A0A077ZH90_TRITR Loading...

[RNA-polymerase]-subunit kinase

AlphaFold DB , UniProt , Accession A0A077ZH90, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 305 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	33.2	Very low	57.3	Low	240 Å²	240	136.7 Å²	136.7	100%	1.182	68%	0.679	S	S	*	*				0	112.9	0	-74.7	179.4	-177.7	0	0	108.9	V3	M1-V3 PolarHBondContact O-N 3.22Å
2	H	29.9	Very low	59.6	Low	202 Å²	202	131.8 Å²	131.8	94%	0.935	66%	0.656	S	S	*	*			trans	-68.3	108.6	171.7	-87.2	-29.5	0	0	0	109.5	S4	H2-S4 PolarHBondContact O-N 3.22Å
3	V	31.6	Very low	61.5	Low	135 Å²	135	125.9 Å²	125.9	82%	0.818	64%	0.635	S	S	*	*			trans	-76.6	105.2	168.8	-179.3	0	0	0	0	107.4	M1 G5	M1-V3 PolarHBondContact O-N 3.22Å; V3-G5 PolarHBondContact O-N 3.41Å
4	S	37.9	Very low	62.8	Low	99 Å²	99	123.7 Å²	123.7	69%	0.692	62%	0.621	S	S	*	*			trans	-52.1	132.6	171.8	74.9	0	0	0	0	110.4	H2 R6	H2-S4 PolarHBondContact O-N 3.22Å; S4-R6 PolarHBondContact O-N 3.37Å
5	G	41.7	Very low	63.2	Low	87 Å²	87	120.8 Å²	120.8	90%	0.897	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.4	45.7	-166.5	0	0	0	0	0	116.7	V3	V3-G5 PolarHBondContact O-N 3.41Å
6	R	52	Low	63.4	Low	230 Å²	230	115 Å²	115	87%	0.868	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.6	-0.8	-175.1	-104.5	-176.5	-178	-178.5	1.8	118.4	S4	S4-R6 PolarHBondContact O-N 3.37Å
7	R	69.2	Low	63.7	Low	212 Å²	212	116.6 Å²	116.6	80%	0.8	59%	0.592	S	S	*	*			trans	-150.1	64.8	171.4	-67.5	-169.6	-179.5	-173.8	0.7	113.1	Y9 L29	R7-Y9 VanDerWaalsContact C-N 3.28Å; R7-L29 WeakPolarHBondContact O-CD1 3.34Å
8	R	80.1	Confident	63.6	Low	76 Å²	76	112.1 Å²	112.1	29%	0.287	58%	0.58	S	S	.	*	S	Bend	trans	-65.9	-33.8	171	179.7	172.3	174.6	-172.3	-8.5	112.1	D28 L29 K30 N31	R8-D28 WeakPolarHBondContact CG-OD1 3.49Å; R8-D28 IonicContact CZ-OD2 3.53Å; R8-D28 IonicContact NE-OD1 3.08Å; R8-D28 PolarHBondContact NE-OD1 2.83Å; R8-D28 VanDerWaalsContact NE-OD1 3.12Å; R8-D28 IonicContact NE-OD2 3Å; R8-D28 PolarHBondContact NE-OD2 2.85Å; R8-D28 IonicContact NH2-OD1 3.96Å; R8-D28 IonicContact NH2-OD2 2.85Å; R8-D28 PolarHBondContact NH2-OD2 3.09Å; R8-L29 WeakPolarHBondContact O-CB 3.47Å; R8-L29 PolarHBondContact O-N 2.77Å; R8-K30 HydrophobicContact CG-CB 4.48Å; R8-N31 PolarHBondContact NH2-ND2 3.21Å
9	Y	81.6	Confident	63.5	Low	33 Å²	33	111.9 Å²	111.9	13%	0.129	58%	0.576	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.5	127.3	-175.6	-56.8	-76.6	0	0	0	110.8	R7 R27 D28 V35 L37 A77 F79 T83	R7-Y9 VanDerWaalsContact C-N 3.28Å; Y9-R27 CarbonylContact C-O 3.53Å; Y9-R27 VanDerWaalsContact CA-O 3.31Å; Y9-R27 WeakPolarHBondContact CA-O 3.37Å; Y9-D28 HydrophobicContact CD1-CB 3.86Å; Y9-D28 HydrophobicContact CE1-CB 3.63Å; Y9-D28 VanDerWaalsContact CE1-CG 3.46Å; Y9-V35 HydrophobicContact CD1-CG2 3.74Å; Y9-V35 HydrophobicContact CE1-CG2 4.06Å; Y9-L37 HydrophobicContact CD1-CD2 4.38Å; Y9-L37 HydrophobicContact CG-CD2 4.09Å; Y9-A77 WeakPolarHBondContact OH-CB 3.44Å; Y9-F79 HydrophobicContact CE2-CD2 4.26Å; Y9-T83 HydrophobicContact CD1-CG2 3.67Å; Y9-T83 HydrophobicContact CD2-CG2 3.72Å; Y9-T83 WeakPolarHBondContact CD2-OG1 3.49Å; Y9-T83 HydrophobicContact CE1-CG2 3.28Å; Y9-T83 HydrophobicContact CE2-CG2 3.35Å; Y9-T83 WeakPolarHBondContact CE2-OG1 3.23Å; Y9-T83 HydrophobicContact CG-CG2 3.87Å
10	E	86.3	Confident	63.5	Low	97 Å²	97	109.9 Å²	109.9	45%	0.453	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.5	119.6	173.3	178	-179.3	-150.1	0	0	109.4	L12 A26 R27 L29	E10-L12 HydrophobicContact CG-CD2 4.45Å; E10-A26 CarbonylContact O-C 3.58Å; E10-A26 WeakPolarHBondContact O-CA 3.42Å; E10-A26 WeakPolarHBondContact O-CB 3.49Å; E10-R27 HydrophobicContact CB-CB 4.46Å; E10-R27 PolarHBondContact N-O 3.15Å; E10-R27 PolarHBondContact O-N 3.42Å; E10-L29 HydrophobicContact CB-CD1 4.41Å; E10-L29 HydrophobicContact CB-CD2 3.96Å; E10-L29 HydrophobicContact CB-CG 4.28Å
11	K	86.6	Confident	63.7	Low	93 Å²	93	104.9 Å²	104.9	40%	0.404	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	132.2	176.8	-70.4	-177.3	179	-168.1	0	110.3	Y24 L37	K11-Y24 HydrophobicContact CD-CD1 4.43Å; K11-Y24 HydrophobicContact CD-CG 4.39Å; K11-L37 HydrophobicContact CG-CD1 3.86Å
12	L	85.4	Confident	65.5	Low	78 Å²	78	94.8 Å²	94.8	41%	0.408	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-55.2	-178.4	-61.2	177.9	0	0	0	112.1	E10 K25 R27 I34	E10-L12 HydrophobicContact CG-CD2 4.45Å; L12-K25 HydrophobicContact CB-CB 4.34Å; L12-K25 HydrophobicContact CB-CD 4.37Å; L12-K25 HydrophobicContact CB-CG 4.09Å; L12-K25 HydrophobicContact CD1-CD 4.4Å; L12-K25 HydrophobicContact CD1-CG 4.13Å; L12-K25 PolarHBondContact N-O 3.05Å; L12-R27 HydrophobicContact CD1-CB 4.23Å; L12-I34 HydrophobicContact CD1-CD1 3.63Å
13	S	83.9	Confident	67.8	Low	55 Å²	55	87.2 Å²	87.2	39%	0.385	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	160.2	-178.1	67.2	0	0	0	0	111.8	Y24 K25	S13-Y24 CarbonylContact O-C 3.56Å; S13-Y24 VanDerWaalsContact O-CA 3.3Å; S13-Y24 WeakPolarHBondContact O-CA 2.94Å; S13-K25 PolarHBondContact N-O 3.23Å; S13-K25 PolarHBondContact O-N 3.4Å; S13-K25 WeakPolarHBondContact OG-CB 3.48Å
14	H	79.9	Confident	70	Confident	95 Å²	95	82.9 Å²	82.9	44%	0.44	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	135.8	168.9	-170.6	-116.2	0	0	0	109.4	G16 Y24	H14-G16 VanDerWaalsContact CE1-C 3.41Å; H14-G16 PolarHBondContact NE2-O 2.77Å; H14-Y24 HydrophobicContact CB-CD1 4.43Å; H14-Y24 HydrophobicContact CB-CE1 4.49Å; H14-Y24 AromaticContact CD2-CD1 3.95Å; H14-Y24 AromaticContact CD2-CE1 3.59Å; H14-Y24 AromaticContact CD2-CZ 3.95Å
15	L	69.2	Low	72	Confident	80 Å²	80	81.2 Å²	81.2	42%	0.419	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	-32.8	179	-67.7	173.8	0	0	0	112.4	V23 K25 A36 L89	L15-V23 HydrophobicContact CB-CB 4.29Å; L15-V23 HydrophobicContact CB-CG1 4.19Å; L15-V23 WeakPolarHBondContact CB-O 3.48Å; L15-V23 HydrophobicContact CD1-CG1 4.1Å; L15-V23 PolarHBondContact N-O 2.97Å; L15-K25 HydrophobicContact CD1-CB 3.95Å; L15-K25 HydrophobicContact CD2-CB 4.03Å; L15-K25 HydrophobicContact CG-CB 3.93Å; L15-A36 HydrophobicContact CD1-CB 4.22Å; L15-L89 HydrophobicContact CD1-CD1 4.21Å; L15-L89 HydrophobicContact CD1-CD2 3.8Å; L15-L89 HydrophobicContact CD1-CG 4.44Å; L15-L89 HydrophobicContact CD2-CD2 3.7Å; L15-L89 HydrophobicContact CG-CD2 4.39Å
16	G	65.9	Low	74	Confident	28 Å²	28	77.1 Å²	77.1	29%	0.289	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	174.8	154.5	-179.8	0	0	0	0	0	112.4	H14 V23	H14-G16 VanDerWaalsContact CE1-C 3.41Å; H14-G16 PolarHBondContact NE2-O 2.77Å; G16-V23 PolarHBondContact N-O 2.68Å; G16-V23 PolarHBondContact O-N 2.88Å
17	E	68.2	Low	75.5	Confident	142 Å²	142	70.2 Å²	70.2	66%	0.664	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.9	127.7	174.8	171.3	157.8	-147.1	0	0	107.9	N22 I41	E17-N22 WeakPolarHBondContact CB-OD1 3.31Å; E17-N22 VanDerWaalsContact CG-OD1 3.23Å; E17-N22 WeakPolarHBondContact CG-OD1 3.34Å; E17-I41 HydrophobicContact CG-CD1 4.35Å
18	G	62.3	Low	76.2	Confident	36 Å²	36	60.1 Å²	60.1	37%	0.371	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	165.3	172.2	0	0	0	0	0	109.8	F20 A21 I41	G18-F20 PolarHBondContact O-N 3.45Å; G18-A21 PolarHBondContact N-O 2.86Å; G18-A21 PolarHBondContact O-N 3.16Å; G18-A21 VanDerWaalsContact O-N 3.17Å; G18-I41 WeakPolarHBondContact O-CD1 3.37Å
19	Q	61.3	Low	76.5	Confident	108 Å²	108	60.8 Å²	60.8	51%	0.505	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-33	-175.9	-178.4	175.5	-18.3	0	0	114	V153	Q19-V153 VanDerWaalsContact OE1-CG2 3.3Å
20	F	64.5	Low	76.6	Confident	71 Å²	71	66.9 Å²	66.9	31%	0.311	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-13	-175.9	-56.2	-69.9	0	0	0	113.9	G18 Q40 I41 V153	G18-F20 PolarHBondContact O-N 3.45Å; F20-Q40 CarbonylContact O-C 3.42Å; F20-Q40 VanDerWaalsContact O-CA 3.23Å; F20-Q40 WeakPolarHBondContact O-CA 3.44Å; F20-Q40 PolarHBondContact O-OE1 3.48Å; F20-Q40 VanDerWaalsContact O-OE1 3.13Å; F20-I41 PolarHBondContact O-N 2.73Å; F20-V153 HydrophobicContact CE2-CB 4.37Å; F20-V153 HydrophobicContact CE2-CG1 4.2Å; F20-V153 HydrophobicContact CE2-CG2 3.89Å; F20-V153 HydrophobicContact CZ-CG2 3.75Å
21	A	67	Low	76.4	Confident	5 Å²	5	66.6 Å²	66.6	4%	0.041	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	148.5	-174.5	0	0	0	0	0	114.6	G18 K38 K39	G18-A21 PolarHBondContact N-O 2.86Å; G18-A21 PolarHBondContact O-N 3.16Å; G18-A21 VanDerWaalsContact O-N 3.17Å; A21-K38 HydrophobicContact CB-CD 4.21Å; A21-K38 HydrophobicContact CB-CG 3.38Å; A21-K39 CarbonylContact C-O 2.97Å; A21-K39 WeakPolarHBondContact CA-O 3.35Å; A21-K39 WeakPolarHBondContact CB-O 3.19Å
22	N	71.9	Confident	76.2	Confident	28 Å²	28	67.5 Å²	67.5	15%	0.15	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	129.6	167.4	-69	-11.1	0	0	0	110.3	E17 Y24 K38 K39 I41	E17-N22 WeakPolarHBondContact CB-OD1 3.31Å; E17-N22 VanDerWaalsContact CG-OD1 3.23Å; E17-N22 WeakPolarHBondContact CG-OD1 3.34Å; N22-Y24 HydrophobicContact CB-CD2 4.42Å; N22-Y24 HydrophobicContact CB-CE2 3.53Å; N22-K38 CarbonylContact O-C 3.19Å; N22-K38 WeakPolarHBondContact O-CA 3.44Å; N22-K39 PolarHBondContact N-O 2.73Å; N22-K39 PolarHBondContact O-N 3.37Å; N22-I41 WeakPolarHBondContact OD1-CD1 3.34Å
23	V	77.1	Confident	75.9	Confident	43 Å²	43	65.6 Å²	65.6	26%	0.261	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	128.2	179.5	-168.7	0	0	0	0	109.2	L15 G16 A36 L37 K38	L15-V23 HydrophobicContact CB-CB 4.29Å; L15-V23 HydrophobicContact CB-CG1 4.19Å; L15-V23 WeakPolarHBondContact CB-O 3.48Å; L15-V23 HydrophobicContact CD1-CG1 4.1Å; L15-V23 PolarHBondContact N-O 2.97Å; G16-V23 PolarHBondContact N-O 2.68Å; G16-V23 PolarHBondContact O-N 2.88Å; V23-A36 HydrophobicContact CG1-CB 4.08Å; V23-L37 CarbonylContact C-O 3.4Å; V23-L37 WeakPolarHBondContact CA-O 3.27Å; V23-K38 HydrophobicContact CG2-CB 4.27Å; V23-K38 HydrophobicContact CG2-CG 4.19Å
24	Y	77.7	Confident	75.7	Confident	45 Å²	45	64.9 Å²	64.9	18%	0.176	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	137.9	178.9	-59.5	-92.4	0	0	0	110.4	K11 S13 H14 N22 A36 L37 K39	K11-Y24 HydrophobicContact CD-CD1 4.43Å; K11-Y24 HydrophobicContact CD-CG 4.39Å; S13-Y24 CarbonylContact O-C 3.56Å; S13-Y24 VanDerWaalsContact O-CA 3.3Å; S13-Y24 WeakPolarHBondContact O-CA 2.94Å; H14-Y24 HydrophobicContact CB-CD1 4.43Å; H14-Y24 HydrophobicContact CB-CE1 4.49Å; H14-Y24 AromaticContact CD2-CD1 3.95Å; H14-Y24 AromaticContact CD2-CE1 3.59Å; H14-Y24 AromaticContact CD2-CZ 3.95Å; N22-Y24 HydrophobicContact CB-CD2 4.42Å; N22-Y24 HydrophobicContact CB-CE2 3.53Å; Y24-A36 CarbonylContact O-C 3.47Å; Y24-A36 VanDerWaalsContact O-CA 3.24Å; Y24-A36 WeakPolarHBondContact O-CA 3.23Å; Y24-L37 PolarHBondContact N-O 3.12Å; Y24-L37 PolarHBondContact O-N 3.35Å; Y24-K39 HydrophobicContact CD2-CB 4.46Å; Y24-K39 HydrophobicContact CE2-CB 4.1Å; Y24-K39 HydrophobicContact CE2-CD 4.36Å
25	K	80.7	Confident	75.6	Confident	64 Å²	64	60.4 Å²	60.4	28%	0.278	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	134.4	162.3	-175.5	175.2	-165.6	172.7	0	108.2	L12 S13 L15 I34 L89	L12-K25 HydrophobicContact CB-CB 4.34Å; L12-K25 HydrophobicContact CB-CD 4.37Å; L12-K25 HydrophobicContact CB-CG 4.09Å; L12-K25 HydrophobicContact CD1-CD 4.4Å; L12-K25 HydrophobicContact CD1-CG 4.13Å; L12-K25 PolarHBondContact N-O 3.05Å; S13-K25 PolarHBondContact N-O 3.23Å; S13-K25 PolarHBondContact O-N 3.4Å; S13-K25 WeakPolarHBondContact OG-CB 3.48Å; L15-K25 HydrophobicContact CD1-CB 3.95Å; L15-K25 HydrophobicContact CD2-CB 4.03Å; L15-K25 HydrophobicContact CG-CB 3.93Å; K25-I34 HydrophobicContact CD-CG2 4.49Å; K25-I34 HydrophobicContact CG-CG2 3.97Å; K25-L89 HydrophobicContact CB-CD2 4.18Å; K25-L89 HydrophobicContact CD-CD2 3.77Å; K25-L89 HydrophobicContact CG-CD1 4.03Å; K25-L89 HydrophobicContact CG-CD2 3.82Å; K25-L89 HydrophobicContact CG-CG 4.47Å
26	A	82.8	Confident	75.8	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	162.5	175.2	0	0	0	0	0	111.8	E10 I34 V35 L37	E10-A26 CarbonylContact O-C 3.58Å; E10-A26 WeakPolarHBondContact O-CA 3.42Å; E10-A26 WeakPolarHBondContact O-CB 3.49Å; A26-I34 CarbonylContact O-C 3.48Å; A26-I34 WeakPolarHBondContact O-CA 3.17Å; A26-V35 HydrophobicContact CB-CG2 3.91Å; A26-V35 PolarHBondContact N-O 3.31Å; A26-V35 PolarHBondContact O-N 3.19Å; A26-V35 VanDerWaalsContact O-O 3.14Å; A26-L37 HydrophobicContact CB-CD1 3.56Å; A26-L37 HydrophobicContact CB-CD2 4.17Å; A26-L37 HydrophobicContact CB-CG 3.55Å
27	R	84.9	Confident	76.2	Confident	86 Å²	86	56 Å²	56	33%	0.325	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	126.9	169.7	-174.8	-179.3	-68.7	-91.8	1	109.2	Y9 E10 L12 L29 D32 C33 I34	Y9-R27 CarbonylContact C-O 3.53Å; Y9-R27 VanDerWaalsContact CA-O 3.31Å; Y9-R27 WeakPolarHBondContact CA-O 3.37Å; E10-R27 HydrophobicContact CB-CB 4.46Å; E10-R27 PolarHBondContact N-O 3.15Å; E10-R27 PolarHBondContact O-N 3.42Å; L12-R27 HydrophobicContact CD1-CB 4.23Å; R27-L29 HydrophobicContact CG-CD2 4.23Å; R27-L29 PolarHBondContact O-N 3Å; R27-D32 IonicContact CZ-OD1 2.73Å; R27-D32 IonicContact NH1-OD1 3.34Å; R27-D32 PolarHBondContact NH1-OD1 3.11Å; R27-C33 CarbonylContact C-O 3.37Å; R27-C33 WeakPolarHBondContact CA-O 3.38Å; R27-I34 HydrophobicContact CB-CD1 4.37Å
28	D	83.8	Confident	76.5	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	106.9	166.3	-172.3	-9.7	0	0	0	108.4	R8 Y9 K30 N31 D32 C33 V35	R8-D28 WeakPolarHBondContact CG-OD1 3.49Å; R8-D28 IonicContact CZ-OD2 3.53Å; R8-D28 IonicContact NE-OD1 3.08Å; R8-D28 PolarHBondContact NE-OD1 2.83Å; R8-D28 VanDerWaalsContact NE-OD1 3.12Å; R8-D28 IonicContact NE-OD2 3Å; R8-D28 PolarHBondContact NE-OD2 2.85Å; R8-D28 IonicContact NH2-OD1 3.96Å; R8-D28 IonicContact NH2-OD2 2.85Å; R8-D28 PolarHBondContact NH2-OD2 3.09Å; Y9-D28 HydrophobicContact CD1-CB 3.86Å; Y9-D28 HydrophobicContact CE1-CB 3.63Å; Y9-D28 VanDerWaalsContact CE1-CG 3.46Å; D28-K30 PolarHBondContact O-N 3.27Å; D28-K30 WeakPolarHBondContact OD1-CB 3.31Å; D28-K30 PolarHBondContact OD1-N 2.81Å; D28-N31 PolarHBondContact O-N 2.85Å; D28-N31 PolarHBondContact OD2-ND2 3.14Å; D28-D32 VanDerWaalsContact O-CA 3.27Å; D28-D32 WeakPolarHBondContact O-CA 3.21Å; D28-D32 PolarHBondContact O-N 2.88Å; D28-C33 PolarHBondContact N-O 2.89Å; D28-V35 HydrophobicContact CB-CG1 4.03Å
29	L	85.4	Confident	77	Confident	90 Å²	90	53.1 Å²	53.1	47%	0.471	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-15.7	-178	-58.3	-174.1	0	0	0	112.7	R7 R8 E10 R27	R7-L29 WeakPolarHBondContact O-CD1 3.34Å; R8-L29 WeakPolarHBondContact O-CB 3.47Å; R8-L29 PolarHBondContact O-N 2.77Å; E10-L29 HydrophobicContact CB-CD1 4.41Å; E10-L29 HydrophobicContact CB-CD2 3.96Å; E10-L29 HydrophobicContact CB-CG 4.28Å; R27-L29 HydrophobicContact CG-CD2 4.23Å; R27-L29 PolarHBondContact O-N 3Å
30	K	83.8	Confident	77.3	Confident	161 Å²	161	49.8 Å²	49.8	70%	0.7	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-40.5	176.8	-175.4	179.6	175.8	-178.1	0	112.2	R8 D28	R8-K30 HydrophobicContact CG-CB 4.48Å; D28-K30 PolarHBondContact O-N 3.27Å; D28-K30 WeakPolarHBondContact OD1-CB 3.31Å; D28-K30 PolarHBondContact OD1-N 2.81Å
31	N	82.1	Confident	77.2	Confident	90 Å²	90	48.7 Å²	48.7	48%	0.481	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	0.6	-172	-60.7	-44.8	0	0	0	113	R8 D28 C33	R8-N31 PolarHBondContact NH2-ND2 3.21Å; D28-N31 PolarHBondContact O-N 2.85Å; D28-N31 PolarHBondContact OD2-ND2 3.14Å; N31-C33 PolarHBondContact O-N 3.25Å
32	D	82.6	Confident	76.8	Confident	112 Å²	112	56.8 Å²	56.8	60%	0.599	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.6	44.5	-173.9	-163.9	31.9	0	0	0	114.2	R27 D28	R27-D32 IonicContact CZ-OD1 2.73Å; R27-D32 IonicContact NH1-OD1 3.34Å; R27-D32 PolarHBondContact NH1-OD1 3.11Å; D28-D32 VanDerWaalsContact O-CA 3.27Å; D28-D32 WeakPolarHBondContact O-CA 3.21Å; D28-D32 PolarHBondContact O-N 2.88Å
33	C	79.8	Confident	75.8	Confident	39 Å²	39	62 Å²	62	26%	0.264	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	153	179.6	69.5	0	0	0	0	111.5	R27 D28 N31	R27-C33 CarbonylContact C-O 3.37Å; R27-C33 WeakPolarHBondContact CA-O 3.38Å; D28-C33 PolarHBondContact N-O 2.89Å; N31-C33 PolarHBondContact O-N 3.25Å
34	I	79.1	Confident	74.5	Confident	40 Å²	40	61.5 Å²	61.5	21%	0.205	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	133.6	174.1	-57.1	-62	0	0	0	109.2	L12 K25 A26 R27 L89	L12-I34 HydrophobicContact CD1-CD1 3.63Å; K25-I34 HydrophobicContact CD-CG2 4.49Å; K25-I34 HydrophobicContact CG-CG2 3.97Å; A26-I34 CarbonylContact O-C 3.48Å; A26-I34 WeakPolarHBondContact O-CA 3.17Å; R27-I34 HydrophobicContact CB-CD1 4.37Å; I34-L89 HydrophobicContact CG2-CB 3.63Å; I34-L89 HydrophobicContact CG2-CD1 3.49Å; I34-L89 VanDerWaalsContact CG2-CD1 3.49Å; I34-L89 HydrophobicContact CG2-CG 4.09Å
35	V	76.8	Confident	73.1	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	173.7	-178.2	-52.5	0	0	0	0	110.6	Y9 A26 D28 L37 T83 T85 L89	Y9-V35 HydrophobicContact CD1-CG2 3.74Å; Y9-V35 HydrophobicContact CE1-CG2 4.06Å; A26-V35 HydrophobicContact CB-CG2 3.91Å; A26-V35 PolarHBondContact N-O 3.31Å; A26-V35 PolarHBondContact O-N 3.19Å; A26-V35 VanDerWaalsContact O-O 3.14Å; D28-V35 HydrophobicContact CB-CG1 4.03Å; V35-L37 HydrophobicContact CG2-CD2 4.19Å; V35-T83 HydrophobicContact CG2-CG2 4.34Å; V35-T85 HydrophobicContact CB-CG2 4.21Å; V35-T85 HydrophobicContact CG1-CG2 3.68Å; V35-L89 WeakPolarHBondContact O-CD1 3.34Å
36	A	74.2	Confident	71.7	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.008	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	121.8	174.9	0	0	0	0	0	112.2	L15 V23 Y24 F84 V86 L89	L15-A36 HydrophobicContact CD1-CB 4.22Å; V23-A36 HydrophobicContact CG1-CB 4.08Å; Y24-A36 CarbonylContact O-C 3.47Å; Y24-A36 VanDerWaalsContact O-CA 3.24Å; Y24-A36 WeakPolarHBondContact O-CA 3.23Å; A36-F84 CarbonylContact C-O 3.48Å; A36-F84 PolarHBondContact N-O 3Å; A36-F84 VanDerWaalsContact N-O 3.15Å; A36-F84 CarbonylContact O-C 3.57Å; A36-F84 VanDerWaalsContact O-CA 3.24Å; A36-F84 WeakPolarHBondContact O-CA 3.41Å; A36-F84 WeakPolarHBondContact O-CB 3.37Å; A36-F84 PolarHBondContact O-N 2.98Å; A36-V86 HydrophobicContact CB-CB 3.72Å; A36-V86 HydrophobicContact CB-CG2 3.26Å; A36-L89 HydrophobicContact CB-CD1 4.33Å
37	L	75	Confident	70.1	Confident	14 Å²	14	74.5 Å²	74.5	7%	0.073	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	108.3	178.1	-50	-179.5	0	0	0	109.6	Y9 K11 V23 Y24 A26 V35 K39 T83	Y9-L37 HydrophobicContact CD1-CD2 4.38Å; Y9-L37 HydrophobicContact CG-CD2 4.09Å; K11-L37 HydrophobicContact CG-CD1 3.86Å; V23-L37 CarbonylContact C-O 3.4Å; V23-L37 WeakPolarHBondContact CA-O 3.27Å; Y24-L37 PolarHBondContact N-O 3.12Å; Y24-L37 PolarHBondContact O-N 3.35Å; A26-L37 HydrophobicContact CB-CD1 3.56Å; A26-L37 HydrophobicContact CB-CD2 4.17Å; A26-L37 HydrophobicContact CB-CG 3.55Å; V35-L37 HydrophobicContact CG2-CD2 4.19Å; L37-K39 PolarHBondContact O-N 3.13Å; L37-T83 HydrophobicContact CD2-CG2 3.2Å
38	K	73.6	Confident	68.4	Low	26 Å²	26	76.4 Å²	76.4	11%	0.113	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	100.2	170	-178.9	-172.9	-167.7	-171.5	0	108.3	A21 N22 V23 E60 H82 F84 D135	A21-K38 HydrophobicContact CB-CD 4.21Å; A21-K38 HydrophobicContact CB-CG 3.38Å; N22-K38 CarbonylContact O-C 3.19Å; N22-K38 WeakPolarHBondContact O-CA 3.44Å; V23-K38 HydrophobicContact CG2-CB 4.27Å; V23-K38 HydrophobicContact CG2-CG 4.19Å; K38-E60 IonicContact NZ-OE1 2.77Å; K38-E60 PolarHBondContact NZ-OE1 3.22Å; K38-E60 IonicContact NZ-OE2 3.06Å; K38-E60 PolarHBondContact NZ-OE2 2.79Å; K38-H82 WeakPolarHBondContact O-CB 3.45Å; K38-F84 HydrophobicContact CB-CD2 3.36Å; K38-F84 HydrophobicContact CB-CE2 3.41Å; K38-F84 VanDerWaalsContact CB-CE2 3.41Å; K38-F84 HydrophobicContact CB-CG 4.22Å; K38-F84 HydrophobicContact CB-CZ 4.28Å; K38-F84 HydrophobicContact CD-CD2 4.33Å; K38-F84 HydrophobicContact CD-CE1 4.34Å; K38-F84 HydrophobicContact CD-CE2 3.77Å; K38-F84 HydrophobicContact CD-CZ 3.76Å; K38-F84 HydrophobicContact CG-CD2 4.39Å; K38-F84 HydrophobicContact CG-CE2 4Å; K38-F84 HydrophobicContact CG-CZ 4.49Å; K38-D135 IonicContact NZ-OD1 3.35Å; K38-D135 PolarHBondContact NZ-OD1 2.86Å
39	K	72.3	Confident	66.8	Low	92 Å²	92	81 Å²	81	40%	0.4	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	116.7	178.8	-177.7	-170.4	178.6	-165.4	0	109.2	A21 N22 Y24 L37 I41 M81	A21-K39 CarbonylContact C-O 2.97Å; A21-K39 WeakPolarHBondContact CA-O 3.35Å; A21-K39 WeakPolarHBondContact CB-O 3.19Å; N22-K39 PolarHBondContact N-O 2.73Å; N22-K39 PolarHBondContact O-N 3.37Å; Y24-K39 HydrophobicContact CD2-CB 4.46Å; Y24-K39 HydrophobicContact CE2-CB 4.1Å; Y24-K39 HydrophobicContact CE2-CD 4.36Å; L37-K39 PolarHBondContact O-N 3.13Å; K39-I41 PolarHBondContact O-N 3.35Å; K39-M81 HydrophobicContact CD-CE 3.78Å; K39-M81 HydrophobicContact CG-CE 4.01Å
40	Q	67.2	Low	64.8	Low	38 Å²	38	82.5 Å²	82.5	18%	0.178	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	135.2	176.9	-66.5	-77.4	-41.9	0	0	111.6	F20 A57 H82	F20-Q40 CarbonylContact O-C 3.42Å; F20-Q40 VanDerWaalsContact O-CA 3.23Å; F20-Q40 WeakPolarHBondContact O-CA 3.44Å; F20-Q40 PolarHBondContact O-OE1 3.48Å; F20-Q40 VanDerWaalsContact O-OE1 3.13Å; Q40-A57 HydrophobicContact CG-CB 4.24Å; Q40-H82 WeakPolarHBondContact CG-NE2 3.31Å
41	I	64.3	Low	63.1	Low	49 Å²	49	80.8 Å²	80.8	25%	0.251	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-79.2	124.6	170.2	-57.2	174.3	0	0	0	106.5	E17 G18 F20 N22 K39 M43	E17-I41 HydrophobicContact CG-CD1 4.35Å; G18-I41 WeakPolarHBondContact O-CD1 3.37Å; F20-I41 PolarHBondContact O-N 2.73Å; N22-I41 WeakPolarHBondContact OD1-CD1 3.34Å; K39-I41 PolarHBondContact O-N 3.35Å; I41-M43 VanDerWaalsContact C-N 3.34Å; I41-M43 HydrophobicContact CG2-CG 4.09Å; I41-M43 HydrophobicContact CG2-SD 4.05Å; I41-M43 PolarHBondContact O-N 2.81Å
42	K	57.9	Low	61.9	Low	174 Å²	174	79.8 Å²	79.8	76%	0.757	43%	0.428	S	S	*	.			trans	-75.5	91.3	172.6	-67.8	-173.3	176.6	-169.2	0	108.1
43	M	50.4	Low	60.6	Low	138 Å²	138	79.2 Å²	79.2	68%	0.68	42%	0.424	S	S	*	.			trans	-84.5	120.2	169.5	-66	-69.9	-90	0	0	107.8	I41	I41-M43 VanDerWaalsContact C-N 3.34Å; I41-M43 HydrophobicContact CG2-CG 4.09Å; I41-M43 HydrophobicContact CG2-SD 4.05Å; I41-M43 PolarHBondContact O-N 2.81Å
44	G	51	Low	59.8	Low	32 Å²	32	80.8 Å²	80.8	33%	0.33	43%	0.43	S	S	.	.	S	Bend	trans	139	153.6	170.7	0	0	0	0	0	115.6	E48 Q49	G44-E48 WeakPolarHBondContact CA-OE2 3.3Å; G44-Q49 PolarHBondContact O-NE2 2.78Å
45	S	48.3	Very low	59.1	Low	75 Å²	75	87.1 Å²	87.1	52%	0.524	45%	0.451	S	S	.	.			trans	-59.1	155.9	175.3	-62	0	0	0	0	110.2	S47 E48 Q49	S45-S47 PolarHBondContact O-N 2.73Å; S45-E48 PolarHBondContact N-OE2 3.46Å; S45-E48 PolarHBondContact O-N 2.82Å; S45-Q49 WeakPolarHBondContact O-CG 3.17Å; S45-Q49 PolarHBondContact O-N 2.79Å; S45-Q49 VanDerWaalsContact O-N 3.16Å
46	R	50.7	Low	58.4	Low	223 Å²	223	89 Å²	89	84%	0.842	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	-23.6	177.4	-91.2	-179.3	169.1	175.9	-3	114.1
47	S	48.2	Very low	57.7	Low	84 Å²	84	89 Å²	89	59%	0.587	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-40.8	172.9	44.6	0	0	0	0	113.9	S45 Q49 T50	S45-S47 PolarHBondContact O-N 2.73Å; S47-Q49 VanDerWaalsContact C-N 3.26Å; S47-Q49 PolarHBondContact O-N 2.83Å; S47-T50 PolarHBondContact O-N 3.39Å; S47-T50 PolarHBondContact O-OG1 3.06Å
48	E	50.3	Low	57.2	Low	126 Å²	126	91.6 Å²	91.6	59%	0.589	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-72.3	-21.7	174.8	-67.2	168.7	140.6	0	0	112	G44 S45 T50 D51	G44-E48 WeakPolarHBondContact CA-OE2 3.3Å; S45-E48 PolarHBondContact N-OE2 3.46Å; S45-E48 PolarHBondContact O-N 2.82Å; E48-T50 PolarHBondContact O-N 2.78Å; E48-T50 VanDerWaalsContact O-N 3.15Å; E48-D51 PolarHBondContact O-N 3.17Å
49	Q	48.9	Very low	56.8	Low	97 Å²	97	95.7 Å²	95.7	45%	0.453	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-68.8	-5.4	175.4	-66.7	171.2	37.7	0	0	114	G44 S45 S47	G44-Q49 PolarHBondContact O-NE2 2.78Å; S45-Q49 WeakPolarHBondContact O-CG 3.17Å; S45-Q49 PolarHBondContact O-N 2.79Å; S45-Q49 VanDerWaalsContact O-N 3.16Å; S47-Q49 VanDerWaalsContact C-N 3.26Å; S47-Q49 PolarHBondContact O-N 2.83Å
50	T	45.1	Very low	56.4	Low	121 Å²	121	91.6 Å²	91.6	74%	0.742	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-78.1	-24.2	176.6	58.5	0	0	0	0	112.7	S47 E48 G52	S47-T50 PolarHBondContact O-N 3.39Å; S47-T50 PolarHBondContact O-OG1 3.06Å; E48-T50 PolarHBondContact O-N 2.78Å; E48-T50 VanDerWaalsContact O-N 3.15Å; T50-G52 VanDerWaalsContact C-N 3.3Å; T50-G52 PolarHBondContact O-N 3.31Å; T50-G52 VanDerWaalsContact O-N 3.09Å
51	D	47.6	Very low	56.3	Low	125 Å²	125	90.8 Å²	90.8	67%	0.668	47%	0.47	S	S	*	.	S	Bend	trans	-91.6	58.8	-175.6	-147.6	16.1	0	0	0	111.8	E48	E48-D51 PolarHBondContact O-N 3.17Å
52	G	55.7	Low	56.5	Low	70 Å²	70	94 Å²	94	72%	0.722	48%	0.482	S	S	*	.			trans	49.6	-150	162.8	0	0	0	0	0	117.6	T50	T50-G52 VanDerWaalsContact C-N 3.3Å; T50-G52 PolarHBondContact O-N 3.31Å; T50-G52 VanDerWaalsContact O-N 3.09Å
53	L	55.9	Low	56.8	Low	100 Å²	100	86.3 Å²	86.3	52%	0.524	45%	0.449	S	S	.	.	S	Bend	trans	-74.5	139.7	173.2	-74.3	160.1	0	0	0	109.2	R55 I58	L53-R55 PolarHBondContact O-N 2.93Å; L53-I58 HydrophobicContact CB-CD1 4.01Å; L53-I58 HydrophobicContact CB-CG1 3.87Å
54	N	63.6	Low	57.6	Low	71 Å²	71	79.9 Å²	79.9	38%	0.38	42%	0.417	S	S	.	.			trans	-51.8	127.4	173.9	-174	-21.8	0	0	0	110.1	T56 A57 I58	N54-T56 PolarHBondContact O-N 3.44Å; N54-T56 VanDerWaalsContact O-N 3.11Å; N54-T56 WeakPolarHBondContact OD1-CB 3.48Å; N54-T56 PolarHBondContact OD1-N 3.35Å; N54-T56 VanDerWaalsContact OD1-N 3.14Å; N54-T56 PolarHBondContact OD1-OG1 3.03Å; N54-A57 HydrophobicContact CB-CB 4.48Å; N54-A57 WeakPolarHBondContact O-CA 3.03Å; N54-A57 WeakPolarHBondContact O-CB 3.48Å; N54-A57 PolarHBondContact O-N 3.29Å; N54-I58 PolarHBondContact O-N 3.09Å
55	R	64.6	Low	58.4	Low	174 Å²	174	84 Å²	84	66%	0.657	43%	0.428	S	S	*	.	H	α-helix	trans	-52.6	-35.8	-178.1	-68.5	-176.6	178.1	-171.5	-0.1	112.3	L53 A57 I58 R59	L53-R55 PolarHBondContact O-N 2.93Å; R55-A57 PolarHBondContact O-N 3Å; R55-I58 PolarHBondContact O-N 3.41Å; R55-R59 WeakPolarHBondContact O-CG 3.33Å; R55-R59 PolarHBondContact O-N 3.3Å
56	T	61.1	Low	59.4	Low	38 Å²	38	86.6 Å²	86.6	23%	0.233	43%	0.432	C	S	.	.	H	α-helix	trans	-57.5	-45.5	174.4	-54	0	0	0	0	111.6	N54 R59 E60 G137	N54-T56 PolarHBondContact O-N 3.44Å; N54-T56 VanDerWaalsContact O-N 3.11Å; N54-T56 WeakPolarHBondContact OD1-CB 3.48Å; N54-T56 PolarHBondContact OD1-N 3.35Å; N54-T56 VanDerWaalsContact OD1-N 3.14Å; N54-T56 PolarHBondContact OD1-OG1 3.03Å; T56-R59 PolarHBondContact O-N 2.83Å; T56-E60 PolarHBondContact O-N 3.49Å; T56-G137 WeakPolarHBondContact CG2-O 3.23Å
57	A	60.7	Low	60.1	Low	2 Å²	2	78 Å²	78	2%	0.017	40%	0.402	C	S	.	.	H	α-helix	trans	-69.4	-35.7	178.9	0	0	0	0	0	112.4	Q40 N54 R55 I61	Q40-A57 HydrophobicContact CG-CB 4.24Å; N54-A57 HydrophobicContact CB-CB 4.48Å; N54-A57 WeakPolarHBondContact O-CA 3.03Å; N54-A57 WeakPolarHBondContact O-CB 3.48Å; N54-A57 PolarHBondContact O-N 3.29Å; R55-A57 PolarHBondContact O-N 3Å; A57-I61 VanDerWaalsContact O-CD1 3.31Å; A57-I61 WeakPolarHBondContact O-CD1 3.26Å; A57-I61 WeakPolarHBondContact O-CG1 3.45Å; A57-I61 PolarHBondContact O-N 3.15Å; A57-I61 VanDerWaalsContact O-N 3.09Å
58	I	64.7	Low	61	Low	68 Å²	68	78.8 Å²	78.8	35%	0.349	41%	0.407	S	S	.	.	H	α-helix	trans	-64.5	-42.6	175.2	-61.4	174.7	0	0	0	110.4	L53 N54 R55 I61 K62	L53-I58 HydrophobicContact CB-CD1 4.01Å; L53-I58 HydrophobicContact CB-CG1 3.87Å; N54-I58 PolarHBondContact O-N 3.09Å; R55-I58 PolarHBondContact O-N 3.41Å; I58-I61 PolarHBondContact O-N 2.88Å; I58-K62 HydrophobicContact CG2-CD 4.43Å; I58-K62 WeakPolarHBondContact O-CG 3.21Å; I58-K62 PolarHBondContact O-N 2.97Å
59	R	64.4	Low	61.6	Low	112 Å²	112	76.4 Å²	76.4	42%	0.423	40%	0.396	S	S	.	.	H	α-helix	trans	-62.9	-49.3	177	-73	176.6	-174.2	164.4	-1.3	111.6	R55 T56 I61 K62 L63	R55-R59 WeakPolarHBondContact O-CG 3.33Å; R55-R59 PolarHBondContact O-N 3.3Å; T56-R59 PolarHBondContact O-N 2.83Å; R59-I61 VanDerWaalsContact C-N 3.26Å; R59-I61 PolarHBondContact O-N 2.79Å; R59-K62 PolarHBondContact O-N 2.77Å; R59-K62 VanDerWaalsContact O-N 3.17Å; R59-L63 WeakPolarHBondContact O-CG 3.17Å; R59-L63 PolarHBondContact O-N 2.82Å
60	E	64.2	Low	62.4	Low	7 Å²	7	74.8 Å²	74.8	3%	0.033	40%	0.399	C	S	.	.	H	α-helix	trans	-53.8	-44.8	177	-173.2	-176.3	178.9	0	0	111.2	K38 T56 L64 F136	K38-E60 IonicContact NZ-OE1 2.77Å; K38-E60 PolarHBondContact NZ-OE1 3.22Å; K38-E60 IonicContact NZ-OE2 3.06Å; K38-E60 PolarHBondContact NZ-OE2 2.79Å; T56-E60 PolarHBondContact O-N 3.49Å; E60-L64 HydrophobicContact CG-CD1 3.87Å; E60-L64 VanDerWaalsContact O-CB 3.31Å; E60-L64 WeakPolarHBondContact O-CB 3.44Å; E60-L64 VanDerWaalsContact O-CG 3.29Å; E60-L64 WeakPolarHBondContact O-CG 3.21Å; E60-L64 PolarHBondContact O-N 3.02Å; E60-F136 HydrophobicContact CG-CB 4.16Å
61	I	65.7	Low	63.3	Low	20 Å²	20	69.6 Å²	69.6	10%	0.103	37%	0.367	C	S	.	.	H	α-helix	trans	-64.5	-47	179.1	-70.5	163.8	0	0	0	111.8	A57 I58 R59 L64 Q65 T78 H82	A57-I61 VanDerWaalsContact O-CD1 3.31Å; A57-I61 WeakPolarHBondContact O-CD1 3.26Å; A57-I61 WeakPolarHBondContact O-CG1 3.45Å; A57-I61 PolarHBondContact O-N 3.15Å; A57-I61 VanDerWaalsContact O-N 3.09Å; I58-I61 PolarHBondContact O-N 2.88Å; R59-I61 VanDerWaalsContact C-N 3.26Å; R59-I61 PolarHBondContact O-N 2.79Å; I61-L64 PolarHBondContact O-N 2.86Å; I61-Q65 HydrophobicContact CG2-CG 4.25Å; I61-Q65 WeakPolarHBondContact O-CB 3.21Å; I61-Q65 WeakPolarHBondContact O-CG 3.24Å; I61-Q65 PolarHBondContact O-N 3.17Å; I61-T78 HydrophobicContact CD1-CG2 4.31Å; I61-T78 HydrophobicContact CG1-CG2 4.29Å; I61-T78 HydrophobicContact CG2-CG2 3.73Å; I61-H82 WeakPolarHBondContact CD1-ND1 3.29Å
62	K	67.2	Low	64.1	Low	118 Å²	118	64 Å²	64	51%	0.513	34%	0.337	S	S	.	.	H	α-helix	trans	-61.4	-47.1	-179	-75.5	-175.3	174.7	-168.4	0	111	I58 R59 L64 Q65 E66	I58-K62 HydrophobicContact CG2-CD 4.43Å; I58-K62 WeakPolarHBondContact O-CG 3.21Å; I58-K62 PolarHBondContact O-N 2.97Å; R59-K62 PolarHBondContact O-N 2.77Å; R59-K62 VanDerWaalsContact O-N 3.17Å; K62-L64 PolarHBondContact O-N 2.77Å; K62-Q65 PolarHBondContact O-N 3.33Å; K62-E66 WeakPolarHBondContact O-CG 3.34Å; K62-E66 PolarHBondContact O-N 3.13Å; K62-E66 VanDerWaalsContact O-N 3.13Å
63	L	65.2	Low	64.7	Low	11 Å²	11	61.3 Å²	61.3	6%	0.058	31%	0.306	C	S	.	.	H	α-helix	trans	-58.9	-50	177	-72.4	167.2	0	0	0	111.5	R59 Q65 E66 I67 A139 F141	R59-L63 WeakPolarHBondContact O-CG 3.17Å; R59-L63 PolarHBondContact O-N 2.82Å; L63-Q65 PolarHBondContact O-N 2.97Å; L63-E66 PolarHBondContact O-N 3.18Å; L63-I67 HydrophobicContact CB-CD1 4.37Å; L63-I67 WeakPolarHBondContact O-CB 2.97Å; L63-I67 WeakPolarHBondContact O-CD1 3.24Å; L63-I67 VanDerWaalsContact O-CG1 3.23Å; L63-I67 WeakPolarHBondContact O-CG1 3.19Å; L63-I67 PolarHBondContact O-N 3.23Å; L63-A139 HydrophobicContact CD1-CB 3.8Å; L63-A139 WeakPolarHBondContact CD1-O 3.5Å; L63-F141 HydrophobicContact CD2-CD1 4.08Å; L63-F141 HydrophobicContact CD2-CD2 3.91Å; L63-F141 HydrophobicContact CD2-CE1 3.66Å; L63-F141 HydrophobicContact CD2-CE2 3.46Å; L63-F141 VanDerWaalsContact CD2-CE2 3.46Å; L63-F141 HydrophobicContact CD2-CG 4.2Å; L63-F141 HydrophobicContact CD2-CZ 3.33Å; L63-F141 HydrophobicContact CG-CE2 4.16Å; L63-F141 HydrophobicContact CG-CZ 4.26Å
64	L	66	Low	65.3	Low	3 Å²	3	61.9 Å²	61.9	2%	0.016	30%	0.304	C	S	.	.	H	α-helix	trans	-70.5	-17.2	-179.4	-72.6	176.8	0	0	0	114.5	E60 I61 K62 I72 I73 V75 F84 F136	E60-L64 HydrophobicContact CG-CD1 3.87Å; E60-L64 VanDerWaalsContact O-CB 3.31Å; E60-L64 WeakPolarHBondContact O-CB 3.44Å; E60-L64 VanDerWaalsContact O-CG 3.29Å; E60-L64 WeakPolarHBondContact O-CG 3.21Å; E60-L64 PolarHBondContact O-N 3.02Å; I61-L64 PolarHBondContact O-N 2.86Å; K62-L64 PolarHBondContact O-N 2.77Å; L64-I72 HydrophobicContact CD2-CG2 3.94Å; L64-I73 HydrophobicContact CD1-CG2 4.47Å; L64-I73 HydrophobicContact CD2-CG2 4.18Å; L64-I73 WeakPolarHBondContact CD2-O 3.44Å; L64-V75 HydrophobicContact CB-CB 4.3Å; L64-V75 HydrophobicContact CB-CG2 3.52Å; L64-V75 HydrophobicContact CD1-CG2 3.6Å; L64-V75 HydrophobicContact CG-CG2 4.18Å; L64-F84 HydrophobicContact CD1-CD1 4.39Å; L64-F84 HydrophobicContact CD1-CE1 3.89Å; L64-F136 HydrophobicContact CD1-CD2 4.25Å; L64-F136 HydrophobicContact CD2-CD2 3.33Å; L64-F136 HydrophobicContact CD2-CE2 3.56Å; L64-F136 HydrophobicContact CD2-CG 4.11Å; L64-F136 HydrophobicContact CD2-CZ 4.47Å; L64-F136 HydrophobicContact CG-CD2 3.96Å; L64-F136 HydrophobicContact CG-CG 4.47Å
65	Q	68.6	Low	65.4	Low	118 Å²	118	59.3 Å²	59.3	55%	0.551	29%	0.291	S	S	*	.	H	α-helix	trans	-81.8	-30.8	172.6	-79.2	-179.5	-31.8	0	0	112.2	I61 K62 L63	I61-Q65 HydrophobicContact CG2-CG 4.25Å; I61-Q65 WeakPolarHBondContact O-CB 3.21Å; I61-Q65 WeakPolarHBondContact O-CG 3.24Å; I61-Q65 PolarHBondContact O-N 3.17Å; K62-Q65 PolarHBondContact O-N 3.33Å; L63-Q65 PolarHBondContact O-N 2.97Å
66	E	69.3	Low	65.4	Low	131 Å²	131	54.3 Å²	54.3	61%	0.612	28%	0.277	S	S	*	.	H	α-helix	trans	-86.2	-27.1	180	-70.1	174.4	-163.4	0	0	112.3	K62 L63 F141	K62-E66 WeakPolarHBondContact O-CG 3.34Å; K62-E66 PolarHBondContact O-N 3.13Å; K62-E66 VanDerWaalsContact O-N 3.13Å; L63-E66 PolarHBondContact O-N 3.18Å; E66-F141 VanDerWaalsContact OE2-CZ 3.26Å; E66-F141 WeakPolarHBondContact OE2-CZ 3.5Å
67	I	64.4	Low	65.5	Low	42 Å²	42	53.1 Å²	53.1	22%	0.215	27%	0.271	C	S	.	.			trans	-97	122.8	-176.6	-58.7	165.1	0	0	0	111.2	L63 I72 L115	L63-I67 HydrophobicContact CB-CD1 4.37Å; L63-I67 WeakPolarHBondContact O-CB 2.97Å; L63-I67 WeakPolarHBondContact O-CD1 3.24Å; L63-I67 VanDerWaalsContact O-CG1 3.23Å; L63-I67 WeakPolarHBondContact O-CG1 3.19Å; L63-I67 PolarHBondContact O-N 3.23Å; I67-I72 HydrophobicContact CG2-CB 4.49Å; I67-I72 HydrophobicContact CG2-CD1 3.23Å; I67-I72 HydrophobicContact CG2-CG1 4.44Å; I67-I72 HydrophobicContact CG2-CG2 4.18Å; I67-L115 HydrophobicContact CD1-CD2 4.02Å
68	S	66.8	Low	65.6	Low	100 Å²	100	56 Å²	56	70%	0.699	29%	0.288	S	S	*	.			trans	-128.5	97.2	172.9	178	0	0	0	0	110.3
69	H	64.6	Low	65.2	Low	77 Å²	77	58.5 Å²	58.5	36%	0.356	30%	0.297	S	S	.	.			trans	-132	153.2	179.8	-167.2	-107.5	0	0	0	111.7	N71 I72	H69-N71 PolarHBondContact CE1-OD1 3.09Å; H69-N71 PolarHBondContact ND1-N 2.99Å; H69-N71 VanDerWaalsContact ND1-N 3.17Å; H69-N71 PolarHBondContact ND1-OD1 3.28Å; H69-N71 PolarHBondContact O-N 3.49Å; H69-I72 HydrophobicContact CB-CB 4.11Å; H69-I72 HydrophobicContact CB-CD1 3.47Å; H69-I72 VanDerWaalsContact CB-CD1 3.47Å; H69-I72 HydrophobicContact CB-CG1 3.88Å; H69-I72 PolarHBondContact O-N 2.99Å
70	A	65.9	Low	64.5	Low	62 Å²	62	65.8 Å²	65.8	51%	0.512	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-34.3	178.4	0	0	0	0	0	112.1	K132	A70-K132 PolarHBondContact O-NZ 3.38Å
71	N	63.2	Low	63.8	Low	13 Å²	13	69.9 Å²	69.9	7%	0.07	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	16.3	-176.9	-52.4	93.9	0	0	0	114.5	H69 F110 L131 K132 M133	H69-N71 PolarHBondContact CE1-OD1 3.09Å; H69-N71 PolarHBondContact ND1-N 2.99Å; H69-N71 VanDerWaalsContact ND1-N 3.17Å; H69-N71 PolarHBondContact ND1-OD1 3.28Å; H69-N71 PolarHBondContact O-N 3.49Å; N71-F110 HydrophobicContact CB-CD2 3.66Å; N71-F110 HydrophobicContact CB-CE2 4.27Å; N71-L131 VanDerWaalsContact CA-O 3.25Å; N71-L131 WeakPolarHBondContact CA-O 3.31Å; N71-L131 WeakPolarHBondContact CB-O 3.44Å; N71-L131 PolarHBondContact ND2-O 3.43Å; N71-K132 CarbonylContact O-C 3.52Å; N71-K132 VanDerWaalsContact O-CA 3.29Å; N71-K132 WeakPolarHBondContact O-CA 3.41Å; N71-M133 PolarHBondContact O-N 3.41Å
72	I	64.2	Low	63.2	Low	7 Å²	7	69.8 Å²	69.8	4%	0.036	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-123	138.5	178.7	-63.3	167.4	0	0	0	109.2	L64 I67 H69 K74 F110 L115 F136	L64-I72 HydrophobicContact CD2-CG2 3.94Å; I67-I72 HydrophobicContact CG2-CB 4.49Å; I67-I72 HydrophobicContact CG2-CD1 3.23Å; I67-I72 HydrophobicContact CG2-CG1 4.44Å; I67-I72 HydrophobicContact CG2-CG2 4.18Å; H69-I72 HydrophobicContact CB-CB 4.11Å; H69-I72 HydrophobicContact CB-CD1 3.47Å; H69-I72 VanDerWaalsContact CB-CD1 3.47Å; H69-I72 HydrophobicContact CB-CG1 3.88Å; H69-I72 PolarHBondContact O-N 2.99Å; I72-K74 PolarHBondContact O-N 3.5Å; I72-F110 HydrophobicContact CG1-CE2 3.94Å; I72-L115 HydrophobicContact CD1-CD1 3.12Å; I72-L115 HydrophobicContact CD1-CG 4.47Å; I72-L115 HydrophobicContact CG1-CD1 3.77Å; I72-F136 HydrophobicContact CB-CZ 4.5Å; I72-F136 HydrophobicContact CG1-CZ 4.26Å; I72-F136 HydrophobicContact CG2-CE2 3.76Å; I72-F136 HydrophobicContact CG2-CZ 3.68Å
73	I	68.1	Low	62.2	Low	13 Å²	13	64.4 Å²	64.4	7%	0.067	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-66	128.4	177.3	-164.5	168.4	0	0	0	111	L64 V86 M133 F136	L64-I73 HydrophobicContact CD1-CG2 4.47Å; L64-I73 HydrophobicContact CD2-CG2 4.18Å; L64-I73 WeakPolarHBondContact CD2-O 3.44Å; I73-V86 HydrophobicContact CD1-CB 4.39Å; I73-V86 HydrophobicContact CD1-CG2 3.51Å; I73-M133 WeakPolarHBondContact CB-O 3.15Å; I73-M133 WeakPolarHBondContact CG2-O 3.35Å; I73-M133 PolarHBondContact N-O 2.92Å; I73-M133 VanDerWaalsContact N-O 3.1Å; I73-F136 HydrophobicContact CG2-CE2 4.4Å
74	K	68.3	Low	61.4	Low	113 Å²	113	64.5 Å²	64.5	49%	0.491	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-88.9	131.1	-178.9	-171.8	168.9	-176.4	165.2	0	111.8	I72	I72-K74 PolarHBondContact O-N 3.5Å
75	V	66.4	Low	60.2	Low	17 Å²	17	64.4 Å²	64.4	10%	0.103	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	119.2	167.3	175	0	0	0	0	109	L64 T78 F84	L64-V75 HydrophobicContact CB-CB 4.3Å; L64-V75 HydrophobicContact CB-CG2 3.52Å; L64-V75 HydrophobicContact CD1-CG2 3.6Å; L64-V75 HydrophobicContact CG-CG2 4.18Å; V75-T78 HydrophobicContact CG1-CG2 4.03Å; V75-F84 HydrophobicContact CG2-CD1 3.76Å; V75-F84 HydrophobicContact CG2-CE1 3.9Å
76	I	64.6	Low	59.2	Low	69 Å²	69	59.5 Å²	59.5	35%	0.354	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-33.1	179.3	-67.7	-173.4	0	0	0	112.2	T85	I76-T85 WeakPolarHBondContact CB-OG1 3.5Å; I76-T85 HydrophobicContact CD1-CG2 3.25Å; I76-T85 WeakPolarHBondContact CD1-OG1 3.4Å; I76-T85 HydrophobicContact CG1-CG2 4.06Å; I76-T85 VanDerWaalsContact CG1-OG1 3.26Å; I76-T85 WeakPolarHBondContact CG1-OG1 3.26Å
77	A	63.4	Low	57.6	Low	13 Å²	13	56.9 Å²	56.9	11%	0.107	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	137.1	-179.5	0	0	0	0	0	112.8	Y9 F79 T83	Y9-A77 WeakPolarHBondContact OH-CB 3.44Å; A77-F79 HydrophobicContact CB-CD2 3.83Å; A77-F79 HydrophobicContact CB-CE2 3.66Å; A77-T83 CarbonylContact O-C 3.36Å; A77-T83 WeakPolarHBondContact O-CB 3.47Å; A77-T83 PolarHBondContact O-N 3.37Å
78	T	61.9	Low	56.1	Low	62 Å²	62	61.6 Å²	61.6	38%	0.38	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	107.2	167.2	48.7	0	0	0	0	108.1	I61 V75	I61-T78 HydrophobicContact CD1-CG2 4.31Å; I61-T78 HydrophobicContact CG1-CG2 4.29Å; I61-T78 HydrophobicContact CG2-CG2 3.73Å; V75-T78 HydrophobicContact CG1-CG2 4.03Å
79	F	56.7	Low	54.6	Low	121 Å²	121	58.3 Å²	58.3	53%	0.531	28%	0.278	S	S	.	.			trans	-109.4	168.6	165.1	-73.5	-81.3	0	0	0	108.3	Y9 A77 M81	Y9-F79 HydrophobicContact CE2-CD2 4.26Å; A77-F79 HydrophobicContact CB-CD2 3.83Å; A77-F79 HydrophobicContact CB-CE2 3.66Å; F79-M81 CarbonylContact C-O 3.48Å; F79-M81 CarbonylContact O-C 3.5Å; F79-M81 WeakPolarHBondContact O-CA 3.35Å; F79-M81 PolarHBondContact O-N 3.18Å
80	R	51	Low	53.2	Low	264 Å²	264	57.5 Å²	57.5	100%	0.996	28%	0.278	S	S	*	.	S	Bend	trans	-49.2	-8.2	179.2	-77.8	-179.4	169.1	171.9	-3.6	115.3
81	M	48.9	Very low	52.3	Low	93 Å²	93	56.3 Å²	56.3	46%	0.458	26%	0.263	S	S	.	.	S	Bend	trans	-123.3	128.4	155.2	-65.2	177.9	59.3	0	0	108	K39 F79 T83	K39-M81 HydrophobicContact CD-CE 3.78Å; K39-M81 HydrophobicContact CG-CE 4.01Å; F79-M81 CarbonylContact C-O 3.48Å; F79-M81 CarbonylContact O-C 3.5Å; F79-M81 WeakPolarHBondContact O-CA 3.35Å; F79-M81 PolarHBondContact O-N 3.18Å; M81-T83 PolarHBondContact O-N 2.72Å
82	H	52.5	Low	51.5	Low	18 Å²	18	58.2 Å²	58.2	8%	0.083	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	132.7	-171.9	-43.5	-83.4	0	0	0	111.9	K38 Q40 I61 F84	K38-H82 WeakPolarHBondContact O-CB 3.45Å; Q40-H82 WeakPolarHBondContact CG-NE2 3.31Å; I61-H82 WeakPolarHBondContact CD1-ND1 3.29Å; H82-F84 HydrophobicContact CB-CD2 4.01Å; H82-F84 HydrophobicContact CB-CE2 3.44Å; H82-F84 VanDerWaalsContact CB-CE2 3.44Å; H82-F84 HydrophobicContact CB-CZ 4.39Å
83	T	45.4	Very low	50.9	Low	6 Å²	6	63.1 Å²	63.1	4%	0.037	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	98.5	175.4	-44.5	0	0	0	0	108.9	Y9 V35 L37 A77 M81	Y9-T83 HydrophobicContact CD1-CG2 3.67Å; Y9-T83 HydrophobicContact CD2-CG2 3.72Å; Y9-T83 WeakPolarHBondContact CD2-OG1 3.49Å; Y9-T83 HydrophobicContact CE1-CG2 3.28Å; Y9-T83 HydrophobicContact CE2-CG2 3.35Å; Y9-T83 WeakPolarHBondContact CE2-OG1 3.23Å; Y9-T83 HydrophobicContact CG-CG2 3.87Å; V35-T83 HydrophobicContact CG2-CG2 4.34Å; L37-T83 HydrophobicContact CD2-CG2 3.2Å; A77-T83 CarbonylContact O-C 3.36Å; A77-T83 WeakPolarHBondContact O-CB 3.47Å; A77-T83 PolarHBondContact O-N 3.37Å; M81-T83 PolarHBondContact O-N 2.72Å
84	F	49.9	Very low	50.1	Low	13 Å²	13	62.5 Å²	62.5	6%	0.057	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	147.4	169.8	-62.7	-107.3	0	0	0	107.3	A36 K38 L64 V75 H82	A36-F84 CarbonylContact C-O 3.48Å; A36-F84 PolarHBondContact N-O 3Å; A36-F84 VanDerWaalsContact N-O 3.15Å; A36-F84 CarbonylContact O-C 3.57Å; A36-F84 VanDerWaalsContact O-CA 3.24Å; A36-F84 WeakPolarHBondContact O-CA 3.41Å; A36-F84 WeakPolarHBondContact O-CB 3.37Å; A36-F84 PolarHBondContact O-N 2.98Å; K38-F84 HydrophobicContact CB-CD2 3.36Å; K38-F84 HydrophobicContact CB-CE2 3.41Å; K38-F84 VanDerWaalsContact CB-CE2 3.41Å; K38-F84 HydrophobicContact CB-CG 4.22Å; K38-F84 HydrophobicContact CB-CZ 4.28Å; K38-F84 HydrophobicContact CD-CD2 4.33Å; K38-F84 HydrophobicContact CD-CE1 4.34Å; K38-F84 HydrophobicContact CD-CE2 3.77Å; K38-F84 HydrophobicContact CD-CZ 3.76Å; K38-F84 HydrophobicContact CG-CD2 4.39Å; K38-F84 HydrophobicContact CG-CE2 4Å; K38-F84 HydrophobicContact CG-CZ 4.49Å; L64-F84 HydrophobicContact CD1-CD1 4.39Å; L64-F84 HydrophobicContact CD1-CE1 3.89Å; V75-F84 HydrophobicContact CG2-CD1 3.76Å; V75-F84 HydrophobicContact CG2-CE1 3.9Å; H82-F84 HydrophobicContact CB-CD2 4.01Å; H82-F84 HydrophobicContact CB-CE2 3.44Å; H82-F84 VanDerWaalsContact CB-CE2 3.44Å; H82-F84 HydrophobicContact CB-CZ 4.39Å
85	T	40.6	Very low	49.3	Very low	1 Å²	1	59.2 Å²	59.2	1%	0.006	28%	0.276	C	S	.	.			trans	-109.2	96.7	166.1	-57.3	0	0	0	0	107.7	V35 I76 N87	V35-T85 HydrophobicContact CB-CG2 4.21Å; V35-T85 HydrophobicContact CG1-CG2 3.68Å; I76-T85 WeakPolarHBondContact CB-OG1 3.5Å; I76-T85 HydrophobicContact CD1-CG2 3.25Å; I76-T85 WeakPolarHBondContact CD1-OG1 3.4Å; I76-T85 HydrophobicContact CG1-CG2 4.06Å; I76-T85 VanDerWaalsContact CG1-OG1 3.26Å; I76-T85 WeakPolarHBondContact CG1-OG1 3.26Å; T85-N87 PolarHBondContact O-N 3.07Å
86	V	47	Very low	48.5	Very low	14 Å²	14	62.6 Å²	62.6	9%	0.085	29%	0.294	C	S	.	.			trans	-67.7	92.1	152.5	178.3	0	0	0	0	105.1	A36 I73 R88 L89 M91	A36-V86 HydrophobicContact CB-CB 3.72Å; A36-V86 HydrophobicContact CB-CG2 3.26Å; I73-V86 HydrophobicContact CD1-CB 4.39Å; I73-V86 HydrophobicContact CD1-CG2 3.51Å; V86-R88 PolarHBondContact O-N 2.83Å; V86-L89 HydrophobicContact CB-CD1 4.31Å; V86-L89 HydrophobicContact CG1-CD1 4.36Å; V86-L89 HydrophobicContact CG1-CG 4.37Å; V86-M91 HydrophobicContact CG1-CE 3.87Å; V86-M91 HydrophobicContact CG1-CG 3.44Å; V86-M91 VanDerWaalsContact CG1-CG 3.44Å; V86-M91 HydrophobicContact CG1-SD 4.48Å
87	N	35.6	Very low	47.9	Very low	77 Å²	77	59.4 Å²	59.4	41%	0.412	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	119.2	169.1	-93.4	-32.8	0	0	0	107.6	T85	T85-N87 PolarHBondContact O-N 3.07Å
88	R	33.3	Very low	47.4	Very low	140 Å²	140	62 Å²	62	53%	0.528	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	76.3	171.8	-80.5	156.1	158.4	-133.4	10.7	113.9	V86 V90 K127 E128	V86-R88 PolarHBondContact O-N 2.83Å; R88-V90 PolarHBondContact O-N 3.11Å; R88-K127 HydrophobicContact CB-CD 3.87Å; R88-K127 HydrophobicContact CB-CG 4.02Å; R88-K127 HydrophobicContact CG-CD 4.22Å; R88-K127 VanDerWaalsContact CG-CE 3.49Å; R88-E128 VanDerWaalsContact CD-OE1 3.29Å; R88-E128 WeakPolarHBondContact CD-OE1 3.43Å; R88-E128 IonicContact CZ-OE1 3.12Å; R88-E128 IonicContact NE-OE1 3.78Å; R88-E128 IonicContact NH1-OE1 3.11Å; R88-E128 PolarHBondContact NH1-OE1 3.24Å
89	L	35.8	Very low	47	Very low	31 Å²	31	59.8 Å²	59.8	16%	0.162	28%	0.282	C	S	.	.	S	Bend	trans	-42.5	92.4	162.2	-111.9	118.3	0	0	0	113.2	L15 K25 I34 V35 A36 V86	L15-L89 HydrophobicContact CD1-CD1 4.21Å; L15-L89 HydrophobicContact CD1-CD2 3.8Å; L15-L89 HydrophobicContact CD1-CG 4.44Å; L15-L89 HydrophobicContact CD2-CD2 3.7Å; L15-L89 HydrophobicContact CG-CD2 4.39Å; K25-L89 HydrophobicContact CB-CD2 4.18Å; K25-L89 HydrophobicContact CD-CD2 3.77Å; K25-L89 HydrophobicContact CG-CD1 4.03Å; K25-L89 HydrophobicContact CG-CD2 3.82Å; K25-L89 HydrophobicContact CG-CG 4.47Å; I34-L89 HydrophobicContact CG2-CB 3.63Å; I34-L89 HydrophobicContact CG2-CD1 3.49Å; I34-L89 VanDerWaalsContact CG2-CD1 3.49Å; I34-L89 HydrophobicContact CG2-CG 4.09Å; V35-L89 WeakPolarHBondContact O-CD1 3.34Å; A36-L89 HydrophobicContact CB-CD1 4.33Å; V86-L89 HydrophobicContact CB-CD1 4.31Å; V86-L89 HydrophobicContact CG1-CD1 4.36Å; V86-L89 HydrophobicContact CG1-CG 4.37Å
90	V	34.6	Very low	47.2	Very low	61 Å²	61	55.9 Å²	55.9	37%	0.37	28%	0.276	S	S	.	.				-143	81.5	112.9	-162.9	0	0	0	0	108	R88 Q92 K295	R88-V90 PolarHBondContact O-N 3.11Å; V90-Q92 PolarHBondContact O-N 3.42Å; V90-K295 VanDerWaalsContact CB-NZ 3.29Å; V90-K295 HydrophobicContact CG1-CD 3.99Å
91	M	46.5	Very low	47.6	Very low	37 Å²	37	44.8 Å²	44.8	18%	0.182	23%	0.234	C	C	.	.			trans	-80.2	107.4	174.2	-68.5	-58.8	-168.4	0	0	108.4	V86 L124 I125 S126 K132	V86-M91 HydrophobicContact CG1-CE 3.87Å; V86-M91 HydrophobicContact CG1-CG 3.44Å; V86-M91 VanDerWaalsContact CG1-CG 3.44Å; V86-M91 HydrophobicContact CG1-SD 4.48Å; M91-L124 HydrophobicContact CB-CB 3.93Å; M91-L124 HydrophobicContact CB-CD1 4.03Å; M91-L124 HydrophobicContact CB-CD2 4.18Å; M91-L124 HydrophobicContact CB-CG 4.28Å; M91-L124 HydrophobicContact CE-CB 4.45Å; M91-L124 HydrophobicContact CG-CB 3.94Å; M91-L124 HydrophobicContact CG-CD1 3.94Å; M91-L124 HydrophobicContact CG-CG 4.48Å; M91-L124 HydrophobicContact SD-CB 3.61Å; M91-I125 WeakPolarHBondContact CA-O 3.23Å; M91-S126 VanDerWaalsContact SD-CA 3.56Å; M91-S126 PolarHBondContact SD-N 3.49Å; M91-S126 VanDerWaalsContact SD-N 3.42Å; M91-K132 HydrophobicContact CE-CB 4.38Å; M91-K132 HydrophobicContact CE-CD 3.82Å; M91-K132 HydrophobicContact CE-CG 4.37Å
92	Q	46.7	Very low	48.2	Very low	52 Å²	52	40.8 Å²	40.8	24%	0.243	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	141.5	169.9	-159.4	73.5	42.1	0	0	108.2	V90 L94 D96 V97 I125	V90-Q92 PolarHBondContact O-N 3.42Å; Q92-L94 PolarHBondContact O-N 3.42Å; Q92-D96 HydrophobicContact CG-CB 3.69Å; Q92-D96 PolarHBondContact NE2-OD2 3.1Å; Q92-V97 HydrophobicContact CB-CG2 3.56Å; Q92-V97 HydrophobicContact CG-CG2 3.42Å; Q92-V97 VanDerWaalsContact CG-CG2 3.42Å; Q92-I125 PolarHBondContact O-N 3.04Å
93	K	51	Low	48.6	Very low	110 Å²	110	40 Å²	40	48%	0.478	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	138.5	169.7	-64.8	176.1	179.3	174.1	0	107.4	L95 D96	K93-L95 PolarHBondContact O-N 3.49Å; K93-D96 WeakPolarHBondContact CB-OD2 3.29Å; K93-D96 PolarHBondContact O-N 3.26Å
94	L	52.8	Low	49.6	Very low	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-52.3	-33.7	-180	-170.7	65.7	0	0	0	112.6	Q92 D96 V97 S103 I107 L123 I125 L131 L186	Q92-L94 PolarHBondContact O-N 3.42Å; L94-D96 VanDerWaalsContact C-N 3.32Å; L94-D96 PolarHBondContact O-N 3.26Å; L94-V97 CarbonylContact O-C 3.48Å; L94-V97 PolarHBondContact O-N 2.66Å; L94-V97 VanDerWaalsContact O-N 3.15Å; L94-S103 WeakPolarHBondContact CD1-OG 3.44Å; L94-I107 HydrophobicContact CD2-CD1 3.57Å; L94-I107 HydrophobicContact CD2-CG1 4.1Å; L94-L123 HydrophobicContact CB-CB 4Å; L94-L123 HydrophobicContact CD2-CB 4.24Å; L94-L123 HydrophobicContact CD2-CD1 3.71Å; L94-L123 PolarHBondContact N-O 3.19Å; L94-I125 HydrophobicContact CD1-CD1 3.4Å; L94-I125 VanDerWaalsContact CD1-CD1 3.4Å; L94-I125 HydrophobicContact CD1-CG1 4Å; L94-L131 HydrophobicContact CD1-CD1 4.31Å; L94-L186 HydrophobicContact CD2-CD1 4.27Å; L94-L186 HydrophobicContact CG-CD1 4.46Å
95	L	51.9	Low	50.3	Low	44 Å²	44	40 Å²	40	23%	0.23	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-64.1	-31.7	177.8	-69	174.8	0	0	0	114	K93 V97 P120 E185 L186	K93-L95 PolarHBondContact O-N 3.49Å; L95-V97 PolarHBondContact O-N 2.85Å; L95-P120 HydrophobicContact CD1-CB 3.6Å; L95-P120 HydrophobicContact CD1-CG 3.86Å; L95-P120 HydrophobicContact CD2-CB 4.24Å; L95-P120 HydrophobicContact CG-CB 3.69Å; L95-P120 HydrophobicContact CG-CG 4.41Å; L95-E185 WeakPolarHBondContact CD1-OE1 3.33Å; L95-E185 HydrophobicContact CD2-CB 4.45Å; L95-E185 HydrophobicContact CD2-CG 3.81Å; L95-L186 HydrophobicContact CD2-CD2 3.82Å; L95-L186 HydrophobicContact CD2-CG 4.14Å
96	D	49.2	Very low	51.3	Low	88 Å²	88	40.4 Å²	40.4	47%	0.471	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-80.5	-7.5	179.4	-37.9	-34.7	0	0	0	111.3	Q92 K93 L94	Q92-D96 HydrophobicContact CG-CB 3.69Å; Q92-D96 PolarHBondContact NE2-OD2 3.1Å; K93-D96 WeakPolarHBondContact CB-OD2 3.29Å; K93-D96 PolarHBondContact O-N 3.26Å; L94-D96 VanDerWaalsContact C-N 3.32Å; L94-D96 PolarHBondContact O-N 3.26Å
97	V	52.3	Low	52.2	Low	2 Å²	2	39.8 Å²	39.8	1%	0.012	21%	0.212	C	C	.	.	S	Bend	trans	-116.8	102.2	179.7	-158.5	0	0	0	0	109.7	Q92 L94 L95 V99 I125 L291 L294	Q92-V97 HydrophobicContact CB-CG2 3.56Å; Q92-V97 HydrophobicContact CG-CG2 3.42Å; Q92-V97 VanDerWaalsContact CG-CG2 3.42Å; L94-V97 CarbonylContact O-C 3.48Å; L94-V97 PolarHBondContact O-N 2.66Å; L94-V97 VanDerWaalsContact O-N 3.15Å; L95-V97 PolarHBondContact O-N 2.85Å; V97-V99 VanDerWaalsContact C-N 3.27Å; V97-V99 HydrophobicContact CB-CG2 3.96Å; V97-V99 HydrophobicContact CG1-CG2 3.14Å; V97-V99 PolarHBondContact O-N 2.69Å; V97-I125 HydrophobicContact CB-CD1 4.42Å; V97-I125 HydrophobicContact CG2-CD1 4.44Å; V97-L291 HydrophobicContact CB-CD2 3.93Å; V97-L291 HydrophobicContact CG1-CD2 3.28Å; V97-L291 HydrophobicContact CG1-CG 4.15Å; V97-L291 HydrophobicContact CG2-CD2 3.43Å; V97-L291 VanDerWaalsContact CG2-CD2 3.43Å; V97-L294 HydrophobicContact CG1-CD1 3.63Å
98	S	52.1	Low	53.6	Low	69 Å²	69	36.1 Å²	36.1	48%	0.483	19%	0.193	S	C	.	.			trans	-68.8	80.5	171	-179.5	0	0	0	0	111.6	R189	S98-R189 PolarHBondContact OG-NH2 2.9Å
99	V	54.4	Low	55	Low	15 Å²	15	35 Å²	35	9%	0.091	19%	0.193	C	C	.	.			trans	-114.8	33.5	173.4	-139.6	0	0	0	0	113.8	V97 K101 N102 S103 L287 L290	V97-V99 VanDerWaalsContact C-N 3.27Å; V97-V99 HydrophobicContact CB-CG2 3.96Å; V97-V99 HydrophobicContact CG1-CG2 3.14Å; V97-V99 PolarHBondContact O-N 2.69Å; V99-K101 PolarHBondContact O-N 2.76Å; V99-N102 HydrophobicContact CB-CB 4.13Å; V99-N102 HydrophobicContact CG1-CB 3.81Å; V99-N102 WeakPolarHBondContact O-CA 3.29Å; V99-N102 WeakPolarHBondContact O-CB 3.31Å; V99-N102 PolarHBondContact O-N 2.89Å; V99-S103 PolarHBondContact O-N 3.31Å; V99-L287 HydrophobicContact CB-CD1 3.81Å; V99-L287 HydrophobicContact CG1-CD1 3.57Å; V99-L287 HydrophobicContact CG2-CD1 3.54Å; V99-L290 HydrophobicContact CG1-CD1 4.31Å
100	G	60.2	Low	56.1	Low	39 Å²	39	33.5 Å²	33.5	40%	0.402	19%	0.186	S	C	.	.	H	α-helix	trans	34	-105	161.3	0	0	0	0	0	114.2	V104	G100-V104 WeakPolarHBondContact O-CG2 3.4Å; G100-V104 PolarHBondContact O-N 2.88Å
101	K	59.7	Low	57.3	Low	30 Å²	30	31.3 Å²	31.3	13%	0.13	17%	0.171	C	C	.	.	H	α-helix	trans	-67.7	-36.9	-178.6	-63.2	-157.8	169	-167.6	0	114.8	V99 V104 A105 Y274 K277 P279	V99-K101 PolarHBondContact O-N 2.76Å; K101-V104 PolarHBondContact O-N 3.34Å; K101-A105 VanDerWaalsContact O-CB 3.31Å; K101-A105 WeakPolarHBondContact O-CB 3.49Å; K101-A105 PolarHBondContact O-N 3.46Å; K101-Y274 WeakPolarHBondContact CA-OH 3.1Å; K101-Y274 HydrophobicContact CB-CE1 4.25Å; K101-Y274 HydrophobicContact CD-CE1 4.48Å; K101-Y274 HydrophobicContact CD-CE2 4.43Å; K101-Y274 HydrophobicContact CG-CE1 4.08Å; K101-Y274 HydrophobicContact CG-CE2 4.15Å; K101-Y274 WeakPolarHBondContact CG-OH 3.38Å; K101-Y274 PolarHBondContact NZ-O 2.87Å; K101-Y274 VanDerWaalsContact NZ-O 3.08Å; K101-K277 PolarHBondContact NZ-O 2.86Å; K101-K277 VanDerWaalsContact NZ-O 3.15Å; K101-P279 HydrophobicContact CD-CG 4.09Å; K101-P279 WeakPolarHBondContact CD-O 3.42Å; K101-P279 WeakPolarHBondContact CE-O 3.11Å; K101-P279 PolarHBondContact NZ-O 2.94Å
102	N	60.2	Low	57.6	Low	10 Å²	10	32.6 Å²	32.6	5%	0.053	18%	0.183	C	C	.	.	H	α-helix	trans	-67.5	-45.2	179.6	-80	65.3	0	0	0	112.4	V99 V104 A105 L106 V281 C282 L287	V99-N102 HydrophobicContact CB-CB 4.13Å; V99-N102 HydrophobicContact CG1-CB 3.81Å; V99-N102 WeakPolarHBondContact O-CA 3.29Å; V99-N102 WeakPolarHBondContact O-CB 3.31Å; V99-N102 PolarHBondContact O-N 2.89Å; N102-V104 VanDerWaalsContact C-N 3.25Å; N102-V104 PolarHBondContact O-N 3.42Å; N102-A105 PolarHBondContact O-N 3.33Å; N102-L106 WeakPolarHBondContact O-CB 3.5Å; N102-L106 VanDerWaalsContact O-CG 3.26Å; N102-L106 WeakPolarHBondContact O-CG 3.47Å; N102-L106 PolarHBondContact O-N 3.37Å; N102-V281 HydrophobicContact CB-CG1 4.39Å; N102-V281 WeakPolarHBondContact ND2-CG1 3.45Å; N102-C282 PolarHBondContact ND2-N 3.49Å; N102-C282 PolarHBondContact ND2-O 3.09Å; N102-C282 PolarHBondContact ND2-SG 2.7Å; N102-C282 PolarHBondContact OD1-N 3.3Å; N102-C282 PolarHBondContact OD1-SG 2.92Å; N102-C282 VanDerWaalsContact OD1-SG 3.38Å; N102-L287 HydrophobicContact CB-CD1 4.46Å
103	S	62.3	Low	58	Low	1 Å²	1	32.1 Å²	32.1	1%	0.007	18%	0.184	C	C	.	.	H	α-helix	trans	-57	-44.7	175.4	-62.2	0	0	0	0	110.6	L94 V99 I107	L94-S103 WeakPolarHBondContact CD1-OG 3.44Å; V99-S103 PolarHBondContact O-N 3.31Å; S103-I107 WeakPolarHBondContact O-CD1 3.44Å; S103-I107 WeakPolarHBondContact O-CG1 3.09Å; S103-I107 PolarHBondContact O-N 2.77Å
104	V	64.9	Low	58	Low	4 Å²	4	33.7 Å²	33.7	2%	0.024	20%	0.198	C	C	.	.	H	α-helix	trans	-66.3	-48.6	179	176.3	0	0	0	0	111.2	G100 K101 N102 L106 I107 F108 I183 M248 Y274 F275	G100-V104 WeakPolarHBondContact O-CG2 3.4Å; G100-V104 PolarHBondContact O-N 2.88Å; K101-V104 PolarHBondContact O-N 3.34Å; N102-V104 VanDerWaalsContact C-N 3.25Å; N102-V104 PolarHBondContact O-N 3.42Å; V104-L106 PolarHBondContact O-N 2.89Å; V104-I107 PolarHBondContact O-N 2.61Å; V104-F108 HydrophobicContact CG1-CD2 3.75Å; V104-F108 HydrophobicContact CG1-CE2 3.74Å; V104-F108 WeakPolarHBondContact O-CD2 3Å; V104-F108 PolarHBondContact O-N 3.17Å; V104-I183 HydrophobicContact CG1-CD1 4.01Å; V104-I183 HydrophobicContact CG2-CD1 4.44Å; V104-I183 HydrophobicContact CG2-CG1 4.13Å; V104-I183 HydrophobicContact CG2-CG2 4.14Å; V104-M248 HydrophobicContact CG2-CE 3.99Å; V104-Y274 HydrophobicContact CB-CE1 4.06Å; V104-Y274 HydrophobicContact CG1-CE1 3.8Å; V104-F275 HydrophobicContact CG1-CE1 4.22Å; V104-F275 HydrophobicContact CG1-CZ 3.98Å
105	A	64.4	Low	57.9	Low	14 Å²	14	35 Å²	35	12%	0.116	20%	0.204	C	C	.	.	H	α-helix	trans	-60.8	-44.6	-179.3	0	0	0	0	0	113.2	K101 N102 I107 F108 E109 F275 V281	K101-A105 VanDerWaalsContact O-CB 3.31Å; K101-A105 WeakPolarHBondContact O-CB 3.49Å; K101-A105 PolarHBondContact O-N 3.46Å; N102-A105 PolarHBondContact O-N 3.33Å; A105-I107 PolarHBondContact O-N 3.04Å; A105-F108 PolarHBondContact O-N 3.32Å; A105-E109 PolarHBondContact O-N 3.24Å; A105-F275 HydrophobicContact CB-CD1 4.01Å; A105-F275 HydrophobicContact CB-CE1 3.74Å; A105-V281 HydrophobicContact CB-CB 4.34Å; A105-V281 HydrophobicContact CB-CG1 3.95Å; A105-V281 HydrophobicContact CB-CG2 3.4Å
106	L	63.3	Low	57.9	Low	11 Å²	11	34.8 Å²	34.8	6%	0.058	20%	0.202	C	C	.	.	H	α-helix	trans	-61.6	-33.7	178.1	-73.3	167.5	0	0	0	112.2	N102 V104 F110 L131 L287	N102-L106 WeakPolarHBondContact O-CB 3.5Å; N102-L106 VanDerWaalsContact O-CG 3.26Å; N102-L106 WeakPolarHBondContact O-CG 3.47Å; N102-L106 PolarHBondContact O-N 3.37Å; V104-L106 PolarHBondContact O-N 2.89Å; L106-F110 WeakPolarHBondContact O-CB 3.36Å; L106-F110 PolarHBondContact O-N 2.87Å; L106-L131 HydrophobicContact CB-CB 3.81Å; L106-L131 HydrophobicContact CB-CD2 3.66Å; L106-L131 HydrophobicContact CB-CG 4.35Å; L106-L131 HydrophobicContact CD1-CB 4.04Å; L106-L131 HydrophobicContact CD2-CB 4.35Å; L106-L131 HydrophobicContact CG-CB 4.3Å; L106-L287 HydrophobicContact CD1-CD2 3.49Å; L106-L287 VanDerWaalsContact CD1-CD2 3.49Å
107	I	64.1	Low	58.4	Low	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-75.4	-39.1	176.5	-54.4	158.6	0	0	0	111.3	L94 S103 V104 A105 F110 M111 L118 L123 L131 L179 I182	L94-I107 HydrophobicContact CD2-CD1 3.57Å; L94-I107 HydrophobicContact CD2-CG1 4.1Å; S103-I107 WeakPolarHBondContact O-CD1 3.44Å; S103-I107 WeakPolarHBondContact O-CG1 3.09Å; S103-I107 PolarHBondContact O-N 2.77Å; V104-I107 PolarHBondContact O-N 2.61Å; A105-I107 PolarHBondContact O-N 3.04Å; I107-F110 WeakPolarHBondContact O-CB 3.25Å; I107-F110 PolarHBondContact O-N 3.45Å; I107-M111 HydrophobicContact CG2-CG 4.47Å; I107-M111 WeakPolarHBondContact O-CG 3.29Å; I107-M111 PolarHBondContact O-N 2.89Å; I107-L118 HydrophobicContact CG2-CD1 4.24Å; I107-L118 HydrophobicContact CG2-CD2 4.17Å; I107-L123 HydrophobicContact CD1-CD1 3.87Å; I107-L123 HydrophobicContact CG1-CD1 3.93Å; I107-L131 HydrophobicContact CB-CD2 4.48Å; I107-L131 HydrophobicContact CG1-CD2 3.81Å; I107-L179 HydrophobicContact CB-CD1 3.79Å; I107-L179 HydrophobicContact CD1-CD1 3.73Å; I107-L179 HydrophobicContact CG1-CD1 4.37Å; I107-L179 HydrophobicContact CG2-CD1 3.29Å; I107-L179 HydrophobicContact CG2-CD2 4.17Å; I107-L179 HydrophobicContact CG2-CG 4.29Å; I107-I182 HydrophobicContact CD1-CG2 4.38Å
108	F	65.2	Low	58.6	Low	1 Å²	1	32 Å²	32	0%	0.004	19%	0.187	C	C	.	.	H	α-helix	trans	-65.1	-43.2	176.6	-87.8	-76.6	0	0	0	112.5	V104 A105 F110 M111 C112 L179 I183 I251 P269 M270 F275	V104-F108 HydrophobicContact CG1-CD2 3.75Å; V104-F108 HydrophobicContact CG1-CE2 3.74Å; V104-F108 WeakPolarHBondContact O-CD2 3Å; V104-F108 PolarHBondContact O-N 3.17Å; A105-F108 PolarHBondContact O-N 3.32Å; F108-F110 PolarHBondContact O-N 2.96Å; F108-M111 PolarHBondContact O-N 3.34Å; F108-M111 VanDerWaalsContact O-N 3.08Å; F108-C112 PolarHBondContact O-N 3.32Å; F108-L179 HydrophobicContact CD1-CD2 4.27Å; F108-L179 HydrophobicContact CD2-CD2 4.35Å; F108-L179 HydrophobicContact CE1-CD2 3.89Å; F108-L179 HydrophobicContact CE2-CD2 4.02Å; F108-L179 HydrophobicContact CG-CD2 4.48Å; F108-L179 HydrophobicContact CZ-CD2 3.77Å; F108-I183 HydrophobicContact CE2-CD1 3.83Å; F108-I183 HydrophobicContact CZ-CD1 4.41Å; F108-I251 HydrophobicContact CE2-CG2 3.8Å; F108-I251 HydrophobicContact CZ-CG2 3.73Å; F108-P269 HydrophobicContact CD1-CB 4.48Å; F108-P269 HydrophobicContact CD1-CG 3.99Å; F108-P269 HydrophobicContact CE1-CB 3.75Å; F108-P269 HydrophobicContact CE1-CG 3.29Å; F108-P269 HydrophobicContact CZ-CB 3.89Å; F108-P269 HydrophobicContact CZ-CG 3.92Å; F108-M270 HydrophobicContact CB-CG 3.97Å; F108-M270 HydrophobicContact CB-SD 4.37Å; F108-M270 HydrophobicContact CD1-CG 4.13Å; F108-M270 HydrophobicContact CG-CG 4.32Å; F108-F275 HydrophobicContact CB-CZ 4.35Å; F108-F275 HydrophobicContact CD2-CE1 4.48Å; F108-F275 HydrophobicContact CD2-CE2 4.35Å; F108-F275 AromaticContact CD2-CZ 3.59Å; F108-F275 HydrophobicContact CD2-CZ 3.59Å; F108-F275 HydrophobicContact CE2-CZ 4.13Å; F108-F275 HydrophobicContact CG-CZ 4.08Å
109	E	63	Low	59	Low	115 Å²	115	29.5 Å²	29.5	54%	0.537	17%	0.168	S	C	.	.	H	α-helix	trans	-60	-36.6	173.8	-171	176.8	-173.8	0	0	111.5	A105	A105-E109 PolarHBondContact O-N 3.24Å
110	F	59.7	Low	59	Low	1 Å²	1	29 Å²	29	0%	0.004	17%	0.165	C	C	.	.	H	α-helix	trans	-66.6	-39.5	172.7	179.5	-86.9	0	0	0	112.9	N71 I72 L106 I107 F108 C112 T113 L115 M133	N71-F110 HydrophobicContact CB-CD2 3.66Å; N71-F110 HydrophobicContact CB-CE2 4.27Å; I72-F110 HydrophobicContact CG1-CE2 3.94Å; L106-F110 WeakPolarHBondContact O-CB 3.36Å; L106-F110 PolarHBondContact O-N 2.87Å; I107-F110 WeakPolarHBondContact O-CB 3.25Å; I107-F110 PolarHBondContact O-N 3.45Å; F108-F110 PolarHBondContact O-N 2.96Å; F110-C112 PolarHBondContact O-N 3.09Å; F110-T113 WeakPolarHBondContact O-CA 3.49Å; F110-T113 WeakPolarHBondContact O-CB 3.21Å; F110-T113 PolarHBondContact O-N 3.09Å; F110-T113 PolarHBondContact O-OG1 3.34Å; F110-L115 HydrophobicContact CE1-CB 3.94Å; F110-L115 HydrophobicContact CE1-CD1 4.33Å; F110-L115 HydrophobicContact CE2-CD1 3.82Å; F110-L115 HydrophobicContact CZ-CB 3.73Å; F110-L115 HydrophobicContact CZ-CD1 3.41Å; F110-L115 VanDerWaalsContact CZ-CD1 3.41Å; F110-L115 HydrophobicContact CZ-CG 4.18Å; F110-M133 HydrophobicContact CD1-SD 3.78Å; F110-M133 HydrophobicContact CE1-CE 4.41Å; F110-M133 HydrophobicContact CE1-CG 4.04Å; F110-M133 HydrophobicContact CE1-SD 3Å; F110-M133 WeakPolarHBondContact CE1-SD 3.2Å; F110-M133 HydrophobicContact CE2-CB 3.99Å; F110-M133 HydrophobicContact CE2-CG 3.98Å; F110-M133 HydrophobicContact CE2-SD 3.97Å; F110-M133 HydrophobicContact CZ-CB 3.9Å; F110-M133 HydrophobicContact CZ-CE 4.37Å; F110-M133 HydrophobicContact CZ-CG 3.69Å; F110-M133 HydrophobicContact CZ-SD 3.09Å; F110-M133 WeakPolarHBondContact CZ-SD 3.34Å
111	M	59.9	Low	58.8	Low	14 Å²	14	29.9 Å²	29.9	7%	0.069	17%	0.165	C	C	.	.	H	α-helix	trans	-62.7	-25.1	-179	-75.8	-56.6	-73.7	0	0	113.3	I107 F108 T113 D114 L118 D175 I176 L179 V266	I107-M111 HydrophobicContact CG2-CG 4.47Å; I107-M111 WeakPolarHBondContact O-CG 3.29Å; I107-M111 PolarHBondContact O-N 2.89Å; F108-M111 PolarHBondContact O-N 3.34Å; F108-M111 VanDerWaalsContact O-N 3.08Å; M111-T113 PolarHBondContact O-N 2.69Å; M111-T113 VanDerWaalsContact O-N 3.11Å; M111-D114 PolarHBondContact O-N 2.94Å; M111-L118 HydrophobicContact CE-CD1 4.2Å; M111-L118 HydrophobicContact CG-CD1 4.2Å; M111-L118 HydrophobicContact SD-CD1 3.25Å; M111-L118 WeakPolarHBondContact SD-CD1 3.37Å; M111-L118 HydrophobicContact SD-CG 4.16Å; M111-D175 HydrophobicContact CE-CB 3.62Å; M111-D175 HydrophobicContact SD-CB 4.4Å; M111-I176 HydrophobicContact CE-CD1 3.34Å; M111-I176 HydrophobicContact CE-CG1 3.8Å; M111-I176 HydrophobicContact CG-CD1 4.2Å; M111-L179 HydrophobicContact CG-CD2 4.07Å; M111-V266 HydrophobicContact CB-CG1 4.2Å
112	C	53.1	Low	59.1	Low	64 Å²	64	28.9 Å²	28.9	43%	0.432	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-5.5	169.6	-63	0	0	0	0	113.8	F108 F110 M270	F108-C112 PolarHBondContact O-N 3.32Å; F110-C112 PolarHBondContact O-N 3.09Å; C112-M270 PolarHBondContact SG-SD 2.85Å
113	T	53.4	Low	59.3	Low	43 Å²	43	28.4 Å²	28.4	26%	0.264	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.8	10.3	-177.5	70.3	0	0	0	0	114.8	F110 M111	F110-T113 WeakPolarHBondContact O-CA 3.49Å; F110-T113 WeakPolarHBondContact O-CB 3.21Å; F110-T113 PolarHBondContact O-N 3.09Å; F110-T113 PolarHBondContact O-OG1 3.34Å; M111-T113 PolarHBondContact O-N 2.69Å; M111-T113 VanDerWaalsContact O-N 3.11Å
114	D	52.7	Low	59.4	Low	143 Å²	143	29.6 Å²	29.6	77%	0.765	16%	0.164	S	C	*	.			trans	55.5	55	169.4	-70.2	-32.6	0	0	0	115.6	M111	M111-D114 PolarHBondContact O-N 2.94Å
115	L	50.1	Low	59.3	Low	27 Å²	27	29.4 Å²	29.4	14%	0.141	16%	0.164	C	C	.	.			trans	-121.9	125	180	-67.3	164.1	0	0	0	113.3	I67 I72 F110 F136	I67-L115 HydrophobicContact CD1-CD2 4.02Å; I72-L115 HydrophobicContact CD1-CD1 3.12Å; I72-L115 HydrophobicContact CD1-CG 4.47Å; I72-L115 HydrophobicContact CG1-CD1 3.77Å; F110-L115 HydrophobicContact CE1-CB 3.94Å; F110-L115 HydrophobicContact CE1-CD1 4.33Å; F110-L115 HydrophobicContact CE2-CD1 3.82Å; F110-L115 HydrophobicContact CZ-CB 3.73Å; F110-L115 HydrophobicContact CZ-CD1 3.41Å; F110-L115 VanDerWaalsContact CZ-CD1 3.41Å; F110-L115 HydrophobicContact CZ-CG 4.18Å; L115-F136 HydrophobicContact CB-CE1 4.49Å; L115-F136 HydrophobicContact CD1-CE1 4.32Å; L115-F136 HydrophobicContact CD2-CE1 4.23Å
116	E	51.3	Low	59.3	Low	40 Å²	40	28.9 Å²	28.9	19%	0.187	16%	0.159	C	C	.	.	S	Bend	trans	-76.6	141.1	179.6	-58.4	-178.6	164.4	0	0	112.5	R140 D175	E116-R140 PolarHBondContact OE2-N 3.29Å; E116-D175 WeakPolarHBondContact CA-OD2 3.37Å
117	D	59.4	Low	59.2	Low	27 Å²	27	32.4 Å²	32.4	14%	0.144	17%	0.174	C	C	.	.			trans	93	63.6	173.8	-158.4	35.4	0	0	0	117.2	K119 M133 D175	D117-K119 WeakPolarHBondContact OD1-CE 3.5Å; D117-K119 IonicContact OD1-NZ 2.83Å; D117-K119 PolarHBondContact OD1-NZ 3.08Å; D117-K119 IonicContact OD2-NZ 2.73Å; D117-K119 PolarHBondContact OD2-NZ 3.45Å; D117-M133 WeakPolarHBondContact O-CE 3.25Å; D117-D175 WeakPolarHBondContact CA-OD1 3.37Å; D117-D175 PolarHBondContact N-OD1 3.3Å
118	L	58.3	Low	59.3	Low	4 Å²	4	35.6 Å²	35.6	2%	0.021	19%	0.189	C	C	.	.			trans	-75.5	120.1	168.4	-87	175.4	0	0	0	113.1	I107 M111 L123 M133 D175 A178 L179	I107-L118 HydrophobicContact CG2-CD1 4.24Å; I107-L118 HydrophobicContact CG2-CD2 4.17Å; M111-L118 HydrophobicContact CE-CD1 4.2Å; M111-L118 HydrophobicContact CG-CD1 4.2Å; M111-L118 HydrophobicContact SD-CD1 3.25Å; M111-L118 WeakPolarHBondContact SD-CD1 3.37Å; M111-L118 HydrophobicContact SD-CG 4.16Å; L118-L123 HydrophobicContact CD2-CD1 4.26Å; L118-L123 HydrophobicContact CD2-CD2 3.8Å; L118-L123 HydrophobicContact CD2-CG 4.32Å; L118-M133 HydrophobicContact CD2-CE 4.4Å; L118-M133 HydrophobicContact CD2-SD 3.67Å; L118-M133 HydrophobicContact CG-SD 4.36Å; L118-D175 HydrophobicContact CD1-CB 4.24Å; L118-D175 PolarHBondContact N-OD1 3.11Å; L118-A178 HydrophobicContact CB-CB 4.25Å; L118-A178 WeakPolarHBondContact O-CB 3.4Å; L118-L179 HydrophobicContact CD1-CB 4.09Å
119	K	60.4	Low	59	Low	16 Å²	16	35.6 Å²	35.6	7%	0.07	19%	0.189	C	C	.	.			trans	-138.8	148.1	165	-65.3	179.6	-168.6	104.7	0	109.6	D117 S121 N122 L123 V154	D117-K119 WeakPolarHBondContact OD1-CE 3.5Å; D117-K119 IonicContact OD1-NZ 2.83Å; D117-K119 PolarHBondContact OD1-NZ 3.08Å; D117-K119 IonicContact OD2-NZ 2.73Å; D117-K119 PolarHBondContact OD2-NZ 3.45Å; K119-S121 PolarHBondContact O-N 3.14Å; K119-N122 HydrophobicContact CB-CB 4.36Å; K119-N122 WeakPolarHBondContact O-CA 3.02Å; K119-N122 VanDerWaalsContact O-CB 3.31Å; K119-N122 WeakPolarHBondContact O-CB 3.32Å; K119-N122 PolarHBondContact O-N 3.06Å; K119-L123 PolarHBondContact O-N 3Å; K119-V154 HydrophobicContact CD-CG1 4.26Å
120	P	54.2	Low	59.2	Low	4 Å²	4	31.5 Å²	31.5	3%	0.026	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-63.2	-29.2	-179.2	13.6	-17	0	0	0	113.1	L95 N122 L123 Y158 I182	L95-P120 HydrophobicContact CD1-CB 3.6Å; L95-P120 HydrophobicContact CD1-CG 3.86Å; L95-P120 HydrophobicContact CD2-CB 4.24Å; L95-P120 HydrophobicContact CG-CB 3.69Å; L95-P120 HydrophobicContact CG-CG 4.41Å; P120-N122 PolarHBondContact O-N 3.03Å; P120-L123 PolarHBondContact O-N 3.4Å; P120-Y158 HydrophobicContact CG-CE1 3.86Å; P120-Y158 HydrophobicContact CG-CE2 3.98Å; P120-Y158 VanDerWaalsContact CG-CZ 3.44Å; P120-Y158 VanDerWaalsContact CG-OH 3.24Å; P120-Y158 WeakPolarHBondContact CG-OH 3.41Å; P120-I182 HydrophobicContact CB-CD1 4.42Å; P120-I182 HydrophobicContact CB-CG1 4.15Å; P120-I182 HydrophobicContact CB-CG2 4.35Å; P120-I182 HydrophobicContact CG-CD1 4.33Å; P120-I182 HydrophobicContact CG-CG1 3.84Å
121	S	55.3	Low	59.4	Low	59 Å²	59	31.5 Å²	31.5	41%	0.413	17%	0.171	S	C	.	.	G	3₁₀ helix	trans	-65.6	-22.2	172.8	58.5	0	0	0	0	113.8	K119	K119-S121 PolarHBondContact O-N 3.14Å
122	N	65.8	Low	59.6	Low	9 Å²	9	32.6 Å²	32.6	5%	0.048	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-90	-10.5	-180	-70.5	6.2	0	0	0	111.5	K119 P120 M133 A134	K119-N122 HydrophobicContact CB-CB 4.36Å; K119-N122 WeakPolarHBondContact O-CA 3.02Å; K119-N122 VanDerWaalsContact O-CB 3.31Å; K119-N122 WeakPolarHBondContact O-CB 3.32Å; K119-N122 PolarHBondContact O-N 3.06Å; P120-N122 PolarHBondContact O-N 3.03Å; N122-M133 CarbonylContact O-C 3.54Å; N122-M133 VanDerWaalsContact O-CA 3.29Å; N122-M133 WeakPolarHBondContact O-CA 3.36Å; N122-A134 WeakPolarHBondContact CB-O 3.24Å; N122-A134 PolarHBondContact O-N 3.42Å
123	L	64.8	Low	60.2	Low	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	103	179.4	-66.9	179	0	0	0	110	L94 I107 L118 K119 P120 L131 M133 I182	L94-L123 HydrophobicContact CB-CB 4Å; L94-L123 HydrophobicContact CD2-CB 4.24Å; L94-L123 HydrophobicContact CD2-CD1 3.71Å; L94-L123 PolarHBondContact N-O 3.19Å; I107-L123 HydrophobicContact CD1-CD1 3.87Å; I107-L123 HydrophobicContact CG1-CD1 3.93Å; L118-L123 HydrophobicContact CD2-CD1 4.26Å; L118-L123 HydrophobicContact CD2-CD2 3.8Å; L118-L123 HydrophobicContact CD2-CG 4.32Å; K119-L123 PolarHBondContact O-N 3Å; P120-L123 PolarHBondContact O-N 3.4Å; L123-L131 HydrophobicContact CB-CD1 4.08Å; L123-L131 HydrophobicContact CD2-CD1 4.37Å; L123-L131 HydrophobicContact CD2-CD2 4.2Å; L123-L131 HydrophobicContact CD2-CG 4.47Å; L123-M133 HydrophobicContact CD2-CG 3.59Å; L123-M133 HydrophobicContact CD2-SD 4.22Å; L123-I182 HydrophobicContact CD1-CD1 4.18Å
124	L	64.7	Low	60.5	Low	25 Å²	25	28.3 Å²	28.3	13%	0.131	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	133.1	-178.1	-58	-173.6	0	0	0	110.6	M91 L131 K132 A134	M91-L124 HydrophobicContact CB-CB 3.93Å; M91-L124 HydrophobicContact CB-CD1 4.03Å; M91-L124 HydrophobicContact CB-CD2 4.18Å; M91-L124 HydrophobicContact CB-CG 4.28Å; M91-L124 HydrophobicContact CE-CB 4.45Å; M91-L124 HydrophobicContact CG-CB 3.94Å; M91-L124 HydrophobicContact CG-CD1 3.94Å; M91-L124 HydrophobicContact CG-CG 4.48Å; M91-L124 HydrophobicContact SD-CB 3.61Å; L124-L131 CarbonylContact O-C 3.54Å; L124-K132 WeakPolarHBondContact CB-O 3.32Å; L124-K132 PolarHBondContact N-O 3.15Å; L124-K132 PolarHBondContact O-N 2.55Å; L124-A134 HydrophobicContact CD1-CB 3.46Å; L124-A134 VanDerWaalsContact CD1-CB 3.46Å; L124-A134 HydrophobicContact CG-CB 3.84Å
125	I	62	Low	61	Low	1 Å²	1	25 Å²	25	1%	0.005	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	124.8	172.9	-56	165.8	0	0	0	110.6	M91 Q92 L94 V97 G129 L131 L291	M91-I125 WeakPolarHBondContact CA-O 3.23Å; Q92-I125 PolarHBondContact O-N 3.04Å; L94-I125 HydrophobicContact CD1-CD1 3.4Å; L94-I125 VanDerWaalsContact CD1-CD1 3.4Å; L94-I125 HydrophobicContact CD1-CG1 4Å; V97-I125 HydrophobicContact CB-CD1 4.42Å; V97-I125 HydrophobicContact CG2-CD1 4.44Å; I125-G129 VanDerWaalsContact CG2-O 3.32Å; I125-G129 WeakPolarHBondContact CG2-O 3.38Å; I125-L131 HydrophobicContact CG1-CD1 3.86Å; I125-L291 HydrophobicContact CB-CD1 4.28Å; I125-L291 HydrophobicContact CG2-CD1 3.44Å; I125-L291 VanDerWaalsContact CG2-CD1 3.44Å
126	S	64	Low	61.4	Low	2 Å²	2	23.8 Å²	23.8	1%	0.014	13%	0.125	C	C	.	.			trans	-67	164	174.8	70.2	0	0	0	0	111.8	M91 E128 G129 V130	M91-S126 VanDerWaalsContact SD-CA 3.56Å; M91-S126 PolarHBondContact SD-N 3.49Å; M91-S126 VanDerWaalsContact SD-N 3.42Å; S126-E128 PolarHBondContact O-N 3.23Å; S126-E128 VanDerWaalsContact O-N 3.14Å; S126-G129 PolarHBondContact O-N 3.48Å; S126-V130 PolarHBondContact N-O 2.73Å; S126-V130 WeakPolarHBondContact OG-CB 3.46Å; S126-V130 PolarHBondContact OG-N 3.01Å; S126-V130 VanDerWaalsContact OG-N 3.09Å; S126-V130 PolarHBondContact OG-O 2.82Å; S126-V130 VanDerWaalsContact OG-O 3.09Å
127	K	62.2	Low	61.3	Low	86 Å²	86	22.4 Å²	22.4	37%	0.374	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-17.4	176.6	72.5	174.8	-168.7	175.8	0	113.4	R88 G129 A288	R88-K127 HydrophobicContact CB-CD 3.87Å; R88-K127 HydrophobicContact CB-CG 4.02Å; R88-K127 HydrophobicContact CG-CD 4.22Å; R88-K127 VanDerWaalsContact CG-CE 3.49Å; K127-G129 VanDerWaalsContact C-N 3.27Å; K127-A288 VanDerWaalsContact O-CB 3.31Å; K127-A288 WeakPolarHBondContact O-CB 3.3Å
128	E	65.1	Low	60.5	Low	67 Å²	67	25.1 Å²	25.1	31%	0.313	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	6.5	173	-67	76.4	-159	0	0	112.8	R88 S126 V130	R88-E128 VanDerWaalsContact CD-OE1 3.29Å; R88-E128 WeakPolarHBondContact CD-OE1 3.43Å; R88-E128 IonicContact CZ-OE1 3.12Å; R88-E128 IonicContact NE-OE1 3.78Å; R88-E128 IonicContact NH1-OE1 3.11Å; R88-E128 PolarHBondContact NH1-OE1 3.24Å; S126-E128 PolarHBondContact O-N 3.23Å; S126-E128 VanDerWaalsContact O-N 3.14Å; E128-V130 HydrophobicContact CB-CG2 4.43Å; E128-V130 PolarHBondContact O-N 3.38Å
129	G	60.8	Low	59.7	Low	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.138	C	C	.	.	S	Bend	trans	83.7	-10.6	-178.7	0	0	0	0	0	114.4	I125 S126 K127 L131 L287	I125-G129 VanDerWaalsContact CG2-O 3.32Å; I125-G129 WeakPolarHBondContact CG2-O 3.38Å; S126-G129 PolarHBondContact O-N 3.48Å; K127-G129 VanDerWaalsContact C-N 3.27Å; G129-L131 PolarHBondContact O-N 3.22Å; G129-L287 WeakPolarHBondContact O-CD2 3.22Å
130	V	65.6	Low	58.6	Low	29 Å²	29	28 Å²	28	18%	0.176	15%	0.147	C	C	.	.			trans	-71.8	122.9	-178.5	-174.5	0	0	0	0	111.5	S126 E128	S126-V130 PolarHBondContact N-O 2.73Å; S126-V130 WeakPolarHBondContact OG-CB 3.46Å; S126-V130 PolarHBondContact OG-N 3.01Å; S126-V130 VanDerWaalsContact OG-N 3.09Å; S126-V130 PolarHBondContact OG-O 2.82Å; S126-V130 VanDerWaalsContact OG-O 3.09Å; E128-V130 HydrophobicContact CB-CG2 4.43Å; E128-V130 PolarHBondContact O-N 3.38Å
131	L	63.7	Low	57.9	Low	1 Å²	1	33.3 Å²	33.3	1%	0.005	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	132.8	170.2	-174.5	71.1	0	0	0	110.6	N71 L94 L106 I107 L123 L124 I125 G129	N71-L131 VanDerWaalsContact CA-O 3.25Å; N71-L131 WeakPolarHBondContact CA-O 3.31Å; N71-L131 WeakPolarHBondContact CB-O 3.44Å; N71-L131 PolarHBondContact ND2-O 3.43Å; L94-L131 HydrophobicContact CD1-CD1 4.31Å; L106-L131 HydrophobicContact CB-CB 3.81Å; L106-L131 HydrophobicContact CB-CD2 3.66Å; L106-L131 HydrophobicContact CB-CG 4.35Å; L106-L131 HydrophobicContact CD1-CB 4.04Å; L106-L131 HydrophobicContact CD2-CB 4.35Å; L106-L131 HydrophobicContact CG-CB 4.3Å; I107-L131 HydrophobicContact CB-CD2 4.48Å; I107-L131 HydrophobicContact CG1-CD2 3.81Å; L123-L131 HydrophobicContact CB-CD1 4.08Å; L123-L131 HydrophobicContact CD2-CD1 4.37Å; L123-L131 HydrophobicContact CD2-CD2 4.2Å; L123-L131 HydrophobicContact CD2-CG 4.47Å; L124-L131 CarbonylContact O-C 3.54Å; I125-L131 HydrophobicContact CG1-CD1 3.86Å; G129-L131 PolarHBondContact O-N 3.22Å
132	K	65.9	Low	56.9	Low	37 Å²	37	39.1 Å²	39.1	16%	0.161	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	127.6	177.7	-61.1	-167.3	-173.8	-73.7	0	110.4	A70 N71 M91 L124	A70-K132 PolarHBondContact O-NZ 3.38Å; N71-K132 CarbonylContact O-C 3.52Å; N71-K132 VanDerWaalsContact O-CA 3.29Å; N71-K132 WeakPolarHBondContact O-CA 3.41Å; M91-K132 HydrophobicContact CE-CB 4.38Å; M91-K132 HydrophobicContact CE-CD 3.82Å; M91-K132 HydrophobicContact CE-CG 4.37Å; L124-K132 WeakPolarHBondContact CB-O 3.32Å; L124-K132 PolarHBondContact N-O 3.15Å; L124-K132 PolarHBondContact O-N 2.55Å
133	M	64.7	Low	55.4	Low	2 Å²	2	42 Å²	42	1%	0.01	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	138.6	167.5	-88.9	-168.1	62.9	0	0	111.8	N71 I73 F110 D117 L118 N122 L123 F136	N71-M133 PolarHBondContact O-N 3.41Å; I73-M133 WeakPolarHBondContact CB-O 3.15Å; I73-M133 WeakPolarHBondContact CG2-O 3.35Å; I73-M133 PolarHBondContact N-O 2.92Å; I73-M133 VanDerWaalsContact N-O 3.1Å; F110-M133 HydrophobicContact CD1-SD 3.78Å; F110-M133 HydrophobicContact CE1-CE 4.41Å; F110-M133 HydrophobicContact CE1-CG 4.04Å; F110-M133 HydrophobicContact CE1-SD 3Å; F110-M133 WeakPolarHBondContact CE1-SD 3.2Å; F110-M133 HydrophobicContact CE2-CB 3.99Å; F110-M133 HydrophobicContact CE2-CG 3.98Å; F110-M133 HydrophobicContact CE2-SD 3.97Å; F110-M133 HydrophobicContact CZ-CB 3.9Å; F110-M133 HydrophobicContact CZ-CE 4.37Å; F110-M133 HydrophobicContact CZ-CG 3.69Å; F110-M133 HydrophobicContact CZ-SD 3.09Å; F110-M133 WeakPolarHBondContact CZ-SD 3.34Å; D117-M133 WeakPolarHBondContact O-CE 3.25Å; L118-M133 HydrophobicContact CD2-CE 4.4Å; L118-M133 HydrophobicContact CD2-SD 3.67Å; L118-M133 HydrophobicContact CG-SD 4.36Å; N122-M133 CarbonylContact O-C 3.54Å; N122-M133 VanDerWaalsContact O-CA 3.29Å; N122-M133 WeakPolarHBondContact O-CA 3.36Å; L123-M133 HydrophobicContact CD2-CG 3.59Å; L123-M133 HydrophobicContact CD2-SD 4.22Å; M133-F136 HydrophobicContact CB-CE2 4.44Å; M133-F136 HydrophobicContact CB-CZ 4.02Å
134	A	60.3	Low	54	Low	15 Å²	15	45.9 Å²	45.9	12%	0.124	25%	0.253	C	S	.	.			trans	-124	157.1	175.4	0	0	0	0	0	110.2	N122 L124	N122-A134 WeakPolarHBondContact CB-O 3.24Å; N122-A134 PolarHBondContact O-N 3.42Å; L124-A134 HydrophobicContact CD1-CB 3.46Å; L124-A134 VanDerWaalsContact CD1-CB 3.46Å; L124-A134 HydrophobicContact CG-CB 3.84Å
135	D	62.6	Low	52.4	Low	73 Å²	73	49.8 Å²	49.8	39%	0.39	28%	0.282	S	S	.	.			trans	65.7	81.7	176.7	-152.3	7.3	0	0	0	115.5	K38 G137	K38-D135 IonicContact NZ-OD1 3.35Å; K38-D135 PolarHBondContact NZ-OD1 2.86Å; D135-G137 PolarHBondContact O-N 3.37Å; D135-G137 PolarHBondContact OD1-N 3.08Å
136	F	58.5	Low	51.1	Low	3 Å²	3	57.3 Å²	57.3	1%	0.013	32%	0.322	C	S	.	.			trans	-91.1	23.9	173.3	-65.7	-94.5	0	0	0	111.8	E60 L64 I72 I73 L115 M133 L138 A139	E60-F136 HydrophobicContact CG-CB 4.16Å; L64-F136 HydrophobicContact CD1-CD2 4.25Å; L64-F136 HydrophobicContact CD2-CD2 3.33Å; L64-F136 HydrophobicContact CD2-CE2 3.56Å; L64-F136 HydrophobicContact CD2-CG 4.11Å; L64-F136 HydrophobicContact CD2-CZ 4.47Å; L64-F136 HydrophobicContact CG-CD2 3.96Å; L64-F136 HydrophobicContact CG-CG 4.47Å; I72-F136 HydrophobicContact CB-CZ 4.5Å; I72-F136 HydrophobicContact CG1-CZ 4.26Å; I72-F136 HydrophobicContact CG2-CE2 3.76Å; I72-F136 HydrophobicContact CG2-CZ 3.68Å; I73-F136 HydrophobicContact CG2-CE2 4.4Å; L115-F136 HydrophobicContact CB-CE1 4.49Å; L115-F136 HydrophobicContact CD1-CE1 4.32Å; L115-F136 HydrophobicContact CD2-CE1 4.23Å; M133-F136 HydrophobicContact CB-CE2 4.44Å; M133-F136 HydrophobicContact CB-CZ 4.02Å; F136-L138 PolarHBondContact O-N 2.94Å; F136-L138 VanDerWaalsContact O-N 3.09Å; F136-A139 HydrophobicContact CB-CB 3.98Å; F136-A139 HydrophobicContact CD1-CB 3.94Å; F136-A139 HydrophobicContact CG-CB 4.47Å; F136-A139 PolarHBondContact O-N 3.05Å
137	G	49.5	Very low	49.7	Very low	11 Å²	11	63.7 Å²	63.7	11%	0.113	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-28.9	-176.7	0	0	0	0	0	113.3	T56 D135	T56-G137 WeakPolarHBondContact CG2-O 3.23Å; D135-G137 PolarHBondContact O-N 3.37Å; D135-G137 PolarHBondContact OD1-N 3.08Å
138	L	41.2	Very low	48.3	Very low	84 Å²	84	66.1 Å²	66.1	44%	0.44	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-8.9	-179.4	-61.6	176.7	0	0	0	114.4	F136 V154	F136-L138 PolarHBondContact O-N 2.94Å; F136-L138 VanDerWaalsContact O-N 3.09Å; L138-V154 HydrophobicContact CD1-CG2 3.73Å
139	A	42.3	Very low	46.7	Very low	9 Å²	9	67.3 Å²	67.3	7%	0.074	38%	0.382	C	S	.	.			trans	-61.8	141.3	-176.3	0	0	0	0	0	111.8	L63 F136	L63-A139 HydrophobicContact CD1-CB 3.8Å; L63-A139 WeakPolarHBondContact CD1-O 3.5Å; F136-A139 HydrophobicContact CB-CB 3.98Å; F136-A139 HydrophobicContact CD1-CB 3.94Å; F136-A139 HydrophobicContact CG-CB 4.47Å; F136-A139 PolarHBondContact O-N 3.05Å
140	R	38.1	Very low	45.2	Very low	70 Å²	70	73.2 Å²	73.2	26%	0.264	42%	0.418	S	S	.	.			trans	-123.5	154.8	178.2	-63	-175.9	178	-166.8	-3.3	110.1	E116 Q147	E116-R140 PolarHBondContact OE2-N 3.29Å; R140-Q147 PolarHBondContact NH1-O 3.03Å
141	F	38	Very low	43.5	Very low	117 Å²	117	76.4 Å²	76.4	51%	0.513	44%	0.44	S	S	.	.			trans	-74	133.5	166.9	-70.8	-82.6	0	0	0	109	L63 E66 G143 A144	L63-F141 HydrophobicContact CD2-CD1 4.08Å; L63-F141 HydrophobicContact CD2-CD2 3.91Å; L63-F141 HydrophobicContact CD2-CE1 3.66Å; L63-F141 HydrophobicContact CD2-CE2 3.46Å; L63-F141 VanDerWaalsContact CD2-CE2 3.46Å; L63-F141 HydrophobicContact CD2-CG 4.2Å; L63-F141 HydrophobicContact CD2-CZ 3.33Å; L63-F141 HydrophobicContact CG-CE2 4.16Å; L63-F141 HydrophobicContact CG-CZ 4.26Å; E66-F141 VanDerWaalsContact OE2-CZ 3.26Å; E66-F141 WeakPolarHBondContact OE2-CZ 3.5Å; F141-G143 PolarHBondContact O-N 3.1Å; F141-A144 PolarHBondContact O-N 2.91Å
142	F	35.2	Very low	41.9	Very low	180 Å²	180	83.3 Å²	83.3	79%	0.789	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	132.2	172.9	-142.5	-95.3	0	0	0	110
143	G	34.4	Very low	40.4	Very low	71 Å²	71	84.5 Å²	84.5	73%	0.732	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.9	3.4	178.3	0	0	0	0	0	116.9	F141 S145	F141-G143 PolarHBondContact O-N 3.1Å; G143-S145 PolarHBondContact O-N 3.43Å; G143-S145 VanDerWaalsContact O-N 3.11Å
144	A	35.4	Very low	39.6	Very low	80 Å²	80	87 Å²	87	66%	0.661	50%	0.501	S	S	*	.			trans	-76.3	92.3	166.4	0	0	0	0	0	110.3	F141	F141-A144 PolarHBondContact O-N 2.91Å
145	S	31.6	Very low	39.9	Very low	107 Å²	107	89.3 Å²	89.3	75%	0.748	51%	0.514	S	S	*	.			trans	-62.8	145.5	176.5	46.4	0	0	0	0	113	G143	G143-S145 PolarHBondContact O-N 3.43Å; G143-S145 VanDerWaalsContact O-N 3.11Å
146	D	33.3	Very low	40.9	Very low	159 Å²	159	89.4 Å²	89.4	85%	0.85	51%	0.509	S	S	*	.			trans	61.9	65.7	162.8	-77.3	-20.6	0	0	0	119.4
147	Q	35.2	Very low	42.5	Very low	137 Å²	137	93.7 Å²	93.7	64%	0.64	53%	0.525	S	S	*	.			trans	-144.7	118.5	152.3	-65.4	-167.9	2.6	0	0	113.2	R140 L149	R140-Q147 PolarHBondContact NH1-O 3.03Å; Q147-L149 PolarHBondContact O-N 3.18Å
148	T	32.4	Very low	44.4	Very low	137 Å²	137	94 Å²	94	84%	0.84	52%	0.523	S	S	*	.			trans	-39.8	124.8	171.9	49.3	0	0	0	0	112.5
149	L	31.8	Very low	46.7	Very low	92 Å²	92	91.8 Å²	91.8	48%	0.482	51%	0.509	S	S	.	.			trans	-67.4	130.5	171.4	-75.5	160.6	0	0	0	109.7	Q147 P151 Y170	Q147-L149 PolarHBondContact O-N 3.18Å; L149-P151 WeakPolarHBondContact O-CD 3.4Å; L149-Y170 HydrophobicContact CD1-CD1 3.94Å; L149-Y170 HydrophobicContact CD1-CE1 3.56Å; L149-Y170 HydrophobicContact CG-CE1 4.35Å
150	T	30.1	Very low	49.1	Very low	124 Å²	124	91.4 Å²	91.4	76%	0.761	51%	0.505	S	S	*	.			trans	-72.3	115.5	169.5	-44.6	0	0	0	0	108.3	L152	T150-L152 VanDerWaalsContact C-N 3.33Å; T150-L152 PolarHBondContact O-N 3.02Å
151	P	30.4	Very low	51.8	Low	96 Å²	96	88 Å²	88	62%	0.623	49%	0.493	S	S	*	.	S	Bend	trans	-86.1	73.8	-173.1	33.7	-31.3	0	0	0	109.5	L149	L149-P151 WeakPolarHBondContact O-CD 3.4Å
152	L	29.1	Very low	54.4	Low	146 Å²	146	82.6 Å²	82.6	76%	0.764	47%	0.469	S	S	*	.			trans	179.4	93.2	169.9	-95.4	136.3	0	0	0	108.3	T150	T150-L152 VanDerWaalsContact C-N 3.33Å; T150-L152 PolarHBondContact O-N 3.02Å
153	V	35	Very low	57.1	Low	62 Å²	62	76.4 Å²	76.4	38%	0.376	44%	0.444	S	S	.	.	S	Bend	trans	175.5	58.4	135.6	-164	0	0	0	0	109.5	Q19 F20	Q19-V153 VanDerWaalsContact OE1-CG2 3.3Å; F20-V153 HydrophobicContact CE2-CB 4.37Å; F20-V153 HydrophobicContact CE2-CG1 4.2Å; F20-V153 HydrophobicContact CE2-CG2 3.89Å; F20-V153 HydrophobicContact CZ-CG2 3.75Å
154	V	46.4	Very low	59.9	Low	53 Å²	53	73.5 Å²	73.5	32%	0.321	41%	0.411	S	S	.	.	S	Bend	trans	-139	132.8	173.2	171.3	0	0	0	0	106.8	K119 L138 R156	K119-V154 HydrophobicContact CD-CG1 4.26Å; L138-V154 HydrophobicContact CD1-CG2 3.73Å; V154-R156 PolarHBondContact O-N 3.14Å
155	T	66.5	Low	62.7	Low	65 Å²	65	70 Å²	70	40%	0.399	38%	0.381	S	S	.	.			trans	-52.1	110.2	170.7	-52.8	0	0	0	0	108.2	W157 Y158	T155-W157 HydrophobicContact CG2-CB 4.1Å; T155-W157 HydrophobicContact CG2-CD2 3.73Å; T155-W157 HydrophobicContact CG2-CE3 3.78Å; T155-W157 HydrophobicContact CG2-CG 3.86Å; T155-W157 PolarHBondContact O-N 3.22Å; T155-Y158 HydrophobicContact CG2-CD2 4.13Å; T155-Y158 HydrophobicContact CG2-CE2 3.72Å; T155-Y158 PolarHBondContact O-N 2.96Å
156	R	85.2	Confident	65.5	Low	74 Å²	74	65.8 Å²	65.8	28%	0.279	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-57	-25.8	-171.1	-176.6	-177.9	-62.7	104.1	-1.4	113	V154 Y158 R159 G195 E196 S197 D198 Q201	V154-R156 PolarHBondContact O-N 3.14Å; R156-Y158 PolarHBondContact O-N 2.9Å; R156-R159 VanDerWaalsContact O-CB 3.23Å; R156-R159 WeakPolarHBondContact O-CB 3.35Å; R156-R159 PolarHBondContact O-N 3.06Å; R156-G195 PolarHBondContact NH1-O 2.96Å; R156-E196 VanDerWaalsContact NH1-C 3.3Å; R156-E196 PolarHBondContact NH1-O 3.26Å; R156-S197 WeakPolarHBondContact CD-O 3.49Å; R156-D198 WeakPolarHBondContact CD-OD1 3.18Å; R156-D198 IonicContact CZ-OD1 2.79Å; R156-D198 IonicContact NE-OD1 3.9Å; R156-D198 PolarHBondContact NE-OD1 2.98Å; R156-D198 IonicContact NH2-OD1 2.72Å; R156-Q201 HydrophobicContact CG-CB 3.97Å; R156-Q201 HydrophobicContact CG-CG 3.95Å; R156-Q201 PolarHBondContact O-NE2 3.33Å
157	W	90.5	Very high	68.2	Low	93 Å²	93	59.6 Å²	59.6	35%	0.352	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-58	-24.7	-173.1	-54.2	-16.1	0	0	0	114.5	T155 P191 F193 P194 G195 Q201	T155-W157 HydrophobicContact CG2-CB 4.1Å; T155-W157 HydrophobicContact CG2-CD2 3.73Å; T155-W157 HydrophobicContact CG2-CE3 3.78Å; T155-W157 HydrophobicContact CG2-CG 3.86Å; T155-W157 PolarHBondContact O-N 3.22Å; W157-P191 HydrophobicContact CD2-CB 4.18Å; W157-P191 HydrophobicContact CD2-CG 4.31Å; W157-P191 HydrophobicContact CE3-CB 3.63Å; W157-P191 HydrophobicContact CE3-CG 3.42Å; W157-P191 VanDerWaalsContact CE3-CG 3.42Å; W157-P191 HydrophobicContact CH2-CG 4.08Å; W157-P191 HydrophobicContact CZ3-CB 4.05Å; W157-P191 HydrophobicContact CZ3-CG 3.29Å; W157-F193 VanDerWaalsContact CA-O 3.25Å; W157-F193 WeakPolarHBondContact CA-O 3.45Å; W157-F193 WeakPolarHBondContact CB-O 3.3Å; W157-P194 VanDerWaalsContact CD1-CA 3.46Å; W157-P194 HydrophobicContact CD2-CB 4.31Å; W157-P194 HydrophobicContact CZ2-CB 4.23Å; W157-G195 VanDerWaalsContact CD1-N 3.32Å; W157-G195 PolarHBondContact NE1-O 3.39Å; W157-Q201 PolarHBondContact O-NE2 3.49Å; W157-Q201 VanDerWaalsContact O-NE2 3.11Å
158	Y	89.6	Confident	70.4	Confident	17 Å²	17	63.2 Å²	63.2	7%	0.067	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-103.3	4.9	179.8	-46	-76.6	0	0	0	113	P120 T155 R156 A160 C181 I182 E185	P120-Y158 HydrophobicContact CG-CE1 3.86Å; P120-Y158 HydrophobicContact CG-CE2 3.98Å; P120-Y158 VanDerWaalsContact CG-CZ 3.44Å; P120-Y158 VanDerWaalsContact CG-OH 3.24Å; P120-Y158 WeakPolarHBondContact CG-OH 3.41Å; T155-Y158 HydrophobicContact CG2-CD2 4.13Å; T155-Y158 HydrophobicContact CG2-CE2 3.72Å; T155-Y158 PolarHBondContact O-N 2.96Å; R156-Y158 PolarHBondContact O-N 2.9Å; Y158-A160 PolarHBondContact O-N 3.11Å; Y158-C181 HydrophobicContact CD1-CB 3.64Å; Y158-C181 HydrophobicContact CE1-CB 4.35Å; Y158-I182 HydrophobicContact CD1-CG1 4.1Å; Y158-I182 HydrophobicContact CE1-CG1 4.08Å; Y158-E185 WeakPolarHBondContact CE1-OE2 3.34Å; Y158-E185 VanDerWaalsContact CZ-OE2 3.26Å; Y158-E185 PolarHBondContact OH-OE2 2.98Å
159	R	89.8	Confident	72.5	Confident	39 Å²	39	66.4 Å²	66.4	15%	0.147	33%	0.329	C	S	.	.			trans	-74.4	129.2	-176.6	-169.7	179.2	-68.7	166.2	2.5	110.3	R156 L163 L164 W177 D198	R156-R159 VanDerWaalsContact O-CB 3.23Å; R156-R159 WeakPolarHBondContact O-CB 3.35Å; R156-R159 PolarHBondContact O-N 3.06Å; R159-L163 HydrophobicContact CG-CB 3.76Å; R159-L163 HydrophobicContact CG-CD1 3.94Å; R159-L163 HydrophobicContact CG-CG 4.49Å; R159-L164 HydrophobicContact CG-CD2 4.27Å; R159-L164 HydrophobicContact CG-CG 4.13Å; R159-W177 PolarHBondContact O-NE1 3.3Å; R159-D198 VanDerWaalsContact NH1-CG 3.34Å; R159-D198 IonicContact NH1-OD1 3.64Å; R159-D198 PolarHBondContact NH1-OD1 3.5Å; R159-D198 VanDerWaalsContact NH1-OD1 3.08Å; R159-D198 IonicContact NH1-OD2 3.9Å; R159-D198 PolarHBondContact NH1-OD2 3.19Å
160	A	92.9	Very high	74.5	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	32%	0.323	C	S	.	.			trans	-69.1	149.5	178.2	0	0	0	0	0	112.4	Y158 E162 L163 L164 V174 W177	Y158-A160 PolarHBondContact O-N 3.11Å; A160-E162 VanDerWaalsContact C-N 3.29Å; A160-E162 HydrophobicContact CB-CG 4.44Å; A160-E162 VanDerWaalsContact CB-OE1 3.3Å; A160-E162 WeakPolarHBondContact CB-OE1 3.34Å; A160-E162 WeakPolarHBondContact CB-OE2 3.33Å; A160-E162 PolarHBondContact O-N 3.2Å; A160-L163 WeakPolarHBondContact O-CB 3.5Å; A160-L163 PolarHBondContact O-N 3.24Å; A160-L163 VanDerWaalsContact O-N 3.12Å; A160-L164 PolarHBondContact O-N 3.19Å; A160-V174 HydrophobicContact CB-CB 4.5Å; A160-V174 HydrophobicContact CB-CG1 4.33Å; A160-V174 HydrophobicContact CB-CG2 4.35Å; A160-W177 VanDerWaalsContact CA-CD1 3.48Å; A160-W177 HydrophobicContact CB-CB 3.8Å; A160-W177 HydrophobicContact CB-CD2 4.2Å; A160-W177 HydrophobicContact CB-CG 3.66Å
161	P	95.1	Very high	76.6	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-63	-31.1	-174.3	25.7	-35.4	0	0	0	113.5	L163 L164 Y165 W177 W217 Y258	P161-L163 VanDerWaalsContact C-N 3.27Å; P161-L163 PolarHBondContact O-N 3.08Å; P161-L164 PolarHBondContact O-N 2.84Å; P161-L164 VanDerWaalsContact O-N 3.11Å; P161-Y165 HydrophobicContact CB-CD2 4.35Å; P161-Y165 HydrophobicContact CB-CE2 4.26Å; P161-Y165 WeakPolarHBondContact O-CD2 3.47Å; P161-Y165 PolarHBondContact O-N 3.4Å; P161-W177 HydrophobicContact CG-CE3 4.2Å; P161-W177 HydrophobicContact CG-CH2 3.86Å; P161-W177 HydrophobicContact CG-CZ2 4.35Å; P161-W177 HydrophobicContact CG-CZ3 3.78Å; P161-W217 HydrophobicContact CB-CH2 4.23Å; P161-W217 HydrophobicContact CB-CZ3 3.94Å; P161-W217 HydrophobicContact CG-CH2 4.34Å; P161-W217 HydrophobicContact CG-CZ3 4.1Å; P161-Y258 HydrophobicContact CB-CD1 4.13Å; P161-Y258 HydrophobicContact CB-CE1 4.26Å; P161-Y258 HydrophobicContact CG-CD1 3.85Å; P161-Y258 HydrophobicContact CG-CE1 4.31Å
162	E	93.3	Very high	78.7	Confident	3 Å²	3	60.1 Å²	60.1	1%	0.014	29%	0.29	C	S	.	.	H	α-helix	trans	-62.5	-34	175.6	65.1	-84.4	-154.9	0	0	112.6	A160 G166 S167 V174 W217 P260 R263	A160-E162 VanDerWaalsContact C-N 3.29Å; A160-E162 HydrophobicContact CB-CG 4.44Å; A160-E162 VanDerWaalsContact CB-OE1 3.3Å; A160-E162 WeakPolarHBondContact CB-OE1 3.34Å; A160-E162 WeakPolarHBondContact CB-OE2 3.33Å; A160-E162 PolarHBondContact O-N 3.2Å; E162-G166 PolarHBondContact O-N 3.24Å; E162-S167 WeakPolarHBondContact O-CA 3.08Å; E162-S167 WeakPolarHBondContact O-CB 3.43Å; E162-S167 PolarHBondContact O-N 2.9Å; E162-V174 HydrophobicContact CG-CG2 4.39Å; E162-V174 WeakPolarHBondContact OE1-CG2 3.4Å; E162-W217 HydrophobicContact CB-CH2 3.79Å; E162-W217 HydrophobicContact CB-CZ2 3.69Å; E162-P260 HydrophobicContact CG-CG 4.44Å; E162-R263 IonicContact OE1-CZ 3.87Å; E162-R263 IonicContact OE1-NH1 3.28Å; E162-R263 PolarHBondContact OE1-NH1 2.78Å; E162-R263 IonicContact OE1-NH2 3.03Å; E162-R263 PolarHBondContact OE1-NH2 3.25Å; E162-R263 IonicContact OE2-CZ 2.69Å; E162-R263 IonicContact OE2-NH1 3.74Å; E162-R263 IonicContact OE2-NH2 2.7Å; E162-R263 PolarHBondContact OE2-NH2 3.34Å
163	L	92	Very high	81.3	Confident	50 Å²	50	53.1 Å²	53.1	26%	0.262	25%	0.254	S	S	.	.	H	α-helix	trans	-74.8	-33.9	174.5	-64.5	-179.3	0	0	0	111.4	R159 A160 P161 G166 V174	R159-L163 HydrophobicContact CG-CB 3.76Å; R159-L163 HydrophobicContact CG-CD1 3.94Å; R159-L163 HydrophobicContact CG-CG 4.49Å; A160-L163 WeakPolarHBondContact O-CB 3.5Å; A160-L163 PolarHBondContact O-N 3.24Å; A160-L163 VanDerWaalsContact O-N 3.12Å; P161-L163 VanDerWaalsContact C-N 3.27Å; P161-L163 PolarHBondContact O-N 3.08Å; L163-G166 PolarHBondContact O-N 2.93Å; L163-V174 HydrophobicContact CD1-CG1 3.59Å; L163-V174 HydrophobicContact CD1-CG2 4.09Å; L163-V174 HydrophobicContact CD2-CG2 4.4Å; L163-V174 HydrophobicContact CG-CG1 4.47Å; L163-V174 HydrophobicContact CG-CG2 4.12Å
164	L	93.3	Very high	83.7	Confident	10 Å²	10	51.4 Å²	51.4	5%	0.052	24%	0.243	C	C	.	.	H	α-helix	trans	-72.9	-31.8	177.8	-66.8	166.7	0	0	0	112.4	R159 A160 P161 G166 D198 Q201 L202 I205	R159-L164 HydrophobicContact CG-CD2 4.27Å; R159-L164 HydrophobicContact CG-CG 4.13Å; A160-L164 PolarHBondContact O-N 3.19Å; P161-L164 PolarHBondContact O-N 2.84Å; P161-L164 VanDerWaalsContact O-N 3.11Å; L164-G166 PolarHBondContact O-N 3.12Å; L164-D198 HydrophobicContact CD2-CB 3.82Å; L164-Q201 HydrophobicContact CD1-CB 4.04Å; L164-Q201 HydrophobicContact CD1-CG 3.48Å; L164-Q201 VanDerWaalsContact CD1-CG 3.48Å; L164-Q201 HydrophobicContact CD2-CB 4.19Å; L164-Q201 HydrophobicContact CD2-CG 4.16Å; L164-Q201 HydrophobicContact CG-CG 4.47Å; L164-L202 HydrophobicContact CB-CD1 4.05Å; L164-L202 HydrophobicContact CB-CD2 3.57Å; L164-L202 HydrophobicContact CB-CG 3.7Å; L164-L202 HydrophobicContact CD1-CD2 3.8Å; L164-L202 HydrophobicContact CD1-CG 3.96Å; L164-L202 HydrophobicContact CG-CD2 4.32Å; L164-L202 HydrophobicContact CG-CG 4.35Å; L164-I205 HydrophobicContact CD1-CD1 3.67Å
165	Y	94	Very high	85.2	Confident	7 Å²	7	49.6 Å²	49.6	3%	0.027	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	9.2	172.6	-68.5	-53.8	0	0	0	113.5	P161 L202 P212 W217 V220 L223 P224 D225 Y226	P161-Y165 HydrophobicContact CB-CD2 4.35Å; P161-Y165 HydrophobicContact CB-CE2 4.26Å; P161-Y165 WeakPolarHBondContact O-CD2 3.47Å; P161-Y165 PolarHBondContact O-N 3.4Å; Y165-L202 HydrophobicContact CD1-CD1 3.92Å; Y165-L202 HydrophobicContact CD1-CD2 4.29Å; Y165-L202 HydrophobicContact CD2-CD2 4.22Å; Y165-L202 HydrophobicContact CE1-CD1 3.64Å; Y165-L202 HydrophobicContact CE1-CD2 3.86Å; Y165-L202 HydrophobicContact CE1-CG 4.37Å; Y165-L202 HydrophobicContact CE2-CD2 3.76Å; Y165-L202 HydrophobicContact CG-CD2 4.47Å; Y165-P212 HydrophobicContact CE2-CG 4.22Å; Y165-W217 AromaticContact CD2-CH2 3.84Å; Y165-W217 HydrophobicContact CD2-CH2 3.84Å; Y165-W217 AromaticContact CD2-CZ3 3.7Å; Y165-W217 HydrophobicContact CD2-CZ3 3.7Å; Y165-W217 HydrophobicContact CE2-CH2 4.46Å; Y165-W217 AromaticContact CE2-CZ3 3.87Å; Y165-W217 HydrophobicContact CE2-CZ3 3.87Å; Y165-V220 HydrophobicContact CD2-CG2 4.43Å; Y165-V220 HydrophobicContact CE2-CG2 4.39Å; Y165-L223 HydrophobicContact CD2-CD1 4.21Å; Y165-L223 HydrophobicContact CG-CD1 4.26Å; Y165-L223 WeakPolarHBondContact O-CB 3.46Å; Y165-P224 WeakPolarHBondContact O-CD 3.44Å; Y165-D225 PolarHBondContact O-N 2.73Å; Y165-Y226 HydrophobicContact CD1-CD2 4.05Å; Y165-Y226 AromaticContact CE1-CD2 3.81Å; Y165-Y226 HydrophobicContact CE1-CD2 3.81Å; Y165-Y226 HydrophobicContact CE1-CE2 4.44Å; Y165-Y226 HydrophobicContact CE2-CD2 4.44Å; Y165-Y226 HydrophobicContact CG-CD2 4.46Å
166	G	90.3	Very high	86.2	Confident	18 Å²	18	46.6 Å²	46.6	19%	0.186	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	22	170.9	0	0	0	0	0	115.2	E162 L163 L164 R168 P224 D225	E162-G166 PolarHBondContact O-N 3.24Å; L163-G166 PolarHBondContact O-N 2.93Å; L164-G166 PolarHBondContact O-N 3.12Å; G166-R168 PolarHBondContact O-N 3.08Å; G166-P224 WeakPolarHBondContact O-CG 3.32Å; G166-D225 WeakPolarHBondContact CA-OD2 3.2Å
167	S	89.2	Confident	86.5	Confident	28 Å²	28	43 Å²	43	20%	0.196	20%	0.2	C	C	.	.			trans	-55.7	131.8	174.1	-176.4	0	0	0	0	110.8	E162 Y169	E162-S167 WeakPolarHBondContact O-CA 3.08Å; E162-S167 WeakPolarHBondContact O-CB 3.43Å; E162-S167 PolarHBondContact O-N 2.9Å; S167-Y169 PolarHBondContact OG-N 3.24Å; S167-Y169 PolarHBondContact OG-O 3.19Å
168	R	81.8	Confident	86.3	Confident	213 Å²	213	38.9 Å²	38.9	80%	0.804	19%	0.185	S	C	*	.	S	Bend	trans	-85.4	-13	175.1	-61.7	-172.8	-179.6	-160.4	1	113.1	G166	G166-R168 PolarHBondContact O-N 3.08Å
169	Y	75.8	Confident	86	Confident	204 Å²	204	38 Å²	38	80%	0.8	18%	0.182	S	C	*	.			trans	-112.8	121	178.7	-57.7	-76.9	0	0	0	108.6	S167	S167-Y169 PolarHBondContact OG-N 3.24Å; S167-Y169 PolarHBondContact OG-O 3.19Å
170	Y	74.3	Confident	86	Confident	89 Å²	89	36.2 Å²	36.2	35%	0.349	18%	0.175	S	C	.	.			trans	-119.7	150.8	175.4	53.3	-90.8	0	0	0	109.4	L149	L149-Y170 HydrophobicContact CD1-CD1 3.94Å; L149-Y170 HydrophobicContact CD1-CE1 3.56Å; L149-Y170 HydrophobicContact CG-CE1 4.35Å
171	S	73.4	Confident	85.9	Confident	44 Å²	44	36.3 Å²	36.3	31%	0.308	18%	0.175	S	C	.	.			trans	-130.4	178.3	178.8	69.2	0	0	0	0	109.7	G173 V174	S171-G173 PolarHBondContact O-N 3.34Å; S171-G173 PolarHBondContact OG-N 2.96Å; S171-V174 PolarHBondContact O-N 3.16Å; S171-V174 VanDerWaalsContact O-N 3.08Å
172	A	75.8	Confident	85.3	Confident	47 Å²	47	36.3 Å²	36.3	39%	0.388	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-18.9	170.5	0	0	0	0	0	113.5	V174 D175 I176	A172-V174 PolarHBondContact O-N 3.49Å; A172-D175 PolarHBondContact O-N 3.13Å; A172-D175 VanDerWaalsContact O-N 3.12Å; A172-I176 PolarHBondContact O-N 2.85Å
173	G	83.1	Confident	84.8	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-56.8	-30.4	175	0	0	0	0	0	113.7	S171 D175 I176 W177 R263	S171-G173 PolarHBondContact O-N 3.34Å; S171-G173 PolarHBondContact OG-N 2.96Å; G173-D175 VanDerWaalsContact C-N 3.34Å; G173-D175 PolarHBondContact O-N 3.37Å; G173-I176 PolarHBondContact O-N 2.86Å; G173-W177 PolarHBondContact O-N 2.77Å; G173-R263 WeakPolarHBondContact CA-O 3.32Å; G173-R263 PolarHBondContact O-NH1 2.67Å
174	V	85.9	Confident	84.6	Confident	25 Å²	25	33.8 Å²	33.8	15%	0.152	16%	0.162	C	C	.	.	H	α-helix	trans	-61.3	-43.9	176.7	174.2	0	0	0	0	111.1	A160 E162 L163 S171 A172 W177 A178	A160-V174 HydrophobicContact CB-CB 4.5Å; A160-V174 HydrophobicContact CB-CG1 4.33Å; A160-V174 HydrophobicContact CB-CG2 4.35Å; E162-V174 HydrophobicContact CG-CG2 4.39Å; E162-V174 WeakPolarHBondContact OE1-CG2 3.4Å; L163-V174 HydrophobicContact CD1-CG1 3.59Å; L163-V174 HydrophobicContact CD1-CG2 4.09Å; L163-V174 HydrophobicContact CD2-CG2 4.4Å; L163-V174 HydrophobicContact CG-CG1 4.47Å; L163-V174 HydrophobicContact CG-CG2 4.12Å; S171-V174 PolarHBondContact O-N 3.16Å; S171-V174 VanDerWaalsContact O-N 3.08Å; A172-V174 PolarHBondContact O-N 3.49Å; V174-W177 WeakPolarHBondContact O-CB 3.25Å; V174-W177 PolarHBondContact O-N 3.41Å; V174-A178 PolarHBondContact O-N 3.33Å; V174-A178 VanDerWaalsContact O-N 3.09Å
175	D	78	Confident	84.2	Confident	16 Å²	16	34.2 Å²	34.2	9%	0.086	16%	0.164	C	C	.	.	H	α-helix	trans	-69.4	-36	179	-65.2	-57.4	0	0	0	111.3	M111 E116 D117 L118 A172 G173 W177 A178 L179	M111-D175 HydrophobicContact CE-CB 3.62Å; M111-D175 HydrophobicContact SD-CB 4.4Å; E116-D175 WeakPolarHBondContact CA-OD2 3.37Å; D117-D175 WeakPolarHBondContact CA-OD1 3.37Å; D117-D175 PolarHBondContact N-OD1 3.3Å; L118-D175 HydrophobicContact CD1-CB 4.24Å; L118-D175 PolarHBondContact N-OD1 3.11Å; A172-D175 PolarHBondContact O-N 3.13Å; A172-D175 VanDerWaalsContact O-N 3.12Å; G173-D175 VanDerWaalsContact C-N 3.34Å; G173-D175 PolarHBondContact O-N 3.37Å; D175-W177 VanDerWaalsContact C-N 3.32Å; D175-W177 PolarHBondContact O-N 3.12Å; D175-A178 WeakPolarHBondContact O-CB 3.45Å; D175-A178 PolarHBondContact O-N 2.85Å; D175-L179 WeakPolarHBondContact O-CB 3.45Å; D175-L179 PolarHBondContact O-N 3.36Å
176	I	86.2	Confident	83.2	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-64.1	-36.2	174	-64.8	-64	0	0	0	112.4	M111 A172 G173 L179 G180 W254 C255 R263 V266	M111-I176 HydrophobicContact CE-CD1 3.34Å; M111-I176 HydrophobicContact CE-CG1 3.8Å; M111-I176 HydrophobicContact CG-CD1 4.2Å; A172-I176 PolarHBondContact O-N 2.85Å; G173-I176 PolarHBondContact O-N 2.86Å; I176-L179 HydrophobicContact CD1-CD2 4.46Å; I176-L179 WeakPolarHBondContact O-CB 3.5Å; I176-L179 PolarHBondContact O-N 3.45Å; I176-G180 PolarHBondContact O-N 3.06Å; I176-W254 HydrophobicContact CD1-CH2 4.36Å; I176-W254 HydrophobicContact CD1-CZ3 4.17Å; I176-W254 HydrophobicContact CG1-CZ3 4.49Å; I176-W254 HydrophobicContact CG2-CE3 4.08Å; I176-W254 HydrophobicContact CG2-CH2 3.99Å; I176-W254 HydrophobicContact CG2-CZ3 3.4Å; I176-C255 HydrophobicContact CG2-CB 4.27Å; I176-R263 HydrophobicContact CB-CB 4.1Å; I176-R263 HydrophobicContact CG2-CB 3.85Å; I176-R263 HydrophobicContact CG2-CG 4.02Å; I176-V266 HydrophobicContact CD1-CG1 3.5Å; I176-V266 HydrophobicContact CG1-CG1 4.42Å
177	W	91.6	Very high	82.8	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-66.5	-45.7	173.1	176	-78.1	0	0	0	111.7	R159 A160 P161 G173 V174 D175 L179 G180 C181 F193 I205 L209 L256 R263	R159-W177 PolarHBondContact O-NE1 3.3Å; A160-W177 VanDerWaalsContact CA-CD1 3.48Å; A160-W177 HydrophobicContact CB-CB 3.8Å; A160-W177 HydrophobicContact CB-CD2 4.2Å; A160-W177 HydrophobicContact CB-CG 3.66Å; P161-W177 HydrophobicContact CG-CE3 4.2Å; P161-W177 HydrophobicContact CG-CH2 3.86Å; P161-W177 HydrophobicContact CG-CZ2 4.35Å; P161-W177 HydrophobicContact CG-CZ3 3.78Å; G173-W177 PolarHBondContact O-N 2.77Å; V174-W177 WeakPolarHBondContact O-CB 3.25Å; V174-W177 PolarHBondContact O-N 3.41Å; D175-W177 VanDerWaalsContact C-N 3.32Å; D175-W177 PolarHBondContact O-N 3.12Å; W177-L179 PolarHBondContact O-N 3.35Å; W177-G180 PolarHBondContact O-N 3.09Å; W177-G180 VanDerWaalsContact O-N 3.16Å; W177-C181 PolarHBondContact NE1-SG 3.48Å; W177-C181 VanDerWaalsContact NE1-SG 3.44Å; W177-C181 PolarHBondContact O-N 3.26Å; W177-C181 PolarHBondContact O-SG 2.94Å; W177-F193 AromaticContact CZ2-CE2 3.94Å; W177-F193 HydrophobicContact CZ2-CE2 3.94Å; W177-I205 HydrophobicContact CH2-CG2 3.78Å; W177-I205 HydrophobicContact CZ2-CD1 3.8Å; W177-I205 HydrophobicContact CZ2-CG1 4.01Å; W177-I205 HydrophobicContact CZ2-CG2 3.98Å; W177-L209 HydrophobicContact CH2-CD1 3.51Å; W177-L209 HydrophobicContact CZ2-CD1 4.39Å; W177-L209 HydrophobicContact CZ3-CD1 4.09Å; W177-L256 HydrophobicContact CD2-CD2 3.86Å; W177-L256 HydrophobicContact CE3-CD2 4.03Å; W177-L256 HydrophobicContact CG-CD2 4.29Å; W177-L256 HydrophobicContact CH2-CD2 4.49Å; W177-L256 HydrophobicContact CZ2-CD2 4.32Å; W177-L256 HydrophobicContact CZ3-CB 4.35Å; W177-L256 HydrophobicContact CZ3-CD2 4.36Å; W177-R263 VanDerWaalsContact CB-NH1 3.33Å
178	A	86.2	Confident	82.6	Confident	5 Å²	5	38.9 Å²	38.9	4%	0.041	18%	0.182	C	C	.	.	H	α-helix	trans	-58.4	-40.9	175.6	0	0	0	0	0	110.9	L118 V174 D175 C181 I182	L118-A178 HydrophobicContact CB-CB 4.25Å; L118-A178 WeakPolarHBondContact O-CB 3.4Å; V174-A178 PolarHBondContact O-N 3.33Å; V174-A178 VanDerWaalsContact O-N 3.09Å; D175-A178 WeakPolarHBondContact O-CB 3.45Å; D175-A178 PolarHBondContact O-N 2.85Å; A178-C181 WeakPolarHBondContact O-CB 3.18Å; A178-C181 PolarHBondContact O-N 3.42Å; A178-I182 VanDerWaalsContact O-CG1 3.26Å; A178-I182 WeakPolarHBondContact O-CG1 3.5Å; A178-I182 PolarHBondContact O-N 3.04Å
179	L	83.3	Confident	82.4	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-56.8	-51.9	172.3	175.3	55.8	0	0	0	112.1	I107 F108 M111 L118 D175 I176 W177 C181 I182 I183	I107-L179 HydrophobicContact CB-CD1 3.79Å; I107-L179 HydrophobicContact CD1-CD1 3.73Å; I107-L179 HydrophobicContact CG1-CD1 4.37Å; I107-L179 HydrophobicContact CG2-CD1 3.29Å; I107-L179 HydrophobicContact CG2-CD2 4.17Å; I107-L179 HydrophobicContact CG2-CG 4.29Å; F108-L179 HydrophobicContact CD1-CD2 4.27Å; F108-L179 HydrophobicContact CD2-CD2 4.35Å; F108-L179 HydrophobicContact CE1-CD2 3.89Å; F108-L179 HydrophobicContact CE2-CD2 4.02Å; F108-L179 HydrophobicContact CG-CD2 4.48Å; F108-L179 HydrophobicContact CZ-CD2 3.77Å; M111-L179 HydrophobicContact CG-CD2 4.07Å; L118-L179 HydrophobicContact CD1-CB 4.09Å; D175-L179 WeakPolarHBondContact O-CB 3.45Å; D175-L179 PolarHBondContact O-N 3.36Å; I176-L179 HydrophobicContact CD1-CD2 4.46Å; I176-L179 WeakPolarHBondContact O-CB 3.5Å; I176-L179 PolarHBondContact O-N 3.45Å; W177-L179 PolarHBondContact O-N 3.35Å; L179-C181 PolarHBondContact O-N 3.2Å; L179-I182 WeakPolarHBondContact O-CB 3.5Å; L179-I182 PolarHBondContact O-N 3.38Å; L179-I183 HydrophobicContact CD1-CD1 3.74Å; L179-I183 HydrophobicContact CD1-CG1 3.88Å; L179-I183 HydrophobicContact CG-CD1 3.81Å; L179-I183 HydrophobicContact CG-CG1 4.36Å; L179-I183 WeakPolarHBondContact O-CG1 3.44Å; L179-I183 PolarHBondContact O-N 3.3Å
180	G	89.6	Confident	82.7	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-55.6	-41	177.4	0	0	0	0	0	112.6	I176 W177 I183 A184 L252	I176-G180 PolarHBondContact O-N 3.06Å; W177-G180 PolarHBondContact O-N 3.09Å; W177-G180 VanDerWaalsContact O-N 3.16Å; G180-I183 PolarHBondContact O-N 3.44Å; G180-A184 WeakPolarHBondContact O-CB 3.17Å; G180-A184 PolarHBondContact O-N 3.31Å; G180-L252 WeakPolarHBondContact O-CD2 3.3Å
181	C	91.4	Very high	83.3	Confident	2 Å²	2	25.5 Å²	25.5	1%	0.014	14%	0.144	C	C	.	.	H	α-helix	trans	-64.7	-41.3	175.7	-64.3	0	0	0	0	112.3	Y158 W177 A178 L179 A184 E185	Y158-C181 HydrophobicContact CD1-CB 3.64Å; Y158-C181 HydrophobicContact CE1-CB 4.35Å; W177-C181 PolarHBondContact NE1-SG 3.48Å; W177-C181 VanDerWaalsContact NE1-SG 3.44Å; W177-C181 PolarHBondContact O-N 3.26Å; W177-C181 PolarHBondContact O-SG 2.94Å; A178-C181 WeakPolarHBondContact O-CB 3.18Å; A178-C181 PolarHBondContact O-N 3.42Å; L179-C181 PolarHBondContact O-N 3.2Å; C181-A184 PolarHBondContact O-N 3.12Å; C181-E185 WeakPolarHBondContact O-CB 3.26Å; C181-E185 PolarHBondContact O-N 2.87Å
182	I	82	Confident	84.2	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-64	-45.1	176.3	-68.2	164.1	0	0	0	110.8	I107 P120 L123 Y158 A178 L179 A184 E185 L186	I107-I182 HydrophobicContact CD1-CG2 4.38Å; P120-I182 HydrophobicContact CB-CD1 4.42Å; P120-I182 HydrophobicContact CB-CG1 4.15Å; P120-I182 HydrophobicContact CB-CG2 4.35Å; P120-I182 HydrophobicContact CG-CD1 4.33Å; P120-I182 HydrophobicContact CG-CG1 3.84Å; L123-I182 HydrophobicContact CD1-CD1 4.18Å; Y158-I182 HydrophobicContact CD1-CG1 4.1Å; Y158-I182 HydrophobicContact CE1-CG1 4.08Å; A178-I182 VanDerWaalsContact O-CG1 3.26Å; A178-I182 WeakPolarHBondContact O-CG1 3.5Å; A178-I182 PolarHBondContact O-N 3.04Å; L179-I182 WeakPolarHBondContact O-CB 3.5Å; L179-I182 PolarHBondContact O-N 3.38Å; I182-A184 VanDerWaalsContact C-N 3.35Å; I182-E185 PolarHBondContact O-N 3.31Å; I182-L186 HydrophobicContact CG2-CD1 4.22Å; I182-L186 WeakPolarHBondContact O-CG 3.45Å; I182-L186 PolarHBondContact O-N 3.27Å
183	I	83.1	Confident	85.1	Confident	1 Å²	1	21.8 Å²	21.8	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-61.3	-46.6	178.5	-65.1	172.5	0	0	0	110	V104 F108 L179 G180 E185 L186 L187 M248 I251 L252	V104-I183 HydrophobicContact CG1-CD1 4.01Å; V104-I183 HydrophobicContact CG2-CD1 4.44Å; V104-I183 HydrophobicContact CG2-CG1 4.13Å; V104-I183 HydrophobicContact CG2-CG2 4.14Å; F108-I183 HydrophobicContact CE2-CD1 3.83Å; F108-I183 HydrophobicContact CZ-CD1 4.41Å; L179-I183 HydrophobicContact CD1-CD1 3.74Å; L179-I183 HydrophobicContact CD1-CG1 3.88Å; L179-I183 HydrophobicContact CG-CD1 3.81Å; L179-I183 HydrophobicContact CG-CG1 4.36Å; L179-I183 WeakPolarHBondContact O-CG1 3.44Å; L179-I183 PolarHBondContact O-N 3.3Å; G180-I183 PolarHBondContact O-N 3.44Å; I183-E185 VanDerWaalsContact C-N 3.34Å; I183-E185 PolarHBondContact O-N 3.29Å; I183-L186 PolarHBondContact O-N 3.29Å; I183-L187 HydrophobicContact CG2-CD1 4.34Å; I183-L187 WeakPolarHBondContact O-CG 3.46Å; I183-L187 PolarHBondContact O-N 3.35Å; I183-M248 HydrophobicContact CG2-CE 3.91Å; I183-M248 HydrophobicContact CG2-SD 3.44Å; I183-M248 WeakPolarHBondContact CG2-SD 3.38Å; I183-I251 HydrophobicContact CD1-CG2 4.18Å; I183-L252 HydrophobicContact CB-CD2 3.94Å; I183-L252 HydrophobicContact CG2-CD2 3.77Å; I183-L252 HydrophobicContact CG2-CG 4.34Å
184	A	87.7	Confident	85.5	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-62.1	-41.2	176.8	0	0	0	0	0	112	G180 C181 I182 L186 L187 L188 L192 L252	G180-A184 WeakPolarHBondContact O-CB 3.17Å; G180-A184 PolarHBondContact O-N 3.31Å; C181-A184 PolarHBondContact O-N 3.12Å; I182-A184 VanDerWaalsContact C-N 3.35Å; A184-L186 PolarHBondContact O-N 2.93Å; A184-L187 PolarHBondContact O-N 3.49Å; A184-L188 WeakPolarHBondContact O-CB 3.21Å; A184-L188 WeakPolarHBondContact O-CG 3.37Å; A184-L188 PolarHBondContact O-N 2.93Å; A184-L192 HydrophobicContact CB-CB 4Å; A184-L192 HydrophobicContact CB-CD1 4.25Å; A184-L192 HydrophobicContact CB-CD2 3.65Å; A184-L192 HydrophobicContact CB-CG 4.18Å; A184-L252 HydrophobicContact CB-CD2 4.02Å
185	E	84.8	Confident	85.8	Confident	19 Å²	19	22.5 Å²	22.5	9%	0.089	12%	0.12	C	C	.	.	H	α-helix	trans	-64.1	-38.4	176.7	179.6	171.5	-179.3	0	0	112.6	L95 Y158 C181 I182 I183 L187 L188 R189 A190	L95-E185 WeakPolarHBondContact CD1-OE1 3.33Å; L95-E185 HydrophobicContact CD2-CB 4.45Å; L95-E185 HydrophobicContact CD2-CG 3.81Å; Y158-E185 WeakPolarHBondContact CE1-OE2 3.34Å; Y158-E185 VanDerWaalsContact CZ-OE2 3.26Å; Y158-E185 PolarHBondContact OH-OE2 2.98Å; C181-E185 WeakPolarHBondContact O-CB 3.26Å; C181-E185 PolarHBondContact O-N 2.87Å; I182-E185 PolarHBondContact O-N 3.31Å; I183-E185 VanDerWaalsContact C-N 3.34Å; I183-E185 PolarHBondContact O-N 3.29Å; E185-L187 VanDerWaalsContact C-N 3.25Å; E185-L187 PolarHBondContact O-N 3.42Å; E185-L188 PolarHBondContact O-N 2.95Å; E185-R189 VanDerWaalsContact O-CA 3.32Å; E185-R189 WeakPolarHBondContact O-CA 3.47Å; E185-R189 PolarHBondContact O-N 3.05Å; E185-A190 WeakPolarHBondContact CA-O 3.36Å
186	L	74.5	Confident	86.4	Confident	17 Å²	17	29.3 Å²	29.3	9%	0.089	15%	0.151	C	C	.	.	H	α-helix	trans	-60.9	-36.2	174.2	-74.9	169.5	0	0	0	112.2	L94 L95 I182 I183 A184 R189	L94-L186 HydrophobicContact CD2-CD1 4.27Å; L94-L186 HydrophobicContact CG-CD1 4.46Å; L95-L186 HydrophobicContact CD2-CD2 3.82Å; L95-L186 HydrophobicContact CD2-CG 4.14Å; I182-L186 HydrophobicContact CG2-CD1 4.22Å; I182-L186 WeakPolarHBondContact O-CG 3.45Å; I182-L186 PolarHBondContact O-N 3.27Å; I183-L186 PolarHBondContact O-N 3.29Å; A184-L186 PolarHBondContact O-N 2.93Å; L186-R189 PolarHBondContact O-NE 3.49Å
187	L	81.4	Confident	86.6	Confident	72 Å²	72	31.9 Å²	31.9	38%	0.377	17%	0.169	S	C	.	.	H	α-helix	trans	-79	-39.9	178.3	-63.4	168.1	0	0	0	112.2	I183 A184 E185 L241 M248 L252	I183-L187 HydrophobicContact CG2-CD1 4.34Å; I183-L187 WeakPolarHBondContact O-CG 3.46Å; I183-L187 PolarHBondContact O-N 3.35Å; A184-L187 PolarHBondContact O-N 3.49Å; E185-L187 VanDerWaalsContact C-N 3.25Å; E185-L187 PolarHBondContact O-N 3.42Å; L187-L241 HydrophobicContact CB-CD2 3.55Å; L187-L241 HydrophobicContact CD1-CD1 3.95Å; L187-L241 HydrophobicContact CD1-CD2 4.34Å; L187-M248 HydrophobicContact CD1-CE 4.24Å; L187-M248 HydrophobicContact CD1-CG 3.56Å; L187-M248 HydrophobicContact CD1-SD 3.88Å; L187-L252 HydrophobicContact CD1-CD1 4.16Å
188	L	84.7	Confident	86.6	Confident	61 Å²	61	34.9 Å²	34.9	32%	0.319	19%	0.185	S	C	.	.	H	α-helix	trans	-78.8	-26.3	-179.2	-74.5	171.4	0	0	0	113.8	A184 E185 A190 L192 I240 L241	A184-L188 WeakPolarHBondContact O-CB 3.21Å; A184-L188 WeakPolarHBondContact O-CG 3.37Å; A184-L188 PolarHBondContact O-N 2.93Å; E185-L188 PolarHBondContact O-N 2.95Å; L188-A190 WeakPolarHBondContact CB-O 3.38Å; L188-A190 PolarHBondContact O-N 3.26Å; L188-L192 HydrophobicContact CD1-CB 4.41Å; L188-L192 HydrophobicContact CD1-CD1 3.77Å; L188-I240 HydrophobicContact CD1-CG2 4.48Å; L188-I240 HydrophobicContact CD2-CG2 4.43Å; L188-I240 WeakPolarHBondContact CD2-O 3.26Å; L188-L241 HydrophobicContact CD2-CD2 3.66Å; L188-L241 HydrophobicContact CD2-CG 4.45Å; L188-L241 HydrophobicContact CG-CD2 3.65Å
189	R	78.4	Confident	86.9	Confident	144 Å²	144	40.4 Å²	40.4	54%	0.543	21%	0.213	S	C	.	.	S	Bend	trans	60	14.9	-163.1	-52.5	-61.3	176.5	-177.4	-11.1	114.6	S98 E185 L186	S98-R189 PolarHBondContact OG-NH2 2.9Å; E185-R189 VanDerWaalsContact O-CA 3.32Å; E185-R189 WeakPolarHBondContact O-CA 3.47Å; E185-R189 PolarHBondContact O-N 3.05Å; L186-R189 PolarHBondContact O-NE 3.49Å
190	A	80.7	Confident	87.5	Confident	48 Å²	48	41.1 Å²	41.1	40%	0.397	22%	0.217	S	C	.	.	S	Bend	trans	-143.9	147.8	175.4	0	0	0	0	0	108.9	E185 L188 L192	E185-A190 WeakPolarHBondContact CA-O 3.36Å; L188-A190 WeakPolarHBondContact CB-O 3.38Å; L188-A190 PolarHBondContact O-N 3.26Å; A190-L192 PolarHBondContact O-N 3.17Å
191	P	87	Confident	87.7	Confident	33 Å²	33	41.1 Å²	41.1	21%	0.214	22%	0.217	C	C	.	.			trans	-56.5	135.8	177.8	-21.2	29.7	0	0	0	111.2	W157 F193 P194	W157-P191 HydrophobicContact CD2-CB 4.18Å; W157-P191 HydrophobicContact CD2-CG 4.31Å; W157-P191 HydrophobicContact CE3-CB 3.63Å; W157-P191 HydrophobicContact CE3-CG 3.42Å; W157-P191 VanDerWaalsContact CE3-CG 3.42Å; W157-P191 HydrophobicContact CH2-CG 4.08Å; W157-P191 HydrophobicContact CZ3-CB 4.05Å; W157-P191 HydrophobicContact CZ3-CG 3.29Å; P191-F193 PolarHBondContact O-N 2.94Å; P191-P194 HydrophobicContact CB-CB 4.14Å; P191-P194 WeakPolarHBondContact O-CD 3.38Å
192	L	92.7	Very high	87.9	Confident	12 Å²	12	42 Å²	42	6%	0.063	22%	0.222	C	C	.	.	S	Bend	trans	-64.5	-40.5	179.9	-179	64.2	0	0	0	112	A184 L188 A190 I208 W237 I240 L256	A184-L192 HydrophobicContact CB-CB 4Å; A184-L192 HydrophobicContact CB-CD1 4.25Å; A184-L192 HydrophobicContact CB-CD2 3.65Å; A184-L192 HydrophobicContact CB-CG 4.18Å; L188-L192 HydrophobicContact CD1-CB 4.41Å; L188-L192 HydrophobicContact CD1-CD1 3.77Å; A190-L192 PolarHBondContact O-N 3.17Å; L192-I208 HydrophobicContact CD1-CD1 3.68Å; L192-I208 HydrophobicContact CG-CD1 4.27Å; L192-W237 HydrophobicContact CD1-CZ3 4.37Å; L192-W237 HydrophobicContact CD2-CH2 4Å; L192-W237 HydrophobicContact CD2-CZ3 4.46Å; L192-I240 HydrophobicContact CD1-CG2 4.19Å; L192-L256 HydrophobicContact CD2-CD1 3.72Å
193	F	94.9	Very high	88.5	Confident	1 Å²	1	48.9 Å²	48.9	0%	0.004	25%	0.247	C	C	.	.			trans	-130.1	76.3	-177	-53.8	-60.6	0	0	0	111.8	W157 W177 P191 G195 Q201 R204 I205 I208 L209	W157-F193 VanDerWaalsContact CA-O 3.25Å; W157-F193 WeakPolarHBondContact CA-O 3.45Å; W157-F193 WeakPolarHBondContact CB-O 3.3Å; W177-F193 AromaticContact CZ2-CE2 3.94Å; W177-F193 HydrophobicContact CZ2-CE2 3.94Å; P191-F193 PolarHBondContact O-N 2.94Å; F193-G195 VanDerWaalsContact C-N 3.26Å; F193-G195 PolarHBondContact O-N 3.44Å; F193-Q201 PolarHBondContact O-NE2 3.27Å; F193-Q201 PolarHBondContact O-OE1 2.84Å; F193-R204 HydrophobicContact CB-CB 4.48Å; F193-R204 HydrophobicContact CD1-CB 4.33Å; F193-I205 HydrophobicContact CB-CG1 4.49Å; F193-I205 HydrophobicContact CD1-CG1 4.01Å; F193-I205 HydrophobicContact CD2-CG1 4.09Å; F193-I205 HydrophobicContact CE1-CB 4.41Å; F193-I205 HydrophobicContact CE1-CG1 4.18Å; F193-I205 HydrophobicContact CE2-CG1 4.27Å; F193-I205 HydrophobicContact CG-CG1 3.95Å; F193-I205 HydrophobicContact CZ-CG1 4.31Å; F193-I208 HydrophobicContact CD1-CD1 4.08Å; F193-I208 HydrophobicContact CE1-CB 3.9Å; F193-I208 HydrophobicContact CE1-CD1 3.69Å; F193-I208 HydrophobicContact CE1-CG1 4.07Å; F193-I208 HydrophobicContact CE1-CG2 4.29Å; F193-L209 HydrophobicContact CZ-CD1 4.23Å; F193-L209 HydrophobicContact CZ-CG 4.3Å
194	P	91.1	Very high	89.1	Confident	39 Å²	39	52 Å²	52	25%	0.253	26%	0.259	S	S	.	.			trans	-81.6	64.8	-175.6	27	-25.4	0	0	0	112.8	W157 P191 R204	W157-P194 VanDerWaalsContact CD1-CA 3.46Å; W157-P194 HydrophobicContact CD2-CB 4.31Å; W157-P194 HydrophobicContact CZ2-CB 4.23Å; P191-P194 HydrophobicContact CB-CB 4.14Å; P191-P194 WeakPolarHBondContact O-CD 3.38Å; P194-R204 PolarHBondContact O-NE 2.97Å; P194-R204 PolarHBondContact O-NH2 3.3Å
195	G	92.5	Very high	89.5	Confident	1 Å²	1	52 Å²	52	1%	0.01	26%	0.259	C	S	.	.			trans	-74.8	134.3	-176.6	0	0	0	0	0	115.4	R156 W157 F193 D200	R156-G195 PolarHBondContact NH1-O 2.96Å; W157-G195 VanDerWaalsContact CD1-N 3.32Å; W157-G195 PolarHBondContact NE1-O 3.39Å; F193-G195 VanDerWaalsContact C-N 3.26Å; F193-G195 PolarHBondContact O-N 3.44Å; G195-D200 VanDerWaalsContact CA-OD2 3.3Å; G195-D200 WeakPolarHBondContact CA-OD2 3.43Å
196	E	90.2	Very high	90.1	Very high	160 Å²	160	51.8 Å²	51.8	75%	0.748	26%	0.259	S	S	*	.	S	Bend	trans	-84	-26.6	-178.8	-63.2	-175.2	170.2	0	0	113.3	R156 D200	R156-E196 VanDerWaalsContact NH1-C 3.3Å; R156-E196 PolarHBondContact NH1-O 3.26Å; E196-D200 PolarHBondContact N-OD2 3.07Å
197	S	91.6	Very high	91	Very high	54 Å²	54	55.8 Å²	55.8	38%	0.378	28%	0.278	S	S	.	.	S	Bend	trans	-139.2	169.6	175.9	66.9	0	0	0	0	110.2	R156 L199 D200 Q201	R156-S197 WeakPolarHBondContact CD-O 3.49Å; S197-L199 VanDerWaalsContact C-N 3.25Å; S197-L199 PolarHBondContact O-N 3.11Å; S197-D200 PolarHBondContact O-N 3.29Å; S197-D200 WeakPolarHBondContact OG-CB 3.35Å; S197-D200 PolarHBondContact OG-N 3.47Å; S197-D200 VanDerWaalsContact OG-N 3.1Å; S197-Q201 WeakPolarHBondContact O-CB 3.28Å; S197-Q201 PolarHBondContact O-N 3.01Å
198	D	91.6	Very high	91.7	Very high	63 Å²	63	53.7 Å²	53.7	34%	0.337	27%	0.266	S	S	.	.	H	α-helix	trans	-62.9	-35.7	178.8	-69.5	4	0	0	0	111.3	R156 R159 L164 Q201 L202	R156-D198 WeakPolarHBondContact CD-OD1 3.18Å; R156-D198 IonicContact CZ-OD1 2.79Å; R156-D198 IonicContact NE-OD1 3.9Å; R156-D198 PolarHBondContact NE-OD1 2.98Å; R156-D198 IonicContact NH2-OD1 2.72Å; R159-D198 VanDerWaalsContact NH1-CG 3.34Å; R159-D198 IonicContact NH1-OD1 3.64Å; R159-D198 PolarHBondContact NH1-OD1 3.5Å; R159-D198 VanDerWaalsContact NH1-OD1 3.08Å; R159-D198 IonicContact NH1-OD2 3.9Å; R159-D198 PolarHBondContact NH1-OD2 3.19Å; L164-D198 HydrophobicContact CD2-CB 3.82Å; D198-Q201 PolarHBondContact O-N 3.47Å; D198-L202 PolarHBondContact O-N 3.41Å; D198-L202 VanDerWaalsContact O-N 3.07Å
199	L	92.7	Very high	92.3	Very high	121 Å²	121	51.5 Å²	51.5	63%	0.634	26%	0.255	S	S	*	.	H	α-helix	trans	-68	-42.8	173.2	-175.4	65.6	0	0	0	112.4	S197 Q201 L202 R203	S197-L199 VanDerWaalsContact C-N 3.25Å; S197-L199 PolarHBondContact O-N 3.11Å; L199-Q201 VanDerWaalsContact C-N 3.32Å; L199-L202 PolarHBondContact O-N 3.05Å; L199-R203 PolarHBondContact O-N 2.68Å
200	D	94.3	Very high	93.2	Very high	16 Å²	16	44.8 Å²	44.8	9%	0.086	23%	0.231	C	C	.	.	H	α-helix	trans	-66.3	-36.4	176.3	-175	50.8	0	0	0	111.8	G195 E196 S197 R203 R204	G195-D200 VanDerWaalsContact CA-OD2 3.3Å; G195-D200 WeakPolarHBondContact CA-OD2 3.43Å; E196-D200 PolarHBondContact N-OD2 3.07Å; S197-D200 PolarHBondContact O-N 3.29Å; S197-D200 WeakPolarHBondContact OG-CB 3.35Å; S197-D200 PolarHBondContact OG-N 3.47Å; S197-D200 VanDerWaalsContact OG-N 3.1Å; D200-R203 WeakPolarHBondContact O-CB 3.38Å; D200-R203 PolarHBondContact O-N 2.95Å; D200-R203 IonicContact OD1-CZ 2.71Å; D200-R203 VanDerWaalsContact OD1-CZ 3.28Å; D200-R203 IonicContact OD1-NE 3.85Å; D200-R203 PolarHBondContact OD1-NE 2.79Å; D200-R203 VanDerWaalsContact OD1-NE 3.11Å; D200-R203 IonicContact OD1-NH2 3.53Å; D200-R203 PolarHBondContact OD1-NH2 3.49Å; D200-R204 WeakPolarHBondContact O-CG 3.46Å; D200-R204 PolarHBondContact O-N 2.9Å; D200-R204 IonicContact OD1-NE 2.69Å; D200-R204 IonicContact OD2-CZ 2.68Å; D200-R204 IonicContact OD2-NE 3.6Å; D200-R204 PolarHBondContact OD2-NE 2.91Å; D200-R204 IonicContact OD2-NH2 3.85Å
201	Q	95	Very high	93.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.3	-49.4	174.2	-173.3	69.5	26.6	0	0	110.8	R156 W157 L164 F193 S197 D198 L199 R203 R204 I205	R156-Q201 HydrophobicContact CG-CB 3.97Å; R156-Q201 HydrophobicContact CG-CG 3.95Å; R156-Q201 PolarHBondContact O-NE2 3.33Å; W157-Q201 PolarHBondContact O-NE2 3.49Å; W157-Q201 VanDerWaalsContact O-NE2 3.11Å; L164-Q201 HydrophobicContact CD1-CB 4.04Å; L164-Q201 HydrophobicContact CD1-CG 3.48Å; L164-Q201 VanDerWaalsContact CD1-CG 3.48Å; L164-Q201 HydrophobicContact CD2-CB 4.19Å; L164-Q201 HydrophobicContact CD2-CG 4.16Å; L164-Q201 HydrophobicContact CG-CG 4.47Å; F193-Q201 PolarHBondContact O-NE2 3.27Å; F193-Q201 PolarHBondContact O-OE1 2.84Å; S197-Q201 WeakPolarHBondContact O-CB 3.28Å; S197-Q201 PolarHBondContact O-N 3.01Å; D198-Q201 PolarHBondContact O-N 3.47Å; L199-Q201 VanDerWaalsContact C-N 3.32Å; Q201-R203 VanDerWaalsContact C-N 3.32Å; Q201-R203 PolarHBondContact O-N 3.4Å; Q201-R204 PolarHBondContact O-N 2.91Å; Q201-I205 HydrophobicContact CG-CD1 4.19Å; Q201-I205 VanDerWaalsContact O-CG1 3.28Å; Q201-I205 WeakPolarHBondContact O-CG1 3.35Å; Q201-I205 PolarHBondContact O-N 3.3Å
202	L	95.1	Very high	94.3	Very high	21 Å²	21	42.3 Å²	42.3	11%	0.11	21%	0.21	C	C	.	.	H	α-helix	trans	-58.5	-43.8	175.1	-77.5	172.6	0	0	0	111.9	L164 Y165 D198 L199 R204 I205 V206	L164-L202 HydrophobicContact CB-CD1 4.05Å; L164-L202 HydrophobicContact CB-CD2 3.57Å; L164-L202 HydrophobicContact CB-CG 3.7Å; L164-L202 HydrophobicContact CD1-CD2 3.8Å; L164-L202 HydrophobicContact CD1-CG 3.96Å; L164-L202 HydrophobicContact CG-CD2 4.32Å; L164-L202 HydrophobicContact CG-CG 4.35Å; Y165-L202 HydrophobicContact CD1-CD1 3.92Å; Y165-L202 HydrophobicContact CD1-CD2 4.29Å; Y165-L202 HydrophobicContact CD2-CD2 4.22Å; Y165-L202 HydrophobicContact CE1-CD1 3.64Å; Y165-L202 HydrophobicContact CE1-CD2 3.86Å; Y165-L202 HydrophobicContact CE1-CG 4.37Å; Y165-L202 HydrophobicContact CE2-CD2 3.76Å; Y165-L202 HydrophobicContact CG-CD2 4.47Å; D198-L202 PolarHBondContact O-N 3.41Å; D198-L202 VanDerWaalsContact O-N 3.07Å; L199-L202 PolarHBondContact O-N 3.05Å; L202-R204 PolarHBondContact O-N 3.11Å; L202-I205 PolarHBondContact O-N 3.03Å; L202-V206 WeakPolarHBondContact O-CG2 3.35Å; L202-V206 PolarHBondContact O-N 3.04Å
203	R	94.8	Very high	94.3	Very high	143 Å²	143	43.8 Å²	43.8	54%	0.54	22%	0.221	S	C	.	.	H	α-helix	trans	-56.8	-49.6	176.6	-178.6	-179.7	67.5	148.2	1.4	111.5	L199 D200 Q201 I205 V206 E207	L199-R203 PolarHBondContact O-N 2.68Å; D200-R203 WeakPolarHBondContact O-CB 3.38Å; D200-R203 PolarHBondContact O-N 2.95Å; D200-R203 IonicContact OD1-CZ 2.71Å; D200-R203 VanDerWaalsContact OD1-CZ 3.28Å; D200-R203 IonicContact OD1-NE 3.85Å; D200-R203 PolarHBondContact OD1-NE 2.79Å; D200-R203 VanDerWaalsContact OD1-NE 3.11Å; D200-R203 IonicContact OD1-NH2 3.53Å; D200-R203 PolarHBondContact OD1-NH2 3.49Å; Q201-R203 VanDerWaalsContact C-N 3.32Å; Q201-R203 PolarHBondContact O-N 3.4Å; R203-I205 VanDerWaalsContact C-N 3.31Å; R203-I205 PolarHBondContact O-N 3.4Å; R203-V206 PolarHBondContact O-N 3.29Å; R203-E207 HydrophobicContact CG-CG 4.43Å; R203-E207 IonicContact NE-OE1 2.85Å; R203-E207 WeakPolarHBondContact O-CG 3.4Å; R203-E207 PolarHBondContact O-N 3.24Å
204	R	95.5	Very high	94.2	Very high	66 Å²	66	48 Å²	48	25%	0.249	24%	0.241	C	C	.	.	H	α-helix	trans	-63.2	-36.4	179.3	-71.2	175.5	179.5	-96.6	13.2	112.7	F193 P194 D200 Q201 L202	F193-R204 HydrophobicContact CB-CB 4.48Å; F193-R204 HydrophobicContact CD1-CB 4.33Å; P194-R204 PolarHBondContact O-NE 2.97Å; P194-R204 PolarHBondContact O-NH2 3.3Å; D200-R204 WeakPolarHBondContact O-CG 3.46Å; D200-R204 PolarHBondContact O-N 2.9Å; D200-R204 IonicContact OD1-NE 2.69Å; D200-R204 IonicContact OD2-CZ 2.68Å; D200-R204 IonicContact OD2-NE 3.6Å; D200-R204 PolarHBondContact OD2-NE 2.91Å; D200-R204 IonicContact OD2-NH2 3.85Å; Q201-R204 PolarHBondContact O-N 2.91Å; L202-R204 PolarHBondContact O-N 3.11Å
205	I	96.8	Very high	94.4	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-62.2	-48.8	173.5	-67.6	167.9	0	0	0	110	L164 W177 F193 Q201 L202 R203 E207 I208 L209 Y258	L164-I205 HydrophobicContact CD1-CD1 3.67Å; W177-I205 HydrophobicContact CH2-CG2 3.78Å; W177-I205 HydrophobicContact CZ2-CD1 3.8Å; W177-I205 HydrophobicContact CZ2-CG1 4.01Å; W177-I205 HydrophobicContact CZ2-CG2 3.98Å; F193-I205 HydrophobicContact CB-CG1 4.49Å; F193-I205 HydrophobicContact CD1-CG1 4.01Å; F193-I205 HydrophobicContact CD2-CG1 4.09Å; F193-I205 HydrophobicContact CE1-CB 4.41Å; F193-I205 HydrophobicContact CE1-CG1 4.18Å; F193-I205 HydrophobicContact CE2-CG1 4.27Å; F193-I205 HydrophobicContact CG-CG1 3.95Å; F193-I205 HydrophobicContact CZ-CG1 4.31Å; Q201-I205 HydrophobicContact CG-CD1 4.19Å; Q201-I205 VanDerWaalsContact O-CG1 3.28Å; Q201-I205 WeakPolarHBondContact O-CG1 3.35Å; Q201-I205 PolarHBondContact O-N 3.3Å; L202-I205 PolarHBondContact O-N 3.03Å; R203-I205 VanDerWaalsContact C-N 3.31Å; R203-I205 PolarHBondContact O-N 3.4Å; I205-E207 PolarHBondContact O-N 3.43Å; I205-I208 PolarHBondContact O-N 3.29Å; I205-L209 HydrophobicContact CG2-CD1 3.98Å; I205-L209 WeakPolarHBondContact O-CB 3.47Å; I205-L209 PolarHBondContact O-N 3.45Å; I205-Y258 HydrophobicContact CG2-CE1 3.83Å
206	V	95.8	Very high	94.4	Very high	14 Å²	14	57.6 Å²	57.6	9%	0.085	28%	0.284	C	S	.	.	H	α-helix	trans	-65.6	-34.8	-179.6	169.9	0	0	0	0	112.6	L202 R203 I208 G210 C232	L202-V206 WeakPolarHBondContact O-CG2 3.35Å; L202-V206 PolarHBondContact O-N 3.04Å; R203-V206 PolarHBondContact O-N 3.29Å; V206-I208 PolarHBondContact O-N 3.21Å; V206-G210 CarbonylContact O-C 3.5Å; V206-G210 WeakPolarHBondContact O-CA 3.35Å; V206-G210 PolarHBondContact O-N 3.25Å; V206-C232 HydrophobicContact CG1-CB 4.14Å
207	E	95	Very high	94.7	Very high	102 Å²	102	50.6 Å²	50.6	48%	0.477	25%	0.251	S	S	.	.	H	α-helix	trans	-60.4	-29.8	176.4	-78.9	170.7	178.2	0	0	112.9	R203 I205 V235	R203-E207 HydrophobicContact CG-CG 4.43Å; R203-E207 IonicContact NE-OE1 2.85Å; R203-E207 WeakPolarHBondContact O-CG 3.4Å; R203-E207 PolarHBondContact O-N 3.24Å; I205-E207 PolarHBondContact O-N 3.43Å; E207-V235 VanDerWaalsContact O-CG2 3.3Å; E207-V235 WeakPolarHBondContact O-CG2 3.46Å
208	I	96.1	Very high	94.8	Very high	28 Å²	28	52 Å²	52	14%	0.144	26%	0.258	C	S	.	.	H	α-helix	trans	-99.5	-51.1	-179.1	-63.5	-169	0	0	0	111.1	L192 F193 I205 V206 V235 I240	L192-I208 HydrophobicContact CD1-CD1 3.68Å; L192-I208 HydrophobicContact CG-CD1 4.27Å; F193-I208 HydrophobicContact CD1-CD1 4.08Å; F193-I208 HydrophobicContact CE1-CB 3.9Å; F193-I208 HydrophobicContact CE1-CD1 3.69Å; F193-I208 HydrophobicContact CE1-CG1 4.07Å; F193-I208 HydrophobicContact CE1-CG2 4.29Å; I205-I208 PolarHBondContact O-N 3.29Å; V206-I208 PolarHBondContact O-N 3.21Å; I208-V235 PolarHBondContact O-N 3.05Å; I208-I240 HydrophobicContact CG2-CD1 3.54Å; I208-I240 HydrophobicContact CG2-CG1 4.45Å
209	L	96.8	Very high	94.9	Very high	15 Å²	15	50.1 Å²	50.1	8%	0.079	25%	0.254	C	S	.	.	H	α-helix	trans	-90.4	-4.7	-171.8	-59.2	-177.5	0	0	0	113.6	W177 F193 I205 K234 W237 L256 Y258	W177-L209 HydrophobicContact CH2-CD1 3.51Å; W177-L209 HydrophobicContact CZ2-CD1 4.39Å; W177-L209 HydrophobicContact CZ3-CD1 4.09Å; F193-L209 HydrophobicContact CZ-CD1 4.23Å; F193-L209 HydrophobicContact CZ-CG 4.3Å; I205-L209 HydrophobicContact CG2-CD1 3.98Å; I205-L209 WeakPolarHBondContact O-CB 3.47Å; I205-L209 PolarHBondContact O-N 3.45Å; L209-K234 WeakPolarHBondContact O-CB 3.32Å; L209-W237 HydrophobicContact CD2-CZ2 3.85Å; L209-L256 HydrophobicContact CD1-CB 4.24Å; L209-Y258 HydrophobicContact CB-CE2 3.93Å
210	G	96.1	Very high	95	Very high	3 Å²	3	44.3 Å²	44.3	3%	0.031	22%	0.224	C	C	.	.			trans	77.1	174.3	-172.6	0	0	0	0	0	112.4	V206 C232 Y258	V206-G210 CarbonylContact O-C 3.5Å; V206-G210 WeakPolarHBondContact O-CA 3.35Å; V206-G210 PolarHBondContact O-N 3.25Å; G210-C232 CarbonylContact C-O 3.47Å; G210-C232 WeakPolarHBondContact CA-O 3.24Å; G210-Y258 WeakPolarHBondContact O-CE2 3.22Å; G210-Y258 PolarHBondContact O-OH 3.3Å
211	T	95.6	Very high	94.9	Very high	24 Å²	24	47.2 Å²	47.2	15%	0.147	24%	0.242	C	C	.	.			trans	-72.5	133.3	-179	-53.2	0	0	0	0	110.9	K230 P231 C232	T211-K230 PolarHBondContact OG1-O 2.92Å; T211-P231 WeakPolarHBondContact OG1-CA 3.5Å; T211-C232 PolarHBondContact N-O 3.06Å; T211-C232 PolarHBondContact OG1-N 3.17Å
212	P	95.6	Very high	94.8	Very high	4 Å²	4	54.2 Å²	54.2	3%	0.026	28%	0.279	C	S	.	.			trans	-63.3	141.7	172.9	27.7	-34.8	0	0	0	110.4	Y165 W217 V220 Y226 Y258	Y165-P212 HydrophobicContact CE2-CG 4.22Å; P212-W217 HydrophobicContact CB-CE3 4.18Å; P212-V220 HydrophobicContact CB-CG2 4.17Å; P212-V220 HydrophobicContact CG-CG2 4.39Å; P212-Y226 HydrophobicContact CG-CE2 4.27Å; P212-Y258 HydrophobicContact CB-CD1 3.94Å; P212-Y258 HydrophobicContact CB-CD2 4.08Å; P212-Y258 HydrophobicContact CB-CE1 4.04Å; P212-Y258 HydrophobicContact CB-CE2 4.16Å; P212-Y258 HydrophobicContact CB-CG 3.98Å; P212-Y258 HydrophobicContact CG-CE1 4.25Å
213	S	93.7	Very high	94.7	Very high	43 Å²	43	54.6 Å²	54.6	30%	0.301	28%	0.281	S	S	.	.			trans	-132.4	162	-177.6	69.5	0	0	0	0	110.3	E215 N216 W217	S213-E215 PolarHBondContact O-N 2.71Å; S213-E215 VanDerWaalsContact O-N 3.09Å; S213-E215 PolarHBondContact OG-N 3.45Å; S213-N216 PolarHBondContact N-OD1 2.87Å; S213-N216 PolarHBondContact O-N 3.16Å; S213-N216 PolarHBondContact O-OD1 2.97Å; S213-N216 PolarHBondContact OG-N 2.71Å; S213-W217 CarbonylContact O-C 3.53Å; S213-W217 WeakPolarHBondContact O-CA 3.22Å; S213-W217 PolarHBondContact O-N 3Å
214	E	93.5	Very high	94.6	Very high	89 Å²	89	51.8 Å²	51.8	42%	0.416	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-18.7	173.2	-71.8	-62.7	134.2	0	0	113.2	P218 G219 V220 V221	E214-P218 WeakPolarHBondContact O-CA 3.46Å; E214-P218 WeakPolarHBondContact O-CG 3.35Å; E214-G219 PolarHBondContact OE1-N 3.44Å; E214-G219 PolarHBondContact OE2-N 3.05Å; E214-V220 PolarHBondContact OE1-N 3.29Å; E214-V221 HydrophobicContact CG-CG1 4.46Å; E214-V221 WeakPolarHBondContact OE1-CG1 3.35Å; E214-V221 VanDerWaalsContact OE1-CG2 3.27Å; E214-V221 WeakPolarHBondContact OE1-CG2 3.28Å; E214-V221 PolarHBondContact OE1-N 3.33Å
215	E	94.1	Very high	94.5	Very high	181 Å²	181	53.5 Å²	53.5	85%	0.846	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-47.4	174.6	-176.5	-176.6	-179.7	0	0	112	S213	S213-E215 PolarHBondContact O-N 2.71Å; S213-E215 VanDerWaalsContact O-N 3.09Å; S213-E215 PolarHBondContact OG-N 3.45Å
216	N	93.8	Very high	94.4	Very high	61 Å²	61	55.3 Å²	55.3	33%	0.326	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-17.3	-178	68.2	28.3	0	0	0	113.4	S213 N259	S213-N216 PolarHBondContact N-OD1 2.87Å; S213-N216 PolarHBondContact O-N 3.16Å; S213-N216 PolarHBondContact O-OD1 2.97Å; S213-N216 PolarHBondContact OG-N 2.71Å; N216-N259 WeakPolarHBondContact O-CB 3.28Å
217	W	95.2	Very high	94.1	Very high	13 Å²	13	60 Å²	60	5%	0.049	33%	0.326	C	S	.	.	S	Bend	trans	-151.4	84.7	177.1	-169.4	-1.9	0	0	0	111	P161 E162 Y165 P212 S213 G219 V220 L223 Y258 N259	P161-W217 HydrophobicContact CB-CH2 4.23Å; P161-W217 HydrophobicContact CB-CZ3 3.94Å; P161-W217 HydrophobicContact CG-CH2 4.34Å; P161-W217 HydrophobicContact CG-CZ3 4.1Å; E162-W217 HydrophobicContact CB-CH2 3.79Å; E162-W217 HydrophobicContact CB-CZ2 3.69Å; Y165-W217 AromaticContact CD2-CH2 3.84Å; Y165-W217 HydrophobicContact CD2-CH2 3.84Å; Y165-W217 AromaticContact CD2-CZ3 3.7Å; Y165-W217 HydrophobicContact CD2-CZ3 3.7Å; Y165-W217 HydrophobicContact CE2-CH2 4.46Å; Y165-W217 AromaticContact CE2-CZ3 3.87Å; Y165-W217 HydrophobicContact CE2-CZ3 3.87Å; P212-W217 HydrophobicContact CB-CE3 4.18Å; S213-W217 CarbonylContact O-C 3.53Å; S213-W217 WeakPolarHBondContact O-CA 3.22Å; S213-W217 PolarHBondContact O-N 3Å; W217-G219 PolarHBondContact O-N 3.18Å; W217-V220 HydrophobicContact CB-CB 4.05Å; W217-V220 HydrophobicContact CB-CG1 4.49Å; W217-V220 HydrophobicContact CD2-CB 3.77Å; W217-V220 HydrophobicContact CD2-CG2 3.7Å; W217-V220 HydrophobicContact CE3-CB 3.92Å; W217-V220 HydrophobicContact CE3-CG2 3.34Å; W217-V220 HydrophobicContact CG-CB 3.81Å; W217-V220 HydrophobicContact CG-CG2 4.27Å; W217-V220 HydrophobicContact CH2-CG2 4.3Å; W217-V220 HydrophobicContact CZ3-CG2 3.69Å; W217-V220 WeakPolarHBondContact O-CB 3.31Å; W217-V220 WeakPolarHBondContact O-CG1 3.39Å; W217-V220 PolarHBondContact O-N 2.94Å; W217-V220 VanDerWaalsContact O-N 3.13Å; W217-L223 HydrophobicContact CH2-CD1 3.56Å; W217-L223 HydrophobicContact CZ2-CD1 3.42Å; W217-L223 VanDerWaalsContact CZ2-CD1 3.42Å; W217-L223 HydrophobicContact CZ3-CD1 4.38Å; W217-Y258 AromaticContact CE3-CD1 3.95Å; W217-Y258 HydrophobicContact CE3-CD1 3.95Å; W217-Y258 HydrophobicContact CE3-CG 4.17Å; W217-Y258 HydrophobicContact CZ3-CD1 4.05Å; W217-N259 HydrophobicContact CB-CB 4.34Å; W217-N259 HydrophobicContact CG-CB 4.2Å
218	P	94.7	Very high	93.7	Very high	83 Å²	83	60.4 Å²	60.4	54%	0.539	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	127.9	175.8	-24.9	33.9	0	0	0	111.7	E214	E214-P218 WeakPolarHBondContact O-CA 3.46Å; E214-P218 WeakPolarHBondContact O-CG 3.35Å
219	G	93.5	Very high	93.2	Very high	24 Å²	24	62.7 Å²	62.7	25%	0.247	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.7	8.4	-179.3	0	0	0	0	0	115.2	E214 W217 V221 L222	E214-G219 PolarHBondContact OE1-N 3.44Å; E214-G219 PolarHBondContact OE2-N 3.05Å; W217-G219 PolarHBondContact O-N 3.18Å; G219-V221 PolarHBondContact O-N 3.06Å; G219-L222 WeakPolarHBondContact O-CB 3.29Å; G219-L222 PolarHBondContact O-N 3.46Å
220	V	93.8	Very high	92.9	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-58.8	-36.1	178.3	67	0	0	0	0	112	Y165 P212 E214 W217 L222 L223 Y226	Y165-V220 HydrophobicContact CD2-CG2 4.43Å; Y165-V220 HydrophobicContact CE2-CG2 4.39Å; P212-V220 HydrophobicContact CB-CG2 4.17Å; P212-V220 HydrophobicContact CG-CG2 4.39Å; E214-V220 PolarHBondContact OE1-N 3.29Å; W217-V220 HydrophobicContact CB-CB 4.05Å; W217-V220 HydrophobicContact CB-CG1 4.49Å; W217-V220 HydrophobicContact CD2-CB 3.77Å; W217-V220 HydrophobicContact CD2-CG2 3.7Å; W217-V220 HydrophobicContact CE3-CB 3.92Å; W217-V220 HydrophobicContact CE3-CG2 3.34Å; W217-V220 HydrophobicContact CG-CB 3.81Å; W217-V220 HydrophobicContact CG-CG2 4.27Å; W217-V220 HydrophobicContact CH2-CG2 4.3Å; W217-V220 HydrophobicContact CZ3-CG2 3.69Å; W217-V220 WeakPolarHBondContact O-CB 3.31Å; W217-V220 WeakPolarHBondContact O-CG1 3.39Å; W217-V220 PolarHBondContact O-N 2.94Å; W217-V220 VanDerWaalsContact O-N 3.13Å; V220-L222 PolarHBondContact O-N 2.87Å; V220-L222 VanDerWaalsContact O-N 3.16Å; V220-L223 HydrophobicContact CG2-CD1 4.18Å; V220-L223 WeakPolarHBondContact O-CB 3.32Å; V220-L223 PolarHBondContact O-N 3.38Å; V220-Y226 HydrophobicContact CG1-CE2 4.21Å; V220-Y226 HydrophobicContact CG2-CD2 3.75Å; V220-Y226 HydrophobicContact CG2-CE2 3.74Å
221	V	93.3	Very high	92.7	Very high	77 Å²	77	75.5 Å²	75.5	47%	0.467	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-68.6	-13	179.4	-55.8	0	0	0	0	113.5	E214 G219 Y226	E214-V221 HydrophobicContact CG-CG1 4.46Å; E214-V221 WeakPolarHBondContact OE1-CG1 3.35Å; E214-V221 VanDerWaalsContact OE1-CG2 3.27Å; E214-V221 WeakPolarHBondContact OE1-CG2 3.28Å; E214-V221 PolarHBondContact OE1-N 3.33Å; G219-V221 PolarHBondContact O-N 3.06Å; V221-Y226 HydrophobicContact CB-CD1 4.21Å; V221-Y226 HydrophobicContact CB-CE1 4.15Å; V221-Y226 HydrophobicContact CG1-CD1 4.3Å; V221-Y226 HydrophobicContact CG1-CE1 3.75Å
222	L	93.2	Very high	92.6	Very high	147 Å²	147	77.1 Å²	77.1	77%	0.77	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-90.7	-5	179.4	-55.6	175.6	0	0	0	112.5	G219 V220	G219-L222 WeakPolarHBondContact O-CB 3.29Å; G219-L222 PolarHBondContact O-N 3.46Å; V220-L222 PolarHBondContact O-N 2.87Å; V220-L222 VanDerWaalsContact O-N 3.16Å
223	L	92.9	Very high	92.6	Very high	29 Å²	29	82.4 Å²	82.4	15%	0.152	46%	0.464	C	S	.	.	S	Bend	trans	-71.5	142.9	-179.9	-67.1	174.2	0	0	0	111.2	Y165 W217 V220 D225 Y226	Y165-L223 HydrophobicContact CD2-CD1 4.21Å; Y165-L223 HydrophobicContact CG-CD1 4.26Å; Y165-L223 WeakPolarHBondContact O-CB 3.46Å; W217-L223 HydrophobicContact CH2-CD1 3.56Å; W217-L223 HydrophobicContact CZ2-CD1 3.42Å; W217-L223 VanDerWaalsContact CZ2-CD1 3.42Å; W217-L223 HydrophobicContact CZ3-CD1 4.38Å; V220-L223 HydrophobicContact CG2-CD1 4.18Å; V220-L223 WeakPolarHBondContact O-CB 3.32Å; V220-L223 PolarHBondContact O-N 3.38Å; L223-D225 VanDerWaalsContact C-N 3.29Å; L223-D225 PolarHBondContact O-N 3.27Å; L223-D225 VanDerWaalsContact O-N 3.16Å; L223-Y226 WeakPolarHBondContact O-CB 3.41Å; L223-Y226 PolarHBondContact O-N 2.75Å; L223-Y226 VanDerWaalsContact O-N 3.13Å
224	P	92.9	Very high	92.7	Very high	84 Å²	84	84.8 Å²	84.8	55%	0.545	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-38.9	-169.1	-30.9	38.5	0	0	0	115.6	Y165 G166	Y165-P224 WeakPolarHBondContact O-CD 3.44Å; G166-P224 WeakPolarHBondContact O-CG 3.32Å
225	D	93.2	Very high	92.8	Very high	101 Å²	101	82.6 Å²	82.6	54%	0.54	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	19	-175.1	-56.1	-41.7	0	0	0	112.1	Y165 G166 L223 L227	Y165-D225 PolarHBondContact O-N 2.73Å; G166-D225 WeakPolarHBondContact CA-OD2 3.2Å; L223-D225 VanDerWaalsContact C-N 3.29Å; L223-D225 PolarHBondContact O-N 3.27Å; L223-D225 VanDerWaalsContact O-N 3.16Å; D225-L227 PolarHBondContact O-N 2.84Å
226	Y	93.5	Very high	92.9	Very high	40 Å²	40	77.2 Å²	77.2	16%	0.157	44%	0.443	C	S	.	.			trans	-68.1	125.5	176.8	-177.3	-95.2	0	0	0	111.5	Y165 P212 V220 V221 L223 P228	Y165-Y226 HydrophobicContact CD1-CD2 4.05Å; Y165-Y226 AromaticContact CE1-CD2 3.81Å; Y165-Y226 HydrophobicContact CE1-CD2 3.81Å; Y165-Y226 HydrophobicContact CE1-CE2 4.44Å; Y165-Y226 HydrophobicContact CE2-CD2 4.44Å; Y165-Y226 HydrophobicContact CG-CD2 4.46Å; P212-Y226 HydrophobicContact CG-CE2 4.27Å; V220-Y226 HydrophobicContact CG1-CE2 4.21Å; V220-Y226 HydrophobicContact CG2-CD2 3.75Å; V220-Y226 HydrophobicContact CG2-CE2 3.74Å; V221-Y226 HydrophobicContact CB-CD1 4.21Å; V221-Y226 HydrophobicContact CB-CE1 4.15Å; V221-Y226 HydrophobicContact CG1-CD1 4.3Å; V221-Y226 HydrophobicContact CG1-CE1 3.75Å; L223-Y226 WeakPolarHBondContact O-CB 3.41Å; L223-Y226 PolarHBondContact O-N 2.75Å; L223-Y226 VanDerWaalsContact O-N 3.13Å; Y226-P228 HydrophobicContact CD1-CG 4.47Å; Y226-P228 HydrophobicContact CE1-CB 4.48Å; Y226-P228 HydrophobicContact CE1-CG 4.05Å
227	L	89.8	Confident	93	Very high	112 Å²	112	74.7 Å²	74.7	59%	0.586	43%	0.428	S	S	*	.			trans	-118.8	120.3	175.3	-65.1	176.5	0	0	0	109.4	D225 T229	D225-L227 PolarHBondContact O-N 2.84Å; L227-T229 PolarHBondContact O-N 3.2Å
228	P	86	Confident	92.9	Very high	111 Å²	111	80.3 Å²	80.3	72%	0.721	45%	0.45	S	S	*	.			trans	-59.4	126.4	175.2	-23.1	32.4	0	0	0	111.5	Y226	Y226-P228 HydrophobicContact CD1-CG 4.47Å; Y226-P228 HydrophobicContact CE1-CB 4.48Å; Y226-P228 HydrophobicContact CE1-CG 4.05Å
229	T	86.9	Confident	92.9	Very high	76 Å²	76	83 Å²	83	47%	0.466	46%	0.455	S	S	.	.			trans	-115.5	162.4	175	61.2	0	0	0	0	111.1	L227	L227-T229 PolarHBondContact O-N 3.2Å
230	K	89.5	Confident	92.9	Very high	176 Å²	176	83.4 Å²	83.4	77%	0.765	45%	0.451	S	S	*	.			trans	-55.8	132.1	170.8	-175.6	179.1	177.1	-177.1	0	109.5	T211 C232	T211-K230 PolarHBondContact OG1-O 2.92Å; K230-C232 PolarHBondContact O-N 2.94Å
231	P	92.5	Very high	92.7	Very high	111 Å²	111	83.9 Å²	83.9	72%	0.721	45%	0.454	S	S	*	.			trans	-58.5	127.7	176.8	-26.5	35	0	0	0	112.2	T211	T211-P231 WeakPolarHBondContact OG1-CA 3.5Å
232	C	93.7	Very high	92.5	Very high	58 Å²	58	84.9 Å²	84.9	39%	0.392	46%	0.462	S	S	.	.			trans	-119.9	134.2	174.2	-68.1	0	0	0	0	109.4	V206 G210 T211 K230	V206-C232 HydrophobicContact CG1-CB 4.14Å; G210-C232 CarbonylContact C-O 3.47Å; G210-C232 WeakPolarHBondContact CA-O 3.24Å; T211-C232 PolarHBondContact N-O 3.06Å; T211-C232 PolarHBondContact OG1-N 3.17Å; K230-C232 PolarHBondContact O-N 2.94Å
233	P	95.3	Very high	92	Very high	115 Å²	115	84 Å²	84	75%	0.747	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-72.1	152.7	175.8	31.2	-34.6	0	0	0	111.2
234	K	95.9	Very high	91.7	Very high	93 Å²	93	83 Å²	83	40%	0.404	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-64.8	135.3	170.4	177.2	175.1	170	-170.1	0	110.4	L209 E253	L209-K234 WeakPolarHBondContact O-CB 3.32Å; K234-E253 IonicContact NZ-OE1 2.67Å; K234-E253 PolarHBondContact NZ-OE1 3.2Å
235	V	96.2	Very high	91.4	Very high	42 Å²	42	82.2 Å²	82.2	26%	0.255	46%	0.455	S	S	.	.	P	Polyproline II helix	trans	-78.4	130.1	171.5	178.7	0	0	0	0	108.8	E207 I208 W237 Q239 I240	E207-V235 VanDerWaalsContact O-CG2 3.3Å; E207-V235 WeakPolarHBondContact O-CG2 3.46Å; I208-V235 PolarHBondContact O-N 3.05Å; V235-W237 PolarHBondContact O-N 3.16Å; V235-Q239 HydrophobicContact CG1-CB 4.1Å; V235-I240 HydrophobicContact CB-CD1 4.05Å; V235-I240 HydrophobicContact CG1-CD1 3.87Å; V235-I240 HydrophobicContact CG1-CG1 3.89Å
236	P	95.7	Very high	91.1	Very high	69 Å²	69	82 Å²	82	45%	0.448	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-60	132.3	176.5	-24.2	33.9	0	0	0	111.9	R238 Q239	P236-R238 PolarHBondContact O-N 3.27Å; P236-R238 VanDerWaalsContact O-N 3.09Å; P236-Q239 HydrophobicContact CB-CG 4.36Å; P236-Q239 WeakPolarHBondContact O-CB 3.41Å; P236-Q239 PolarHBondContact O-N 3.02Å
237	W	94.7	Very high	90.7	Very high	7 Å²	7	82.4 Å²	82.4	3%	0.027	46%	0.457	C	S	.	.	H	α-helix	trans	-54.6	-34	-177.8	-81.4	111.5	0	0	0	114.3	L192 L209 V235 Q239 I240 L241 I249 L252 L256	L192-W237 HydrophobicContact CD1-CZ3 4.37Å; L192-W237 HydrophobicContact CD2-CH2 4Å; L192-W237 HydrophobicContact CD2-CZ3 4.46Å; L209-W237 HydrophobicContact CD2-CZ2 3.85Å; V235-W237 PolarHBondContact O-N 3.16Å; W237-Q239 PolarHBondContact O-N 3.44Å; W237-Q239 VanDerWaalsContact O-N 3.16Å; W237-I240 HydrophobicContact CD2-CD1 4.38Å; W237-I240 HydrophobicContact CE3-CB 4.28Å; W237-I240 HydrophobicContact CE3-CD1 3.96Å; W237-I240 HydrophobicContact CE3-CG2 4.4Å; W237-I240 HydrophobicContact CZ3-CD1 4.34Å; W237-I240 HydrophobicContact CZ3-CG2 4.3Å; W237-I240 PolarHBondContact O-N 2.88Å; W237-L241 HydrophobicContact CE3-CD1 3.93Å; W237-L241 HydrophobicContact CZ3-CD1 4.05Å; W237-L241 PolarHBondContact O-N 3.27Å; W237-I249 HydrophobicContact CB-CB 4.42Å; W237-I249 HydrophobicContact CB-CD1 4.17Å; W237-I249 HydrophobicContact CB-CG1 4.02Å; W237-I249 HydrophobicContact CB-CG2 3.62Å; W237-I249 HydrophobicContact CG-CG2 3.94Å; W237-L252 HydrophobicContact CE3-CD1 4.38Å; W237-L252 HydrophobicContact CH2-CB 4.42Å; W237-L252 HydrophobicContact CZ2-CB 4.23Å; W237-L252 HydrophobicContact CZ3-CD1 4.29Å; W237-L256 HydrophobicContact CH2-CD1 3.45Å; W237-L256 VanDerWaalsContact CH2-CD1 3.45Å; W237-L256 HydrophobicContact CZ2-CD1 3.66Å
238	R	93.5	Very high	90.5	Very high	132 Å²	132	77.3 Å²	77.3	50%	0.498	43%	0.431	S	S	.	.	H	α-helix	trans	-62.2	-20.5	176.3	-65.5	-172.9	177.2	-83.3	14.3	114.1	P236 P242 D246 I249	P236-R238 PolarHBondContact O-N 3.27Å; P236-R238 VanDerWaalsContact O-N 3.09Å; R238-P242 VanDerWaalsContact O-CA 3.31Å; R238-P242 WeakPolarHBondContact O-CA 3.47Å; R238-D246 IonicContact CZ-OD1 3.4Å; R238-D246 IonicContact NE-OD1 3.87Å; R238-D246 IonicContact NH2-OD1 2.6Å; R238-D246 PolarHBondContact NH2-OD1 3.36Å; R238-D246 IonicContact NH2-OD2 2.87Å; R238-D246 PolarHBondContact NH2-OD2 3.05Å; R238-I249 HydrophobicContact CG-CD1 3.7Å
239	Q	94.6	Very high	90.8	Very high	140 Å²	140	72.7 Å²	72.7	65%	0.654	40%	0.4	S	S	*	.	H	α-helix	trans	-81.3	-30.3	173.5	-61.5	-177.9	11.8	0	0	112	V235 P236 W237	V235-Q239 HydrophobicContact CG1-CB 4.1Å; P236-Q239 HydrophobicContact CB-CG 4.36Å; P236-Q239 WeakPolarHBondContact O-CB 3.41Å; P236-Q239 PolarHBondContact O-N 3.02Å; W237-Q239 PolarHBondContact O-N 3.44Å; W237-Q239 VanDerWaalsContact O-N 3.16Å
240	I	93.5	Very high	91	Very high	32 Å²	32	70.7 Å²	70.7	16%	0.164	39%	0.394	C	S	.	.	H	α-helix	trans	-85.3	-41.9	179.8	-58	144.9	0	0	0	110.3	L188 L192 I208 V235 W237	L188-I240 HydrophobicContact CD1-CG2 4.48Å; L188-I240 HydrophobicContact CD2-CG2 4.43Å; L188-I240 WeakPolarHBondContact CD2-O 3.26Å; L192-I240 HydrophobicContact CD1-CG2 4.19Å; I208-I240 HydrophobicContact CG2-CD1 3.54Å; I208-I240 HydrophobicContact CG2-CG1 4.45Å; V235-I240 HydrophobicContact CB-CD1 4.05Å; V235-I240 HydrophobicContact CG1-CD1 3.87Å; V235-I240 HydrophobicContact CG1-CG1 3.89Å; W237-I240 HydrophobicContact CD2-CD1 4.38Å; W237-I240 HydrophobicContact CE3-CB 4.28Å; W237-I240 HydrophobicContact CE3-CD1 3.96Å; W237-I240 HydrophobicContact CE3-CG2 4.4Å; W237-I240 HydrophobicContact CZ3-CD1 4.34Å; W237-I240 HydrophobicContact CZ3-CG2 4.3Å; W237-I240 PolarHBondContact O-N 2.88Å
241	L	91	Very high	91	Very high	9 Å²	9	62.4 Å²	62.4	5%	0.047	36%	0.358	C	S	.	.			trans	-127.5	76.2	-176.8	-70.8	172.1	0	0	0	110.3	L187 L188 W237 S243 A244 L252	L187-L241 HydrophobicContact CB-CD2 3.55Å; L187-L241 HydrophobicContact CD1-CD1 3.95Å; L187-L241 HydrophobicContact CD1-CD2 4.34Å; L188-L241 HydrophobicContact CD2-CD2 3.66Å; L188-L241 HydrophobicContact CD2-CG 4.45Å; L188-L241 HydrophobicContact CG-CD2 3.65Å; W237-L241 HydrophobicContact CE3-CD1 3.93Å; W237-L241 HydrophobicContact CZ3-CD1 4.05Å; W237-L241 PolarHBondContact O-N 3.27Å; L241-S243 PolarHBondContact O-N 2.98Å; L241-A244 HydrophobicContact CB-CB 3.83Å; L241-A244 PolarHBondContact O-N 3.42Å; L241-L252 HydrophobicContact CD1-CD1 3.23Å
242	P	89.2	Confident	90.9	Very high	99 Å²	99	57.1 Å²	57.1	64%	0.643	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-27	-176.9	-23.4	34.3	0	0	0	114	R238	R238-P242 VanDerWaalsContact O-CA 3.31Å; R238-P242 WeakPolarHBondContact O-CA 3.47Å
243	S	82.3	Confident	90.9	Very high	127 Å²	127	58.5 Å²	58.5	89%	0.888	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-3.6	-178.1	-52.5	0	0	0	0	114.1	L241	L241-S243 PolarHBondContact O-N 2.98Å
244	A	85.9	Confident	90.8	Very high	9 Å²	9	54.1 Å²	54.1	7%	0.074	29%	0.293	C	S	.	.			trans	-77.6	135.2	178.1	0	0	0	0	0	110.8	L241 M248 I249	L241-A244 HydrophobicContact CB-CB 3.83Å; L241-A244 PolarHBondContact O-N 3.42Å; A244-M248 HydrophobicContact CB-CB 4.31Å; A244-M248 HydrophobicContact CB-CG 4.1Å; A244-I249 HydrophobicContact CB-CD1 4.32Å; A244-I249 HydrophobicContact CB-CG1 3.86Å
245	D	85.9	Confident	90.6	Very high	67 Å²	67	49.7 Å²	49.7	36%	0.358	27%	0.274	S	S	.	.			trans	-73.2	165.8	170	59.3	25.4	0	0	0	111.2	E247 M248 I249	D245-E247 PolarHBondContact O-N 3.02Å; D245-M248 PolarHBondContact O-N 3.38Å; D245-M248 WeakPolarHBondContact OD1-CB 3.37Å; D245-M248 PolarHBondContact OD1-N 3.03Å; D245-I249 WeakPolarHBondContact O-CG1 3.38Å; D245-I249 PolarHBondContact O-N 2.96Å
246	D	88	Confident	90.6	Very high	98 Å²	98	48.1 Å²	48.1	52%	0.524	26%	0.264	S	S	.	.	H	α-helix	trans	-61.3	-34.1	-177.5	-76.2	-56.8	0	0	0	111.9	R238 I249 G250	R238-D246 IonicContact CZ-OD1 3.4Å; R238-D246 IonicContact NE-OD1 3.87Å; R238-D246 IonicContact NH2-OD1 2.6Å; R238-D246 PolarHBondContact NH2-OD1 3.36Å; R238-D246 IonicContact NH2-OD2 2.87Å; R238-D246 PolarHBondContact NH2-OD2 3.05Å; D246-I249 PolarHBondContact O-N 3.18Å; D246-G250 PolarHBondContact O-N 3.46Å
247	E	85.2	Confident	90.5	Very high	47 Å²	47	47.4 Å²	47.4	22%	0.22	26%	0.255	C	S	.	.	H	α-helix	trans	-65.2	-46.8	177.3	-69.4	81.2	177	0	0	112.2	D245 G250 I251 A273 Y274 K277	D245-E247 PolarHBondContact O-N 3.02Å; E247-G250 PolarHBondContact O-N 3.26Å; E247-I251 WeakPolarHBondContact O-CG1 3.36Å; E247-I251 PolarHBondContact O-N 3.25Å; E247-A273 HydrophobicContact CG-CB 3.65Å; E247-Y274 HydrophobicContact CB-CD2 4.09Å; E247-K277 IonicContact OE1-NZ 3.89Å; E247-K277 PolarHBondContact OE1-NZ 2.75Å
248	M	86.2	Confident	90.6	Very high	6 Å²	6	47.7 Å²	47.7	3%	0.03	26%	0.256	C	S	.	.	H	α-helix	trans	-63.2	-42.5	175.1	176.3	53.8	79.4	0	0	111.5	V104 I183 L187 A244 D245 G250 I251 L252 Y274	V104-M248 HydrophobicContact CG2-CE 3.99Å; I183-M248 HydrophobicContact CG2-CE 3.91Å; I183-M248 HydrophobicContact CG2-SD 3.44Å; I183-M248 WeakPolarHBondContact CG2-SD 3.38Å; L187-M248 HydrophobicContact CD1-CE 4.24Å; L187-M248 HydrophobicContact CD1-CG 3.56Å; L187-M248 HydrophobicContact CD1-SD 3.88Å; A244-M248 HydrophobicContact CB-CB 4.31Å; A244-M248 HydrophobicContact CB-CG 4.1Å; D245-M248 PolarHBondContact O-N 3.38Å; D245-M248 WeakPolarHBondContact OD1-CB 3.37Å; D245-M248 PolarHBondContact OD1-N 3.03Å; M248-G250 VanDerWaalsContact C-N 3.28Å; M248-G250 PolarHBondContact O-N 2.82Å; M248-I251 PolarHBondContact O-N 3.29Å; M248-L252 HydrophobicContact CG-CD1 4.3Å; M248-L252 WeakPolarHBondContact O-CG 3.41Å; M248-L252 PolarHBondContact O-N 3.42Å; M248-L252 HydrophobicContact SD-CD1 4.41Å; M248-L252 HydrophobicContact SD-CG 4.24Å; M248-Y274 HydrophobicContact CB-CD2 4.35Å; M248-Y274 HydrophobicContact CB-CE2 4.08Å; M248-Y274 HydrophobicContact CE-CD2 4.48Å; M248-Y274 HydrophobicContact CE-CE1 4.24Å; M248-Y274 HydrophobicContact CE-CE2 3.47Å; M248-Y274 VanDerWaalsContact CE-CE2 3.47Å; M248-Y274 WeakPolarHBondContact CE-OH 3.47Å
249	I	91.3	Very high	90.6	Very high	13 Å²	13	42.5 Å²	42.5	7%	0.067	24%	0.238	C	C	.	.	H	α-helix	trans	-59.3	-43.6	174.9	-69.7	172.3	0	0	0	109.9	W237 R238 A244 D245 D246 I251 L252 E253	W237-I249 HydrophobicContact CB-CB 4.42Å; W237-I249 HydrophobicContact CB-CD1 4.17Å; W237-I249 HydrophobicContact CB-CG1 4.02Å; W237-I249 HydrophobicContact CB-CG2 3.62Å; W237-I249 HydrophobicContact CG-CG2 3.94Å; R238-I249 HydrophobicContact CG-CD1 3.7Å; A244-I249 HydrophobicContact CB-CD1 4.32Å; A244-I249 HydrophobicContact CB-CG1 3.86Å; D245-I249 WeakPolarHBondContact O-CG1 3.38Å; D245-I249 PolarHBondContact O-N 2.96Å; D246-I249 PolarHBondContact O-N 3.18Å; I249-I251 VanDerWaalsContact C-N 3.34Å; I249-I251 PolarHBondContact O-N 3.45Å; I249-L252 PolarHBondContact O-N 3.46Å; I249-E253 HydrophobicContact CG2-CG 4.31Å; I249-E253 WeakPolarHBondContact O-CB 3.34Å; I249-E253 WeakPolarHBondContact O-CG 3.36Å; I249-E253 PolarHBondContact O-N 2.85Å
250	G	90.8	Very high	90.4	Very high	34 Å²	34	36.9 Å²	36.9	35%	0.351	21%	0.214	S	C	.	.	H	α-helix	trans	-59.9	-40.9	175.8	0	0	0	0	0	113.2	D246 E247 M248 E253 W254	D246-G250 PolarHBondContact O-N 3.46Å; E247-G250 PolarHBondContact O-N 3.26Å; M248-G250 VanDerWaalsContact C-N 3.28Å; M248-G250 PolarHBondContact O-N 2.82Å; G250-E253 PolarHBondContact O-N 2.85Å; G250-W254 WeakPolarHBondContact O-CB 3.35Å; G250-W254 PolarHBondContact O-N 3.22Å
251	I	89	Confident	90.3	Very high	3 Å²	3	39.5 Å²	39.5	2%	0.015	23%	0.234	C	C	.	.	H	α-helix	trans	-62.6	-46.9	174.1	-70.1	173	0	0	0	110.9	F108 I183 E247 M248 I249 W254 C255 P269 Y274 F275	F108-I251 HydrophobicContact CE2-CG2 3.8Å; F108-I251 HydrophobicContact CZ-CG2 3.73Å; I183-I251 HydrophobicContact CD1-CG2 4.18Å; E247-I251 WeakPolarHBondContact O-CG1 3.36Å; E247-I251 PolarHBondContact O-N 3.25Å; M248-I251 PolarHBondContact O-N 3.29Å; I249-I251 VanDerWaalsContact C-N 3.34Å; I249-I251 PolarHBondContact O-N 3.45Å; I251-W254 PolarHBondContact O-N 3.36Å; I251-C255 WeakPolarHBondContact O-CB 3.34Å; I251-C255 PolarHBondContact O-N 2.71Å; I251-C255 PolarHBondContact O-SG 3.12Å; I251-P269 HydrophobicContact CG1-CB 4.15Å; I251-Y274 HydrophobicContact CD1-CD1 3.53Å; I251-Y274 HydrophobicContact CD1-CD2 4.15Å; I251-Y274 HydrophobicContact CD1-CE1 4.25Å; I251-Y274 HydrophobicContact CD1-CG 3.45Å; I251-Y274 VanDerWaalsContact CD1-CG 3.45Å; I251-F275 HydrophobicContact CD1-CE2 3.86Å; I251-F275 HydrophobicContact CD1-CZ 4.14Å
252	L	92	Very high	90.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.9	-41.4	178.9	-73.1	172.2	0	0	0	112.1	G180 I183 A184 L187 W237 L241 M248 I249 W254 C255 L256	G180-L252 WeakPolarHBondContact O-CD2 3.3Å; I183-L252 HydrophobicContact CB-CD2 3.94Å; I183-L252 HydrophobicContact CG2-CD2 3.77Å; I183-L252 HydrophobicContact CG2-CG 4.34Å; A184-L252 HydrophobicContact CB-CD2 4.02Å; L187-L252 HydrophobicContact CD1-CD1 4.16Å; W237-L252 HydrophobicContact CE3-CD1 4.38Å; W237-L252 HydrophobicContact CH2-CB 4.42Å; W237-L252 HydrophobicContact CZ2-CB 4.23Å; W237-L252 HydrophobicContact CZ3-CD1 4.29Å; L241-L252 HydrophobicContact CD1-CD1 3.23Å; M248-L252 HydrophobicContact CG-CD1 4.3Å; M248-L252 WeakPolarHBondContact O-CG 3.41Å; M248-L252 PolarHBondContact O-N 3.42Å; M248-L252 HydrophobicContact SD-CD1 4.41Å; M248-L252 HydrophobicContact SD-CG 4.24Å; I249-L252 PolarHBondContact O-N 3.46Å; L252-W254 VanDerWaalsContact C-N 3.28Å; L252-W254 PolarHBondContact O-N 2.88Å; L252-C255 PolarHBondContact O-N 3.18Å; L252-L256 HydrophobicContact CD2-CD1 4.47Å; L252-L256 VanDerWaalsContact O-CB 3.29Å; L252-L256 WeakPolarHBondContact O-CB 3.19Å; L252-L256 WeakPolarHBondContact O-CG 3.41Å; L252-L256 PolarHBondContact O-N 2.96Å
253	E	92.9	Very high	90.2	Very high	86 Å²	86	37.6 Å²	37.6	40%	0.402	22%	0.218	S	C	.	.	H	α-helix	trans	-60.9	-38.7	174.4	-76.7	-166.7	146	0	0	112.2	K234 I249 G250 Q257	K234-E253 IonicContact NZ-OE1 2.67Å; K234-E253 PolarHBondContact NZ-OE1 3.2Å; I249-E253 HydrophobicContact CG2-CG 4.31Å; I249-E253 WeakPolarHBondContact O-CB 3.34Å; I249-E253 WeakPolarHBondContact O-CG 3.36Å; I249-E253 PolarHBondContact O-N 2.85Å; G250-E253 PolarHBondContact O-N 2.85Å; E253-Q257 WeakPolarHBondContact O-CG 3.47Å
254	W	92.6	Very high	90	Very high	24 Å²	24	34.4 Å²	34.4	9%	0.091	19%	0.194	C	C	.	.	H	α-helix	trans	-69.4	-46.7	176.6	-175.4	88.3	0	0	0	112	I176 G250 I251 L252 L256 Q257 H265 V266 P269	I176-W254 HydrophobicContact CD1-CH2 4.36Å; I176-W254 HydrophobicContact CD1-CZ3 4.17Å; I176-W254 HydrophobicContact CG1-CZ3 4.49Å; I176-W254 HydrophobicContact CG2-CE3 4.08Å; I176-W254 HydrophobicContact CG2-CH2 3.99Å; I176-W254 HydrophobicContact CG2-CZ3 3.4Å; G250-W254 WeakPolarHBondContact O-CB 3.35Å; G250-W254 PolarHBondContact O-N 3.22Å; I251-W254 PolarHBondContact O-N 3.36Å; L252-W254 VanDerWaalsContact C-N 3.28Å; L252-W254 PolarHBondContact O-N 2.88Å; W254-L256 VanDerWaalsContact C-N 3.32Å; W254-L256 PolarHBondContact O-N 3.4Å; W254-Q257 WeakPolarHBondContact O-CG 3.45Å; W254-Q257 PolarHBondContact O-NE2 2.81Å; W254-H265 WeakPolarHBondContact CZ2-O 3.14Å; W254-V266 HydrophobicContact CH2-CG1 4.31Å; W254-P269 HydrophobicContact CD2-CG 4.05Å; W254-P269 HydrophobicContact CE3-CB 4.35Å; W254-P269 HydrophobicContact CE3-CG 3.67Å; W254-P269 HydrophobicContact CH2-CG 4.18Å; W254-P269 HydrophobicContact CZ3-CG 3.72Å
255	C	92.1	Very high	89.6	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-66.4	-29.9	-179.6	-75.6	0	0	0	0	113.5	I176 I251 L252 R263	I176-C255 HydrophobicContact CG2-CB 4.27Å; I251-C255 WeakPolarHBondContact O-CB 3.34Å; I251-C255 PolarHBondContact O-N 2.71Å; I251-C255 PolarHBondContact O-SG 3.12Å; L252-C255 PolarHBondContact O-N 3.18Å; C255-R263 VanDerWaalsContact O-CD 3.22Å; C255-R263 WeakPolarHBondContact O-CD 3.12Å
256	L	95.6	Very high	89.1	Confident	8 Å²	8	36.7 Å²	36.7	4%	0.042	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	34.5	-172	-61	172.8	0	0	0	112.6	W177 L192 L209 W237 L252 W254	W177-L256 HydrophobicContact CD2-CD2 3.86Å; W177-L256 HydrophobicContact CE3-CD2 4.03Å; W177-L256 HydrophobicContact CG-CD2 4.29Å; W177-L256 HydrophobicContact CH2-CD2 4.49Å; W177-L256 HydrophobicContact CZ2-CD2 4.32Å; W177-L256 HydrophobicContact CZ3-CB 4.35Å; W177-L256 HydrophobicContact CZ3-CD2 4.36Å; L192-L256 HydrophobicContact CD2-CD1 3.72Å; L209-L256 HydrophobicContact CD1-CB 4.24Å; W237-L256 HydrophobicContact CH2-CD1 3.45Å; W237-L256 VanDerWaalsContact CH2-CD1 3.45Å; W237-L256 HydrophobicContact CZ2-CD1 3.66Å; L252-L256 HydrophobicContact CD2-CD1 4.47Å; L252-L256 VanDerWaalsContact O-CB 3.29Å; L252-L256 WeakPolarHBondContact O-CB 3.19Å; L252-L256 WeakPolarHBondContact O-CG 3.41Å; L252-L256 PolarHBondContact O-N 2.96Å; W254-L256 VanDerWaalsContact C-N 3.32Å; W254-L256 PolarHBondContact O-N 3.4Å
257	Q	95.1	Very high	88.3	Confident	55 Å²	55	36.8 Å²	36.8	26%	0.257	20%	0.199	S	C	.	.			trans	-74.7	137	170.1	-65.7	-177.1	70.8	0	0	111	E253 W254 N262 R263	E253-Q257 WeakPolarHBondContact O-CG 3.47Å; W254-Q257 WeakPolarHBondContact O-CG 3.45Å; W254-Q257 PolarHBondContact O-NE2 2.81Å; Q257-N262 HydrophobicContact CB-CB 4.29Å; Q257-N262 PolarHBondContact NE2-O 3.41Å; Q257-N262 PolarHBondContact OE1-ND2 2.97Å; Q257-R263 HydrophobicContact CB-CG 4.4Å; Q257-R263 PolarHBondContact O-NE 3.32Å; Q257-R263 PolarHBondContact O-NH2 3.13Å
258	Y	95.6	Very high	87.9	Confident	12 Å²	12	38.9 Å²	38.9	5%	0.047	21%	0.211	C	C	.	.	S	Bend	trans	-56.2	-53.6	175.7	-85.5	-61.9	0	0	0	111.8	P161 I205 L209 G210 P212 W217 P260 R263	P161-Y258 HydrophobicContact CB-CD1 4.13Å; P161-Y258 HydrophobicContact CB-CE1 4.26Å; P161-Y258 HydrophobicContact CG-CD1 3.85Å; P161-Y258 HydrophobicContact CG-CE1 4.31Å; I205-Y258 HydrophobicContact CG2-CE1 3.83Å; L209-Y258 HydrophobicContact CB-CE2 3.93Å; G210-Y258 WeakPolarHBondContact O-CE2 3.22Å; G210-Y258 PolarHBondContact O-OH 3.3Å; P212-Y258 HydrophobicContact CB-CD1 3.94Å; P212-Y258 HydrophobicContact CB-CD2 4.08Å; P212-Y258 HydrophobicContact CB-CE1 4.04Å; P212-Y258 HydrophobicContact CB-CE2 4.16Å; P212-Y258 HydrophobicContact CB-CG 3.98Å; P212-Y258 HydrophobicContact CG-CE1 4.25Å; W217-Y258 AromaticContact CE3-CD1 3.95Å; W217-Y258 HydrophobicContact CE3-CD1 3.95Å; W217-Y258 HydrophobicContact CE3-CG 4.17Å; W217-Y258 HydrophobicContact CZ3-CD1 4.05Å; Y258-P260 VanDerWaalsContact O-CD 3.24Å; Y258-P260 WeakPolarHBondContact O-CD 3.09Å; Y258-R263 PolarHBondContact O-NH2 2.81Å
259	N	93.8	Very high	87.4	Confident	24 Å²	24	38.8 Å²	38.8	13%	0.128	21%	0.21	C	C	.	.	S	Bend	trans	-67.2	114.3	179.9	-171.7	-6.7	0	0	0	111.6	N216 W217 C261 N262	N216-N259 WeakPolarHBondContact O-CB 3.28Å; W217-N259 HydrophobicContact CB-CB 4.34Å; W217-N259 HydrophobicContact CG-CB 4.2Å; N259-C261 PolarHBondContact O-N 3.43Å; N259-C261 WeakPolarHBondContact OD1-CB 3.4Å; N259-C261 PolarHBondContact OD1-N 3.05Å; N259-N262 PolarHBondContact O-N 3.35Å; N259-N262 VanDerWaalsContact O-N 3.08Å
260	P	91.5	Very high	86.4	Confident	21 Å²	21	41.4 Å²	41.4	14%	0.136	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-63.6	-23.1	179.2	26.4	-34.7	0	0	0	113.3	E162 Y258 N262 R263	E162-P260 HydrophobicContact CG-CG 4.44Å; Y258-P260 VanDerWaalsContact O-CD 3.24Å; Y258-P260 WeakPolarHBondContact O-CD 3.09Å; P260-N262 PolarHBondContact O-N 3.44Å; P260-R263 PolarHBondContact O-N 3.08Å
261	C	89.8	Confident	85.6	Confident	87 Å²	87	47 Å²	47	59%	0.588	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-65.9	-20.5	175.8	-62.5	0	0	0	0	113.1	N259 R263 T264	N259-C261 PolarHBondContact O-N 3.43Å; N259-C261 WeakPolarHBondContact OD1-CB 3.4Å; N259-C261 PolarHBondContact OD1-N 3.05Å; C261-R263 VanDerWaalsContact C-N 3.33Å; C261-T264 PolarHBondContact O-OG1 3.29Å
262	N	90.5	Very high	84.9	Confident	68 Å²	68	48.2 Å²	48.2	36%	0.364	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-87.7	-6.1	176.3	-61.4	-4.4	0	0	0	112.5	Q257 N259 P260	Q257-N262 HydrophobicContact CB-CB 4.29Å; Q257-N262 PolarHBondContact NE2-O 3.41Å; Q257-N262 PolarHBondContact OE1-ND2 2.97Å; N259-N262 PolarHBondContact O-N 3.35Å; N259-N262 VanDerWaalsContact O-N 3.08Å; P260-N262 PolarHBondContact O-N 3.44Å
263	R	89.3	Confident	84	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.261	C	S	.	.	S	Bend	trans	-103.2	36.8	-179.6	-69.6	-176.6	-93.5	143.8	-7.3	112.3	E162 G173 I176 W177 C255 Q257 Y258 P260 C261	E162-R263 IonicContact OE1-CZ 3.87Å; E162-R263 IonicContact OE1-NH1 3.28Å; E162-R263 PolarHBondContact OE1-NH1 2.78Å; E162-R263 IonicContact OE1-NH2 3.03Å; E162-R263 PolarHBondContact OE1-NH2 3.25Å; E162-R263 IonicContact OE2-CZ 2.69Å; E162-R263 IonicContact OE2-NH1 3.74Å; E162-R263 IonicContact OE2-NH2 2.7Å; E162-R263 PolarHBondContact OE2-NH2 3.34Å; G173-R263 WeakPolarHBondContact CA-O 3.32Å; G173-R263 PolarHBondContact O-NH1 2.67Å; I176-R263 HydrophobicContact CB-CB 4.1Å; I176-R263 HydrophobicContact CG2-CB 3.85Å; I176-R263 HydrophobicContact CG2-CG 4.02Å; W177-R263 VanDerWaalsContact CB-NH1 3.33Å; C255-R263 VanDerWaalsContact O-CD 3.22Å; C255-R263 WeakPolarHBondContact O-CD 3.12Å; Q257-R263 HydrophobicContact CB-CG 4.4Å; Q257-R263 PolarHBondContact O-NE 3.32Å; Q257-R263 PolarHBondContact O-NH2 3.13Å; Y258-R263 PolarHBondContact O-NH2 2.81Å; P260-R263 PolarHBondContact O-N 3.08Å; C261-R263 VanDerWaalsContact C-N 3.33Å
264	T	76.3	Confident	82.9	Confident	61 Å²	61	46 Å²	46	37%	0.374	24%	0.243	S	C	.	.			trans	-108.7	-40.7	-171.6	50.6	0	0	0	0	113.6	C261 V266	C261-T264 PolarHBondContact O-OG1 3.29Å; T264-V266 PolarHBondContact O-N 3.02Å
265	H	78.5	Confident	81.8	Confident	109 Å²	109	46.7 Å²	46.7	51%	0.505	25%	0.247	S	C	.	.			trans	-93.8	84.3	-171.8	-62.5	-66.8	0	0	0	111.8	W254 E267 I268	W254-H265 WeakPolarHBondContact CZ2-O 3.14Å; H265-E267 VanDerWaalsContact C-OE2 3.27Å; H265-E267 WeakPolarHBondContact CA-OE2 3.39Å; H265-E267 PolarHBondContact O-N 2.88Å; H265-E267 VanDerWaalsContact O-N 3.12Å; H265-I268 HydrophobicContact CB-CD1 3.71Å; H265-I268 HydrophobicContact CB-CG1 3.92Å; H265-I268 WeakPolarHBondContact O-CB 3.18Å; H265-I268 WeakPolarHBondContact O-CG1 3.39Å; H265-I268 PolarHBondContact O-N 2.94Å
266	V	74.3	Confident	80.8	Confident	15 Å²	15	50.9 Å²	50.9	9%	0.091	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-19	-179.8	-63.5	0	0	0	0	113.5	M111 I176 W254 T264 I268 P269 M270	M111-V266 HydrophobicContact CB-CG1 4.2Å; I176-V266 HydrophobicContact CD1-CG1 3.5Å; I176-V266 HydrophobicContact CG1-CG1 4.42Å; W254-V266 HydrophobicContact CH2-CG1 4.31Å; T264-V266 PolarHBondContact O-N 3.02Å; V266-I268 PolarHBondContact O-N 3.38Å; V266-P269 WeakPolarHBondContact O-CD 3.43Å; V266-P269 VanDerWaalsContact O-CG 3.28Å; V266-P269 WeakPolarHBondContact O-CG 3.18Å; V266-M270 VanDerWaalsContact O-CG 3.32Å; V266-M270 WeakPolarHBondContact O-CG 3.42Å; V266-M270 PolarHBondContact O-N 3.23Å
267	E	72.8	Confident	79.5	Confident	99 Å²	99	55.8 Å²	55.8	46%	0.463	29%	0.294	S	S	.	.	H	α-helix	trans	-62.9	-28.7	174.9	-55.1	82	-179.6	0	0	111.8	H265 M270 Q271	H265-E267 VanDerWaalsContact C-OE2 3.27Å; H265-E267 WeakPolarHBondContact CA-OE2 3.39Å; H265-E267 PolarHBondContact O-N 2.88Å; H265-E267 VanDerWaalsContact O-N 3.12Å; E267-M270 PolarHBondContact O-N 3.17Å; E267-Q271 WeakPolarHBondContact O-CB 3.5Å; E267-Q271 WeakPolarHBondContact O-CG 3.27Å; E267-Q271 PolarHBondContact O-N 3.42Å
268	I	76.5	Confident	77.5	Confident	92 Å²	92	61 Å²	61	47%	0.472	32%	0.316	S	S	.	.	H	α-helix	trans	-60.9	-59.7	-179	-62.7	174.4	0	0	0	111.3	H265 V266 M270 Q271 S272	H265-I268 HydrophobicContact CB-CD1 3.71Å; H265-I268 HydrophobicContact CB-CG1 3.92Å; H265-I268 WeakPolarHBondContact O-CB 3.18Å; H265-I268 WeakPolarHBondContact O-CG1 3.39Å; H265-I268 PolarHBondContact O-N 2.94Å; V266-I268 PolarHBondContact O-N 3.38Å; I268-M270 VanDerWaalsContact C-N 3.29Å; I268-M270 PolarHBondContact O-N 2.57Å; I268-Q271 PolarHBondContact O-N 2.83Å; I268-S272 PolarHBondContact O-N 2.95Å
269	P	75.4	Confident	75.9	Confident	4 Å²	4	64.9 Å²	64.9	3%	0.026	34%	0.342	C	S	.	.	H	α-helix	trans	-64.5	-34	176.9	24.6	-34.8	0	0	0	112	F108 I251 W254 V266 Q271 S272 F275	F108-P269 HydrophobicContact CD1-CB 4.48Å; F108-P269 HydrophobicContact CD1-CG 3.99Å; F108-P269 HydrophobicContact CE1-CB 3.75Å; F108-P269 HydrophobicContact CE1-CG 3.29Å; F108-P269 HydrophobicContact CZ-CB 3.89Å; F108-P269 HydrophobicContact CZ-CG 3.92Å; I251-P269 HydrophobicContact CG1-CB 4.15Å; W254-P269 HydrophobicContact CD2-CG 4.05Å; W254-P269 HydrophobicContact CE3-CB 4.35Å; W254-P269 HydrophobicContact CE3-CG 3.67Å; W254-P269 HydrophobicContact CH2-CG 4.18Å; W254-P269 HydrophobicContact CZ3-CG 3.72Å; V266-P269 WeakPolarHBondContact O-CD 3.43Å; V266-P269 VanDerWaalsContact O-CG 3.28Å; V266-P269 WeakPolarHBondContact O-CG 3.18Å; P269-Q271 VanDerWaalsContact C-N 3.26Å; P269-Q271 PolarHBondContact O-N 2.89Å; P269-S272 WeakPolarHBondContact O-CB 3.36Å; P269-S272 PolarHBondContact O-N 3.43Å; P269-S272 PolarHBondContact O-OG 3Å; P269-F275 WeakPolarHBondContact O-CD2 3.5Å; P269-F275 WeakPolarHBondContact O-CE2 3.47Å
270	M	70.9	Confident	74.3	Confident	68 Å²	68	70.4 Å²	70.4	34%	0.335	36%	0.362	S	S	.	.	H	α-helix	trans	-63.7	-29.7	178.1	-72.3	-175.3	75.7	0	0	113.5	F108 C112 V266 E267 I268 S272 F275	F108-M270 HydrophobicContact CB-CG 3.97Å; F108-M270 HydrophobicContact CB-SD 4.37Å; F108-M270 HydrophobicContact CD1-CG 4.13Å; F108-M270 HydrophobicContact CG-CG 4.32Å; C112-M270 PolarHBondContact SG-SD 2.85Å; V266-M270 VanDerWaalsContact O-CG 3.32Å; V266-M270 WeakPolarHBondContact O-CG 3.42Å; V266-M270 PolarHBondContact O-N 3.23Å; E267-M270 PolarHBondContact O-N 3.17Å; I268-M270 VanDerWaalsContact C-N 3.29Å; I268-M270 PolarHBondContact O-N 2.57Å; M270-S272 VanDerWaalsContact C-N 3.28Å; M270-F275 WeakPolarHBondContact O-CD2 3.5Å
271	Q	73.8	Confident	72.8	Confident	152 Å²	152	72.1 Å²	72.1	71%	0.71	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-6.9	173.8	-71	171.3	18.5	0	0	113.3	E267 I268 P269	E267-Q271 WeakPolarHBondContact O-CB 3.5Å; E267-Q271 WeakPolarHBondContact O-CG 3.27Å; E267-Q271 PolarHBondContact O-N 3.42Å; I268-Q271 PolarHBondContact O-N 2.83Å; P269-Q271 VanDerWaalsContact C-N 3.26Å; P269-Q271 PolarHBondContact O-N 2.89Å
272	S	73	Confident	71.1	Confident	28 Å²	28	69.1 Å²	69.1	20%	0.196	35%	0.352	C	S	.	.	S	Bend	trans	-63.9	157.2	-178.9	75	0	0	0	0	112.2	I268 P269 M270 Y274 F275 T276	I268-S272 PolarHBondContact O-N 2.95Å; P269-S272 WeakPolarHBondContact O-CB 3.36Å; P269-S272 PolarHBondContact O-N 3.43Å; P269-S272 PolarHBondContact O-OG 3Å; M270-S272 VanDerWaalsContact C-N 3.28Å; S272-Y274 PolarHBondContact O-N 3.43Å; S272-Y274 VanDerWaalsContact OG-CB 3.3Å; S272-Y274 WeakPolarHBondContact OG-CB 3.29Å; S272-Y274 PolarHBondContact OG-N 3.22Å; S272-F275 PolarHBondContact O-N 3.29Å; S272-T276 PolarHBondContact O-OG1 3.28Å
273	A	72.8	Confident	69.9	Low	30 Å²	30	68.6 Å²	68.6	25%	0.248	35%	0.353	C	S	.	.	H	α-helix	trans	-56.8	-18.6	173.7	0	0	0	0	0	113.2	E247 F275 T276 K277	E247-A273 HydrophobicContact CG-CB 3.65Å; A273-F275 VanDerWaalsContact C-N 3.3Å; A273-F275 PolarHBondContact O-N 2.97Å; A273-T276 WeakPolarHBondContact CA-OG1 3.12Å; A273-T276 PolarHBondContact O-N 2.92Å; A273-K277 HydrophobicContact CB-CD 3.81Å; A273-K277 HydrophobicContact CB-CG 4.03Å; A273-K277 WeakPolarHBondContact O-CB 3.49Å; A273-K277 WeakPolarHBondContact O-CG 2.93Å; A273-K277 PolarHBondContact O-N 3.21Å
274	Y	71.7	Confident	68.7	Low	10 Å²	10	72.4 Å²	72.4	4%	0.039	37%	0.374	C	S	.	.	H	α-helix	trans	-56.4	-44.1	177.7	-171.2	-103.3	0	0	0	112.7	K101 V104 E247 M248 I251 S272	K101-Y274 WeakPolarHBondContact CA-OH 3.1Å; K101-Y274 HydrophobicContact CB-CE1 4.25Å; K101-Y274 HydrophobicContact CD-CE1 4.48Å; K101-Y274 HydrophobicContact CD-CE2 4.43Å; K101-Y274 HydrophobicContact CG-CE1 4.08Å; K101-Y274 HydrophobicContact CG-CE2 4.15Å; K101-Y274 WeakPolarHBondContact CG-OH 3.38Å; K101-Y274 PolarHBondContact NZ-O 2.87Å; K101-Y274 VanDerWaalsContact NZ-O 3.08Å; V104-Y274 HydrophobicContact CB-CE1 4.06Å; V104-Y274 HydrophobicContact CG1-CE1 3.8Å; E247-Y274 HydrophobicContact CB-CD2 4.09Å; M248-Y274 HydrophobicContact CB-CD2 4.35Å; M248-Y274 HydrophobicContact CB-CE2 4.08Å; M248-Y274 HydrophobicContact CE-CD2 4.48Å; M248-Y274 HydrophobicContact CE-CE1 4.24Å; M248-Y274 HydrophobicContact CE-CE2 3.47Å; M248-Y274 VanDerWaalsContact CE-CE2 3.47Å; M248-Y274 WeakPolarHBondContact CE-OH 3.47Å; I251-Y274 HydrophobicContact CD1-CD1 3.53Å; I251-Y274 HydrophobicContact CD1-CD2 4.15Å; I251-Y274 HydrophobicContact CD1-CE1 4.25Å; I251-Y274 HydrophobicContact CD1-CG 3.45Å; I251-Y274 VanDerWaalsContact CD1-CG 3.45Å; S272-Y274 PolarHBondContact O-N 3.43Å; S272-Y274 VanDerWaalsContact OG-CB 3.3Å; S272-Y274 WeakPolarHBondContact OG-CB 3.29Å; S272-Y274 PolarHBondContact OG-N 3.22Å
275	F	69.4	Low	68.2	Low	37 Å²	37	76.4 Å²	76.4	16%	0.162	39%	0.388	C	S	.	.	H	α-helix	trans	-88.1	-19.2	-177	-61.1	-70.5	0	0	0	113.1	V104 A105 F108 I251 P269 M270 S272 A273 V281	V104-F275 HydrophobicContact CG1-CE1 4.22Å; V104-F275 HydrophobicContact CG1-CZ 3.98Å; A105-F275 HydrophobicContact CB-CD1 4.01Å; A105-F275 HydrophobicContact CB-CE1 3.74Å; F108-F275 HydrophobicContact CB-CZ 4.35Å; F108-F275 HydrophobicContact CD2-CE1 4.48Å; F108-F275 HydrophobicContact CD2-CE2 4.35Å; F108-F275 AromaticContact CD2-CZ 3.59Å; F108-F275 HydrophobicContact CD2-CZ 3.59Å; F108-F275 HydrophobicContact CE2-CZ 4.13Å; F108-F275 HydrophobicContact CG-CZ 4.08Å; I251-F275 HydrophobicContact CD1-CE2 3.86Å; I251-F275 HydrophobicContact CD1-CZ 4.14Å; P269-F275 WeakPolarHBondContact O-CD2 3.5Å; P269-F275 WeakPolarHBondContact O-CE2 3.47Å; M270-F275 WeakPolarHBondContact O-CD2 3.5Å; S272-F275 PolarHBondContact O-N 3.29Å; A273-F275 VanDerWaalsContact C-N 3.3Å; A273-F275 PolarHBondContact O-N 2.97Å; F275-V281 HydrophobicContact CD1-CG2 4.5Å
276	T	69.5	Low	67.5	Low	89 Å²	89	76.1 Å²	76.1	55%	0.546	39%	0.387	S	S	.	.	H	α-helix	trans	-106.3	-10.8	-176.4	57.5	0	0	0	0	113.9	S272 A273 Y280	S272-T276 PolarHBondContact O-OG1 3.28Å; A273-T276 WeakPolarHBondContact CA-OG1 3.12Å; A273-T276 PolarHBondContact O-N 2.92Å; T276-Y280 WeakPolarHBondContact O-CE1 3.33Å
277	K	68.2	Low	67	Low	111 Å²	111	75.5 Å²	75.5	48%	0.483	38%	0.383	S	S	.	.	S	Bend	trans	-99.3	145.8	172.9	-69.5	-178	-179.5	168.8	0	111.9	K101 E247 A273 P279	K101-K277 PolarHBondContact NZ-O 2.86Å; K101-K277 VanDerWaalsContact NZ-O 3.15Å; E247-K277 IonicContact OE1-NZ 3.89Å; E247-K277 PolarHBondContact OE1-NZ 2.75Å; A273-K277 HydrophobicContact CB-CD 3.81Å; A273-K277 HydrophobicContact CB-CG 4.03Å; A273-K277 WeakPolarHBondContact O-CB 3.49Å; A273-K277 WeakPolarHBondContact O-CG 2.93Å; A273-K277 PolarHBondContact O-N 3.21Å; K277-P279 CarbonylContact O-C 3.57Å
278	K	54.4	Low	66.5	Low	164 Å²	164	71.6 Å²	71.6	71%	0.713	37%	0.368	S	S	*	.	S	Bend	trans	-58.5	146.3	169.5	-71.7	-174.8	178.6	-177.5	0	111.4	Y280	K278-Y280 HydrophobicContact CD-CE2 4.15Å; K278-Y280 HydrophobicContact CG-CD2 3.86Å; K278-Y280 HydrophobicContact CG-CE1 4.27Å; K278-Y280 HydrophobicContact CG-CE2 3.51Å; K278-Y280 HydrophobicContact CG-CG 4.4Å
279	P	62.3	Low	65.9	Low	93 Å²	93	71.5 Å²	71.5	60%	0.604	37%	0.368	S	S	*	.	S	Bend	cis	-66.4	137	-6.6	28.2	-32.4	0	0	0	109.8	K101 K277	K101-P279 HydrophobicContact CD-CG 4.09Å; K101-P279 WeakPolarHBondContact CD-O 3.42Å; K101-P279 WeakPolarHBondContact CE-O 3.11Å; K101-P279 PolarHBondContact NZ-O 2.94Å; K277-P279 CarbonylContact O-C 3.57Å
280	Y	59.6	Low	65.3	Low	141 Å²	141	74.8 Å²	74.8	55%	0.553	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-71.1	163	173.6	-61.5	-60.6	0	0	0	109.1	T276 K278 C282	T276-Y280 WeakPolarHBondContact O-CE1 3.33Å; K278-Y280 HydrophobicContact CD-CE2 4.15Å; K278-Y280 HydrophobicContact CG-CD2 3.86Å; K278-Y280 HydrophobicContact CG-CE1 4.27Å; K278-Y280 HydrophobicContact CG-CE2 3.51Å; K278-Y280 HydrophobicContact CG-CG 4.4Å; Y280-C282 PolarHBondContact O-N 3.38Å
281	V	59.9	Low	64.7	Low	57 Å²	57	72 Å²	72	35%	0.345	37%	0.371	S	S	.	.	P	Polyproline II helix	trans	-54.6	125.2	163.6	-179.5	0	0	0	0	107.6	N102 A105 F275	N102-V281 HydrophobicContact CB-CG1 4.39Å; N102-V281 WeakPolarHBondContact ND2-CG1 3.45Å; A105-V281 HydrophobicContact CB-CB 4.34Å; A105-V281 HydrophobicContact CB-CG1 3.95Å; A105-V281 HydrophobicContact CB-CG2 3.4Å; F275-V281 HydrophobicContact CD1-CG2 4.5Å
282	C	54.7	Low	64.1	Low	24 Å²	24	71 Å²	71	16%	0.162	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-69.1	154.5	175.3	76.8	0	0	0	0	110	N102 Y280 E286	N102-C282 PolarHBondContact ND2-N 3.49Å; N102-C282 PolarHBondContact ND2-O 3.09Å; N102-C282 PolarHBondContact ND2-SG 2.7Å; N102-C282 PolarHBondContact OD1-N 3.3Å; N102-C282 PolarHBondContact OD1-SG 2.92Å; N102-C282 VanDerWaalsContact OD1-SG 3.38Å; Y280-C282 PolarHBondContact O-N 3.38Å; C282-E286 WeakPolarHBondContact CA-OE2 3.17Å; C282-E286 HydrophobicContact CB-CB 3.67Å; C282-E286 HydrophobicContact CB-CG 4.44Å; C282-E286 VanDerWaalsContact CB-OE2 3.28Å; C282-E286 WeakPolarHBondContact CB-OE2 3.48Å
283	S	64.8	Low	63.5	Low	56 Å²	56	74.9 Å²	74.9	39%	0.392	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-61	158	175.6	58.7	0	0	0	0	111.9	E285 E286 L287	S283-E285 PolarHBondContact O-N 3.34Å; S283-E285 VanDerWaalsContact O-N 3.12Å; S283-E286 PolarHBondContact N-OE2 3.4Å; S283-E286 PolarHBondContact O-N 3.19Å; S283-E286 VanDerWaalsContact OG-CG 3.29Å; S283-E286 WeakPolarHBondContact OG-CG 3.09Å; S283-E286 PolarHBondContact OG-N 3.48Å; S283-E286 PolarHBondContact OG-OE2 3.08Å; S283-L287 PolarHBondContact O-N 3.34Å
284	D	64.3	Low	62.5	Low	80 Å²	80	76.8 Å²	76.8	43%	0.428	39%	0.386	S	S	.	.	H	α-helix	trans	-51.3	-35.5	173.1	-74.9	-4.3	0	0	0	112.1	A288	D284-A288 WeakPolarHBondContact O-CB 3.44Å; D284-A288 PolarHBondContact O-N 3.4Å
285	E	64.2	Low	61.4	Low	145 Å²	145	80.1 Å²	80.1	68%	0.678	40%	0.4	S	S	*	.	H	α-helix	trans	-69.2	-43.7	177.2	-173.5	173.1	-169.7	0	0	112.6	S283 L287 A288 N289	S283-E285 PolarHBondContact O-N 3.34Å; S283-E285 VanDerWaalsContact O-N 3.12Å; E285-L287 VanDerWaalsContact C-N 3.32Å; E285-L287 PolarHBondContact O-N 3.01Å; E285-A288 WeakPolarHBondContact O-CB 3.35Å; E285-A288 PolarHBondContact O-N 3.43Å; E285-N289 VanDerWaalsContact O-CG 3.26Å; E285-N289 PolarHBondContact O-N 2.87Å; E285-N289 PolarHBondContact O-ND2 3.46Å; E285-N289 VanDerWaalsContact O-ND2 3.17Å
286	E	65.1	Low	60	Low	104 Å²	104	84.6 Å²	84.6	49%	0.486	42%	0.416	S	S	.	.	H	α-helix	trans	-63.5	-40.6	174.6	-74	166.6	138.2	0	0	111.2	C282 S283 N289 L290	C282-E286 WeakPolarHBondContact CA-OE2 3.17Å; C282-E286 HydrophobicContact CB-CB 3.67Å; C282-E286 HydrophobicContact CB-CG 4.44Å; C282-E286 VanDerWaalsContact CB-OE2 3.28Å; C282-E286 WeakPolarHBondContact CB-OE2 3.48Å; S283-E286 PolarHBondContact N-OE2 3.4Å; S283-E286 PolarHBondContact O-N 3.19Å; S283-E286 VanDerWaalsContact OG-CG 3.29Å; S283-E286 WeakPolarHBondContact OG-CG 3.09Å; S283-E286 PolarHBondContact OG-N 3.48Å; S283-E286 PolarHBondContact OG-OE2 3.08Å; E286-N289 PolarHBondContact O-N 3.35Å; E286-L290 WeakPolarHBondContact O-CD1 3.45Å; E286-L290 WeakPolarHBondContact O-CG 3.3Å; E286-L290 PolarHBondContact O-N 3.25Å
287	L	63	Low	58.6	Low	1 Å²	1	85.9 Å²	85.9	1%	0.005	43%	0.426	C	S	.	.	H	α-helix	trans	-62.8	-43.7	174.4	175.8	61.7	0	0	0	111.5	V99 N102 L106 G129 S283 E285 N289 L290 L291	V99-L287 HydrophobicContact CB-CD1 3.81Å; V99-L287 HydrophobicContact CG1-CD1 3.57Å; V99-L287 HydrophobicContact CG2-CD1 3.54Å; N102-L287 HydrophobicContact CB-CD1 4.46Å; L106-L287 HydrophobicContact CD1-CD2 3.49Å; L106-L287 VanDerWaalsContact CD1-CD2 3.49Å; G129-L287 WeakPolarHBondContact O-CD2 3.22Å; S283-L287 PolarHBondContact O-N 3.34Å; E285-L287 VanDerWaalsContact C-N 3.32Å; E285-L287 PolarHBondContact O-N 3.01Å; L287-N289 VanDerWaalsContact C-N 3.29Å; L287-N289 PolarHBondContact O-N 2.82Å; L287-L290 PolarHBondContact O-N 3.15Å; L287-L291 HydrophobicContact CD1-CD1 4.18Å; L287-L291 HydrophobicContact CD1-CG 4.38Å; L287-L291 HydrophobicContact CG-CD1 4.02Å; L287-L291 WeakPolarHBondContact O-CB 3.36Å; L287-L291 WeakPolarHBondContact O-CD1 3.48Å; L287-L291 WeakPolarHBondContact O-CG 3.47Å; L287-L291 PolarHBondContact O-N 2.69Å
288	A	63	Low	57.5	Low	17 Å²	17	87.8 Å²	87.8	14%	0.14	44%	0.441	C	S	.	.	H	α-helix	trans	-58.6	-41.2	173.7	0	0	0	0	0	112.1	K127 D284 E285 L291 F292	K127-A288 VanDerWaalsContact O-CB 3.31Å; K127-A288 WeakPolarHBondContact O-CB 3.3Å; D284-A288 WeakPolarHBondContact O-CB 3.44Å; D284-A288 PolarHBondContact O-N 3.4Å; E285-A288 WeakPolarHBondContact O-CB 3.35Å; E285-A288 PolarHBondContact O-N 3.43Å; A288-L291 PolarHBondContact O-N 2.99Å; A288-F292 WeakPolarHBondContact O-CB 3.16Å; A288-F292 PolarHBondContact O-N 3.24Å
289	N	64.2	Low	56.7	Low	90 Å²	90	80.9 Å²	80.9	48%	0.481	41%	0.414	S	S	.	.	H	α-helix	trans	-66.9	-45.7	177.3	-71.2	-31.8	0	0	0	111.8	E285 E286 L287 L291 F292 E293	E285-N289 VanDerWaalsContact O-CG 3.26Å; E285-N289 PolarHBondContact O-N 2.87Å; E285-N289 PolarHBondContact O-ND2 3.46Å; E285-N289 VanDerWaalsContact O-ND2 3.17Å; E286-N289 PolarHBondContact O-N 3.35Å; L287-N289 VanDerWaalsContact C-N 3.29Å; L287-N289 PolarHBondContact O-N 2.82Å; N289-L291 VanDerWaalsContact C-N 3.33Å; N289-L291 PolarHBondContact O-N 2.8Å; N289-F292 WeakPolarHBondContact O-CB 3.36Å; N289-F292 PolarHBondContact O-N 3.29Å; N289-F292 VanDerWaalsContact O-N 3.08Å; N289-E293 PolarHBondContact O-N 2.95Å
290	L	61.9	Low	55.4	Low	74 Å²	74	83.2 Å²	83.2	39%	0.387	43%	0.429	S	S	.	.	H	α-helix	trans	-57.2	-45.3	174.1	-81.3	152.3	0	0	0	111.8	V99 E286 L287 F292 E293 L294	V99-L290 HydrophobicContact CG1-CD1 4.31Å; E286-L290 WeakPolarHBondContact O-CD1 3.45Å; E286-L290 WeakPolarHBondContact O-CG 3.3Å; E286-L290 PolarHBondContact O-N 3.25Å; L287-L290 PolarHBondContact O-N 3.15Å; L290-F292 VanDerWaalsContact C-N 3.26Å; L290-F292 PolarHBondContact O-N 3.31Å; L290-E293 PolarHBondContact O-N 3.33Å; L290-L294 WeakPolarHBondContact O-CG 3.37Å; L290-L294 PolarHBondContact O-N 3Å
291	L	59.6	Low	54.6	Low	8 Å²	8	80.7 Å²	80.7	4%	0.042	43%	0.428	C	S	.	.	H	α-helix	trans	-62.8	-32.1	175.9	-75.7	163.6	0	0	0	113.2	V97 I125 L287 A288 N289 K295	V97-L291 HydrophobicContact CB-CD2 3.93Å; V97-L291 HydrophobicContact CG1-CD2 3.28Å; V97-L291 HydrophobicContact CG1-CG 4.15Å; V97-L291 HydrophobicContact CG2-CD2 3.43Å; V97-L291 VanDerWaalsContact CG2-CD2 3.43Å; I125-L291 HydrophobicContact CB-CD1 4.28Å; I125-L291 HydrophobicContact CG2-CD1 3.44Å; I125-L291 VanDerWaalsContact CG2-CD1 3.44Å; L287-L291 HydrophobicContact CD1-CD1 4.18Å; L287-L291 HydrophobicContact CD1-CG 4.38Å; L287-L291 HydrophobicContact CG-CD1 4.02Å; L287-L291 WeakPolarHBondContact O-CB 3.36Å; L287-L291 WeakPolarHBondContact O-CD1 3.48Å; L287-L291 WeakPolarHBondContact O-CG 3.47Å; L287-L291 PolarHBondContact O-N 2.69Å; A288-L291 PolarHBondContact O-N 2.99Å; N289-L291 VanDerWaalsContact C-N 3.33Å; N289-L291 PolarHBondContact O-N 2.8Å; L291-K295 WeakPolarHBondContact O-CG 3.37Å
292	F	61.2	Low	53.3	Low	133 Å²	133	80.1 Å²	80.1	58%	0.583	43%	0.434	S	S	*	.	H	α-helix	trans	-73.8	-41.5	176	-175.1	-95.6	0	0	0	111.4	A288 N289 L290 K295	A288-F292 WeakPolarHBondContact O-CB 3.16Å; A288-F292 PolarHBondContact O-N 3.24Å; N289-F292 WeakPolarHBondContact O-CB 3.36Å; N289-F292 PolarHBondContact O-N 3.29Å; N289-F292 VanDerWaalsContact O-N 3.08Å; L290-F292 VanDerWaalsContact C-N 3.26Å; L290-F292 PolarHBondContact O-N 3.31Å; F292-K295 PolarHBondContact O-N 2.99Å
293	E	58.6	Low	52.1	Low	108 Å²	108	88.2 Å²	88.2	51%	0.505	47%	0.467	S	S	.	.	H	α-helix	trans	-64.4	-41.5	177.5	-71.8	-170.5	163.1	0	0	112.7	N289 L290 K295 R296	N289-E293 PolarHBondContact O-N 2.95Å; L290-E293 PolarHBondContact O-N 3.33Å; E293-K295 PolarHBondContact O-N 2.88Å; E293-K295 VanDerWaalsContact O-N 3.14Å; E293-R296 WeakPolarHBondContact O-CB 3.37Å; E293-R296 PolarHBondContact O-N 3.09Å
294	L	52.3	Low	50.4	Low	70 Å²	70	93.1 Å²	93.1	37%	0.366	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-20.6	175.8	-72.9	169.1	0	0	0	113.5	V97 L290 S299	V97-L294 HydrophobicContact CG1-CD1 3.63Å; L290-L294 WeakPolarHBondContact O-CG 3.37Å; L290-L294 PolarHBondContact O-N 3Å; L294-S299 PolarHBondContact O-OG 3.39Å
295	K	48.5	Very low	48.7	Very low	80 Å²	80	98.7 Å²	98.7	35%	0.348	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-2.8	177	-72.2	173.3	-171.5	149.3	0	113.7	V90 L291 F292 E293	V90-K295 VanDerWaalsContact CB-NZ 3.29Å; V90-K295 HydrophobicContact CG1-CD 3.99Å; L291-K295 WeakPolarHBondContact O-CG 3.37Å; F292-K295 PolarHBondContact O-N 2.99Å; E293-K295 PolarHBondContact O-N 2.88Å; E293-K295 VanDerWaalsContact O-N 3.14Å
296	R	41	Very low	48	Very low	132 Å²	132	96.4 Å²	96.4	50%	0.498	52%	0.517	S	S	.	.	S	Bend	trans	-68.2	131.6	174.3	-68.5	-174.9	-178.5	170.6	5.2	108.8	E293 D298 S299	E293-R296 WeakPolarHBondContact O-CB 3.37Å; E293-R296 PolarHBondContact O-N 3.09Å; R296-D298 PolarHBondContact O-N 3.19Å; R296-S299 WeakPolarHBondContact O-CB 3.31Å; R296-S299 PolarHBondContact O-N 3.19Å; R296-S299 PolarHBondContact O-OG 2.67Å
297	P	40	Very low	47.1	Very low	115 Å²	115	96 Å²	96	75%	0.747	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-19.5	178.9	21.8	-31	0	0	0	113
298	D	44.7	Very low	46.2	Very low	151 Å²	151	101.3 Å²	101.3	81%	0.807	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	4.2	179.1	-50.6	-43.6	0	0	0	113.5	R296	R296-D298 PolarHBondContact O-N 3.19Å
299	S	37.8	Very low	45.2	Very low	20 Å²	20	106.2 Å²	106.2	14%	0.14	57%	0.572	C	S	.	*	S	Bend	trans	-69.5	141.4	175.9	69.1	0	0	0	0	110.5	L294 R296 T301 G302	L294-S299 PolarHBondContact O-OG 3.39Å; R296-S299 WeakPolarHBondContact O-CB 3.31Å; R296-S299 PolarHBondContact O-N 3.19Å; R296-S299 PolarHBondContact O-OG 2.67Å; S299-T301 PolarHBondContact O-N 3.16Å; S299-G302 PolarHBondContact O-N 2.87Å
300	P	35.5	Very low	44	Very low	141 Å²	141	107.3 Å²	107.3	92%	0.916	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.5	-5.2	-175.3	22.4	-31.2	0	0	0	114.4
301	T	42	Very low	42.8	Very low	88 Å²	88	109.5 Å²	109.5	54%	0.54	59%	0.59	S	S	.	*	T	Hydrogen-bonded Turn	trans	-102.6	-0.9	176.2	49.7	0	0	0	0	113.7	S299 K303	S299-T301 PolarHBondContact O-N 3.16Å; T301-K303 VanDerWaalsContact C-N 3.31Å; T301-K303 PolarHBondContact O-N 2.6Å
302	G	33	Very low	41.6	Very low	45 Å²	45	116.7 Å²	116.7	46%	0.464	63%	0.629	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.6	12.9	-173.7	0	0	0	0	0	116.9	S299	S299-G302 PolarHBondContact O-N 2.87Å
303	K	29.1	Very low	40.1	Very low	195 Å²	195	115.5 Å²	115.5	85%	0.848	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.4	-7.9	-178.1	-81.5	-171.7	176.2	179.5	0	116.1	T301	T301-K303 VanDerWaalsContact C-N 3.31Å; T301-K303 PolarHBondContact O-N 2.6Å
304	D	28.6	Very low	38.6	Very low	158 Å²	158	116.1 Å²	116.1	85%	0.845	64%	0.643	S	S	*	*			trans	-145	90.7	176.5	-62.4	-61.3	0	0	0	109.8
305	V	30.6	Very low	37.3	Very low	198 Å²	198	120.3 Å²	120.3	100%	1.2	67%	0.668	S	S	*	*			trans	-126.9	0	166.8	-179.5	0	0	0	0	108.9

Retrieved 305 of 305 residues in 726.3 ms (Link to these results)

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