Å
4	I	59.7	Low	66.7	Low	129 Å²	129	127.6 Å²	127.6	66%	0.662	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-31.6	-178.7	-57	169.9	0	0	0	111.5	D2	D2-I4 PolarHBondContact O-N 3.04Å
5	R	60.7	Low	68.3	Low	184 Å²	184	124.5 Å²	124.5	69%	0.694	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-27.3	-178.3	-66.2	-178.4	-164.3	-154.3	-0.6	112.9	D2 R7	D2-R5 HydrophobicContact CB-CB 4.25Å; D2-R5 HydrophobicContact CB-CG 3.85Å; D2-R5 PolarHBondContact O-N 3.15Å; D2-R5 IonicContact OD2-CZ 2.96Å; D2-R5 IonicContact OD2-NE 2.74Å; D2-R5 PolarHBondContact OD2-NE 3.21Å; D2-R5 IonicContact OD2-NH2 3.22Å; D2-R5 PolarHBondContact OD2-NH2 3.25Å; R5-R7 PolarHBondContact O-N 2.97Å; R5-R7 VanDerWaalsContact O-N 3.16Å
6	A	57.5	Low	69.9	Low	46 Å²	46	117.9 Å²	117.9	38%	0.38	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.2	18.4	-178.6	0	0	0	0	0	114.7	G8	A6-G8 PolarHBondContact O-N 3.18Å
7	R	61.4	Low	71.3	Confident	184 Å²	184	121.4 Å²	121.4	69%	0.694	59%	0.585	S	S	*	*			trans	-74	91.7	176.9	-70.4	-178.2	179.8	-175	1.1	109.8	R5 R143	R5-R7 PolarHBondContact O-N 2.97Å; R5-R7 VanDerWaalsContact O-N 3.16Å; R7-R143 PolarHBondContact O-NH1 3.1Å
8	G	65.7	Low	72.6	Confident	44 Å²	44	117.3 Å²	117.3	45%	0.454	57%	0.57	S	S	.	*			trans	-78.2	175.3	173.2	0	0	0	0	0	113.6	A6 L10	A6-G8 PolarHBondContact O-N 3.18Å; G8-L10 VanDerWaalsContact C-N 3.32Å
9	F	70.1	Confident	73.6	Confident	191 Å²	191	114.2 Å²	114.2	84%	0.838	57%	0.566	S	S	*	*	S	Bend	trans	-68.8	-37.6	159.4	174.1	-100.1	0	0	0	110.5
10	L	76.8	Confident	74.5	Confident	66 Å²	66	116.8 Å²	116.8	35%	0.346	58%	0.582	S	S	.	*	S	Bend	trans	-76.5	155.2	176.7	-61.6	176.3	0	0	0	111.7	G8 R12 V92 T94	G8-L10 VanDerWaalsContact C-N 3.32Å; L10-R12 PolarHBondContact O-N 2.94Å; L10-V92 WeakPolarHBondContact CD1-O 3.34Å; L10-T94 HydrophobicContact CD1-CG2 3.88Å; L10-T94 HydrophobicContact CD2-CG2 4.39Å; L10-T94 HydrophobicContact CG-CG2 4.02Å
11	K	77.6	Confident	75.4	Confident	162 Å²	162	116 Å²	116	70%	0.704	58%	0.579	S	S	*	*			trans	-53.8	139.2	166.8	-68.9	-178.3	-178.3	176.7	0	108.4	L13	K11-L13 VanDerWaalsContact C-N 3.31Å; K11-L13 HydrophobicContact CB-CG 4.37Å; K11-L13 PolarHBondContact O-N 2.98Å
12	R	78.4	Confident	77.7	Confident	114 Å²	114	105.3 Å²	105.3	43%	0.43	53%	0.527	S	S	.	.			trans	-72.6	93	176.7	-172.3	-168.6	-167.8	151.4	9.2	109.3	R3 L10	R3-R12 VanDerWaalsContact C-NH1 3.34Å; R3-R12 PolarHBondContact O-NH1 3.36Å; L10-R12 PolarHBondContact O-N 2.94Å
13	L	82.8	Confident	79.7	Confident	65 Å²	65	103.8 Å²	103.8	34%	0.34	52%	0.517	S	S	.	.			trans	-113.9	152.4	168.7	-60.4	176.5	0	0	0	107.8	K11 L69 V90 V92	K11-L13 VanDerWaalsContact C-N 3.31Å; K11-L13 HydrophobicContact CB-CG 4.37Å; K11-L13 PolarHBondContact O-N 2.98Å; L13-L69 HydrophobicContact CD2-CD1 4.31Å; L13-L69 HydrophobicContact CD2-CD2 3.99Å; L13-L69 HydrophobicContact CD2-CG 4.49Å; L13-V90 HydrophobicContact CB-CG1 4.25Å; L13-V90 HydrophobicContact CD1-CG1 4.1Å; L13-V92 WeakPolarHBondContact O-CG2 3.34Å
14	D	85.6	Confident	81.3	Confident	105 Å²	105	99.9 Å²	99.9	56%	0.561	51%	0.509	S	S	*	.			trans	-85.1	141	170.3	-59.9	-42.3	0	0	0	107.6	Y16	D14-Y16 PolarHBondContact O-N 3.08Å
15	A	90.1	Very high	83	Confident	81 Å²	81	95.6 Å²	95.6	67%	0.669	49%	0.49	S	S	*	.			trans	-63.9	135	174.1	0	0	0	0	0	108.2	V90 V92	A15-V90 WeakPolarHBondContact CA-O 3.39Å; A15-V92 HydrophobicContact CB-CG2 3.96Å
16	Y	94.3	Very high	84.6	Confident	19 Å²	19	86.9 Å²	86.9	8%	0.075	46%	0.457	C	S	.	.	B	Isolated β-bridge	trans	-134.5	124.2	-175.1	176.6	-99.7	0	0	0	110.4	D14 P18 L64 K66 F86 P89 V90	D14-Y16 PolarHBondContact O-N 3.08Å; Y16-P18 HydrophobicContact CE1-CB 3.93Å; Y16-L64 VanDerWaalsContact CE2-O 3.32Å; Y16-L64 WeakPolarHBondContact CE2-O 3.3Å; Y16-K66 HydrophobicContact CD1-CB 4.38Å; Y16-K66 HydrophobicContact CD1-CD 3.65Å; Y16-K66 HydrophobicContact CD1-CG 4.36Å; Y16-K66 HydrophobicContact CD2-CB 3.62Å; Y16-K66 HydrophobicContact CD2-CD 4.41Å; Y16-K66 HydrophobicContact CD2-CG 4.35Å; Y16-K66 HydrophobicContact CE1-CD 3.82Å; Y16-K66 HydrophobicContact CE2-CB 3.77Å; Y16-K66 HydrophobicContact CG-CB 3.91Å; Y16-K66 HydrophobicContact CG-CD 3.94Å; Y16-K66 HydrophobicContact CG-CG 4.13Å; Y16-F86 WeakPolarHBondContact CE1-O 3.29Å; Y16-F86 PolarHBondContact OH-O 2.89Å; Y16-P89 WeakPolarHBondContact O-CA 3.42Å; Y16-V90 PolarHBondContact N-O 3.44Å; Y16-V90 PolarHBondContact O-N 2.99Å
17	E	94.4	Very high	86.2	Confident	176 Å²	176	89 Å²	89	82%	0.822	46%	0.459	S	S	*	.			trans	-111.4	120.7	171.1	-67.7	177.4	178.2	0	0	107.3	A19	E17-A19 PolarHBondContact O-N 3.44Å
18	P	93.7	Very high	87.7	Confident	49 Å²	49	85.9 Å²	85.9	32%	0.318	45%	0.454	S	S	.	.			trans	-65.4	134.4	-179.4	28.9	-35.5	0	0	0	110.1	Y16 V22 K87	Y16-P18 HydrophobicContact CE1-CB 3.93Å; P18-V22 HydrophobicContact CB-CG2 4.35Å; P18-K87 WeakPolarHBondContact CG-O 3.43Å
19	A	92.6	Very high	89	Confident	58 Å²	58	84 Å²	84	48%	0.479	43%	0.433	S	S	.	.			trans	-72.7	149.4	169.6	0	0	0	0	0	110.2	E17 N21 V22	E17-A19 PolarHBondContact O-N 3.44Å; A19-N21 PolarHBondContact O-N 3.06Å; A19-V22 HydrophobicContact CB-CG2 4.33Å; A19-V22 WeakPolarHBondContact O-CG2 3.41Å; A19-V22 PolarHBondContact O-N 2.66Å
20	D	91.1	Very high	90.1	Very high	166 Å²	166	75.5 Å²	75.5	89%	0.888	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-31.2	175.7	-63.1	-36.6	0	0	0	111.7	V22	D20-V22 VanDerWaalsContact C-N 3.3Å; D20-V22 PolarHBondContact O-N 2.82Å
21	N	93.6	Very high	90.7	Very high	99 Å²	99	76 Å²	76	53%	0.529	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	24.3	-177.2	-55.1	-9.8	0	0	0	113.5	A19 E23 D24 T25	A19-N21 PolarHBondContact O-N 3.06Å; N21-E23 VanDerWaalsContact C-N 3.26Å; N21-E23 PolarHBondContact O-N 3.15Å; N21-D24 PolarHBondContact O-N 3Å; N21-T25 VanDerWaalsContact O-CG2 3.32Å; N21-T25 WeakPolarHBondContact O-CG2 3.45Å; N21-T25 PolarHBondContact O-N 2.84Å; N21-T25 PolarHBondContact O-OG1 2.79Å
22	V	94.4	Very high	91.2	Very high	3 Å²	3	75 Å²	75	2%	0.018	40%	0.4	C	S	.	.	H	α-helix	trans	-58.6	-37.8	178.1	165.5	0	0	0	0	111.3	P18 A19 D20 T25 V26 L64 F86 K87	P18-V22 HydrophobicContact CB-CG2 4.35Å; A19-V22 HydrophobicContact CB-CG2 4.33Å; A19-V22 WeakPolarHBondContact O-CG2 3.41Å; A19-V22 PolarHBondContact O-N 2.66Å; D20-V22 VanDerWaalsContact C-N 3.3Å; D20-V22 PolarHBondContact O-N 2.82Å; V22-T25 WeakPolarHBondContact CA-OG1 3.16Å; V22-T25 PolarHBondContact O-OG1 3.3Å; V22-V26 HydrophobicContact CG1-CG2 4.38Å; V22-V26 WeakPolarHBondContact O-CB 3.34Å; V22-V26 WeakPolarHBondContact O-CG2 3.19Å; V22-V26 PolarHBondContact O-N 3.47Å; V22-V26 VanDerWaalsContact O-N 3.09Å; V22-L64 HydrophobicContact CG2-CD2 4.1Å; V22-F86 HydrophobicContact CG1-CB 3.75Å; V22-K87 HydrophobicContact CG1-CG 4.2Å
23	E	94.1	Very high	91.7	Very high	58 Å²	58	71.1 Å²	71.1	27%	0.271	39%	0.391	S	S	.	.	H	α-helix	trans	-66.1	-47.8	179	-62.7	-157.7	168.8	0	0	112.5	N21 T25 V26 Q27 K43 V83 K87	N21-E23 VanDerWaalsContact C-N 3.26Å; N21-E23 PolarHBondContact O-N 3.15Å; E23-T25 VanDerWaalsContact C-N 3.34Å; E23-T25 PolarHBondContact O-N 2.92Å; E23-V26 PolarHBondContact O-N 3.42Å; E23-Q27 WeakPolarHBondContact O-CB 3.3Å; E23-Q27 PolarHBondContact O-N 3.03Å; E23-K43 VanDerWaalsContact CD-NZ 3.29Å; E23-K43 IonicContact OE1-NZ 3.8Å; E23-K43 PolarHBondContact OE1-NZ 2.92Å; E23-K43 IonicContact OE2-NZ 3.3Å; E23-K43 PolarHBondContact OE2-NZ 3.46Å; E23-V83 HydrophobicContact CG-CG1 3.94Å; E23-K87 WeakPolarHBondContact OE1-CE 3.44Å; E23-K87 IonicContact OE1-NZ 2.69Å; E23-K87 PolarHBondContact OE1-NZ 2.95Å
24	D	93.1	Very high	91.8	Very high	98 Å²	98	69.1 Å²	69.1	52%	0.524	38%	0.378	S	S	.	.	H	α-helix	trans	-64.6	-40.4	-177.8	-59.8	-30.1	0	0	0	111.6	N21 Q27 M28	N21-D24 PolarHBondContact O-N 3Å; D24-Q27 PolarHBondContact O-N 3.42Å; D24-M28 WeakPolarHBondContact O-CB 3.49Å; D24-M28 PolarHBondContact O-N 2.88Å
25	T	94.2	Very high	91.2	Very high	40 Å²	40	71.8 Å²	71.8	25%	0.245	39%	0.393	C	S	.	.	H	α-helix	trans	-65	-43	176.9	51.3	0	0	0	0	111.4	N21 V22 E23 Q27 M28 I29	N21-T25 VanDerWaalsContact O-CG2 3.32Å; N21-T25 WeakPolarHBondContact O-CG2 3.45Å; N21-T25 PolarHBondContact O-N 2.84Å; N21-T25 PolarHBondContact O-OG1 2.79Å; V22-T25 WeakPolarHBondContact CA-OG1 3.16Å; V22-T25 PolarHBondContact O-OG1 3.3Å; E23-T25 VanDerWaalsContact C-N 3.34Å; E23-T25 PolarHBondContact O-N 2.92Å; T25-Q27 VanDerWaalsContact C-N 3.34Å; T25-M28 PolarHBondContact O-N 3.31Å; T25-I29 WeakPolarHBondContact O-CD1 3.43Å; T25-I29 WeakPolarHBondContact O-CG1 3.32Å; T25-I29 PolarHBondContact O-N 3.18Å
26	V	94.2	Very high	90.1	Very high	0 Å²	0	71.8 Å²	71.8	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-65.4	-38.9	175.5	176.1	0	0	0	0	111.1	V22 E23 M28 I29 F30 W42 F56 L64 V79 V83	V22-V26 HydrophobicContact CG1-CG2 4.38Å; V22-V26 WeakPolarHBondContact O-CB 3.34Å; V22-V26 WeakPolarHBondContact O-CG2 3.19Å; V22-V26 PolarHBondContact O-N 3.47Å; V22-V26 VanDerWaalsContact O-N 3.09Å; E23-V26 PolarHBondContact O-N 3.42Å; V26-M28 PolarHBondContact O-N 3.38Å; V26-I29 PolarHBondContact O-N 2.86Å; V26-F30 WeakPolarHBondContact O-CB 3.3Å; V26-F30 PolarHBondContact O-N 3.23Å; V26-W42 HydrophobicContact CG1-CZ3 4.06Å; V26-F56 HydrophobicContact CG1-CE2 4.47Å; V26-F56 HydrophobicContact CG1-CZ 3.78Å; V26-L64 HydrophobicContact CG2-CD1 4.1Å; V26-V79 HydrophobicContact CG1-CG1 4.09Å; V26-V83 HydrophobicContact CB-CG2 4.12Å; V26-V83 HydrophobicContact CG1-CG2 3.78Å; V26-V83 HydrophobicContact CG2-CG2 4.39Å
27	Q	92.9	Very high	88.2	Confident	92 Å²	92	75.3 Å²	75.3	43%	0.43	42%	0.418	S	S	.	.	H	α-helix	trans	-61.5	-42.6	175.4	-174.1	-179.8	-7.4	0	0	111.9	E23 D24 T25 I29 F30 S31 W42	E23-Q27 WeakPolarHBondContact O-CB 3.3Å; E23-Q27 PolarHBondContact O-N 3.03Å; D24-Q27 PolarHBondContact O-N 3.42Å; T25-Q27 VanDerWaalsContact C-N 3.34Å; Q27-I29 VanDerWaalsContact C-N 3.32Å; Q27-I29 PolarHBondContact O-N 3.26Å; Q27-F30 WeakPolarHBondContact O-CB 3.47Å; Q27-F30 PolarHBondContact O-N 2.91Å; Q27-S31 PolarHBondContact O-N 3.07Å; Q27-S31 PolarHBondContact O-OG 2.96Å; Q27-W42 HydrophobicContact CB-CH2 3.99Å; Q27-W42 HydrophobicContact CB-CZ2 3.83Å; Q27-W42 HydrophobicContact CB-CZ3 4.44Å; Q27-W42 HydrophobicContact CG-CD2 4.38Å; Q27-W42 HydrophobicContact CG-CZ2 4.17Å
28	M	92	Very high	86.4	Confident	118 Å²	118	71.5 Å²	71.5	58%	0.581	42%	0.416	S	S	*	.	H	α-helix	trans	-63.8	-36.6	175.7	-177.9	-179.3	63.2	0	0	112.2	D24 T25 V26 S31 K32	D24-M28 WeakPolarHBondContact O-CB 3.49Å; D24-M28 PolarHBondContact O-N 2.88Å; T25-M28 PolarHBondContact O-N 3.31Å; V26-M28 PolarHBondContact O-N 3.38Å; M28-S31 PolarHBondContact O-OG 3.06Å; M28-K32 WeakPolarHBondContact O-CB 3.22Å; M28-K32 PolarHBondContact O-N 3.34Å
29	I	93.1	Very high	84.8	Confident	5 Å²	5	73 Å²	73	3%	0.026	43%	0.427	C	S	.	.	H	α-helix	trans	-72.6	-36.1	176.8	-63.5	162.2	0	0	0	110.5	T25 V26 Q27 K32 C33 F56 E59 A60 T63	T25-I29 WeakPolarHBondContact O-CD1 3.43Å; T25-I29 WeakPolarHBondContact O-CG1 3.32Å; T25-I29 PolarHBondContact O-N 3.18Å; V26-I29 PolarHBondContact O-N 2.86Å; Q27-I29 VanDerWaalsContact C-N 3.32Å; Q27-I29 PolarHBondContact O-N 3.26Å; I29-K32 PolarHBondContact O-N 2.97Å; I29-C33 PolarHBondContact O-N 2.69Å; I29-C33 PolarHBondContact O-SG 3.3Å; I29-F56 HydrophobicContact CB-CE2 4.26Å; I29-F56 HydrophobicContact CG2-CD2 3.77Å; I29-F56 HydrophobicContact CG2-CE2 3.83Å; I29-E59 HydrophobicContact CG2-CB 3.74Å; I29-A60 HydrophobicContact CD1-CB 4.33Å; I29-T63 HydrophobicContact CD1-CG2 3.9Å; I29-T63 WeakPolarHBondContact CD1-OG1 3.41Å; I29-T63 HydrophobicContact CG1-CG2 4.35Å
30	F	92.1	Very high	83.7	Confident	11 Å²	11	81.8 Å²	81.8	5%	0.048	45%	0.448	C	S	.	.	H	α-helix	trans	-62	-48.8	176.8	-179.9	-98.3	0	0	0	110.8	V26 Q27 K32 C33 Y34 W42 F45 F56 V79	V26-F30 WeakPolarHBondContact O-CB 3.3Å; V26-F30 PolarHBondContact O-N 3.23Å; Q27-F30 WeakPolarHBondContact O-CB 3.47Å; Q27-F30 PolarHBondContact O-N 2.91Å; F30-K32 PolarHBondContact O-N 2.75Å; F30-C33 PolarHBondContact O-N 2.95Å; F30-Y34 AromaticContact CD2-CD2 3.45Å; F30-Y34 HydrophobicContact CD2-CD2 3.45Å; F30-Y34 VanDerWaalsContact CD2-CD2 3.45Å; F30-Y34 AromaticContact CD2-CE2 3.92Å; F30-Y34 HydrophobicContact CD2-CE2 3.92Å; F30-Y34 HydrophobicContact CD2-CG 4.27Å; F30-Y34 AromaticContact CE2-CD2 3.43Å; F30-Y34 HydrophobicContact CE2-CD2 3.43Å; F30-Y34 VanDerWaalsContact CE2-CD2 3.43Å; F30-Y34 AromaticContact CE2-CE2 3.92Å; F30-Y34 HydrophobicContact CE2-CE2 3.92Å; F30-Y34 AromaticContact CE2-CG 3.87Å; F30-Y34 HydrophobicContact CE2-CG 3.87Å; F30-Y34 HydrophobicContact CG-CD2 4.24Å; F30-Y34 HydrophobicContact CZ-CD2 4.21Å; F30-Y34 HydrophobicContact CZ-CG 4.26Å; F30-Y34 WeakPolarHBondContact O-CB 3.5Å; F30-Y34 PolarHBondContact O-N 3.48Å; F30-W42 HydrophobicContact CD1-CB 4.05Å; F30-W42 HydrophobicContact CE1-CB 3.88Å; F30-W42 HydrophobicContact CZ-CB 4.49Å; F30-F45 HydrophobicContact CE2-CB 4.07Å; F30-F45 AromaticContact CE2-CD1 3.65Å; F30-F45 HydrophobicContact CE2-CD1 3.65Å; F30-F45 HydrophobicContact CE2-CE1 4.21Å; F30-F45 AromaticContact CE2-CG 3.82Å; F30-F45 HydrophobicContact CE2-CG 3.82Å; F30-F45 HydrophobicContact CZ-CB 4.07Å; F30-F45 HydrophobicContact CZ-CD1 4.11Å; F30-F45 HydrophobicContact CZ-CD2 4.17Å; F30-F45 AromaticContact CZ-CG 3.85Å; F30-F45 HydrophobicContact CZ-CG 3.85Å; F30-F56 HydrophobicContact CB-CE2 3.96Å; F30-F56 HydrophobicContact CD2-CE2 4.38Å; F30-V79 HydrophobicContact CD2-CG2 3.81Å; F30-V79 HydrophobicContact CE2-CG2 3.83Å
31	S	89.6	Confident	83.3	Confident	76 Å²	76	79.2 Å²	79.2	53%	0.531	44%	0.435	S	S	.	.	H	α-helix	trans	-64.2	-28.6	177.3	61.9	0	0	0	0	113.3	Q27 M28	Q27-S31 PolarHBondContact O-N 3.07Å; Q27-S31 PolarHBondContact O-OG 2.96Å; M28-S31 PolarHBondContact O-OG 3.06Å
32	K	89.4	Confident	83.1	Confident	141 Å²	141	75.9 Å²	75.9	61%	0.613	42%	0.415	S	S	*	.	H	α-helix	trans	-73.2	-35.4	174.2	-175.5	-175.5	175.4	-168.7	0	113.1	M28 I29 F30 E59	M28-K32 WeakPolarHBondContact O-CB 3.22Å; M28-K32 PolarHBondContact O-N 3.34Å; I29-K32 PolarHBondContact O-N 2.97Å; F30-K32 PolarHBondContact O-N 2.75Å; K32-E59 IonicContact NZ-OE2 2.66Å; K32-E59 PolarHBondContact NZ-OE2 3.01Å
33	C	87.5	Confident	82.9	Confident	34 Å²	34	78.9 Å²	78.9	23%	0.23	43%	0.427	C	S	.	.	H	α-helix	trans	-91.1	-26.6	-175.4	-65.6	0	0	0	0	113.4	I29 F30 F56	I29-C33 PolarHBondContact O-N 2.69Å; I29-C33 PolarHBondContact O-SG 3.3Å; F30-C33 PolarHBondContact O-N 2.95Å; C33-F56 HydrophobicContact CB-CB 4.49Å; C33-F56 HydrophobicContact CB-CD2 4.3Å
34	Y	85.2	Confident	82.7	Confident	22 Å²	22	80 Å²	80	9%	0.086	44%	0.442	C	S	.	.			trans	-123.6	112.7	-176.8	-63.8	-83.7	0	0	0	109.2	F30 T36 F45 L47 S52 F56	F30-Y34 AromaticContact CD2-CD2 3.45Å; F30-Y34 HydrophobicContact CD2-CD2 3.45Å; F30-Y34 VanDerWaalsContact CD2-CD2 3.45Å; F30-Y34 AromaticContact CD2-CE2 3.92Å; F30-Y34 HydrophobicContact CD2-CE2 3.92Å; F30-Y34 HydrophobicContact CD2-CG 4.27Å; F30-Y34 AromaticContact CE2-CD2 3.43Å; F30-Y34 HydrophobicContact CE2-CD2 3.43Å; F30-Y34 VanDerWaalsContact CE2-CD2 3.43Å; F30-Y34 AromaticContact CE2-CE2 3.92Å; F30-Y34 HydrophobicContact CE2-CE2 3.92Å; F30-Y34 AromaticContact CE2-CG 3.87Å; F30-Y34 HydrophobicContact CE2-CG 3.87Å; F30-Y34 HydrophobicContact CG-CD2 4.24Å; F30-Y34 HydrophobicContact CZ-CD2 4.21Å; F30-Y34 HydrophobicContact CZ-CG 4.26Å; F30-Y34 WeakPolarHBondContact O-CB 3.5Å; F30-Y34 PolarHBondContact O-N 3.48Å; Y34-T36 PolarHBondContact O-N 3.48Å; Y34-F45 AromaticContact CD1-CE1 3.93Å; Y34-F45 HydrophobicContact CD1-CE1 3.93Å; Y34-F45 AromaticContact CD1-CZ 3.94Å; Y34-F45 HydrophobicContact CD1-CZ 3.94Å; Y34-F45 AromaticContact CE1-CE1 3.56Å; Y34-F45 HydrophobicContact CE1-CE1 3.56Å; Y34-F45 AromaticContact CE1-CZ 3.9Å; Y34-F45 HydrophobicContact CE1-CZ 3.9Å; Y34-F45 HydrophobicContact CE2-CE1 4.44Å; Y34-F45 AromaticContact CZ-CE1 3.85Å; Y34-L47 HydrophobicContact CE2-CD2 4.23Å; Y34-L47 WeakPolarHBondContact OH-CD2 3.37Å; Y34-S52 WeakPolarHBondContact OH-CB 3.44Å; Y34-S52 PolarHBondContact OH-OG 3.28Å; Y34-F56 HydrophobicContact CE2-CB 4.21Å; Y34-F56 HydrophobicContact CE2-CD2 4.2Å; Y34-F56 HydrophobicContact CE2-CG 4.21Å
35	D	74	Confident	82.5	Confident	162 Å²	162	78.7 Å²	78.7	87%	0.866	43%	0.431	S	S	*	.			trans	-69	-0.7	176.8	-61.4	-44.1	0	0	0	113.2	A37	D35-A37 PolarHBondContact O-N 2.88Å
36	T	66.6	Low	82.4	Confident	81 Å²	81	79.8 Å²	79.8	50%	0.497	44%	0.444	S	S	.	.	S	Bend	trans	-67.1	102.9	175.6	12.6	0	0	0	0	110.1	Y34 A38	Y34-T36 PolarHBondContact O-N 3.48Å; T36-A38 PolarHBondContact O-N 2.9Å
37	A	54.3	Low	82.2	Confident	93 Å²	93	80.2 Å²	80.2	77%	0.769	45%	0.447	S	S	*	.			trans	-43.8	106.6	174.2	0	0	0	0	0	111.6	D35 S39	D35-A37 PolarHBondContact O-N 2.88Å; A37-S39 VanDerWaalsContact C-N 3.31Å; A37-S39 PolarHBondContact O-N 2.77Å
38	A	56.5	Low	81.9	Confident	95 Å²	95	83.1 Å²	83.1	79%	0.785	47%	0.465	S	S	*	.			trans	26.4	58.2	154.6	0	0	0	0	0	115.8	T36 R40	T36-A38 PolarHBondContact O-N 2.9Å; A38-R40 PolarHBondContact O-N 2.94Å
39	S	60.2	Low	81.9	Confident	80 Å²	80	81.5 Å²	81.5	56%	0.559	46%	0.459	S	S	*	.			trans	-59.2	129.7	165	-85.5	0	0	0	0	107.3	A37 D41 W42	A37-S39 VanDerWaalsContact C-N 3.31Å; A37-S39 PolarHBondContact O-N 2.77Å; S39-D41 PolarHBondContact O-N 2.87Å; S39-W42 PolarHBondContact O-N 3.47Å
40	R	69	Low	81.8	Confident	243 Å²	243	91.7 Å²	91.7	92%	0.917	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.2	-27.8	179.7	-72.2	179.4	177.6	173.2	-1	112.2	A38	A38-R40 PolarHBondContact O-N 2.94Å
41	D	84.2	Confident	81.9	Confident	113 Å²	113	100.6 Å²	100.6	60%	0.604	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.2	47	-178.5	-50.1	-44.1	0	0	0	112.6	S39 K43 S44	S39-D41 PolarHBondContact O-N 2.87Å; D41-K43 PolarHBondContact O-N 3.28Å; D41-S44 WeakPolarHBondContact CB-OG 3.49Å; D41-S44 PolarHBondContact O-N 3.36Å; D41-S44 PolarHBondContact O-OG 3Å
42	W	89.4	Confident	81.9	Confident	29 Å²	29	97.6 Å²	97.6	11%	0.11	51%	0.509	C	S	.	.	G	3₁₀ helix	trans	-54.8	-27.3	176.9	65.9	-91.4	0	0	0	113.4	V26 Q27 F30 S39 S44 F45 V79 V83	V26-W42 HydrophobicContact CG1-CZ3 4.06Å; Q27-W42 HydrophobicContact CB-CH2 3.99Å; Q27-W42 HydrophobicContact CB-CZ2 3.83Å; Q27-W42 HydrophobicContact CB-CZ3 4.44Å; Q27-W42 HydrophobicContact CG-CD2 4.38Å; Q27-W42 HydrophobicContact CG-CZ2 4.17Å; F30-W42 HydrophobicContact CD1-CB 4.05Å; F30-W42 HydrophobicContact CE1-CB 3.88Å; F30-W42 HydrophobicContact CZ-CB 4.49Å; S39-W42 PolarHBondContact O-N 3.47Å; W42-S44 PolarHBondContact O-N 2.94Å; W42-F45 VanDerWaalsContact O-CB 3.3Å; W42-F45 WeakPolarHBondContact O-CB 3.23Å; W42-F45 PolarHBondContact O-N 3.49Å; W42-V79 HydrophobicContact CE3-CB 4.5Å; W42-V79 HydrophobicContact CE3-CG1 3.61Å; W42-V79 HydrophobicContact CZ3-CG1 3.52Å; W42-V83 HydrophobicContact CH2-CG2 4.14Å; W42-V83 HydrophobicContact CZ3-CG2 4.15Å
43	K	89.5	Confident	82.1	Confident	65 Å²	65	92.6 Å²	92.6	28%	0.283	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-64.5	-35	176.2	-68.4	179.7	172	-169.9	0	112.9	E23 D41 F45 Q80	E23-K43 VanDerWaalsContact CD-NZ 3.29Å; E23-K43 IonicContact OE1-NZ 3.8Å; E23-K43 PolarHBondContact OE1-NZ 2.92Å; E23-K43 IonicContact OE2-NZ 3.3Å; E23-K43 PolarHBondContact OE2-NZ 3.46Å; D41-K43 PolarHBondContact O-N 3.28Å; K43-F45 VanDerWaalsContact C-N 3.28Å; K43-F45 PolarHBondContact O-N 3.45Å; K43-Q80 HydrophobicContact CB-CB 4.36Å; K43-Q80 WeakPolarHBondContact O-CB 3.39Å; K43-Q80 PolarHBondContact O-N 3.27Å
44	S	89.8	Confident	82.4	Confident	81 Å²	81	96.7 Å²	96.7	57%	0.566	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-85.9	1.1	-178.8	67.4	0	0	0	0	113.4	D41 W42 A46	D41-S44 WeakPolarHBondContact CB-OG 3.49Å; D41-S44 PolarHBondContact O-N 3.36Å; D41-S44 PolarHBondContact O-OG 3Å; W42-S44 PolarHBondContact O-N 2.94Å; S44-A46 PolarHBondContact O-N 3.04Å
45	F	89.5	Confident	82.8	Confident	71 Å²	71	103 Å²	103	31%	0.311	53%	0.53	S	S	.	.			trans	-61.7	125.4	178.9	-174.7	-93.6	0	0	0	111.2	F30 Y34 W42 K43 L47 T78 V79	F30-F45 HydrophobicContact CE2-CB 4.07Å; F30-F45 AromaticContact CE2-CD1 3.65Å; F30-F45 HydrophobicContact CE2-CD1 3.65Å; F30-F45 HydrophobicContact CE2-CE1 4.21Å; F30-F45 AromaticContact CE2-CG 3.82Å; F30-F45 HydrophobicContact CE2-CG 3.82Å; F30-F45 HydrophobicContact CZ-CB 4.07Å; F30-F45 HydrophobicContact CZ-CD1 4.11Å; F30-F45 HydrophobicContact CZ-CD2 4.17Å; F30-F45 AromaticContact CZ-CG 3.85Å; F30-F45 HydrophobicContact CZ-CG 3.85Å; Y34-F45 AromaticContact CD1-CE1 3.93Å; Y34-F45 HydrophobicContact CD1-CE1 3.93Å; Y34-F45 AromaticContact CD1-CZ 3.94Å; Y34-F45 HydrophobicContact CD1-CZ 3.94Å; Y34-F45 AromaticContact CE1-CE1 3.56Å; Y34-F45 HydrophobicContact CE1-CE1 3.56Å; Y34-F45 AromaticContact CE1-CZ 3.9Å; Y34-F45 HydrophobicContact CE1-CZ 3.9Å; Y34-F45 HydrophobicContact CE2-CE1 4.44Å; Y34-F45 AromaticContact CZ-CE1 3.85Å; W42-F45 VanDerWaalsContact O-CB 3.3Å; W42-F45 WeakPolarHBondContact O-CB 3.23Å; W42-F45 PolarHBondContact O-N 3.49Å; K43-F45 VanDerWaalsContact C-N 3.28Å; K43-F45 PolarHBondContact O-N 3.45Å; F45-L47 HydrophobicContact CD1-CD2 4.19Å; F45-L47 HydrophobicContact CE1-CD2 4.36Å; F45-T78 WeakPolarHBondContact O-CA 3.39Å; F45-V79 HydrophobicContact CB-CG2 4Å; F45-V79 HydrophobicContact CD1-CG2 4.2Å; F45-V79 PolarHBondContact O-N 3.05Å; F45-V79 VanDerWaalsContact O-N 3.15Å
46	A	91.5	Very high	83.8	Confident	63 Å²	63	95.3 Å²	95.3	52%	0.521	49%	0.489	S	S	.	.	B	Isolated β-bridge	trans	-82.6	127	179.7	0	0	0	0	0	111.4	S44 D48	S44-A46 PolarHBondContact O-N 3.04Å; A46-D48 VanDerWaalsContact C-N 3.34Å; A46-D48 PolarHBondContact O-N 2.9Å; A46-D48 VanDerWaalsContact O-N 3.15Å
47	L	89.6	Confident	85.2	Confident	10 Å²	10	91.8 Å²	91.8	5%	0.052	47%	0.467	C	S	.	.			trans	-88.1	65.6	-179.9	-61.2	173.4	0	0	0	111.1	Y34 F45 K53 F56 K77 V79 V82	Y34-L47 HydrophobicContact CE2-CD2 4.23Å; Y34-L47 WeakPolarHBondContact OH-CD2 3.37Å; F45-L47 HydrophobicContact CD1-CD2 4.19Å; F45-L47 HydrophobicContact CE1-CD2 4.36Å; L47-K53 HydrophobicContact CB-CB 4.24Å; L47-K53 HydrophobicContact CB-CD 4.03Å; L47-K53 HydrophobicContact CB-CG 4.17Å; L47-K53 HydrophobicContact CD1-CG 4.41Å; L47-F56 HydrophobicContact CD1-CD1 4.33Å; L47-F56 HydrophobicContact CD1-CE1 4.47Å; L47-F56 HydrophobicContact CD2-CD1 4.29Å; L47-K77 WeakPolarHBondContact CB-O 3.33Å; L47-K77 PolarHBondContact N-O 2.76Å; L47-V79 HydrophobicContact CD2-CG2 4.09Å; L47-V79 HydrophobicContact CG-CG2 4.42Å; L47-V82 HydrophobicContact CD1-CG2 3.9Å
48	D	87.8	Confident	87.1	Confident	152 Å²	152	90.5 Å²	90.5	81%	0.813	45%	0.448	S	S	*	.			trans	-80.6	-39.1	-176	-164.9	33.6	0	0	0	113.1	A46 R50	A46-D48 VanDerWaalsContact C-N 3.34Å; A46-D48 PolarHBondContact O-N 2.9Å; A46-D48 VanDerWaalsContact O-N 3.15Å; D48-R50 PolarHBondContact O-N 3.26Å
49	D	90.8	Very high	89	Confident	85 Å²	85	88.2 Å²	88.2	46%	0.455	42%	0.421	S	S	.	.			trans	-71.5	119.8	175.4	173.2	37.5	0	0	0	111.2	R51 S52 K53	D49-R51 VanDerWaalsContact C-N 3.3Å; D49-R51 PolarHBondContact O-N 3Å; D49-R51 PolarHBondContact OD1-N 2.8Å; D49-S52 VanDerWaalsContact CB-OG 3.29Å; D49-S52 WeakPolarHBondContact CB-OG 3.47Å; D49-S52 PolarHBondContact O-OG 3.29Å; D49-S52 VanDerWaalsContact OD2-CB 3.3Å; D49-S52 WeakPolarHBondContact OD2-CB 3.41Å; D49-S52 PolarHBondContact OD2-N 3.1Å; D49-S52 PolarHBondContact OD2-OG 3.01Å; D49-K53 WeakPolarHBondContact O-CB 3.3Å; D49-K53 PolarHBondContact O-N 2.73Å
50	R	92	Very high	90.6	Very high	218 Å²	218	84.4 Å²	84.4	82%	0.823	39%	0.394	S	S	*	.	H	α-helix	trans	-64.4	-35	-176.9	-61	178.3	-172.9	170.6	2.3	112.1	D48 L54	D48-R50 PolarHBondContact O-N 3.26Å; R50-L54 WeakPolarHBondContact O-CB 3.36Å; R50-L54 PolarHBondContact O-N 3.38Å
51	R	92.6	Very high	91.9	Very high	199 Å²	199	75 Å²	75	75%	0.751	36%	0.361	S	S	*	.	H	α-helix	trans	-75.3	-46.2	-177.2	-71.5	-176.8	176.1	-179.3	0	111.2	D49 L54 R55	D49-R51 VanDerWaalsContact C-N 3.3Å; D49-R51 PolarHBondContact O-N 3Å; D49-R51 PolarHBondContact OD1-N 2.8Å; R51-L54 PolarHBondContact O-N 3.47Å; R51-R55 WeakPolarHBondContact O-CG 3.43Å; R51-R55 PolarHBondContact O-N 2.85Å; R51-R55 VanDerWaalsContact O-N 3.08Å
52	S	90.6	Very high	92.4	Very high	12 Å²	12	75.7 Å²	75.7	8%	0.084	36%	0.358	C	S	.	.	H	α-helix	trans	-62.7	-43.5	173.9	64.4	0	0	0	0	111.7	Y34 D49 L54 R55 F56	Y34-S52 WeakPolarHBondContact OH-CB 3.44Å; Y34-S52 PolarHBondContact OH-OG 3.28Å; D49-S52 VanDerWaalsContact CB-OG 3.29Å; D49-S52 WeakPolarHBondContact CB-OG 3.47Å; D49-S52 PolarHBondContact O-OG 3.29Å; D49-S52 VanDerWaalsContact OD2-CB 3.3Å; D49-S52 WeakPolarHBondContact OD2-CB 3.41Å; D49-S52 PolarHBondContact OD2-N 3.1Å; D49-S52 PolarHBondContact OD2-OG 3.01Å; S52-L54 PolarHBondContact O-N 3.03Å; S52-R55 PolarHBondContact O-N 3.17Å; S52-F56 WeakPolarHBondContact O-CB 3.39Å; S52-F56 PolarHBondContact O-N 3.09Å
53	K	93.6	Very high	92.6	Very high	36 Å²	36	77.8 Å²	77.8	16%	0.157	37%	0.374	C	S	.	.	H	α-helix	trans	-56.5	-48.1	174.8	177.3	173.6	171.9	173.9	0	112.1	L47 D49 F56 I57 L73 L76	L47-K53 HydrophobicContact CB-CB 4.24Å; L47-K53 HydrophobicContact CB-CD 4.03Å; L47-K53 HydrophobicContact CB-CG 4.17Å; L47-K53 HydrophobicContact CD1-CG 4.41Å; D49-K53 WeakPolarHBondContact O-CB 3.3Å; D49-K53 PolarHBondContact O-N 2.73Å; K53-F56 PolarHBondContact O-N 3.35Å; K53-I57 HydrophobicContact CD-CD1 4.48Å; K53-I57 HydrophobicContact CG-CD1 3.75Å; K53-I57 VanDerWaalsContact O-CG1 3.3Å; K53-I57 WeakPolarHBondContact O-CG1 3.2Å; K53-I57 PolarHBondContact O-N 3.29Å; K53-L73 PolarHBondContact NZ-O 3.22Å; K53-L76 VanDerWaalsContact CE-O 3.23Å; K53-L76 WeakPolarHBondContact CE-O 3.24Å; K53-L76 PolarHBondContact NZ-O 3.48Å
54	L	93.5	Very high	92.8	Very high	121 Å²	121	75.9 Å²	75.9	63%	0.634	37%	0.367	S	S	*	.	H	α-helix	trans	-63.7	-43.4	179.6	-174	148.9	0	0	0	111.6	R50 R51 S52 I57 D58	R50-L54 WeakPolarHBondContact O-CB 3.36Å; R50-L54 PolarHBondContact O-N 3.38Å; R51-L54 PolarHBondContact O-N 3.47Å; S52-L54 PolarHBondContact O-N 3.03Å; L54-I57 PolarHBondContact O-N 3.42Å; L54-D58 VanDerWaalsContact O-CB 3.3Å; L54-D58 WeakPolarHBondContact O-CB 3.38Å; L54-D58 PolarHBondContact O-N 3.47Å
55	R	94.2	Very high	92.9	Very high	154 Å²	154	74.4 Å²	74.4	58%	0.581	36%	0.364	S	S	*	.	H	α-helix	trans	-62.8	-43.4	176.6	-72.3	-173	-63.6	-153.1	3.1	112.1	R51 S52 D58 E59	R51-R55 WeakPolarHBondContact O-CG 3.43Å; R51-R55 PolarHBondContact O-N 2.85Å; R51-R55 VanDerWaalsContact O-N 3.08Å; S52-R55 PolarHBondContact O-N 3.17Å; R55-D58 PolarHBondContact O-N 2.72Å; R55-E59 WeakPolarHBondContact O-CG 3.28Å; R55-E59 PolarHBondContact O-N 3.07Å
56	F	94.6	Very high	93.1	Very high	0 Å²	0	71.9 Å²	71.9	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-61.9	-46.6	178.3	176.1	-110.8	0	0	0	111.9	V26 I29 F30 C33 Y34 L47 S52 K53 E59 A60 V79 V82	V26-F56 HydrophobicContact CG1-CE2 4.47Å; V26-F56 HydrophobicContact CG1-CZ 3.78Å; I29-F56 HydrophobicContact CB-CE2 4.26Å; I29-F56 HydrophobicContact CG2-CD2 3.77Å; I29-F56 HydrophobicContact CG2-CE2 3.83Å; F30-F56 HydrophobicContact CB-CE2 3.96Å; F30-F56 HydrophobicContact CD2-CE2 4.38Å; C33-F56 HydrophobicContact CB-CB 4.49Å; C33-F56 HydrophobicContact CB-CD2 4.3Å; Y34-F56 HydrophobicContact CE2-CB 4.21Å; Y34-F56 HydrophobicContact CE2-CD2 4.2Å; Y34-F56 HydrophobicContact CE2-CG 4.21Å; L47-F56 HydrophobicContact CD1-CD1 4.33Å; L47-F56 HydrophobicContact CD1-CE1 4.47Å; L47-F56 HydrophobicContact CD2-CD1 4.29Å; S52-F56 WeakPolarHBondContact O-CB 3.39Å; S52-F56 PolarHBondContact O-N 3.09Å; K53-F56 PolarHBondContact O-N 3.35Å; F56-E59 PolarHBondContact O-N 3.05Å; F56-A60 WeakPolarHBondContact O-CB 3.49Å; F56-A60 PolarHBondContact O-N 2.95Å; F56-V79 HydrophobicContact CE1-CG1 4.45Å; F56-V79 HydrophobicContact CZ-CG1 4.04Å; F56-V82 HydrophobicContact CE1-CB 4.16Å; F56-V82 HydrophobicContact CE1-CG1 3.92Å; F56-V82 HydrophobicContact CE1-CG2 4.03Å
57	I	95.3	Very high	93.1	Very high	7 Å²	7	76.6 Å²	76.6	4%	0.036	36%	0.358	C	S	.	.	H	α-helix	trans	-65.2	-44.6	177.2	-67	169	0	0	0	110.8	K53 L54 E59 A60 E61 V68 L73 L76	K53-I57 HydrophobicContact CD-CD1 4.48Å; K53-I57 HydrophobicContact CG-CD1 3.75Å; K53-I57 VanDerWaalsContact O-CG1 3.3Å; K53-I57 WeakPolarHBondContact O-CG1 3.2Å; K53-I57 PolarHBondContact O-N 3.29Å; L54-I57 PolarHBondContact O-N 3.42Å; I57-E59 VanDerWaalsContact C-N 3.32Å; I57-E59 PolarHBondContact O-N 2.86Å; I57-A60 CarbonylContact O-C 3.58Å; I57-A60 PolarHBondContact O-N 3.23Å; I57-A60 VanDerWaalsContact O-N 3.1Å; I57-E61 HydrophobicContact CG2-CG 4.14Å; I57-E61 WeakPolarHBondContact O-CG 3.19Å; I57-E61 PolarHBondContact O-N 3.33Å; I57-V68 HydrophobicContact CG2-CB 4.18Å; I57-V68 HydrophobicContact CG2-CG2 3.69Å; I57-L73 HydrophobicContact CD1-CD2 3.95Å; I57-L76 HydrophobicContact CD1-CD1 3.91Å
58	D	95.6	Very high	93.3	Very high	67 Å²	67	76.8 Å²	76.8	36%	0.358	36%	0.359	S	S	.	.	H	α-helix	trans	-59.8	-40.6	178.9	-177.6	51.3	0	0	0	112.2	L54 R55 K62	L54-D58 VanDerWaalsContact O-CB 3.3Å; L54-D58 WeakPolarHBondContact O-CB 3.38Å; L54-D58 PolarHBondContact O-N 3.47Å; R55-D58 PolarHBondContact O-N 2.72Å; D58-K62 VanDerWaalsContact O-CG 3.28Å; D58-K62 WeakPolarHBondContact O-CG 3.46Å; D58-K62 PolarHBondContact O-N 3.09Å; D58-K62 WeakPolarHBondContact OD1-CE 3.35Å; D58-K62 IonicContact OD1-NZ 2.81Å; D58-K62 WeakPolarHBondContact OD2-CE 3.47Å; D58-K62 IonicContact OD2-NZ 3.38Å; D58-K62 PolarHBondContact OD2-NZ 3.23Å
59	E	95.4	Very high	93.5	Very high	47 Å²	47	72.6 Å²	72.6	22%	0.22	34%	0.337	C	S	.	.	H	α-helix	trans	-67.3	-40.1	173.4	-70.9	-69.4	118.9	0	0	112.1	I29 K32 R55 F56 I57 K62 T63	I29-E59 HydrophobicContact CG2-CB 3.74Å; K32-E59 IonicContact NZ-OE2 2.66Å; K32-E59 PolarHBondContact NZ-OE2 3.01Å; R55-E59 WeakPolarHBondContact O-CG 3.28Å; R55-E59 PolarHBondContact O-N 3.07Å; F56-E59 PolarHBondContact O-N 3.05Å; I57-E59 VanDerWaalsContact C-N 3.32Å; I57-E59 PolarHBondContact O-N 2.86Å; E59-K62 PolarHBondContact O-N 2.94Å; E59-K62 IonicContact OE1-NZ 3.35Å; E59-K62 PolarHBondContact OE1-NZ 3.1Å; E59-T63 WeakPolarHBondContact O-CG2 3.42Å; E59-T63 PolarHBondContact O-N 3.43Å; E59-T63 VanDerWaalsContact O-N 3.09Å; E59-T63 PolarHBondContact O-OG1 2.88Å; E59-T63 VanDerWaalsContact O-OG1 3.07Å
60	A	94.9	Very high	93.7	Very high	0 Å²	0	75.4 Å²	75.4	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-64.3	-40.1	175.4	0	0	0	0	0	113	I29 F56 I57 K62 T63 L64 F86	I29-A60 HydrophobicContact CD1-CB 4.33Å; F56-A60 WeakPolarHBondContact O-CB 3.49Å; F56-A60 PolarHBondContact O-N 2.95Å; I57-A60 CarbonylContact O-C 3.58Å; I57-A60 PolarHBondContact O-N 3.23Å; I57-A60 VanDerWaalsContact O-N 3.1Å; A60-K62 VanDerWaalsContact C-N 3.33Å; A60-K62 PolarHBondContact O-N 3.45Å; A60-T63 PolarHBondContact O-N 3.09Å; A60-T63 PolarHBondContact O-OG1 3.29Å; A60-T63 VanDerWaalsContact O-OG1 3.09Å; A60-L64 WeakPolarHBondContact O-CB 3.46Å; A60-L64 PolarHBondContact O-N 2.95Å; A60-F86 HydrophobicContact CB-CE2 3.67Å; A60-F86 HydrophobicContact CB-CZ 3.81Å
61	E	94.8	Very high	93.7	Very high	46 Å²	46	67.9 Å²	67.9	22%	0.215	33%	0.332	C	S	.	.	H	α-helix	trans	-63.3	-39.7	175.5	-70.4	-168.5	176.2	0	0	111.9	I57 G65 K66 V68	I57-E61 HydrophobicContact CG2-CG 4.14Å; I57-E61 WeakPolarHBondContact O-CG 3.19Å; I57-E61 PolarHBondContact O-N 3.33Å; E61-G65 VanDerWaalsContact O-CA 3.24Å; E61-G65 WeakPolarHBondContact O-CA 3.23Å; E61-G65 PolarHBondContact O-N 3.03Å; E61-K66 WeakPolarHBondContact CG-O 3.38Å; E61-V68 HydrophobicContact CG-CG2 4.11Å; E61-V68 WeakPolarHBondContact OE1-CA 3.17Å; E61-V68 VanDerWaalsContact OE1-CB 3.23Å; E61-V68 WeakPolarHBondContact OE1-CB 3.45Å; E61-V68 WeakPolarHBondContact OE1-CG2 3.47Å; E61-V68 PolarHBondContact OE1-N 3.29Å
62	K	94.6	Very high	93.7	Very high	126 Å²	126	60.9 Å²	60.9	55%	0.548	31%	0.308	S	S	.	.	H	α-helix	trans	-68.7	-40.7	179.3	-72.6	171.2	-161.8	159.5	0	112.6	D58 E59 A60	D58-K62 VanDerWaalsContact O-CG 3.28Å; D58-K62 WeakPolarHBondContact O-CG 3.46Å; D58-K62 PolarHBondContact O-N 3.09Å; D58-K62 WeakPolarHBondContact OD1-CE 3.35Å; D58-K62 IonicContact OD1-NZ 2.81Å; D58-K62 WeakPolarHBondContact OD2-CE 3.47Å; D58-K62 IonicContact OD2-NZ 3.38Å; D58-K62 PolarHBondContact OD2-NZ 3.23Å; E59-K62 PolarHBondContact O-N 2.94Å; E59-K62 IonicContact OE1-NZ 3.35Å; E59-K62 PolarHBondContact OE1-NZ 3.1Å; A60-K62 VanDerWaalsContact C-N 3.33Å; A60-K62 PolarHBondContact O-N 3.45Å
63	T	94.3	Very high	93.9	Very high	74 Å²	74	63.2 Å²	63.2	45%	0.454	32%	0.319	S	S	.	.	H	α-helix	trans	-77.4	-42.1	-177.3	52.4	0	0	0	0	112.2	I29 E59 A60	I29-T63 HydrophobicContact CD1-CG2 3.9Å; I29-T63 WeakPolarHBondContact CD1-OG1 3.41Å; I29-T63 HydrophobicContact CG1-CG2 4.35Å; E59-T63 WeakPolarHBondContact O-CG2 3.42Å; E59-T63 PolarHBondContact O-N 3.43Å; E59-T63 VanDerWaalsContact O-N 3.09Å; E59-T63 PolarHBondContact O-OG1 2.88Å; E59-T63 VanDerWaalsContact O-OG1 3.07Å; A60-T63 PolarHBondContact O-N 3.09Å; A60-T63 PolarHBondContact O-OG1 3.29Å; A60-T63 VanDerWaalsContact O-OG1 3.09Å
64	L	94	Very high	93.9	Very high	24 Å²	24	67.8 Å²	67.8	13%	0.126	34%	0.341	C	S	.	.	H	α-helix	trans	-90.6	-17.3	-176.7	-64.6	169.9	0	0	0	112.6	Y16 V22 V26 A60 K66 F86	Y16-L64 VanDerWaalsContact CE2-O 3.32Å; Y16-L64 WeakPolarHBondContact CE2-O 3.3Å; V22-L64 HydrophobicContact CG2-CD2 4.1Å; V26-L64 HydrophobicContact CG2-CD1 4.1Å; A60-L64 WeakPolarHBondContact O-CB 3.46Å; A60-L64 PolarHBondContact O-N 2.95Å; L64-K66 PolarHBondContact O-N 3.34Å; L64-F86 HydrophobicContact CB-CD1 3.82Å; L64-F86 HydrophobicContact CB-CE1 3.88Å; L64-F86 HydrophobicContact CD1-CB 3.75Å; L64-F86 HydrophobicContact CD1-CD1 3.39Å; L64-F86 HydrophobicContact CD1-CD2 3.73Å; L64-F86 HydrophobicContact CD1-CE1 3.82Å; L64-F86 HydrophobicContact CD1-CE2 4.15Å; L64-F86 HydrophobicContact CD1-CG 3.35Å; L64-F86 HydrophobicContact CD1-CZ 4.2Å; L64-F86 HydrophobicContact CG-CD1 4.24Å; L64-F86 HydrophobicContact CG-CE1 4.49Å
65	G	91.9	Very high	94	Very high	50 Å²	50	66.8 Å²	66.8	52%	0.515	33%	0.333	S	S	.	.			trans	74.9	4.7	177.3	0	0	0	0	0	114.9	E61	E61-G65 VanDerWaalsContact O-CA 3.24Å; E61-G65 WeakPolarHBondContact O-CA 3.23Å; E61-G65 PolarHBondContact O-N 3.03Å
66	K	93.3	Very high	94	Very high	19 Å²	19	59.8 Å²	59.8	8%	0.083	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-100.5	126.5	174	-179.7	-175.7	-172.2	174.7	0	110.2	Y16 E61 L64 F85 F86 V88	Y16-K66 HydrophobicContact CD1-CB 4.38Å; Y16-K66 HydrophobicContact CD1-CD 3.65Å; Y16-K66 HydrophobicContact CD1-CG 4.36Å; Y16-K66 HydrophobicContact CD2-CB 3.62Å; Y16-K66 HydrophobicContact CD2-CD 4.41Å; Y16-K66 HydrophobicContact CD2-CG 4.35Å; Y16-K66 HydrophobicContact CE1-CD 3.82Å; Y16-K66 HydrophobicContact CE2-CB 3.77Å; Y16-K66 HydrophobicContact CG-CB 3.91Å; Y16-K66 HydrophobicContact CG-CD 3.94Å; Y16-K66 HydrophobicContact CG-CG 4.13Å; E61-K66 WeakPolarHBondContact CG-O 3.38Å; L64-K66 PolarHBondContact O-N 3.34Å; K66-F85 HydrophobicContact CD-CD1 4.31Å; K66-F85 HydrophobicContact CD-CE1 3.68Å; K66-F85 HydrophobicContact CD-CZ 4.18Å; K66-F85 HydrophobicContact CG-CE1 4.05Å; K66-F85 HydrophobicContact CG-CZ 4.46Å; K66-F85 PolarHBondContact NZ-O 3.06Å; K66-F86 HydrophobicContact CB-CD1 3.93Å; K66-F86 HydrophobicContact CB-CE1 3.78Å; K66-F86 HydrophobicContact CD-CD1 3.98Å; K66-F86 HydrophobicContact CD-CE1 4.38Å; K66-F86 HydrophobicContact CG-CD1 4.4Å; K66-F86 HydrophobicContact CG-CE1 4.35Å; K66-F86 WeakPolarHBondContact O-CE1 3.32Å; K66-V88 PolarHBondContact NZ-O 3.34Å
67	R	92.4	Very high	94	Very high	162 Å²	162	66.8 Å²	66.8	61%	0.611	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-84.8	137.8	176.5	-64.8	-177.9	179.4	-139	-7.4	111.7
68	V	93.7	Very high	93.9	Very high	13 Å²	13	68.2 Å²	68.2	8%	0.079	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-85.8	131.2	171.9	-172.4	0	0	0	0	109	I57 E61 E72 L73 L76 F85 F86	I57-V68 HydrophobicContact CG2-CB 4.18Å; I57-V68 HydrophobicContact CG2-CG2 3.69Å; E61-V68 HydrophobicContact CG-CG2 4.11Å; E61-V68 WeakPolarHBondContact OE1-CA 3.17Å; E61-V68 VanDerWaalsContact OE1-CB 3.23Å; E61-V68 WeakPolarHBondContact OE1-CB 3.45Å; E61-V68 WeakPolarHBondContact OE1-CG2 3.47Å; E61-V68 PolarHBondContact OE1-N 3.29Å; V68-E72 HydrophobicContact CG1-CB 4.19Å; V68-L73 HydrophobicContact CB-CD2 4.36Å; V68-L73 HydrophobicContact CG1-CD2 3.72Å; V68-L73 HydrophobicContact CG1-CG 4.29Å; V68-L76 HydrophobicContact CG1-CD1 3.79Å; V68-L76 HydrophobicContact CG2-CD1 4.43Å; V68-F85 HydrophobicContact CB-CE1 4.37Å; V68-F85 HydrophobicContact CB-CZ 4.35Å; V68-F85 HydrophobicContact CG1-CZ 4.33Å; V68-F85 HydrophobicContact CG2-CD1 4.17Å; V68-F85 HydrophobicContact CG2-CE1 3.64Å; V68-F85 HydrophobicContact CG2-CZ 4.1Å; V68-F86 HydrophobicContact CG2-CZ 4.31Å
69	L	92.2	Very high	93.8	Very high	65 Å²	65	65 Å²	65	34%	0.34	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-81.4	149.9	176.6	-60	174.6	0	0	0	110.6	L13 S71 E72 L73	L13-L69 HydrophobicContact CD2-CD1 4.31Å; L13-L69 HydrophobicContact CD2-CD2 3.99Å; L13-L69 HydrophobicContact CD2-CG 4.49Å; L69-S71 PolarHBondContact O-N 2.89Å; L69-S71 VanDerWaalsContact O-N 3.07Å; L69-E72 HydrophobicContact CB-CG 4.25Å; L69-E72 PolarHBondContact O-N 3.45Å; L69-L73 PolarHBondContact O-N 3.47Å
70	N	93.1	Very high	93.8	Very high	144 Å²	144	65.4 Å²	65.4	77%	0.77	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-30.7	174.4	-66.3	-1.9	0	0	0	112.7	E72	N70-E72 VanDerWaalsContact C-N 3.31Å; N70-E72 PolarHBondContact O-N 3.06Å
71	S	93.1	Very high	93.8	Very high	59 Å²	59	68 Å²	68	41%	0.413	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-29	175.8	56.5	0	0	0	0	113.3	L69 H74	L69-S71 PolarHBondContact O-N 2.89Å; L69-S71 VanDerWaalsContact O-N 3.07Å; S71-H74 PolarHBondContact O-CE1 3.09Å; S71-H74 PolarHBondContact O-ND1 2.98Å
72	E	93	Very high	93.9	Very high	52 Å²	52	65.8 Å²	65.8	24%	0.243	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-18.7	-175.8	-52.6	-46.1	126.6	0	0	112.5	V68 L69 N70 H74 Q75 L76 F85	V68-E72 HydrophobicContact CG1-CB 4.19Å; L69-E72 HydrophobicContact CB-CG 4.25Å; L69-E72 PolarHBondContact O-N 3.45Å; N70-E72 VanDerWaalsContact C-N 3.31Å; N70-E72 PolarHBondContact O-N 3.06Å; E72-H74 PolarHBondContact O-N 2.88Å; E72-Q75 WeakPolarHBondContact O-CB 3.5Å; E72-Q75 PolarHBondContact O-N 3.49Å; E72-Q75 VanDerWaalsContact OE2-CD 3.27Å; E72-Q75 PolarHBondContact OE2-NE2 2.91Å; E72-Q75 PolarHBondContact OE2-OE1 2.7Å; E72-L76 PolarHBondContact O-N 3.42Å; E72-F85 HydrophobicContact CB-CE2 4.31Å; E72-F85 HydrophobicContact CG-CE2 4.15Å
73	L	94.4	Very high	93.9	Very high	62 Å²	62	59.8 Å²	59.8	33%	0.325	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-30.9	-175.4	-71.3	176.6	0	0	0	114.1	K53 I57 V68 L69 Q75	K53-L73 PolarHBondContact NZ-O 3.22Å; I57-L73 HydrophobicContact CD1-CD2 3.95Å; V68-L73 HydrophobicContact CB-CD2 4.36Å; V68-L73 HydrophobicContact CG1-CD2 3.72Å; V68-L73 HydrophobicContact CG1-CG 4.29Å; L69-L73 PolarHBondContact O-N 3.47Å; L73-Q75 VanDerWaalsContact C-N 3.32Å
74	H	93.6	Very high	94	Very high	131 Å²	131	59.4 Å²	59.4	61%	0.606	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-20.2	178.9	75.8	-84.9	0	0	0	113.4	S71 E72	S71-H74 PolarHBondContact O-CE1 3.09Å; S71-H74 PolarHBondContact O-ND1 2.98Å; E72-H74 PolarHBondContact O-N 2.88Å
75	Q	94.8	Very high	94	Very high	101 Å²	101	60 Å²	60	47%	0.472	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-28.6	177.9	-59.5	176.3	25.1	0	0	111.7	E72 L73 K77	E72-Q75 WeakPolarHBondContact O-CB 3.5Å; E72-Q75 PolarHBondContact O-N 3.49Å; E72-Q75 VanDerWaalsContact OE2-CD 3.27Å; E72-Q75 PolarHBondContact OE2-NE2 2.91Å; E72-Q75 PolarHBondContact OE2-OE1 2.7Å; L73-Q75 VanDerWaalsContact C-N 3.32Å; Q75-K77 PolarHBondContact O-N 2.99Å
76	L	95.1	Very high	94.2	Very high	6 Å²	6	57.7 Å²	57.7	3%	0.031	28%	0.281	C	S	.	.			trans	-74.5	83.1	179.7	-57.8	-179.9	0	0	0	111.4	K53 I57 V68 E72 D81 V82 F85	K53-L76 VanDerWaalsContact CE-O 3.23Å; K53-L76 WeakPolarHBondContact CE-O 3.24Å; K53-L76 PolarHBondContact NZ-O 3.48Å; I57-L76 HydrophobicContact CD1-CD1 3.91Å; V68-L76 HydrophobicContact CG1-CD1 3.79Å; V68-L76 HydrophobicContact CG2-CD1 4.43Å; E72-L76 PolarHBondContact O-N 3.42Å; L76-D81 HydrophobicContact CD2-CB 4.09Å; L76-D81 WeakPolarHBondContact CD2-O 3.09Å; L76-V82 HydrophobicContact CB-CG2 4.23Å; L76-V82 HydrophobicContact CD1-CG2 4.32Å; L76-V82 HydrophobicContact CD2-CG2 4.15Å; L76-V82 HydrophobicContact CG-CG2 4.47Å; L76-F85 HydrophobicContact CD2-CB 3.98Å; L76-F85 HydrophobicContact CD2-CG 4.48Å
77	K	93.9	Very high	94.3	Very high	147 Å²	147	60.8 Å²	60.8	64%	0.639	30%	0.295	S	S	*	.			trans	-96.9	-33.3	-178.6	-65.9	-178.6	-177.4	177	0	112.3	L47 Q75 D81	L47-K77 WeakPolarHBondContact CB-O 3.33Å; L47-K77 PolarHBondContact N-O 2.76Å; Q75-K77 PolarHBondContact O-N 2.99Å; K77-D81 PolarHBondContact N-OD2 3.46Å
78	T	94	Very high	94.4	Very high	37 Å²	37	57 Å²	57	23%	0.227	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-119.4	164.3	-178.8	63.8	0	0	0	0	110.7	F45 Q80 D81 V82	F45-T78 WeakPolarHBondContact O-CA 3.39Å; T78-Q80 PolarHBondContact O-N 3.27Å; T78-D81 PolarHBondContact N-OD2 2.88Å; T78-D81 WeakPolarHBondContact O-CB 3.37Å; T78-D81 PolarHBondContact O-N 2.93Å; T78-D81 PolarHBondContact OG1-N 3.2Å; T78-D81 PolarHBondContact OG1-OD1 3.27Å; T78-D81 PolarHBondContact OG1-OD2 3.01Å; T78-V82 PolarHBondContact O-N 3.44Å
79	V	93.9	Very high	94.5	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-64.9	-33.1	173.7	-179.4	0	0	0	0	111.1	V26 F30 W42 F45 L47 F56 D81 V82 V83	V26-V79 HydrophobicContact CG1-CG1 4.09Å; F30-V79 HydrophobicContact CD2-CG2 3.81Å; F30-V79 HydrophobicContact CE2-CG2 3.83Å; W42-V79 HydrophobicContact CE3-CB 4.5Å; W42-V79 HydrophobicContact CE3-CG1 3.61Å; W42-V79 HydrophobicContact CZ3-CG1 3.52Å; F45-V79 HydrophobicContact CB-CG2 4Å; F45-V79 HydrophobicContact CD1-CG2 4.2Å; F45-V79 PolarHBondContact O-N 3.05Å; F45-V79 VanDerWaalsContact O-N 3.15Å; L47-V79 HydrophobicContact CD2-CG2 4.09Å; L47-V79 HydrophobicContact CG-CG2 4.42Å; F56-V79 HydrophobicContact CE1-CG1 4.45Å; F56-V79 HydrophobicContact CZ-CG1 4.04Å; V79-D81 VanDerWaalsContact C-N 3.32Å; V79-D81 PolarHBondContact O-N 2.63Å; V79-V82 WeakPolarHBondContact O-CB 3.32Å; V79-V82 PolarHBondContact O-N 3.34Å; V79-V82 VanDerWaalsContact O-N 3.09Å; V79-V83 PolarHBondContact O-N 3.39Å
80	Q	94.7	Very high	94.5	Very high	56 Å²	56	58.6 Å²	58.6	26%	0.262	30%	0.303	S	S	.	.	H	α-helix	trans	-57	-44.5	173	-177.5	57.6	36.3	0	0	111.9	K43 T78 V82 V83 D84	K43-Q80 HydrophobicContact CB-CB 4.36Å; K43-Q80 WeakPolarHBondContact O-CB 3.39Å; K43-Q80 PolarHBondContact O-N 3.27Å; T78-Q80 PolarHBondContact O-N 3.27Å; Q80-V82 PolarHBondContact O-N 2.91Å; Q80-V83 WeakPolarHBondContact O-CB 3.37Å; Q80-V83 PolarHBondContact O-N 3.44Å; Q80-V83 VanDerWaalsContact O-N 3.1Å; Q80-D84 PolarHBondContact NE2-OD1 2.81Å; Q80-D84 PolarHBondContact NE2-OD2 3.27Å; Q80-D84 PolarHBondContact O-N 3.42Å
81	D	95.8	Very high	94.4	Very high	53 Å²	53	57.5 Å²	57.5	28%	0.283	29%	0.293	S	S	.	.	H	α-helix	trans	-59.7	-34.1	177.5	-56	-37.4	0	0	0	111.7	L76 K77 T78 V79 F85	L76-D81 HydrophobicContact CD2-CB 4.09Å; L76-D81 WeakPolarHBondContact CD2-O 3.09Å; K77-D81 PolarHBondContact N-OD2 3.46Å; T78-D81 PolarHBondContact N-OD2 2.88Å; T78-D81 WeakPolarHBondContact O-CB 3.37Å; T78-D81 PolarHBondContact O-N 2.93Å; T78-D81 PolarHBondContact OG1-N 3.2Å; T78-D81 PolarHBondContact OG1-OD1 3.27Å; T78-D81 PolarHBondContact OG1-OD2 3.01Å; V79-D81 VanDerWaalsContact C-N 3.32Å; V79-D81 PolarHBondContact O-N 2.63Å; D81-F85 WeakPolarHBondContact O-CB 3.38Å; D81-F85 PolarHBondContact O-N 2.73Å
82	V	95.1	Very high	94.1	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-70.1	-45	176.6	-179.6	0	0	0	0	110.6	L47 F56 L76 T78 V79 Q80 D84 F85 F86	L47-V82 HydrophobicContact CD1-CG2 3.9Å; F56-V82 HydrophobicContact CE1-CB 4.16Å; F56-V82 HydrophobicContact CE1-CG1 3.92Å; F56-V82 HydrophobicContact CE1-CG2 4.03Å; L76-V82 HydrophobicContact CB-CG2 4.23Å; L76-V82 HydrophobicContact CD1-CG2 4.32Å; L76-V82 HydrophobicContact CD2-CG2 4.15Å; L76-V82 HydrophobicContact CG-CG2 4.47Å; T78-V82 PolarHBondContact O-N 3.44Å; V79-V82 WeakPolarHBondContact O-CB 3.32Å; V79-V82 PolarHBondContact O-N 3.34Å; V79-V82 VanDerWaalsContact O-N 3.09Å; Q80-V82 PolarHBondContact O-N 2.91Å; V82-D84 VanDerWaalsContact C-N 3.32Å; V82-D84 PolarHBondContact O-N 3.31Å; V82-F85 WeakPolarHBondContact O-CB 3.37Å; V82-F85 PolarHBondContact O-N 3.23Å; V82-F86 HydrophobicContact CG1-CD2 3.7Å; V82-F86 HydrophobicContact CG1-CE2 3.6Å; V82-F86 WeakPolarHBondContact O-CD2 3.13Å; V82-F86 PolarHBondContact O-N 2.89Å
83	V	95.4	Very high	93.9	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-58	-47.4	174.7	173.4	0	0	0	0	110.5	E23 V26 W42 V79 Q80 F85 F86 K87	E23-V83 HydrophobicContact CG-CG1 3.94Å; V26-V83 HydrophobicContact CB-CG2 4.12Å; V26-V83 HydrophobicContact CG1-CG2 3.78Å; V26-V83 HydrophobicContact CG2-CG2 4.39Å; W42-V83 HydrophobicContact CH2-CG2 4.14Å; W42-V83 HydrophobicContact CZ3-CG2 4.15Å; V79-V83 PolarHBondContact O-N 3.39Å; Q80-V83 WeakPolarHBondContact O-CB 3.37Å; Q80-V83 PolarHBondContact O-N 3.44Å; Q80-V83 VanDerWaalsContact O-N 3.1Å; V83-F85 VanDerWaalsContact C-N 3.33Å; V83-F85 PolarHBondContact O-N 3.07Å; V83-F86 PolarHBondContact O-N 3.35Å; V83-K87 HydrophobicContact CG1-CD 4.06Å; V83-K87 HydrophobicContact CG1-CG 4.43Å; V83-K87 WeakPolarHBondContact O-CG 3.05Å; V83-K87 PolarHBondContact O-N 3.49Å
84	D	95.6	Very high	93.6	Very high	67 Å²	67	57.2 Å²	57.2	36%	0.358	29%	0.292	S	S	.	.	H	α-helix	trans	-64.5	-39.4	-179.6	-67.9	-26.4	0	0	0	111.4	Q80 V82 F86 K87 V88	Q80-D84 PolarHBondContact NE2-OD1 2.81Å; Q80-D84 PolarHBondContact NE2-OD2 3.27Å; Q80-D84 PolarHBondContact O-N 3.42Å; V82-D84 VanDerWaalsContact C-N 3.32Å; V82-D84 PolarHBondContact O-N 3.31Å; D84-F86 PolarHBondContact O-N 2.81Å; D84-K87 PolarHBondContact O-N 2.86Å; D84-V88 WeakPolarHBondContact O-CG2 3.39Å; D84-V88 PolarHBondContact O-N 3.16Å
85	F	95.9	Very high	93.5	Very high	37 Å²	37	55.4 Å²	55.4	16%	0.162	29%	0.294	C	S	.	.	H	α-helix	trans	-58.6	-46	173.2	176.4	-92.9	0	0	0	112.1	K66 V68 E72 L76 D81 V82 V83 K87 V88	K66-F85 HydrophobicContact CD-CD1 4.31Å; K66-F85 HydrophobicContact CD-CE1 3.68Å; K66-F85 HydrophobicContact CD-CZ 4.18Å; K66-F85 HydrophobicContact CG-CE1 4.05Å; K66-F85 HydrophobicContact CG-CZ 4.46Å; K66-F85 PolarHBondContact NZ-O 3.06Å; V68-F85 HydrophobicContact CB-CE1 4.37Å; V68-F85 HydrophobicContact CB-CZ 4.35Å; V68-F85 HydrophobicContact CG1-CZ 4.33Å; V68-F85 HydrophobicContact CG2-CD1 4.17Å; V68-F85 HydrophobicContact CG2-CE1 3.64Å; V68-F85 HydrophobicContact CG2-CZ 4.1Å; E72-F85 HydrophobicContact CB-CE2 4.31Å; E72-F85 HydrophobicContact CG-CE2 4.15Å; L76-F85 HydrophobicContact CD2-CB 3.98Å; L76-F85 HydrophobicContact CD2-CG 4.48Å; D81-F85 WeakPolarHBondContact O-CB 3.38Å; D81-F85 PolarHBondContact O-N 2.73Å; V82-F85 WeakPolarHBondContact O-CB 3.37Å; V82-F85 PolarHBondContact O-N 3.23Å; V83-F85 VanDerWaalsContact C-N 3.33Å; V83-F85 PolarHBondContact O-N 3.07Å; F85-K87 VanDerWaalsContact C-N 3.34Å; F85-V88 PolarHBondContact O-N 3.36Å
86	F	95.7	Very high	93.4	Very high	1 Å²	1	56.3 Å²	56.3	0%	0.004	29%	0.294	C	S	.	.	H	α-helix	trans	-77.4	-16.2	-179.6	-75.7	-73.8	0	0	0	113.7	Y16 V22 A60 L64 K66 V68 V82 V83 D84 V88	Y16-F86 WeakPolarHBondContact CE1-O 3.29Å; Y16-F86 PolarHBondContact OH-O 2.89Å; V22-F86 HydrophobicContact CG1-CB 3.75Å; A60-F86 HydrophobicContact CB-CE2 3.67Å; A60-F86 HydrophobicContact CB-CZ 3.81Å; L64-F86 HydrophobicContact CB-CD1 3.82Å; L64-F86 HydrophobicContact CB-CE1 3.88Å; L64-F86 HydrophobicContact CD1-CB 3.75Å; L64-F86 HydrophobicContact CD1-CD1 3.39Å; L64-F86 HydrophobicContact CD1-CD2 3.73Å; L64-F86 HydrophobicContact CD1-CE1 3.82Å; L64-F86 HydrophobicContact CD1-CE2 4.15Å; L64-F86 HydrophobicContact CD1-CG 3.35Å; L64-F86 HydrophobicContact CD1-CZ 4.2Å; L64-F86 HydrophobicContact CG-CD1 4.24Å; L64-F86 HydrophobicContact CG-CE1 4.49Å; K66-F86 HydrophobicContact CB-CD1 3.93Å; K66-F86 HydrophobicContact CB-CE1 3.78Å; K66-F86 HydrophobicContact CD-CD1 3.98Å; K66-F86 HydrophobicContact CD-CE1 4.38Å; K66-F86 HydrophobicContact CG-CD1 4.4Å; K66-F86 HydrophobicContact CG-CE1 4.35Å; K66-F86 WeakPolarHBondContact O-CE1 3.32Å; V68-F86 HydrophobicContact CG2-CZ 4.31Å; V82-F86 HydrophobicContact CG1-CD2 3.7Å; V82-F86 HydrophobicContact CG1-CE2 3.6Å; V82-F86 WeakPolarHBondContact O-CD2 3.13Å; V82-F86 PolarHBondContact O-N 2.89Å; V83-F86 PolarHBondContact O-N 3.35Å; D84-F86 PolarHBondContact O-N 2.81Å; F86-V88 VanDerWaalsContact C-N 3.33Å
87	K	95.5	Very high	93.2	Very high	83 Å²	83	57 Å²	57	36%	0.361	30%	0.3	S	S	.	.	H	α-helix	trans	-76.4	-19.4	171.1	-76.9	177.6	175.8	-178.1	0	113.8	P18 V22 E23 V83 D84 F85 P89	P18-K87 WeakPolarHBondContact CG-O 3.43Å; V22-K87 HydrophobicContact CG1-CG 4.2Å; E23-K87 WeakPolarHBondContact OE1-CE 3.44Å; E23-K87 IonicContact OE1-NZ 2.69Å; E23-K87 PolarHBondContact OE1-NZ 2.95Å; V83-K87 HydrophobicContact CG1-CD 4.06Å; V83-K87 HydrophobicContact CG1-CG 4.43Å; V83-K87 WeakPolarHBondContact O-CG 3.05Å; V83-K87 PolarHBondContact O-N 3.49Å; D84-K87 PolarHBondContact O-N 2.86Å; F85-K87 VanDerWaalsContact C-N 3.34Å; K87-P89 WeakPolarHBondContact O-CD 3.32Å
88	V	94.8	Very high	93.1	Very high	84 Å²	84	55.5 Å²	55.5	51%	0.509	29%	0.29	S	S	.	.	S	Bend	trans	-78.7	121.3	-178.2	174.9	0	0	0	0	110.8	K66 D84 F85 F86	K66-V88 PolarHBondContact NZ-O 3.34Å; D84-V88 WeakPolarHBondContact O-CG2 3.39Å; D84-V88 PolarHBondContact O-N 3.16Å; F85-V88 PolarHBondContact O-N 3.36Å; F86-V88 VanDerWaalsContact C-N 3.33Å
89	P	94.9	Very high	93.1	Very high	78 Å²	78	57.9 Å²	57.9	51%	0.506	30%	0.301	S	S	.	.			trans	-69.2	153.7	175.2	29.5	-34.7	0	0	0	111.6	Y16 K87	Y16-P89 WeakPolarHBondContact O-CA 3.42Å; K87-P89 WeakPolarHBondContact O-CD 3.32Å
90	V	92.3	Very high	93	Very high	33 Å²	33	58.8 Å²	58.8	20%	0.2	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-126.2	113.7	177.3	-176.7	0	0	0	0	109.7	L13 A15 Y16	L13-V90 HydrophobicContact CB-CG1 4.25Å; L13-V90 HydrophobicContact CD1-CG1 4.1Å; A15-V90 WeakPolarHBondContact CA-O 3.39Å; Y16-V90 PolarHBondContact N-O 3.44Å; Y16-V90 PolarHBondContact O-N 2.99Å
91	E	90.4	Very high	92.9	Very high	120 Å²	120	63.1 Å²	63.1	56%	0.561	32%	0.322	S	S	*	.			trans	-96.7	132.8	174	-65.7	-177.7	-167.1	0	0	111.2	I93 R98	E91-I93 VanDerWaalsContact C-N 3.33Å; E91-R98 IonicContact OE2-CZ 3.33Å; E91-R98 IonicContact OE2-NE 3.27Å; E91-R98 PolarHBondContact OE2-NE 3.48Å; E91-R98 IonicContact OE2-NH2 2.72Å; E91-R98 PolarHBondContact OE2-NH2 3.2Å
92	V	87.9	Confident	92.7	Very high	59 Å²	59	62.1 Å²	62.1	36%	0.358	32%	0.32	S	S	.	.			trans	-99.6	19.3	179.1	-167.1	0	0	0	0	111.3	L10 L13 A15	L10-V92 WeakPolarHBondContact CD1-O 3.34Å; L13-V92 WeakPolarHBondContact O-CG2 3.34Å; A15-V92 HydrophobicContact CB-CG2 3.96Å
93	I	88	Confident	92.4	Very high	70 Å²	70	70.4 Å²	70.4	36%	0.359	36%	0.364	S	S	.	.			trans	-101.6	134.9	-177.2	-55.4	176.8	0	0	0	109	E91 S97 R98	E91-I93 VanDerWaalsContact C-N 3.33Å; I93-S97 VanDerWaalsContact CG2-CB 3.42Å; I93-R98 HydrophobicContact CG2-CB 4.32Å
94	T	88.8	Confident	92.2	Very high	39 Å²	39	75.4 Å²	75.4	24%	0.239	40%	0.399	C	S	.	.			trans	-67.8	153.7	175.3	67.4	0	0	0	0	110.6	L10 Y96 S97 R98	L10-T94 HydrophobicContact CD1-CG2 3.88Å; L10-T94 HydrophobicContact CD2-CG2 4.39Å; L10-T94 HydrophobicContact CG-CG2 4.02Å; T94-Y96 PolarHBondContact O-N 2.66Å; T94-S97 PolarHBondContact O-N 2.96Å; T94-S97 WeakPolarHBondContact OG1-CB 3.19Å; T94-S97 PolarHBondContact OG1-N 3.39Å; T94-S97 PolarHBondContact OG1-OG 3.18Å; T94-R98 PolarHBondContact O-N 2.76Å
95	S	90.8	Very high	92	Very high	93 Å²	93	74.5 Å²	74.5	65%	0.65	39%	0.394	S	S	*	.	H	α-helix	trans	-55.3	-37.4	173.8	50.2	0	0	0	0	112.1	R98 L99	S95-R98 PolarHBondContact O-N 2.99Å; S95-L99 WeakPolarHBondContact O-CB 2.95Å; S95-L99 PolarHBondContact O-N 3.2Å
96	Y	92.1	Very high	91.9	Very high	120 Å²	120	76 Å²	76	47%	0.471	41%	0.407	S	S	.	.	H	α-helix	trans	-61.1	-53.3	174.6	-178.1	-102.4	0	0	0	112.4	T94 R98 L99 A100 I111 L112	T94-Y96 PolarHBondContact O-N 2.66Å; Y96-R98 VanDerWaalsContact C-N 3.3Å; Y96-R98 PolarHBondContact O-N 2.98Å; Y96-L99 PolarHBondContact O-N 2.96Å; Y96-A100 WeakPolarHBondContact O-CB 3.32Å; Y96-A100 PolarHBondContact O-N 3.23Å; Y96-I111 HydrophobicContact CD2-CG2 4.47Å; Y96-I111 HydrophobicContact CE1-CG2 4.25Å; Y96-I111 HydrophobicContact CE2-CG2 3.63Å; Y96-I111 VanDerWaalsContact CZ-CG2 3.5Å; Y96-I111 WeakPolarHBondContact OH-CG2 3.48Å; Y96-L112 PolarHBondContact OH-O 2.92Å
97	S	91.3	Very high	91.8	Very high	20 Å²	20	85.8 Å²	85.8	14%	0.14	45%	0.45	C	S	.	.	H	α-helix	trans	-60.7	-38.8	177	-68.9	0	0	0	0	112.1	I93 T94 L99 A100 R101 E113	I93-S97 VanDerWaalsContact CG2-CB 3.42Å; T94-S97 PolarHBondContact O-N 2.96Å; T94-S97 WeakPolarHBondContact OG1-CB 3.19Å; T94-S97 PolarHBondContact OG1-N 3.39Å; T94-S97 PolarHBondContact OG1-OG 3.18Å; S97-L99 VanDerWaalsContact C-N 3.34Å; S97-L99 PolarHBondContact O-N 3.29Å; S97-A100 PolarHBondContact O-N 3.16Å; S97-R101 WeakPolarHBondContact O-CB 3.46Å; S97-R101 VanDerWaalsContact O-CG 3.29Å; S97-R101 WeakPolarHBondContact O-CG 3.33Å; S97-R101 PolarHBondContact O-N 3.44Å; S97-R101 VanDerWaalsContact O-N 3.07Å; S97-E113 VanDerWaalsContact CB-OE1 3.28Å; S97-E113 WeakPolarHBondContact CB-OE1 3.45Å; S97-E113 PolarHBondContact OG-OE1 2.74Å
98	R	92.7	Very high	91.8	Very high	116 Å²	116	88.6 Å²	88.6	44%	0.438	47%	0.469	S	S	.	.	H	α-helix	trans	-61.6	-44.2	176.3	-170.7	-175.4	-60.9	106.7	2.8	111	E91 I93 T94 S95 Y96 S102	E91-R98 IonicContact OE2-CZ 3.33Å; E91-R98 IonicContact OE2-NE 3.27Å; E91-R98 PolarHBondContact OE2-NE 3.48Å; E91-R98 IonicContact OE2-NH2 2.72Å; E91-R98 PolarHBondContact OE2-NH2 3.2Å; I93-R98 HydrophobicContact CG2-CB 4.32Å; T94-R98 PolarHBondContact O-N 2.76Å; S95-R98 PolarHBondContact O-N 2.99Å; Y96-R98 VanDerWaalsContact C-N 3.3Å; Y96-R98 PolarHBondContact O-N 2.98Å; R98-S102 PolarHBondContact O-N 2.89Å; R98-S102 VanDerWaalsContact O-N 3.13Å
99	L	93.5	Very high	91.8	Very high	86 Å²	86	87.8 Å²	87.8	45%	0.45	46%	0.461	S	S	.	.	H	α-helix	trans	-70.2	-43.2	-179.8	-164.7	154	0	0	0	111.1	S95 Y96 S97 R101 S102 L105 I111	S95-L99 WeakPolarHBondContact O-CB 2.95Å; S95-L99 PolarHBondContact O-N 3.2Å; Y96-L99 PolarHBondContact O-N 2.96Å; S97-L99 VanDerWaalsContact C-N 3.34Å; S97-L99 PolarHBondContact O-N 3.29Å; L99-R101 VanDerWaalsContact C-N 3.25Å; L99-R101 PolarHBondContact O-N 3.06Å; L99-S102 WeakPolarHBondContact O-CB 3.42Å; L99-S102 PolarHBondContact O-N 3.39Å; L99-S102 VanDerWaalsContact O-N 3.1Å; L99-S102 PolarHBondContact O-OG 3.18Å; L99-L105 HydrophobicContact CD2-CD2 3.73Å; L99-L105 HydrophobicContact CG-CD2 4.35Å; L99-I111 HydrophobicContact CD2-CD1 2.95Å; L99-I111 HydrophobicContact CD2-CG1 4.45Å; L99-I111 HydrophobicContact CG-CD1 4.42Å
100	A	92.7	Very high	91.6	Very high	20 Å²	20	91.9 Å²	91.9	17%	0.165	47%	0.473	C	S	.	.	H	α-helix	trans	-58.8	-36	176.7	0	0	0	0	0	112.8	Y96 S97 I111 E113	Y96-A100 WeakPolarHBondContact O-CB 3.32Å; Y96-A100 PolarHBondContact O-N 3.23Å; S97-A100 PolarHBondContact O-N 3.16Å; A100-I111 HydrophobicContact CB-CB 4.16Å; A100-I111 HydrophobicContact CB-CG2 3.55Å; A100-E113 HydrophobicContact CB-CB 4.15Å
101	R	91.7	Very high	91.7	Very high	146 Å²	146	92.6 Å²	92.6	55%	0.551	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	0	178.6	-63.1	175.8	-172.3	-175.6	3.3	114.2	S97 L99 E113	S97-R101 WeakPolarHBondContact O-CB 3.46Å; S97-R101 VanDerWaalsContact O-CG 3.29Å; S97-R101 WeakPolarHBondContact O-CG 3.33Å; S97-R101 PolarHBondContact O-N 3.44Å; S97-R101 VanDerWaalsContact O-N 3.07Å; L99-R101 VanDerWaalsContact C-N 3.25Å; L99-R101 PolarHBondContact O-N 3.06Å; R101-E113 IonicContact CZ-OE1 2.77Å; R101-E113 IonicContact CZ-OE2 3.89Å; R101-E113 IonicContact NE-OE1 3.39Å; R101-E113 PolarHBondContact NE-OE1 3.3Å; R101-E113 IonicContact NE-OE2 2.75Å; R101-E113 PolarHBondContact NE-OE2 3.39Å; R101-E113 VanDerWaalsContact NH2-CD 3.31Å; R101-E113 IonicContact NH2-OE1 3.13Å; R101-E113 PolarHBondContact NH2-OE1 3.39Å; R101-E113 IonicContact NH2-OE2 2.71Å; R101-E113 PolarHBondContact NH2-OE2 2.86Å; R101-E113 VanDerWaalsContact NH2-OE2 3.13Å
102	S	91.4	Very high	91.7	Very high	33 Å²	33	92.4 Å²	92.4	23%	0.231	48%	0.478	C	S	.	.			trans	-73.9	137.7	-177	69.6	0	0	0	0	111.1	R98 L99 S104 L105	R98-S102 PolarHBondContact O-N 2.89Å; R98-S102 VanDerWaalsContact O-N 3.13Å; L99-S102 WeakPolarHBondContact O-CB 3.42Å; L99-S102 PolarHBondContact O-N 3.39Å; L99-S102 VanDerWaalsContact O-N 3.1Å; L99-S102 PolarHBondContact O-OG 3.18Å; S102-S104 PolarHBondContact O-N 2.98Å; S102-L105 WeakPolarHBondContact OG-CD2 3.35Å; S102-L105 WeakPolarHBondContact OG-CG 3.42Å
103	N	88	Confident	91.8	Very high	174 Å²	174	92.7 Å²	92.7	93%	0.93	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-6.3	177.1	-69.8	-20.2	0	0	0	113.2
104	S	91.6	Very high	91.7	Very high	105 Å²	105	95.6 Å²	95.6	73%	0.734	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	18.1	-174.6	54.1	0	0	0	0	113.6	S102	S102-S104 PolarHBondContact O-N 2.98Å
105	L	91.6	Very high	91.5	Very high	48 Å²	48	96.6 Å²	96.6	25%	0.251	50%	0.504	S	S	.	.			trans	-71.5	138.1	178.2	-66.2	177.7	0	0	0	111.3	L99 S102 L109	L99-L105 HydrophobicContact CD2-CD2 3.73Å; L99-L105 HydrophobicContact CG-CD2 4.35Å; S102-L105 WeakPolarHBondContact OG-CD2 3.35Å; S102-L105 WeakPolarHBondContact OG-CG 3.42Å; L105-L109 HydrophobicContact CB-CD2 4.35Å; L105-L109 HydrophobicContact CD1-CD2 4.08Å; L105-L109 HydrophobicContact CD2-CD2 3.72Å; L105-L109 HydrophobicContact CG-CD2 4.25Å
106	P	95	Very high	91.2	Very high	69 Å²	69	97.5 Å²	97.5	45%	0.448	51%	0.505	S	S	.	.			trans	-55.5	144.9	168.2	-25	34.5	0	0	0	111.5	N108 L109	P106-N108 WeakPolarHBondContact CB-OD1 2.77Å; P106-N108 PolarHBondContact O-N 3.3Å; P106-L109 HydrophobicContact CB-CB 4.27Å; P106-L109 HydrophobicContact CG-CB 4.5Å; P106-L109 PolarHBondContact O-N 3.5Å
107	K	93.2	Very high	90.8	Very high	205 Å²	205	96.3 Å²	96.3	89%	0.891	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-24	-177.3	-66.1	-176.6	179.6	-179.6	0	114.2
108	N	95.2	Very high	90.6	Very high	143 Å²	143	98.2 Å²	98.2	77%	0.765	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	3.3	179.3	64.1	-45.5	0	0	0	113.5	P106	P106-N108 WeakPolarHBondContact CB-OD1 2.77Å; P106-N108 PolarHBondContact O-N 3.3Å
109	L	94.2	Very high	90.4	Very high	66 Å²	66	94.1 Å²	94.1	35%	0.346	49%	0.491	S	S	.	.			trans	-116.9	114.6	-178.4	-176.1	163.7	0	0	0	109.2	L105 P106 I111	L105-L109 HydrophobicContact CB-CD2 4.35Å; L105-L109 HydrophobicContact CD1-CD2 4.08Å; L105-L109 HydrophobicContact CD2-CD2 3.72Å; L105-L109 HydrophobicContact CG-CD2 4.25Å; P106-L109 HydrophobicContact CB-CB 4.27Å; P106-L109 HydrophobicContact CG-CB 4.5Å; P106-L109 PolarHBondContact O-N 3.5Å; L109-I111 HydrophobicContact CD2-CD1 3.46Å; L109-I111 VanDerWaalsContact CD2-CD1 3.46Å; L109-I111 HydrophobicContact CD2-CG1 3.64Å
110	H	91.5	Very high	90	Very high	165 Å²	165	91 Å²	91	76%	0.764	48%	0.476	S	S	*	.			trans	-118.1	129.1	172.7	-63.6	-73.7	0	0	0	109.2
111	I	93.7	Very high	89.6	Confident	47 Å²	47	97 Å²	97	24%	0.241	51%	0.505	C	S	.	.			trans	-117.3	130.6	177.5	-71.3	162.6	0	0	0	108.9	Y96 L99 A100 L109	Y96-I111 HydrophobicContact CD2-CG2 4.47Å; Y96-I111 HydrophobicContact CE1-CG2 4.25Å; Y96-I111 HydrophobicContact CE2-CG2 3.63Å; Y96-I111 VanDerWaalsContact CZ-CG2 3.5Å; Y96-I111 WeakPolarHBondContact OH-CG2 3.48Å; L99-I111 HydrophobicContact CD2-CD1 2.95Å; L99-I111 HydrophobicContact CD2-CG1 4.45Å; L99-I111 HydrophobicContact CG-CD1 4.42Å; A100-I111 HydrophobicContact CB-CB 4.16Å; A100-I111 HydrophobicContact CB-CG2 3.55Å; L109-I111 HydrophobicContact CD2-CD1 3.46Å; L109-I111 VanDerWaalsContact CD2-CD1 3.46Å; L109-I111 HydrophobicContact CD2-CG1 3.64Å
112	L	91.4	Very high	89.4	Confident	116 Å²	116	94.5 Å²	94.5	61%	0.607	51%	0.506	S	S	*	.			trans	-91.8	107.8	177.5	-58.7	177.6	0	0	0	108.7	Y96 D114 V116	Y96-L112 PolarHBondContact OH-O 2.92Å; L112-D114 VanDerWaalsContact C-N 3.32Å; L112-D114 PolarHBondContact O-N 2.74Å; L112-V116 HydrophobicContact CD1-CG2 4.41Å
113	E	89.5	Confident	89.1	Confident	65 Å²	65	95.8 Å²	95.8	30%	0.304	51%	0.51	S	S	.	.	S	Bend	trans	-62	-43.8	179.1	-176.6	171.7	-169.6	0	0	111.3	S97 A100 R101	S97-E113 VanDerWaalsContact CB-OE1 3.28Å; S97-E113 WeakPolarHBondContact CB-OE1 3.45Å; S97-E113 PolarHBondContact OG-OE1 2.74Å; A100-E113 HydrophobicContact CB-CB 4.15Å; R101-E113 IonicContact CZ-OE1 2.77Å; R101-E113 IonicContact CZ-OE2 3.89Å; R101-E113 IonicContact NE-OE1 3.39Å; R101-E113 PolarHBondContact NE-OE1 3.3Å; R101-E113 IonicContact NE-OE2 2.75Å; R101-E113 PolarHBondContact NE-OE2 3.39Å; R101-E113 VanDerWaalsContact NH2-CD 3.31Å; R101-E113 IonicContact NH2-OE1 3.13Å; R101-E113 PolarHBondContact NH2-OE1 3.39Å; R101-E113 IonicContact NH2-OE2 2.71Å; R101-E113 PolarHBondContact NH2-OE2 2.86Å; R101-E113 VanDerWaalsContact NH2-OE2 3.13Å
114	D	86.3	Confident	89.1	Confident	131 Å²	131	92 Å²	92	70%	0.701	49%	0.494	S	S	*	.	S	Bend	trans	-86.9	138.1	178.1	-70.9	-39.2	0	0	0	111.5	L112 V116	L112-D114 VanDerWaalsContact C-N 3.32Å; L112-D114 PolarHBondContact O-N 2.74Å; D114-V116 PolarHBondContact O-N 3.27Å
115	A	84.5	Confident	88.7	Confident	61 Å²	61	95.2 Å²	95.2	50%	0.504	50%	0.497	S	S	.	.			trans	-69.7	104.5	175.5	0	0	0	0	0	109.9	L148	A115-L148 HydrophobicContact CB-CD1 3.9Å; A115-L148 HydrophobicContact CB-CD2 4.4Å; A115-L148 WeakPolarHBondContact O-CD2 3.4Å
116	V	83.7	Confident	88.4	Confident	112 Å²	112	101.6 Å²	101.6	68%	0.679	52%	0.519	S	S	*	.			trans	-82	130.5	171.2	-176.2	0	0	0	0	108.9	L112 D114	L112-V116 HydrophobicContact CD1-CG2 4.41Å; D114-V116 PolarHBondContact O-N 3.27Å
117	R	84.9	Confident	87.9	Confident	95 Å²	95	101.5 Å²	101.5	36%	0.358	53%	0.531	S	S	.	.			trans	-125.1	132.6	175.7	-72.3	-175.2	169.3	-130.4	-2.7	109.1	H119 T137 Y138	R117-H119 PolarHBondContact O-N 2.59Å; R117-T137 PolarHBondContact NH1-O 2.77Å; R117-Y138 VanDerWaalsContact NH1-C 3.25Å; R117-Y138 PolarHBondContact NH1-O 3.47Å
118	F	86.3	Confident	87.4	Confident	59 Å²	59	92.5 Å²	92.5	26%	0.259	50%	0.496	S	S	.	.			trans	-57.4	129	175.5	179	-97.6	0	0	0	111.2	P120 D123 G128	F118-P120 HydrophobicContact CE1-CB 3.91Å; F118-P120 HydrophobicContact CE1-CG 4.41Å; F118-P120 HydrophobicContact CZ-CB 4.07Å; F118-D123 VanDerWaalsContact CA-OD2 3.28Å; F118-D123 WeakPolarHBondContact CA-OD2 3.45Å; F118-D123 HydrophobicContact CD2-CB 3.84Å; F118-D123 HydrophobicContact CE2-CB 3.78Å; F118-G128 WeakPolarHBondContact CZ-O 3.03Å
119	H	87.8	Confident	86.9	Confident	30 Å²	30	90 Å²	90	14%	0.139	49%	0.486	C	S	.	.			trans	-133.7	118.5	171.3	-168.5	-78.8	0	0	0	109.9	R117 L121 T122 D123	R117-H119 PolarHBondContact O-N 2.59Å; H119-L121 PolarHBondContact ND1-N 3.48Å; H119-L121 PolarHBondContact O-N 3.1Å; H119-L121 VanDerWaalsContact O-N 3.08Å; H119-T122 PolarHBondContact ND1-OG1 3.19Å; H119-T122 PolarHBondContact O-N 3.13Å; H119-D123 PolarHBondContact N-OD2 2.85Å; H119-D123 PolarHBondContact O-N 2.72Å
120	P	85.4	Confident	86.4	Confident	20 Å²	20	88.3 Å²	88.3	13%	0.13	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-21.5	-167.7	25.8	-34.8	0	0	0	114.6	F118 T122 G128 Y151	F118-P120 HydrophobicContact CE1-CB 3.91Å; F118-P120 HydrophobicContact CE1-CG 4.41Å; F118-P120 HydrophobicContact CZ-CB 4.07Å; P120-T122 VanDerWaalsContact C-N 3.35Å; P120-G128 WeakPolarHBondContact CB-O 3.28Å; P120-Y151 VanDerWaalsContact CD-CG 3.49Å; P120-Y151 HydrophobicContact CG-CD1 3.94Å; P120-Y151 HydrophobicContact CG-CD2 3.59Å; P120-Y151 HydrophobicContact CG-CE1 3.69Å; P120-Y151 HydrophobicContact CG-CE2 3.34Å; P120-Y151 HydrophobicContact CG-CG 3.89Å
121	L	85.1	Confident	86.2	Confident	147 Å²	147	84.8 Å²	84.8	77%	0.77	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-15.8	175.1	-56.6	-177.4	0	0	0	113.4	H119	H119-L121 PolarHBondContact ND1-N 3.48Å; H119-L121 PolarHBondContact O-N 3.1Å; H119-L121 VanDerWaalsContact O-N 3.08Å
122	T	87.5	Confident	85.8	Confident	93 Å²	93	89.7 Å²	89.7	57%	0.571	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	-38.9	-172.2	-41.2	0	0	0	0	110.6	H119 P120	H119-T122 PolarHBondContact ND1-OG1 3.19Å; H119-T122 PolarHBondContact O-N 3.13Å; P120-T122 VanDerWaalsContact C-N 3.35Å
123	D	85.6	Confident	85.2	Confident	61 Å²	61	88.3 Å²	88.3	33%	0.326	50%	0.497	S	S	.	.			trans	-101	86.5	-178.8	-52.9	-37.8	0	0	0	109.9	F118 H119	F118-D123 VanDerWaalsContact CA-OD2 3.28Å; F118-D123 WeakPolarHBondContact CA-OD2 3.45Å; F118-D123 HydrophobicContact CD2-CB 3.84Å; F118-D123 HydrophobicContact CE2-CB 3.78Å; H119-D123 PolarHBondContact N-OD2 2.85Å; H119-D123 PolarHBondContact O-N 2.72Å
124	T	86.9	Confident	84.9	Confident	95 Å²	95	90.2 Å²	90.2	58%	0.583	50%	0.504	S	S	*	.			trans	-98	4.2	-171.3	55.5	0	0	0	0	115	Y126 G127	T124-Y126 PolarHBondContact O-N 3.29Å; T124-G127 PolarHBondContact O-N 3.49Å
125	E	84.4	Confident	84.9	Confident	172 Å²	172	87.2 Å²	87.2	80%	0.804	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-29.5	-174.5	-64.2	-174.5	163.5	0	0	113.8
126	Y	85	Confident	85	Confident	181 Å²	181	85.7 Å²	85.7	71%	0.71	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.8	38.3	177.4	-56.1	-73.1	0	0	0	112.6	T124 G128 V129	T124-Y126 PolarHBondContact O-N 3.29Å; Y126-G128 PolarHBondContact O-N 3.44Å; Y126-V129 PolarHBondContact O-N 3.37Å; Y126-V129 VanDerWaalsContact O-N 3.17Å
127	G	83.8	Confident	85.2	Confident	68 Å²	68	82 Å²	82	70%	0.701	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	23.3	-176.5	0	0	0	0	0	113.2	T124 V129	T124-G127 PolarHBondContact O-N 3.49Å; G127-V129 VanDerWaalsContact C-N 3.28Å; G127-V129 PolarHBondContact O-N 3.26Å
128	G	83.5	Confident	85.3	Confident	16 Å²	16	84.2 Å²	84.2	17%	0.165	47%	0.466	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	18.4	-176.7	0	0	0	0	0	114	F118 P120 Y126	F118-G128 WeakPolarHBondContact CZ-O 3.03Å; P120-G128 WeakPolarHBondContact CB-O 3.28Å; Y126-G128 PolarHBondContact O-N 3.44Å
129	V	83.2	Confident	85.3	Confident	90 Å²	90	82.4 Å²	82.4	55%	0.545	46%	0.46	S	S	.	.			trans	-98.9	120.3	174.4	-174.8	0	0	0	0	109.5	Y126 G127 P133	Y126-V129 PolarHBondContact O-N 3.37Å; Y126-V129 VanDerWaalsContact O-N 3.17Å; G127-V129 VanDerWaalsContact C-N 3.28Å; G127-V129 PolarHBondContact O-N 3.26Å; V129-P133 HydrophobicContact CG1-CB 4.47Å
130	S	85.1	Confident	85.1	Confident	30 Å²	30	86.9 Å²	86.9	21%	0.21	49%	0.494	C	S	.	.			trans	-87.6	164.7	170.9	74.6	0	0	0	0	111.2	F132 P133	S130-F132 PolarHBondContact O-N 2.8Å; S130-F132 PolarHBondContact OG-N 2.95Å; S130-F132 PolarHBondContact OG-O 2.95Å; S130-P133 WeakPolarHBondContact O-CD 3.1Å
131	A	85.7	Confident	85	Confident	91 Å²	91	87.7 Å²	87.7	75%	0.752	50%	0.501	S	S	*	.	S	Bend	trans	-57.4	-15.9	172.1	0	0	0	0	0	113.7
132	F	85.5	Confident	84.9	Confident	150 Å²	150	87.2 Å²	87.2	66%	0.658	50%	0.498	S	S	*	.	S	Bend	trans	-126.4	69.7	-179.9	-53.3	-75.2	0	0	0	111	S130 K134 S135	S130-F132 PolarHBondContact O-N 2.8Å; S130-F132 PolarHBondContact OG-N 2.95Å; S130-F132 PolarHBondContact OG-O 2.95Å; F132-K134 PolarHBondContact O-N 3.5Å; F132-K134 VanDerWaalsContact O-N 3.1Å; F132-S135 WeakPolarHBondContact O-CB 3.37Å; F132-S135 PolarHBondContact O-N 3.49Å
133	P	80.1	Confident	84.3	Confident	87 Å²	87	88.4 Å²	88.4	57%	0.565	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-25.6	-166.9	23.7	-34.1	0	0	0	114.6	V129 S130	V129-P133 HydrophobicContact CG1-CB 4.47Å; S130-P133 WeakPolarHBondContact O-CD 3.1Å
134	K	82.5	Confident	84.1	Confident	105 Å²	105	90.4 Å²	90.4	46%	0.457	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	3.7	178.4	-61.6	-176.8	177.8	-171.7	0	113.3	F132 E156	F132-K134 PolarHBondContact O-N 3.5Å; F132-K134 VanDerWaalsContact O-N 3.1Å; K134-E156 VanDerWaalsContact CE-OE2 3.31Å; K134-E156 WeakPolarHBondContact CE-OE2 3.28Å; K134-E156 IonicContact NZ-OE1 2.73Å; K134-E156 IonicContact NZ-OE2 2.63Å; K134-E156 PolarHBondContact NZ-OE2 3.04Å
135	S	85.6	Confident	84	Confident	69 Å²	69	94.2 Å²	94.2	48%	0.483	50%	0.502	S	S	.	.			trans	-95.7	125.2	-179.4	-171.5	0	0	0	0	111.2	F132 A153	F132-S135 WeakPolarHBondContact O-CB 3.37Å; F132-S135 PolarHBondContact O-N 3.49Å; S135-A153 WeakPolarHBondContact O-CB 3.33Å
136	S	87.7	Confident	83.9	Confident	29 Å²	29	95.1 Å²	95.1	20%	0.203	50%	0.498	C	S	.	.			trans	-87.3	136.4	175.6	45.8	0	0	0	0	111.9	Y138 Y151	S136-Y138 PolarHBondContact O-N 2.91Å; S136-Y138 WeakPolarHBondContact OG-CD2 3.29Å; S136-Y138 WeakPolarHBondContact OG-CE2 3.44Å; S136-Y138 PolarHBondContact OG-OH 3.36Å; S136-Y151 CarbonylContact C-O 3.43Å; S136-Y151 VanDerWaalsContact CA-O 3.29Å; S136-Y151 WeakPolarHBondContact CA-O 3.38Å; S136-Y151 WeakPolarHBondContact CB-O 3.41Å
137	T	87.5	Confident	83.6	Confident	34 Å²	34	93.6 Å²	93.6	21%	0.209	50%	0.496	C	S	.	.	B	Isolated β-bridge	trans	-92.4	74.5	177	52.1	0	0	0	0	111.4	R117 V139 G150 Y151	R117-T137 PolarHBondContact NH1-O 2.77Å; T137-V139 PolarHBondContact O-N 3.37Å; T137-G150 WeakPolarHBondContact O-CA 3.41Å; T137-Y151 PolarHBondContact N-O 3.13Å; T137-Y151 PolarHBondContact O-N 3.07Å; T137-Y151 WeakPolarHBondContact OG1-CB 3.41Å; T137-Y151 PolarHBondContact OG1-N 3.34Å; T137-Y151 PolarHBondContact OG1-O 2.86Å
138	Y	86.4	Confident	83.7	Confident	142 Å²	142	92 Å²	92	56%	0.557	47%	0.471	S	S	*	.			trans	-71	131.4	179.8	-62.9	-65.9	0	0	0	113.1	R117 S136 R152	R117-Y138 VanDerWaalsContact NH1-C 3.25Å; R117-Y138 PolarHBondContact NH1-O 3.47Å; S136-Y138 PolarHBondContact O-N 2.91Å; S136-Y138 WeakPolarHBondContact OG-CD2 3.29Å; S136-Y138 WeakPolarHBondContact OG-CE2 3.44Å; S136-Y138 PolarHBondContact OG-OH 3.36Å; Y138-R152 HydrophobicContact CE1-CG 4.35Å
139	V	86.6	Confident	83.8	Confident	21 Å²	21	98.4 Å²	98.4	13%	0.127	49%	0.494	C	S	.	.			trans	-102.6	100.8	170.8	-176.8	0	0	0	0	108	T137 F144 R145 L148	T137-V139 PolarHBondContact O-N 3.37Å; V139-F144 HydrophobicContact CG1-CB 3.57Å; V139-R145 HydrophobicContact CG1-CB 4.3Å; V139-L148 HydrophobicContact CG1-CB 4.45Å; V139-L148 HydrophobicContact CG2-CB 3.97Å
140	S	84.5	Confident	84	Confident	123 Å²	123	96 Å²	96	86%	0.86	49%	0.487	S	S	*	.			trans	-72.8	-35.3	-175.9	55.1	0	0	0	0	113.2	L142	S140-L142 PolarHBondContact O-N 3.41Å
141	S	82.3	Confident	84.1	Confident	38 Å²	38	98.1 Å²	98.1	27%	0.266	49%	0.491	S	S	.	.			trans	-77.5	129.7	-173.6	102	0	0	0	0	111.5	R143 F144 R145	S141-R143 PolarHBondContact O-N 3.27Å; S141-F144 PolarHBondContact O-N 2.71Å; S141-F144 WeakPolarHBondContact OG-CB 3.29Å; S141-F144 WeakPolarHBondContact OG-CD2 3.22Å; S141-F144 VanDerWaalsContact OG-CG 3.32Å; S141-F144 WeakPolarHBondContact OG-CG 3.43Å; S141-F144 PolarHBondContact OG-N 2.99Å; S141-R145 WeakPolarHBondContact O-CB 3.46Å; S141-R145 PolarHBondContact O-N 3.01Å
142	L	82.8	Confident	84.2	Confident	137 Å²	137	103.1 Å²	103.1	72%	0.717	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-33.5	176.8	-71.1	169.2	0	0	0	112.3	S140	S140-L142 PolarHBondContact O-N 3.41Å
143	R	76.1	Confident	84.2	Confident	118 Å²	118	96.2 Å²	96.2	45%	0.445	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-54.1	176.1	178.5	179.8	169.9	-160.5	-10.1	111	R7 S141 R145 R146 F147	R7-R143 PolarHBondContact O-NH1 3.1Å; S141-R143 PolarHBondContact O-N 3.27Å; R143-R145 VanDerWaalsContact C-N 3.28Å; R143-R145 PolarHBondContact O-N 3.27Å; R143-R146 PolarHBondContact O-N 3.37Å; R143-F147 HydrophobicContact CG-CE2 4.16Å; R143-F147 WeakPolarHBondContact O-CD2 3.31Å; R143-F147 WeakPolarHBondContact O-CE2 3.37Å
144	F	81.7	Confident	84.1	Confident	103 Å²	103	100.3 Å²	100.3	45%	0.452	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-69.6	-27.8	-174.7	-70.2	-53	0	0	0	112.1	V139 S141 R146 F147 L148	V139-F144 HydrophobicContact CG1-CB 3.57Å; S141-F144 PolarHBondContact O-N 2.71Å; S141-F144 WeakPolarHBondContact OG-CB 3.29Å; S141-F144 WeakPolarHBondContact OG-CD2 3.22Å; S141-F144 VanDerWaalsContact OG-CG 3.32Å; S141-F144 WeakPolarHBondContact OG-CG 3.43Å; S141-F144 PolarHBondContact OG-N 2.99Å; F144-R146 PolarHBondContact O-N 3.33Å; F144-F147 PolarHBondContact O-N 3.05Å; F144-L148 HydrophobicContact CB-CD1 4.06Å; F144-L148 HydrophobicContact CB-CG 4.4Å; F144-L148 HydrophobicContact CD1-CD1 4.31Å; F144-L148 HydrophobicContact CG-CD1 4.3Å; F144-L148 WeakPolarHBondContact O-CB 3.42Å; F144-L148 PolarHBondContact O-N 2.86Å
145	R	83.8	Confident	83.6	Confident	175 Å²	175	100.5 Å²	100.5	66%	0.66	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-57.5	-19.6	176.1	-160.5	177.9	78.5	173.3	5.1	113.8	V139 S141 R143	V139-R145 HydrophobicContact CG1-CB 4.3Å; S141-R145 WeakPolarHBondContact O-CB 3.46Å; S141-R145 PolarHBondContact O-N 3.01Å; R143-R145 VanDerWaalsContact C-N 3.28Å; R143-R145 PolarHBondContact O-N 3.27Å
146	R	81.6	Confident	82.5	Confident	191 Å²	191	102.1 Å²	102.1	72%	0.721	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-77.5	-32.6	175.8	-64	-177.6	178.2	-172.3	-2.8	113.4	R143 F144	R143-R146 PolarHBondContact O-N 3.37Å; F144-R146 PolarHBondContact O-N 3.33Å
147	F	80.6	Confident	81	Confident	149 Å²	149	110.8 Å²	110.8	65%	0.654	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-36	-173	-47.6	-76.6	0	0	0	111.7	R143 F144	R143-F147 HydrophobicContact CG-CE2 4.16Å; R143-F147 WeakPolarHBondContact O-CD2 3.31Å; R143-F147 WeakPolarHBondContact O-CE2 3.37Å; F144-F147 PolarHBondContact O-N 3.05Å
148	L	84.9	Confident	79.4	Confident	34 Å²	34	117.3 Å²	117.3	18%	0.178	54%	0.536	C	S	.	.	S	Bend	trans	-101.6	121.1	179	-56.6	-177.3	0	0	0	109.6	A115 V139 F144	A115-L148 HydrophobicContact CB-CD1 3.9Å; A115-L148 HydrophobicContact CB-CD2 4.4Å; A115-L148 WeakPolarHBondContact O-CD2 3.4Å; V139-L148 HydrophobicContact CG1-CB 4.45Å; V139-L148 HydrophobicContact CG2-CB 3.97Å; F144-L148 HydrophobicContact CB-CD1 4.06Å; F144-L148 HydrophobicContact CB-CG 4.4Å; F144-L148 HydrophobicContact CD1-CD1 4.31Å; F144-L148 HydrophobicContact CG-CD1 4.3Å; F144-L148 WeakPolarHBondContact O-CB 3.42Å; F144-L148 PolarHBondContact O-N 2.86Å
149	K	85.4	Confident	77.8	Confident	150 Å²	150	119.1 Å²	119.1	65%	0.652	55%	0.55	S	S	*	.	P	Polyproline II helix	trans	-81.1	120.5	172.6	-65.8	-177.6	-179.3	176.6	0	108.8
150	G	87.8	Confident	76.2	Confident	39 Å²	39	124.9 Å²	124.9	40%	0.402	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-81	149.9	166.9	0	0	0	0	0	110.6	T137	T137-G150 WeakPolarHBondContact O-CA 3.41Å
151	Y	87.9	Confident	74.6	Confident	76 Å²	76	126.7 Å²	126.7	30%	0.298	57%	0.565	S	S	.	*	B	Isolated β-bridge	trans	-119.4	132.6	173.2	175.9	-107.2	0	0	0	110.2	P120 S136 T137 A153	P120-Y151 VanDerWaalsContact CD-CG 3.49Å; P120-Y151 HydrophobicContact CG-CD1 3.94Å; P120-Y151 HydrophobicContact CG-CD2 3.59Å; P120-Y151 HydrophobicContact CG-CE1 3.69Å; P120-Y151 HydrophobicContact CG-CE2 3.34Å; P120-Y151 HydrophobicContact CG-CG 3.89Å; S136-Y151 CarbonylContact C-O 3.43Å; S136-Y151 VanDerWaalsContact CA-O 3.29Å; S136-Y151 WeakPolarHBondContact CA-O 3.38Å; S136-Y151 WeakPolarHBondContact CB-O 3.41Å; T137-Y151 PolarHBondContact N-O 3.13Å; T137-Y151 PolarHBondContact O-N 3.07Å; T137-Y151 WeakPolarHBondContact OG1-CB 3.41Å; T137-Y151 PolarHBondContact OG1-N 3.34Å; T137-Y151 PolarHBondContact OG1-O 2.86Å; Y151-A153 HydrophobicContact CD1-CB 4.44Å; Y151-A153 HydrophobicContact CE1-CB 3.99Å
152	R	87.5	Confident	73.4	Confident	195 Å²	195	131.2 Å²	131.2	74%	0.736	59%	0.586	S	S	*	*			trans	-98.8	104.5	174.6	-172.5	174.2	179.5	-179.8	-2	108.5	Y138	Y138-R152 HydrophobicContact CE1-CG 4.35Å
153	A	84.9	Confident	72.2	Confident	5 Å²	5	133.3 Å²	133.3	4%	0.041	59%	0.589	C	S	.	*			trans	-65.6	148.9	174.8	0	0	0	0	0	111.2	S135 Y151 T155	S135-A153 WeakPolarHBondContact O-CB 3.33Å; Y151-A153 HydrophobicContact CD1-CB 4.44Å; Y151-A153 HydrophobicContact CE1-CB 3.99Å; A153-T155 PolarHBondContact O-N 3.32Å
154	K	78.1	Confident	71.4	Confident	174 Å²	174	134.8 Å²	134.8	76%	0.757	60%	0.601	S	S	*	*			trans	-75.4	109.3	171.1	-67	-178.6	179.6	-179	0	108.1	E156	K154-E156 PolarHBondContact O-N 3.33Å
155	T	71.1	Confident	70.1	Confident	109 Å²	109	136.4 Å²	136.4	67%	0.669	61%	0.608	S	S	*	*			trans	-83.9	95.3	166.8	-40.6	0	0	0	0	106.1	A153 W157	A153-T155 PolarHBondContact O-N 3.32Å; T155-W157 PolarHBondContact O-N 3.07Å
156	E	64.2	Low	69.3	Low	102 Å²	102	134.1 Å²	134.1	48%	0.477	61%	0.609	S	S	.	*			trans	-47.8	135.5	176.1	-65.6	155.6	-157.5	0	0	110	K134 K154	K134-E156 VanDerWaalsContact CE-OE2 3.31Å; K134-E156 WeakPolarHBondContact CE-OE2 3.28Å; K134-E156 IonicContact NZ-OE1 2.73Å; K134-E156 IonicContact NZ-OE2 2.63Å; K134-E156 PolarHBondContact NZ-OE2 3.04Å; K154-E156 PolarHBondContact O-N 3.33Å
157	W	56.3	Low	68.7	Low	211 Å²	211	132.5 Å²	132.5	80%	0.799	61%	0.607	S	S	*	*	S	Bend		-147.6	-8.8	88.4	-92.2	86.9	0	0	0	116	T155	T155-W157 PolarHBondContact O-N 3.07Å
158	H	53.4	Low	68.5	Low	171 Å²	171	130.2 Å²	130.2	79%	0.792	61%	0.606	S	S	*	*	S	Bend	trans	-113	24	-161.1	-61.1	-72.7	0	0	0	118.1
159	H	52.8	Low	67.9	Low	181 Å²	181	132.9 Å²	132.9	84%	0.838	63%	0.633	S	S	*	*			trans	-120.7	31	176.4	-69.8	-60.7	0	0	0	113.7
160	Y	53.2	Low	67.5	Low	142 Å²	142	129.8 Å²	129.8	56%	0.557	63%	0.626	S	S	*	*			trans	-87.7	-13.3	175.1	-89	-81.3	0	0	0	114.3	D162 K163 H164	Y160-D162 PolarHBondContact O-N 2.85Å; Y160-K163 PolarHBondContact O-N 3.07Å; Y160-H164 AromaticContact CD1-CD2 3.9Å
161	E	50.4	Low	67	Low	161 Å²	161	132 Å²	132	75%	0.752	63%	0.634	S	S	*	*	H	α-helix	trans	-63.5	-41.5	-174.2	-66.6	-177.3	177.3	0	0	111.7	K163 F165	E161-K163 VanDerWaalsContact C-N 3.33Å; E161-K163 PolarHBondContact O-N 2.99Å; E161-F165 VanDerWaalsContact O-CB 3.24Å; E161-F165 WeakPolarHBondContact O-CB 3.47Å; E161-F165 PolarHBondContact O-N 3.14Å
162	D	57	Low	66.5	Low	132 Å²	132	137.1 Å²	137.1	71%	0.706	66%	0.66	S	S	*	*	H	α-helix	trans	-75.6	-13.3	-175.6	-67.9	-21	0	0	0	115.6	Y160	Y160-D162 PolarHBondContact O-N 2.85Å
163	K	58	Low	66.1	Low	182 Å²	182	133.7 Å²	133.7	79%	0.791	66%	0.657	S	S	*	*	H	α-helix	trans	-97.7	-17.6	-179.7	-75.7	-171	177.3	-173	0	114.4	Y160 E161	Y160-K163 PolarHBondContact O-N 3.07Å; E161-K163 VanDerWaalsContact C-N 3.33Å; E161-K163 PolarHBondContact O-N 2.99Å
164	H	58.6	Low	65.9	Low	149 Å²	149	133.6 Å²	133.6	69%	0.69	66%	0.656	S	S	*	*	H	α-helix	trans	-118.8	-3	178.6	-68.4	-63.2	0	0	0	113.4	Y160 D166	Y160-H164 AromaticContact CD1-CD2 3.9Å; H164-D166 PolarHBondContact O-N 3.25Å; H164-D166 VanDerWaalsContact O-N 3.11Å
165	F	55.9	Low	65.7	Low	136 Å²	136	129.4 Å²	129.4	60%	0.596	65%	0.647	S	S	*	*			trans	-73.1	103.7	169.2	-155.1	-95.3	0	0	0	108.8	E161 F167	E161-F165 VanDerWaalsContact O-CB 3.24Å; E161-F165 WeakPolarHBondContact O-CB 3.47Å; E161-F165 PolarHBondContact O-N 3.14Å; F165-F167 HydrophobicContact CB-CE2 4.48Å; F165-F167 HydrophobicContact CB-CZ 4.32Å; F165-F167 AromaticContact CD1-CD1 3.72Å; F165-F167 HydrophobicContact CD1-CD1 3.72Å; F165-F167 AromaticContact CD1-CE1 3.76Å; F165-F167 HydrophobicContact CD1-CE1 3.76Å; F165-F167 HydrophobicContact CD1-CG 4.2Å; F165-F167 HydrophobicContact CD1-CZ 4.28Å; F165-F167 HydrophobicContact CE1-CD1 4.25Å; F165-F167 HydrophobicContact CE1-CE1 4.47Å; F165-F167 VanDerWaalsContact O-CD2 3.24Å; F165-F167 WeakPolarHBondContact O-CD2 3.49Å; F165-F167 WeakPolarHBondContact O-CE2 3.43Å; F165-F167 PolarHBondContact O-N 2.95Å
166	D	65.5	Low	65.8	Low	128 Å²	128	132.7 Å²	132.7	68%	0.684	65%	0.647	S	S	*	*			trans	-65.2	103.6	165.1	-96.6	-21	0	0	0	107.5	H164 T168	H164-D166 PolarHBondContact O-N 3.25Å; H164-D166 VanDerWaalsContact O-N 3.11Å; D166-T168 PolarHBondContact O-N 3.29Å; D166-T168 VanDerWaalsContact O-N 3.09Å
167	F	70.1	Confident	66.2	Low	157 Å²	157	130.2 Å²	130.2	69%	0.689	64%	0.636	S	S	*	*			trans	-70.6	7.3	172.1	-61.3	-81.4	0	0	0	112.7	F165 A169	F165-F167 HydrophobicContact CB-CE2 4.48Å; F165-F167 HydrophobicContact CB-CZ 4.32Å; F165-F167 AromaticContact CD1-CD1 3.72Å; F165-F167 HydrophobicContact CD1-CD1 3.72Å; F165-F167 AromaticContact CD1-CE1 3.76Å; F165-F167 HydrophobicContact CD1-CE1 3.76Å; F165-F167 HydrophobicContact CD1-CG 4.2Å; F165-F167 HydrophobicContact CD1-CZ 4.28Å; F165-F167 HydrophobicContact CE1-CD1 4.25Å; F165-F167 HydrophobicContact CE1-CE1 4.47Å; F165-F167 VanDerWaalsContact O-CD2 3.24Å; F165-F167 WeakPolarHBondContact O-CD2 3.49Å; F165-F167 WeakPolarHBondContact O-CE2 3.43Å; F165-F167 PolarHBondContact O-N 2.95Å; F167-A169 PolarHBondContact O-N 2.85Å
168	T	76.3	Confident	66.9	Low	100 Å²	100	128 Å²	128	61%	0.613	63%	0.632	S	S	*	*	S	Bend	trans	-65.9	132.8	174.9	54.7	0	0	0	0	108.4	D166 T170	D166-T168 PolarHBondContact O-N 3.29Å; D166-T168 VanDerWaalsContact O-N 3.09Å; T168-T170 PolarHBondContact O-N 3.06Å
169	A	71.9	Confident	67.8	Low	91 Å²	91	123.2 Å²	123.2	75%	0.752	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-55.3	129.7	173.9	0	0	0	0	0	108.4	F167 P171	F167-A169 PolarHBondContact O-N 2.85Å; A169-P171 VanDerWaalsContact O-N 3.16Å
170	T	75.8	Confident	68.4	Low	84 Å²	84	118 Å²	118	52%	0.515	59%	0.594	S	S	.	*	P	Polyproline II helix	trans	-50.8	124.7	173.5	21.8	0	0	0	0	108.8	T168 E172 W176	T168-T170 PolarHBondContact O-N 3.06Å; T170-E172 PolarHBondContact O-N 3.06Å; T170-W176 HydrophobicContact CG2-CZ2 4.38Å
171	P	78.6	Confident	69.2	Low	85 Å²	85	113.1 Å²	113.1	55%	0.552	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-57.8	141.7	-179.8	18.4	-27.9	0	0	0	110.2	A169 D173 A174	A169-P171 VanDerWaalsContact O-N 3.16Å; P171-D173 PolarHBondContact O-N 3.12Å; P171-A174 HydrophobicContact CG-CB 4.49Å; P171-A174 VanDerWaalsContact O-CB 3.31Å; P171-A174 WeakPolarHBondContact O-CB 3.47Å; P171-A174 PolarHBondContact O-N 3.07Å
172	E	77.4	Confident	70.2	Confident	184 Å²	184	110.6 Å²	110.6	86%	0.86	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57	-20.5	-175.4	-67.4	-175.1	167.5	0	0	113.5	T170 L177	T170-E172 PolarHBondContact O-N 3.06Å; E172-L177 VanDerWaalsContact C-CD1 3.5Å; E172-L177 WeakPolarHBondContact O-CD1 3.02Å
173	D	79.8	Confident	70.6	Confident	124 Å²	124	113.4 Å²	113.4	66%	0.663	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	1.1	-179.7	-95.7	-36.4	0	0	0	115.5	P171 K180	P171-D173 PolarHBondContact O-N 3.12Å; D173-K180 PolarHBondContact O-NZ 3.23Å; D173-K180 IonicContact OD1-NZ 3.27Å; D173-K180 PolarHBondContact OD1-NZ 3.09Å
174	A	79.6	Confident	70.8	Confident	3 Å²	3	110.9 Å²	110.9	3%	0.025	56%	0.564	C	S	.	*			trans	-55.7	124.5	-179.2	0	0	0	0	0	112	P171 W176 L177	P171-A174 HydrophobicContact CG-CB 4.49Å; P171-A174 VanDerWaalsContact O-CB 3.31Å; P171-A174 WeakPolarHBondContact O-CB 3.47Å; P171-A174 PolarHBondContact O-N 3.07Å; A174-W176 HydrophobicContact CB-CD2 4Å; A174-W176 HydrophobicContact CB-CE3 4.3Å; A174-W176 HydrophobicContact CB-CH2 3.91Å; A174-W176 HydrophobicContact CB-CZ2 3.58Å; A174-W176 HydrophobicContact CB-CZ3 4.26Å; A174-W176 PolarHBondContact O-N 3.25Å; A174-W176 VanDerWaalsContact O-N 3.12Å; A174-L177 HydrophobicContact CB-CD1 4.05Å; A174-L177 HydrophobicContact CB-CG 4.18Å; A174-L177 WeakPolarHBondContact O-CB 3.24Å; A174-L177 PolarHBondContact O-N 3.4Å
175	P	73.2	Confident	71.1	Confident	86 Å²	86	110.7 Å²	110.7	56%	0.558	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.3	-19.9	-172.4	21.3	-30.8	0	0	0	114.1
176	W	74.3	Confident	71.6	Confident	178 Å²	178	110.5 Å²	110.5	67%	0.674	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	5.2	177.2	60.7	86.7	0	0	0	114	T170 A174 K178	T170-W176 HydrophobicContact CG2-CZ2 4.38Å; A174-W176 HydrophobicContact CB-CD2 4Å; A174-W176 HydrophobicContact CB-CE3 4.3Å; A174-W176 HydrophobicContact CB-CH2 3.91Å; A174-W176 HydrophobicContact CB-CZ2 3.58Å; A174-W176 HydrophobicContact CB-CZ3 4.26Å; A174-W176 PolarHBondContact O-N 3.25Å; A174-W176 VanDerWaalsContact O-N 3.12Å; W176-K178 PolarHBondContact O-N 2.91Å
177	L	72.6	Confident	71.4	Confident	49 Å²	49	109.6 Å²	109.6	26%	0.257	57%	0.567	S	S	.	*			trans	-61.1	130.4	171	-83.7	160	0	0	0	109.6	E172 A174 S179 K180 A181	E172-L177 VanDerWaalsContact C-CD1 3.5Å; E172-L177 WeakPolarHBondContact O-CD1 3.02Å; A174-L177 HydrophobicContact CB-CD1 4.05Å; A174-L177 HydrophobicContact CB-CG 4.18Å; A174-L177 WeakPolarHBondContact O-CB 3.24Å; A174-L177 PolarHBondContact O-N 3.4Å; L177-S179 PolarHBondContact O-N 3.4Å; L177-K180 WeakPolarHBondContact O-CA 3.38Å; L177-K180 PolarHBondContact O-N 2.86Å; L177-A181 PolarHBondContact O-N 3.02Å
178	K	71.6	Confident	70.7	Confident	164 Å²	164	110.8 Å²	110.8	71%	0.713	57%	0.572	S	S	*	*	H	α-helix	trans	-51.2	-37.3	-173.5	-154.5	177.3	-178.8	-178	0	113.1	W176 A181 E182	W176-K178 PolarHBondContact O-N 2.91Å; K178-A181 PolarHBondContact O-N 3.08Å; K178-E182 WeakPolarHBondContact O-CB 3.45Å; K178-E182 WeakPolarHBondContact O-CG 3.2Å; K178-E182 PolarHBondContact O-N 3.49Å
179	S	70.7	Confident	69.8	Low	72 Å²	72	113.3 Å²	113.3	50%	0.503	58%	0.58	S	S	.	*	H	α-helix	trans	-69.7	-32.8	176.5	58.1	0	0	0	0	114.5	L177 R183	L177-S179 PolarHBondContact O-N 3.4Å; S179-R183 PolarHBondContact O-N 3.44Å
180	K	66.8	Low	69	Low	72 Å²	72	115.8 Å²	115.8	31%	0.313	58%	0.58	S	S	.	*	H	α-helix	trans	-75.4	-41.5	172.7	-100.4	-175.8	-173.5	177.1	0	110.6	D173 L177 R183 M184	D173-K180 PolarHBondContact O-NZ 3.23Å; D173-K180 IonicContact OD1-NZ 3.27Å; D173-K180 PolarHBondContact OD1-NZ 3.09Å; L177-K180 WeakPolarHBondContact O-CA 3.38Å; L177-K180 PolarHBondContact O-N 2.86Å; K180-R183 WeakPolarHBondContact O-CB 3.47Å; K180-R183 PolarHBondContact O-N 2.93Å; K180-R183 VanDerWaalsContact O-N 3.14Å; K180-M184 WeakPolarHBondContact O-CG 3.24Å; K180-M184 PolarHBondContact O-N 3.44Å
181	A	69.1	Low	67.6	Low	38 Å²	38	120.6 Å²	120.6	31%	0.314	59%	0.594	S	S	.	*	H	α-helix	trans	-59.5	-47.6	174.9	0	0	0	0	0	111.5	L177 K178 R183 M184 D185	L177-A181 PolarHBondContact O-N 3.02Å; K178-A181 PolarHBondContact O-N 3.08Å; A181-R183 PolarHBondContact O-N 3.35Å; A181-M184 PolarHBondContact O-N 3.17Å; A181-D185 PolarHBondContact O-N 3.24Å; A181-D185 VanDerWaalsContact O-N 3.07Å
182	E	70.9	Confident	65.9	Low	108 Å²	108	124.3 Å²	124.3	51%	0.505	61%	0.609	S	S	.	*	H	α-helix	trans	-61.3	-29.7	175.1	-75	169.3	-170.6	0	0	112.9	K178 N186	K178-E182 WeakPolarHBondContact O-CB 3.45Å; K178-E182 WeakPolarHBondContact O-CG 3.2Å; K178-E182 PolarHBondContact O-N 3.49Å; E182-N186 PolarHBondContact O-ND2 2.89Å
183	R	66.3	Low	64	Low	191 Å²	191	120.7 Å²	120.7	72%	0.721	60%	0.602	S	S	*	*	H	α-helix	trans	-72.3	-39.7	172.7	-99.2	-174.8	-179.2	131.8	-0.8	112.4	S179 K180 A181 N186 I187	S179-R183 PolarHBondContact O-N 3.44Å; K180-R183 WeakPolarHBondContact O-CB 3.47Å; K180-R183 PolarHBondContact O-N 2.93Å; K180-R183 VanDerWaalsContact O-N 3.14Å; A181-R183 PolarHBondContact O-N 3.35Å; R183-N186 PolarHBondContact O-N 3.11Å; R183-I187 WeakPolarHBondContact O-CG1 3.31Å
184	M	62.5	Low	62	Low	130 Å²	130	124.6 Å²	124.6	64%	0.64	61%	0.609	S	S	*	*	H	α-helix	trans	-67.4	-37.7	179.8	-70.6	-164.8	70.3	0	0	111.9	K180 A181 N186 I187	K180-M184 WeakPolarHBondContact O-CG 3.24Å; K180-M184 PolarHBondContact O-N 3.44Å; A181-M184 PolarHBondContact O-N 3.17Å; M184-N186 PolarHBondContact O-N 2.75Å; M184-I187 PolarHBondContact O-N 2.98Å
185	D	63.4	Low	60.1	Low	144 Å²	144	138.4 Å²	138.4	77%	0.77	67%	0.669	S	S	*	*	H	α-helix	trans	-69.1	-21.5	177.3	-69.7	-17.6	0	0	0	113	A181	A181-D185 PolarHBondContact O-N 3.24Å; A181-D185 VanDerWaalsContact O-N 3.07Å
186	N	67.2	Low	59.4	Low	133 Å²	133	141 Å²	141	71%	0.711	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-1.2	177.9	-77.3	-43.7	0	0	0	114.3	E182 R183 M184 K188	E182-N186 PolarHBondContact O-ND2 2.89Å; R183-N186 PolarHBondContact O-N 3.11Å; M184-N186 PolarHBondContact O-N 2.75Å; N186-K188 PolarHBondContact O-N 2.96Å
187	I	61	Low	58.6	Low	109 Å²	109	139.1 Å²	139.1	56%	0.559	68%	0.675	S	S	*	*			trans	-74.2	99.6	174.9	-58.4	175.3	0	0	0	108.1	R183 M184 I189	R183-I187 WeakPolarHBondContact O-CG1 3.31Å; M184-I187 PolarHBondContact O-N 2.98Å; I187-I189 PolarHBondContact O-N 2.96Å
188	K	56.7	Low	57.9	Low	182 Å²	182	144.1 Å²	144.1	79%	0.791	70%	0.698	S	S	*	*			trans	-62.2	107.2	163.8	-72.1	-176	178.3	-178.6	0	108.1	N186 D190	N186-K188 PolarHBondContact O-N 2.96Å; K188-D190 PolarHBondContact O-N 3.04Å
189	I	57	Low	57.1	Low	152 Å²	152	142.9 Å²	142.9	78%	0.779	70%	0.697	S	S	*	*			trans	-73.6	76.6	173.8	-54.5	173.8	0	0	0	107.8	I187 K191	I187-I189 PolarHBondContact O-N 2.96Å; I189-K191 PolarHBondContact O-N 3Å
190	D	53.8	Low	56.2	Low	143 Å²	143	147.3 Å²	147.3	77%	0.765	71%	0.709	S	S	*	*			trans	-87.5	83.1	163.9	-91.5	-15.5	0	0	0	107.9	K188	K188-D190 PolarHBondContact O-N 3.04Å
191	K	47.7	Very low	55.5	Low	185 Å²	185	152.3 Å²	152.3	80%	0.804	74%	0.736	S	S	*	*	S	Bend	trans	169	103.5	145.2	-91.6	158.6	-169.6	-176.2	0	109.8	I189	I189-K191 PolarHBondContact O-N 3Å
192	L	41.6	Very low	54.5	Low	164 Å²	164	160.5 Å²	160.5	86%	0.859	77%	0.766	S	S	*	*			trans	0.6	125.1	143.5	-75	142.2	0	0	0	116.1
193	C	39.2	Very low	53.3	Low	107 Å²	107	164.5 Å²	164.5	72%	0.723	79%	0.786	S	S	*	*			trans	-39.1	148.2	155.2	-54.2	0	0	0	0	112.7
194	Y	36.7	Very low	52.2	Low	207 Å²	207	162.3 Å²	162.3	81%	0.812	79%	0.791	S	S	*	*			trans	155.2	94.7	130.8	-80.3	-64.6	0	0	0	108.4
195	F	39.7	Very low	51.3	Low	292 Å²	292	165.3 Å²	165.3	100%	1.281	81%	0.805	S	S	*	*				-155.4	0	126.8	-84.5	-67.3	0	0	0	107.8

Retrieved 195 of 195 residues in 144.3 ms (Link to these results)

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