G4VK61_SCHMA Loading...

Putative fetal globin-inducing factor

AlphaFold DB , UniProt , Accession G4VK61, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 228 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	44.2	Very low	40.1	Very low	245 Å²	245	144.7 Å²	144.7	100%	1.207	79%	0.794	S	S	*	*				0	90.8	0	-76.4	163.3	157.8	0	0	106.1	S3	M1-S3 PolarHBondContact O-N 3.23Å
2	S	36.5	Very low	41.3	Very low	120 Å²	120	147.4 Å²	147.4	84%	0.839	80%	0.796	S	S	*	*			trans	-73.7	115.5	173.4	-80.1	0	0	0	0	107.4	Q4	S2-Q4 PolarHBondContact O-N 3.31Å; S2-Q4 VanDerWaalsContact O-N 3.08Å
3	S	38.9	Very low	42.8	Very low	116 Å²	116	138.7 Å²	138.7	81%	0.811	75%	0.749	S	S	*	*			trans	-57.7	103.1	162.7	42.4	0	0	0	0	108.5	M1 S5	M1-S3 PolarHBondContact O-N 3.23Å; S3-S5 PolarHBondContact O-N 3.06Å
4	Q	39.5	Very low	44.5	Very low	187 Å²	187	136.8 Å²	136.8	87%	0.874	75%	0.747	S	S	*	*			trans	-66.2	113.1	156.6	-76.4	176.1	-50.8	0	0	105.8	S2 E6	S2-Q4 PolarHBondContact O-N 3.31Å; S2-Q4 VanDerWaalsContact O-N 3.08Å; Q4-E6 PolarHBondContact O-N 3.48Å
5	S	38.5	Very low	46.3	Very low	106 Å²	106	132.3 Å²	132.3	74%	0.741	72%	0.718	S	S	*	*			trans	-59.2	117.5	164.5	44.9	0	0	0	0	107.8	S3 D7	S3-S5 PolarHBondContact O-N 3.06Å; S5-D7 PolarHBondContact O-N 3.48Å; S5-D7 VanDerWaalsContact O-N 3.07Å
6	E	36.3	Very low	48.7	Very low	182 Å²	182	130.1 Å²	130.1	85%	0.85	71%	0.705	S	S	*	*			trans	-61.5	103.6	160	-72.5	168.4	166.7	0	0	106.2	Q4 D8	Q4-E6 PolarHBondContact O-N 3.48Å; E6-D8 PolarHBondContact O-N 3.44Å
7	D	35.4	Very low	50.8	Low	131 Å²	131	123.5 Å²	123.5	70%	0.701	67%	0.669	S	S	*	*			trans	-74.4	86.1	171.3	-159.3	-18	0	0	0	106.2	S5 S9	S5-D7 PolarHBondContact O-N 3.48Å; S5-D7 VanDerWaalsContact O-N 3.07Å; D7-S9 PolarHBondContact O-N 3.3Å; D7-S9 PolarHBondContact OD1-OG 3.12Å
8	D	38.1	Very low	52.7	Low	143 Å²	143	118.9 Å²	118.9	77%	0.765	64%	0.644	S	S	*	*			trans	-71.4	43.9	171.3	-108.5	-9.1	0	0	0	110.4	E6 H10	E6-D8 PolarHBondContact O-N 3.44Å; D8-H10 PolarHBondContact O-N 3.3Å
9	S	40.3	Very low	54.3	Low	75 Å²	75	118.6 Å²	118.6	52%	0.524	64%	0.638	S	S	.	*			trans	-78.7	78.7	166.6	38.1	0	0	0	0	108.3	D7 D11	D7-S9 PolarHBondContact O-N 3.3Å; D7-S9 PolarHBondContact OD1-OG 3.12Å; S9-D11 PolarHBondContact O-N 3.23Å
10	H	45	Very low	55.7	Low	165 Å²	165	112.7 Å²	112.7	76%	0.764	61%	0.606	S	S	*	*			trans	-62.1	86.7	155.8	-97.1	-58.3	0	0	0	108.5	D8 E12	D8-H10 PolarHBondContact O-N 3.3Å; H10-E12 PolarHBondContact O-N 3.25Å
11	D	48.3	Very low	57	Low	122 Å²	122	107.7 Å²	107.7	65%	0.652	58%	0.579	S	S	*	*			trans	40.8	72.9	137.7	-56.4	-49.5	0	0	0	116.5	S9 L13	S9-D11 PolarHBondContact O-N 3.23Å; D11-L13 PolarHBondContact O-N 3.08Å
12	E	55	Low	58.8	Low	177 Å²	177	97.1 Å²	97.1	83%	0.827	53%	0.531	S	S	*	.			trans	-68.4	107	148.9	-78.9	-174.7	174.1	0	0	107.4	H10	H10-E12 PolarHBondContact O-N 3.25Å
13	L	60	Low	60.9	Low	34 Å²	34	92 Å²	92	18%	0.178	50%	0.496	C	S	.	.			trans	-52	131.7	165.4	-73.5	172.3	0	0	0	107.6	D11 F15 W35 W45	D11-L13 PolarHBondContact O-N 3.08Å; L13-F15 HydrophobicContact CB-CD2 4.41Å; L13-F15 PolarHBondContact O-N 3.45Å; L13-W35 HydrophobicContact CD1-CE3 3.74Å; L13-W35 HydrophobicContact CD1-CZ3 3.81Å; L13-W35 HydrophobicContact CD2-CB 4.41Å; L13-W35 HydrophobicContact CD2-CE3 4.26Å; L13-W45 HydrophobicContact CB-CZ2 4.07Å; L13-W45 HydrophobicContact CD1-CD2 3.88Å; L13-W45 HydrophobicContact CD1-CE3 4.01Å; L13-W45 HydrophobicContact CD1-CG 4.15Å; L13-W45 HydrophobicContact CD1-CZ3 4.45Å; L13-W45 HydrophobicContact CG-CD2 4.5Å
14	P	66.5	Low	62.8	Low	112 Å²	112	88.6 Å²	88.6	73%	0.727	47%	0.467	S	S	*	.	S	Bend	trans	-73.2	20.9	-172.9	31.4	-36.6	0	0	0	113.2
15	F	72.4	Confident	64.7	Low	70 Å²	70	81 Å²	81	31%	0.307	43%	0.43	S	S	.	.	S	Bend	trans	-123.3	141.4	-170	-56	-68.8	0	0	0	109.5	L13 V20 W35	L13-F15 HydrophobicContact CB-CD2 4.41Å; L13-F15 PolarHBondContact O-N 3.45Å; F15-V20 HydrophobicContact CB-CG2 3.84Å; F15-W35 HydrophobicContact CD2-CD2 4.46Å; F15-W35 AromaticContact CD2-CE2 3.84Å; F15-W35 HydrophobicContact CD2-CZ2 4.14Å; F15-W35 AromaticContact CD2-NE1 3.64Å; F15-W35 AromaticContact CE2-CD1 3.56Å; F15-W35 AromaticContact CE2-CE2 3.98Å; F15-W35 HydrophobicContact CE2-CG 4.37Å; F15-W35 AromaticContact CE2-NE1 3.31Å; F15-W35 VanDerWaalsContact CE2-NE1 3.31Å; F15-W35 AromaticContact CZ-NE1 3.89Å
16	D	83.9	Confident	66.5	Low	96 Å²	96	82.5 Å²	82.5	51%	0.513	43%	0.43	S	S	.	.			trans	-63.8	140.5	172.6	-168.8	-67.4	0	0	0	109.5	D18 E19 V20	D16-D18 PolarHBondContact O-N 3.42Å; D16-D18 VanDerWaalsContact O-N 3.07Å; D16-D18 VanDerWaalsContact OD1-CB 3.23Å; D16-D18 WeakPolarHBondContact OD1-CB 3.36Å; D16-D18 PolarHBondContact OD1-N 3.16Å; D16-E19 HydrophobicContact CB-CB 4.47Å; D16-E19 WeakPolarHBondContact O-CA 3.29Å; D16-E19 WeakPolarHBondContact O-CB 3.4Å; D16-E19 PolarHBondContact O-N 2.99Å; D16-V20 WeakPolarHBondContact O-CG2 3.5Å; D16-V20 PolarHBondContact O-N 3.02Å
17	I	85.5	Confident	68.4	Low	19 Å²	19	77.8 Å²	77.8	10%	0.097	41%	0.41	C	S	.	.	H	α-helix	trans	-50.6	-35.1	176.8	-178.5	58.9	0	0	0	112	V20 M21 W45 T46 Q49 I50	I17-V20 WeakPolarHBondContact O-CB 3.32Å; I17-V20 PolarHBondContact O-N 2.88Å; I17-M21 HydrophobicContact CD1-CG 4.18Å; I17-M21 HydrophobicContact CG1-CG 4.38Å; I17-M21 WeakPolarHBondContact O-CB 3.45Å; I17-M21 WeakPolarHBondContact O-CG 2.97Å; I17-M21 PolarHBondContact O-N 3.5Å; I17-W45 HydrophobicContact CB-CH2 4.14Å; I17-W45 HydrophobicContact CB-CZ3 4.2Å; I17-W45 HydrophobicContact CD1-CE3 4.01Å; I17-W45 HydrophobicContact CD1-CH2 4.21Å; I17-W45 HydrophobicContact CD1-CZ3 3.42Å; I17-W45 VanDerWaalsContact CD1-CZ3 3.42Å; I17-W45 HydrophobicContact CG1-CZ3 4.4Å; I17-T46 HydrophobicContact CD1-CG2 3.94Å; I17-Q49 HydrophobicContact CB-CB 4.16Å; I17-Q49 HydrophobicContact CB-CG 4.45Å; I17-Q49 HydrophobicContact CD1-CB 3.82Å; I17-Q49 HydrophobicContact CD1-CG 4.19Å; I17-Q49 HydrophobicContact CG1-CB 3.89Å; I17-I50 HydrophobicContact CD1-CG2 4.44Å; I17-I50 HydrophobicContact CG1-CG2 4.04Å
18	D	84.8	Confident	69.8	Low	41 Å²	41	76 Å²	76	22%	0.219	41%	0.406	C	S	.	.	H	α-helix	trans	-69	-39.7	179.7	-85.3	-43.8	0	0	0	111.3	D16 V20 M21 A22 K56 Q97	D16-D18 PolarHBondContact O-N 3.42Å; D16-D18 VanDerWaalsContact O-N 3.07Å; D16-D18 VanDerWaalsContact OD1-CB 3.23Å; D16-D18 WeakPolarHBondContact OD1-CB 3.36Å; D16-D18 PolarHBondContact OD1-N 3.16Å; D18-V20 VanDerWaalsContact C-N 3.35Å; D18-M21 PolarHBondContact O-N 2.9Å; D18-A22 WeakPolarHBondContact O-CB 3.09Å; D18-A22 PolarHBondContact O-N 3.29Å; D18-K56 IonicContact OD1-NZ 2.78Å; D18-K56 IonicContact OD2-NZ 3.86Å; D18-K56 PolarHBondContact OD2-NZ 3.25Å; D18-Q97 VanDerWaalsContact C-NE2 3.27Å; D18-Q97 HydrophobicContact CB-CG 4.45Å; D18-Q97 PolarHBondContact O-NE2 3.03Å; D18-Q97 PolarHBondContact O-OE1 3.36Å; D18-Q97 PolarHBondContact OD1-NE2 3.31Å
19	E	82.4	Confident	71	Confident	112 Å²	112	71.5 Å²	71.5	52%	0.523	39%	0.393	S	S	.	.	H	α-helix	trans	-64.7	-40.8	171.6	-172.6	175.6	-167.4	0	0	111.4	D16 M21 A22 A23	D16-E19 HydrophobicContact CB-CB 4.47Å; D16-E19 WeakPolarHBondContact O-CA 3.29Å; D16-E19 WeakPolarHBondContact O-CB 3.4Å; D16-E19 PolarHBondContact O-N 2.99Å; E19-M21 PolarHBondContact O-N 2.66Å; E19-A22 PolarHBondContact O-N 3.36Å; E19-A23 WeakPolarHBondContact O-CB 3.32Å; E19-A23 PolarHBondContact O-N 2.74Å
20	V	82.9	Confident	72.3	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-59.9	-47.1	177.1	162.6	0	0	0	0	111.7	F15 D16 I17 D18 A23 K24 F31 W35 I42 W45	F15-V20 HydrophobicContact CB-CG2 3.84Å; D16-V20 WeakPolarHBondContact O-CG2 3.5Å; D16-V20 PolarHBondContact O-N 3.02Å; I17-V20 WeakPolarHBondContact O-CB 3.32Å; I17-V20 PolarHBondContact O-N 2.88Å; D18-V20 VanDerWaalsContact C-N 3.35Å; V20-A23 PolarHBondContact O-N 2.99Å; V20-K24 PolarHBondContact O-N 3.41Å; V20-K24 VanDerWaalsContact O-N 3.14Å; V20-F31 HydrophobicContact CG1-CE1 4.36Å; V20-F31 WeakPolarHBondContact O-CZ 2.95Å; V20-W35 HydrophobicContact CB-CH2 3.46Å; V20-W35 VanDerWaalsContact CB-CH2 3.46Å; V20-W35 HydrophobicContact CB-CZ2 4.36Å; V20-W35 HydrophobicContact CB-CZ3 4.12Å; V20-W35 HydrophobicContact CG1-CH2 3.42Å; V20-W35 VanDerWaalsContact CG1-CH2 3.42Å; V20-W35 HydrophobicContact CG1-CZ3 3.64Å; V20-W35 HydrophobicContact CG2-CH2 3.16Å; V20-W35 HydrophobicContact CG2-CZ2 3.82Å; V20-W35 HydrophobicContact CG2-CZ3 3.76Å; V20-I42 HydrophobicContact CG1-CG2 4.33Å; V20-W45 HydrophobicContact CB-CZ3 3.96Å; V20-W45 HydrophobicContact CG1-CE3 4.35Å; V20-W45 HydrophobicContact CG1-CZ3 3.92Å; V20-W45 HydrophobicContact CG2-CH2 3.95Å; V20-W45 HydrophobicContact CG2-CZ3 3.6Å
21	M	83.3	Confident	73.2	Confident	9 Å²	9	64.1 Å²	64.1	4%	0.044	35%	0.352	C	S	.	.	H	α-helix	trans	-67.4	-37.2	179.2	-68.7	-68.9	-69	0	0	112	I17 D18 E19 K24 R25 T46 V60	I17-M21 HydrophobicContact CD1-CG 4.18Å; I17-M21 HydrophobicContact CG1-CG 4.38Å; I17-M21 WeakPolarHBondContact O-CB 3.45Å; I17-M21 WeakPolarHBondContact O-CG 2.97Å; I17-M21 PolarHBondContact O-N 3.5Å; D18-M21 PolarHBondContact O-N 2.9Å; E19-M21 PolarHBondContact O-N 2.66Å; M21-K24 WeakPolarHBondContact O-CB 3.39Å; M21-K24 PolarHBondContact O-N 2.87Å; M21-K24 HydrophobicContact SD-CD 4.49Å; M21-R25 WeakPolarHBondContact O-CD 3.36Å; M21-R25 WeakPolarHBondContact O-CG 3.29Å; M21-R25 PolarHBondContact O-N 3.47Å; M21-T46 HydrophobicContact SD-CG2 3.46Å; M21-T46 WeakPolarHBondContact SD-CG2 3.3Å; M21-V60 HydrophobicContact CE-CB 4.09Å; M21-V60 HydrophobicContact CE-CG1 3.89Å; M21-V60 HydrophobicContact CE-CG2 3.21Å; M21-V60 HydrophobicContact SD-CG2 4.41Å
22	A	81.4	Confident	73.8	Confident	23 Å²	23	63.4 Å²	63.4	19%	0.19	35%	0.351	C	S	.	.	H	α-helix	trans	-64.8	-42	174.9	0	0	0	0	0	112.1	D18 E19 K24 R25 N26	D18-A22 WeakPolarHBondContact O-CB 3.09Å; D18-A22 PolarHBondContact O-N 3.29Å; E19-A22 PolarHBondContact O-N 3.36Å; A22-K24 VanDerWaalsContact C-N 3.29Å; A22-K24 PolarHBondContact O-N 3.43Å; A22-R25 PolarHBondContact O-N 3.31Å; A22-N26 PolarHBondContact O-N 2.98Å; A22-N26 PolarHBondContact O-ND2 2.87Å
23	A	80.3	Confident	74.3	Confident	13 Å²	13	59.2 Å²	59.2	11%	0.107	34%	0.342	C	S	.	.	H	α-helix	trans	-59.9	-40.1	174.7	0	0	0	0	0	111.7	E19 V20 R25 N26 N27 M30 F31	E19-A23 WeakPolarHBondContact O-CB 3.32Å; E19-A23 PolarHBondContact O-N 2.74Å; V20-A23 PolarHBondContact O-N 2.99Å; A23-R25 VanDerWaalsContact C-N 3.28Å; A23-R25 PolarHBondContact O-N 3.41Å; A23-N26 PolarHBondContact O-N 3.44Å; A23-N27 CarbonylContact O-C 3.57Å; A23-N27 PolarHBondContact O-N 3.16Å; A23-M30 HydrophobicContact CB-CE 3.46Å; A23-M30 VanDerWaalsContact CB-CE 3.46Å; A23-F31 VanDerWaalsContact C-CE2 3.42Å; A23-F31 HydrophobicContact CB-CE2 3.98Å; A23-F31 HydrophobicContact CB-CZ 3.56Å
24	K	79.1	Confident	74.6	Confident	44 Å²	44	60.4 Å²	60.4	19%	0.191	36%	0.356	C	S	.	.	H	α-helix	trans	-58.9	-42.8	179.6	-83.9	-170.5	155.4	167.6	0	111.4	V20 M21 A22 F31 N43	V20-K24 PolarHBondContact O-N 3.41Å; V20-K24 VanDerWaalsContact O-N 3.14Å; M21-K24 WeakPolarHBondContact O-CB 3.39Å; M21-K24 PolarHBondContact O-N 2.87Å; M21-K24 HydrophobicContact SD-CD 4.49Å; A22-K24 VanDerWaalsContact C-N 3.29Å; A22-K24 PolarHBondContact O-N 3.43Å; K24-F31 VanDerWaalsContact CA-CZ 3.43Å; K24-F31 HydrophobicContact CB-CE2 4.03Å; K24-F31 HydrophobicContact CB-CZ 3.8Å; K24-F31 HydrophobicContact CD-CZ 4.4Å; K24-F31 HydrophobicContact CG-CD1 4.48Å; K24-F31 HydrophobicContact CG-CD2 4.38Å; K24-F31 HydrophobicContact CG-CE1 3.57Å; K24-F31 HydrophobicContact CG-CE2 3.58Å; K24-F31 HydrophobicContact CG-CZ 3.1Å; K24-F31 VanDerWaalsContact N-CE2 3.29Å; K24-N43 PolarHBondContact NZ-OD1 2.95Å
25	R	79.6	Confident	74.7	Confident	26 Å²	26	56.8 Å²	56.8	10%	0.098	33%	0.328	C	S	.	.	H	α-helix	trans	-67.2	-39.7	-179.4	-69	157.6	-173.2	145	8	112.9	M21 A22 A23 E63 D98	M21-R25 WeakPolarHBondContact O-CD 3.36Å; M21-R25 WeakPolarHBondContact O-CG 3.29Å; M21-R25 PolarHBondContact O-N 3.47Å; A22-R25 PolarHBondContact O-N 3.31Å; A23-R25 VanDerWaalsContact C-N 3.28Å; A23-R25 PolarHBondContact O-N 3.41Å; R25-E63 WeakPolarHBondContact CD-OE1 3.19Å; R25-E63 WeakPolarHBondContact CG-OE1 3.4Å; R25-E63 IonicContact CZ-OE1 3.21Å; R25-E63 IonicContact CZ-OE2 2.87Å; R25-E63 IonicContact NE-OE1 2.71Å; R25-E63 PolarHBondContact NE-OE1 3.17Å; R25-E63 IonicContact NE-OE2 3.93Å; R25-E63 PolarHBondContact NE-OE2 3.16Å; R25-E63 IonicContact NH2-OE1 3.26Å; R25-E63 IonicContact NH2-OE2 3.54Å; R25-E63 PolarHBondContact NH2-OE2 3.14Å; R25-D98 IonicContact NH1-OD2 3.33Å
26	N	76.7	Confident	74.8	Confident	139 Å²	139	62.4 Å²	62.4	74%	0.743	36%	0.355	S	S	*	.	H	α-helix	trans	-93.8	-33.9	-169.1	-68	-28.5	0	0	0	113.4	A22 A23	A22-N26 PolarHBondContact O-N 2.98Å; A22-N26 PolarHBondContact O-ND2 2.87Å; A23-N26 PolarHBondContact O-N 3.44Å
27	N	75.3	Confident	74.3	Confident	82 Å²	82	58.8 Å²	58.8	44%	0.439	34%	0.339	S	S	.	.			trans	-153.8	82.4	-177.4	-169.6	-0.6	0	0	0	112.2	A23 G29 M30	A23-N27 CarbonylContact O-C 3.57Å; A23-N27 PolarHBondContact O-N 3.16Å; N27-G29 PolarHBondContact O-N 3.48Å; N27-G29 VanDerWaalsContact O-N 3.1Å; N27-G29 PolarHBondContact OD1-N 2.7Å; N27-M30 HydrophobicContact CB-CB 4.08Å; N27-M30 VanDerWaalsContact O-CB 3.24Å; N27-M30 WeakPolarHBondContact O-CB 3.31Å; N27-M30 PolarHBondContact O-N 2.87Å
28	P	64.3	Low	73.9	Confident	95 Å²	95	61.7 Å²	61.7	62%	0.617	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-27.1	178.9	-20.9	29.3	0	0	0	113.7	M30 F31	P28-M30 VanDerWaalsContact C-N 3.26Å; P28-M30 PolarHBondContact O-N 3.27Å; P28-F31 WeakPolarHBondContact O-CD2 3.23Å
29	G	64.4	Low	73.7	Confident	48 Å²	48	66.2 Å²	66.2	50%	0.495	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-17.2	177.4	0	0	0	0	0	114.1	N27 F31 S33	N27-G29 PolarHBondContact O-N 3.48Å; N27-G29 VanDerWaalsContact O-N 3.1Å; N27-G29 PolarHBondContact OD1-N 2.7Å; G29-F31 VanDerWaalsContact C-N 3.26Å; G29-F31 PolarHBondContact O-N 3.01Å; G29-S33 PolarHBondContact O-OG 2.83Å
30	M	67.8	Low	73.7	Confident	73 Å²	73	66.3 Å²	66.3	36%	0.36	38%	0.378	S	S	.	.	H	α-helix	trans	-68	-27.9	-179.7	-161.8	171.6	51.9	0	0	112.3	A23 N27 P28 S33 A34	A23-M30 HydrophobicContact CB-CE 3.46Å; A23-M30 VanDerWaalsContact CB-CE 3.46Å; N27-M30 HydrophobicContact CB-CB 4.08Å; N27-M30 VanDerWaalsContact O-CB 3.24Å; N27-M30 WeakPolarHBondContact O-CB 3.31Å; N27-M30 PolarHBondContact O-N 2.87Å; P28-M30 VanDerWaalsContact C-N 3.26Å; P28-M30 PolarHBondContact O-N 3.27Å; M30-S33 PolarHBondContact O-N 3.02Å; M30-S33 PolarHBondContact O-OG 3.48Å; M30-A34 HydrophobicContact CG-CB 4.04Å; M30-A34 WeakPolarHBondContact O-CB 3.49Å; M30-A34 PolarHBondContact O-N 2.78Å
31	F	63.5	Low	73.7	Confident	12 Å²	12	70.7 Å²	70.7	5%	0.053	40%	0.402	C	S	.	.	H	α-helix	trans	-61.2	-50	-176.7	-74.2	-86.1	0	0	0	113.2	V20 A23 K24 P28 G29 S33 W35 I42	V20-F31 HydrophobicContact CG1-CE1 4.36Å; V20-F31 WeakPolarHBondContact O-CZ 2.95Å; A23-F31 VanDerWaalsContact C-CE2 3.42Å; A23-F31 HydrophobicContact CB-CE2 3.98Å; A23-F31 HydrophobicContact CB-CZ 3.56Å; K24-F31 VanDerWaalsContact CA-CZ 3.43Å; K24-F31 HydrophobicContact CB-CE2 4.03Å; K24-F31 HydrophobicContact CB-CZ 3.8Å; K24-F31 HydrophobicContact CD-CZ 4.4Å; K24-F31 HydrophobicContact CG-CD1 4.48Å; K24-F31 HydrophobicContact CG-CD2 4.38Å; K24-F31 HydrophobicContact CG-CE1 3.57Å; K24-F31 HydrophobicContact CG-CE2 3.58Å; K24-F31 HydrophobicContact CG-CZ 3.1Å; K24-F31 VanDerWaalsContact N-CE2 3.29Å; P28-F31 WeakPolarHBondContact O-CD2 3.23Å; G29-F31 VanDerWaalsContact C-N 3.26Å; G29-F31 PolarHBondContact O-N 3.01Å; F31-S33 PolarHBondContact O-N 3.41Å; F31-W35 HydrophobicContact CD1-CD2 4.16Å; F31-W35 AromaticContact CD1-CE3 3.6Å; F31-W35 HydrophobicContact CD1-CE3 3.6Å; F31-W35 AromaticContact CD1-CH2 3.74Å; F31-W35 HydrophobicContact CD1-CH2 3.74Å; F31-W35 HydrophobicContact CD1-CZ2 4.36Å; F31-W35 AromaticContact CD1-CZ3 3.39Å; F31-W35 HydrophobicContact CD1-CZ3 3.39Å; F31-W35 AromaticContact CE1-CE3 3.91Å; F31-W35 HydrophobicContact CE1-CE3 3.91Å; F31-W35 AromaticContact CE1-CH2 3.16Å; F31-W35 HydrophobicContact CE1-CH2 3.16Å; F31-W35 AromaticContact CE1-CZ2 3.94Å; F31-W35 HydrophobicContact CE1-CZ2 3.94Å; F31-W35 AromaticContact CE1-CZ3 3.21Å; F31-W35 HydrophobicContact CE1-CZ3 3.21Å; F31-W35 AromaticContact CZ-CH2 3.98Å; F31-W35 HydrophobicContact CZ-CH2 3.98Å; F31-W35 HydrophobicContact CZ-CZ3 4.39Å; F31-W35 PolarHBondContact O-N 3.45Å; F31-I42 HydrophobicContact CB-CD1 3.54Å; F31-I42 HydrophobicContact CD1-CD1 3.36Å; F31-I42 HydrophobicContact CD1-CG1 4.12Å; F31-I42 HydrophobicContact CD1-CG2 3.86Å; F31-I42 HydrophobicContact CE1-CD1 4.45Å; F31-I42 HydrophobicContact CE1-CG2 3.91Å; F31-I42 HydrophobicContact CG-CD1 3.83Å
32	V	61.1	Low	73.5	Confident	106 Å²	106	70.4 Å²	70.4	64%	0.642	40%	0.4	S	S	*	.	H	α-helix	trans	-63.4	-31.6	-178.2	-177.5	0	0	0	0	111.5
33	S	65.9	Low	73.5	Confident	90 Å²	90	71.7 Å²	71.7	63%	0.629	40%	0.404	S	S	*	.	H	α-helix	trans	-94.5	-40.2	-173.3	51.8	0	0	0	0	113.9	G29 M30 F31	G29-S33 PolarHBondContact O-OG 2.83Å; M30-S33 PolarHBondContact O-N 3.02Å; M30-S33 PolarHBondContact O-OG 3.48Å; F31-S33 PolarHBondContact O-N 3.41Å
34	A	65.3	Low	73.8	Confident	59 Å²	59	76.6 Å²	76.6	49%	0.488	43%	0.428	S	S	.	.	H	α-helix	trans	-83.3	-34.7	-176	0	0	0	0	0	112.4	M30	M30-A34 HydrophobicContact CG-CB 4.04Å; M30-A34 WeakPolarHBondContact O-CB 3.49Å; M30-A34 PolarHBondContact O-N 2.78Å
35	W	69.5	Low	74.1	Confident	36 Å²	36	76.1 Å²	76.1	14%	0.136	43%	0.425	C	S	.	.	S	Bend	trans	-109.7	-6.6	-170	-58.3	-7.2	0	0	0	113.8	L13 F15 V20 F31 A37 I42	L13-W35 HydrophobicContact CD1-CE3 3.74Å; L13-W35 HydrophobicContact CD1-CZ3 3.81Å; L13-W35 HydrophobicContact CD2-CB 4.41Å; L13-W35 HydrophobicContact CD2-CE3 4.26Å; F15-W35 HydrophobicContact CD2-CD2 4.46Å; F15-W35 AromaticContact CD2-CE2 3.84Å; F15-W35 HydrophobicContact CD2-CZ2 4.14Å; F15-W35 AromaticContact CD2-NE1 3.64Å; F15-W35 AromaticContact CE2-CD1 3.56Å; F15-W35 AromaticContact CE2-CE2 3.98Å; F15-W35 HydrophobicContact CE2-CG 4.37Å; F15-W35 AromaticContact CE2-NE1 3.31Å; F15-W35 VanDerWaalsContact CE2-NE1 3.31Å; F15-W35 AromaticContact CZ-NE1 3.89Å; V20-W35 HydrophobicContact CB-CH2 3.46Å; V20-W35 VanDerWaalsContact CB-CH2 3.46Å; V20-W35 HydrophobicContact CB-CZ2 4.36Å; V20-W35 HydrophobicContact CB-CZ3 4.12Å; V20-W35 HydrophobicContact CG1-CH2 3.42Å; V20-W35 VanDerWaalsContact CG1-CH2 3.42Å; V20-W35 HydrophobicContact CG1-CZ3 3.64Å; V20-W35 HydrophobicContact CG2-CH2 3.16Å; V20-W35 HydrophobicContact CG2-CZ2 3.82Å; V20-W35 HydrophobicContact CG2-CZ3 3.76Å; F31-W35 HydrophobicContact CD1-CD2 4.16Å; F31-W35 AromaticContact CD1-CE3 3.6Å; F31-W35 HydrophobicContact CD1-CE3 3.6Å; F31-W35 AromaticContact CD1-CH2 3.74Å; F31-W35 HydrophobicContact CD1-CH2 3.74Å; F31-W35 HydrophobicContact CD1-CZ2 4.36Å; F31-W35 AromaticContact CD1-CZ3 3.39Å; F31-W35 HydrophobicContact CD1-CZ3 3.39Å; F31-W35 AromaticContact CE1-CE3 3.91Å; F31-W35 HydrophobicContact CE1-CE3 3.91Å; F31-W35 AromaticContact CE1-CH2 3.16Å; F31-W35 HydrophobicContact CE1-CH2 3.16Å; F31-W35 AromaticContact CE1-CZ2 3.94Å; F31-W35 HydrophobicContact CE1-CZ2 3.94Å; F31-W35 AromaticContact CE1-CZ3 3.21Å; F31-W35 HydrophobicContact CE1-CZ3 3.21Å; F31-W35 AromaticContact CZ-CH2 3.98Å; F31-W35 HydrophobicContact CZ-CH2 3.98Å; F31-W35 HydrophobicContact CZ-CZ3 4.39Å; F31-W35 PolarHBondContact O-N 3.45Å; W35-A37 PolarHBondContact O-N 3.22Å; W35-I42 HydrophobicContact CE3-CD1 4.03Å; W35-I42 HydrophobicContact CE3-CG1 3.87Å; W35-I42 HydrophobicContact CE3-CG2 4.49Å; W35-I42 HydrophobicContact CZ3-CD1 4.45Å; W35-I42 HydrophobicContact CZ3-CG1 4.13Å; W35-I42 HydrophobicContact CZ3-CG2 3.9Å
36	Q	73.8	Confident	74.4	Confident	187 Å²	187	75 Å²	75	87%	0.874	42%	0.421	S	S	*	.			trans	54	21.9	-178.4	-56.8	-175.1	-16.5	0	0	113.7
37	A	72.6	Confident	75	Confident	20 Å²	20	72.9 Å²	72.9	17%	0.165	41%	0.41	C	S	.	.			trans	-114.8	147.5	179	0	0	0	0	0	109.3	W35 D41 I42	W35-A37 PolarHBondContact O-N 3.22Å; A37-D41 HydrophobicContact CB-CB 4.24Å; A37-I42 HydrophobicContact CB-CD1 4.25Å; A37-I42 HydrophobicContact CB-CG1 4.1Å
38	D	78.4	Confident	75.6	Confident	81 Å²	81	72.5 Å²	72.5	43%	0.433	41%	0.408	S	S	.	.			trans	-80.1	165.9	173.7	79.7	33.5	0	0	0	111.4	N40 D41 I42	D38-N40 PolarHBondContact O-N 3.23Å; D38-N40 WeakPolarHBondContact OD1-CA 3.48Å; D38-N40 VanDerWaalsContact OD1-CB 3.24Å; D38-N40 WeakPolarHBondContact OD1-CB 3.36Å; D38-N40 PolarHBondContact OD1-N 3.06Å; D38-D41 PolarHBondContact O-N 3.21Å; D38-D41 PolarHBondContact OD1-N 3.31Å; D38-I42 WeakPolarHBondContact O-CD1 3.46Å; D38-I42 PolarHBondContact O-N 3.09Å
39	E	79.3	Confident	76.8	Confident	135 Å²	135	72.5 Å²	72.5	63%	0.631	40%	0.4	S	S	*	.	H	α-helix	trans	-60.4	-28.9	-176.4	-171	174.5	-173.8	0	0	112.7	N43	E39-N43 WeakPolarHBondContact O-CB 3.32Å; E39-N43 PolarHBondContact O-N 3.05Å; E39-N43 PolarHBondContact O-ND2 3.35Å; E39-N43 VanDerWaalsContact O-ND2 3.09Å
40	N	83.4	Confident	78.1	Confident	114 Å²	114	70.5 Å²	70.5	61%	0.61	38%	0.377	S	S	*	.	H	α-helix	trans	-70.6	-45	178.6	-62.6	-42.1	0	0	0	111.1	D38 I42 N43 L44	D38-N40 PolarHBondContact O-N 3.23Å; D38-N40 WeakPolarHBondContact OD1-CA 3.48Å; D38-N40 VanDerWaalsContact OD1-CB 3.24Å; D38-N40 WeakPolarHBondContact OD1-CB 3.36Å; D38-N40 PolarHBondContact OD1-N 3.06Å; N40-I42 VanDerWaalsContact C-N 3.28Å; N40-I42 PolarHBondContact O-N 3.42Å; N40-N43 WeakPolarHBondContact O-CB 3.3Å; N40-N43 PolarHBondContact O-N 2.96Å; N40-N43 VanDerWaalsContact O-N 3.16Å; N40-L44 WeakPolarHBondContact O-CB 3.43Å; N40-L44 PolarHBondContact O-N 2.94Å
41	D	81.9	Confident	79.1	Confident	93 Å²	93	72.1 Å²	72.1	50%	0.497	38%	0.382	S	S	.	.	H	α-helix	trans	-59.5	-43.7	178.1	-67.1	-31.2	0	0	0	110.8	A37 D38 N43 L44 W45	A37-D41 HydrophobicContact CB-CB 4.24Å; D38-D41 PolarHBondContact O-N 3.21Å; D38-D41 PolarHBondContact OD1-N 3.31Å; D41-N43 PolarHBondContact O-N 3.27Å; D41-L44 PolarHBondContact O-N 3.41Å; D41-W45 WeakPolarHBondContact O-CB 3.44Å; D41-W45 PolarHBondContact O-N 3.15Å
42	I	79.2	Confident	80.4	Confident	2 Å²	2	78.3 Å²	78.3	1%	0.01	42%	0.416	C	S	.	.	H	α-helix	trans	-65.3	-40.8	177.6	-64.8	153.4	0	0	0	110.9	V20 F31 W35 A37 D38 N40 L44 T46	V20-I42 HydrophobicContact CG1-CG2 4.33Å; F31-I42 HydrophobicContact CB-CD1 3.54Å; F31-I42 HydrophobicContact CD1-CD1 3.36Å; F31-I42 HydrophobicContact CD1-CG1 4.12Å; F31-I42 HydrophobicContact CD1-CG2 3.86Å; F31-I42 HydrophobicContact CE1-CD1 4.45Å; F31-I42 HydrophobicContact CE1-CG2 3.91Å; F31-I42 HydrophobicContact CG-CD1 3.83Å; W35-I42 HydrophobicContact CE3-CD1 4.03Å; W35-I42 HydrophobicContact CE3-CG1 3.87Å; W35-I42 HydrophobicContact CE3-CG2 4.49Å; W35-I42 HydrophobicContact CZ3-CD1 4.45Å; W35-I42 HydrophobicContact CZ3-CG1 4.13Å; W35-I42 HydrophobicContact CZ3-CG2 3.9Å; A37-I42 HydrophobicContact CB-CD1 4.25Å; A37-I42 HydrophobicContact CB-CG1 4.1Å; D38-I42 WeakPolarHBondContact O-CD1 3.46Å; D38-I42 PolarHBondContact O-N 3.09Å; N40-I42 VanDerWaalsContact C-N 3.28Å; N40-I42 PolarHBondContact O-N 3.42Å; I42-L44 VanDerWaalsContact C-N 3.34Å; I42-T46 VanDerWaalsContact O-CB 3.24Å; I42-T46 WeakPolarHBondContact O-CB 3.22Å; I42-T46 PolarHBondContact O-N 2.98Å; I42-T46 PolarHBondContact O-OG1 2.94Å
43	N	82.9	Confident	81.9	Confident	50 Å²	50	76 Å²	76	27%	0.267	40%	0.4	S	S	.	.	H	α-helix	trans	-63.1	-41.3	174.9	-73.8	-24.9	0	0	0	111.6	K24 E39 N40 D41 T46 N47	K24-N43 PolarHBondContact NZ-OD1 2.95Å; E39-N43 WeakPolarHBondContact O-CB 3.32Å; E39-N43 PolarHBondContact O-N 3.05Å; E39-N43 PolarHBondContact O-ND2 3.35Å; E39-N43 VanDerWaalsContact O-ND2 3.09Å; N40-N43 WeakPolarHBondContact O-CB 3.3Å; N40-N43 PolarHBondContact O-N 2.96Å; N40-N43 VanDerWaalsContact O-N 3.16Å; D41-N43 PolarHBondContact O-N 3.27Å; N43-T46 PolarHBondContact O-N 3.3Å; N43-N47 WeakPolarHBondContact O-CB 3.24Å; N43-N47 PolarHBondContact O-N 3.41Å; N43-N47 PolarHBondContact O-ND2 3.43Å
44	L	85.9	Confident	83.3	Confident	116 Å²	116	74 Å²	74	61%	0.607	39%	0.385	S	S	*	.	H	α-helix	trans	-63.6	-50.3	178.1	-145.8	102	0	0	0	110.5	N40 D41 I42 T46 N47 D48	N40-L44 WeakPolarHBondContact O-CB 3.43Å; N40-L44 PolarHBondContact O-N 2.94Å; D41-L44 PolarHBondContact O-N 3.41Å; I42-L44 VanDerWaalsContact C-N 3.34Å; L44-T46 PolarHBondContact O-N 3.3Å; L44-N47 WeakPolarHBondContact O-CB 3.39Å; L44-N47 PolarHBondContact O-N 2.87Å; L44-D48 PolarHBondContact O-N 2.93Å
45	W	86.2	Confident	84.7	Confident	34 Å²	34	75 Å²	75	13%	0.129	38%	0.379	C	S	.	.	H	α-helix	trans	-59.2	-46.3	176.1	-176.6	92.1	0	0	0	111.4	L13 I17 V20 D41 N47 D48 Q49	L13-W45 HydrophobicContact CB-CZ2 4.07Å; L13-W45 HydrophobicContact CD1-CD2 3.88Å; L13-W45 HydrophobicContact CD1-CE3 4.01Å; L13-W45 HydrophobicContact CD1-CG 4.15Å; L13-W45 HydrophobicContact CD1-CZ3 4.45Å; L13-W45 HydrophobicContact CG-CD2 4.5Å; I17-W45 HydrophobicContact CB-CH2 4.14Å; I17-W45 HydrophobicContact CB-CZ3 4.2Å; I17-W45 HydrophobicContact CD1-CE3 4.01Å; I17-W45 HydrophobicContact CD1-CH2 4.21Å; I17-W45 HydrophobicContact CD1-CZ3 3.42Å; I17-W45 VanDerWaalsContact CD1-CZ3 3.42Å; I17-W45 HydrophobicContact CG1-CZ3 4.4Å; V20-W45 HydrophobicContact CB-CZ3 3.96Å; V20-W45 HydrophobicContact CG1-CE3 4.35Å; V20-W45 HydrophobicContact CG1-CZ3 3.92Å; V20-W45 HydrophobicContact CG2-CH2 3.95Å; V20-W45 HydrophobicContact CG2-CZ3 3.6Å; D41-W45 WeakPolarHBondContact O-CB 3.44Å; D41-W45 PolarHBondContact O-N 3.15Å; W45-N47 VanDerWaalsContact C-N 3.31Å; W45-N47 PolarHBondContact O-N 3.38Å; W45-D48 PolarHBondContact O-N 3.18Å; W45-D48 VanDerWaalsContact O-N 3.15Å; W45-Q49 HydrophobicContact CD2-CG 3.73Å; W45-Q49 HydrophobicContact CE3-CG 3.84Å; W45-Q49 HydrophobicContact CG-CG 4.5Å; W45-Q49 HydrophobicContact CH2-CG 3.72Å; W45-Q49 HydrophobicContact CZ2-CG 3.58Å; W45-Q49 HydrophobicContact CZ3-CG 3.84Å; W45-Q49 WeakPolarHBondContact O-CG 3.4Å; W45-Q49 PolarHBondContact O-N 3.44Å
46	T	85.8	Confident	85.8	Confident	3 Å²	3	76.3 Å²	76.3	2%	0.018	39%	0.385	C	S	.	.	H	α-helix	trans	-55.1	-48.8	176.5	-58.9	0	0	0	0	110.6	I17 M21 I42 N43 L44 D48 Q49 I50	I17-T46 HydrophobicContact CD1-CG2 3.94Å; M21-T46 HydrophobicContact SD-CG2 3.46Å; M21-T46 WeakPolarHBondContact SD-CG2 3.3Å; I42-T46 VanDerWaalsContact O-CB 3.24Å; I42-T46 WeakPolarHBondContact O-CB 3.22Å; I42-T46 PolarHBondContact O-N 2.98Å; I42-T46 PolarHBondContact O-OG1 2.94Å; N43-T46 PolarHBondContact O-N 3.3Å; L44-T46 PolarHBondContact O-N 3.3Å; T46-D48 VanDerWaalsContact C-N 3.33Å; T46-D48 PolarHBondContact O-N 2.94Å; T46-Q49 PolarHBondContact O-N 3.1Å; T46-I50 HydrophobicContact CG2-CD1 4.49Å; T46-I50 WeakPolarHBondContact O-CG1 3.33Å; T46-I50 PolarHBondContact O-N 3.23Å; T46-I50 VanDerWaalsContact O-N 3.16Å
47	N	87.7	Confident	86.9	Confident	94 Å²	94	69.8 Å²	69.8	50%	0.503	36%	0.355	S	S	.	.	H	α-helix	trans	-62.2	-40.6	179.7	-73.9	-20.7	0	0	0	111.8	N43 L44 W45 I50 K51	N43-N47 WeakPolarHBondContact O-CB 3.24Å; N43-N47 PolarHBondContact O-N 3.41Å; N43-N47 PolarHBondContact O-ND2 3.43Å; L44-N47 WeakPolarHBondContact O-CB 3.39Å; L44-N47 PolarHBondContact O-N 2.87Å; W45-N47 VanDerWaalsContact C-N 3.31Å; W45-N47 PolarHBondContact O-N 3.38Å; N47-I50 PolarHBondContact O-N 2.97Å; N47-K51 WeakPolarHBondContact O-CB 3.39Å; N47-K51 PolarHBondContact O-N 3.1Å; N47-K51 VanDerWaalsContact O-N 3.09Å
48	D	89.3	Confident	88	Confident	75 Å²	75	68.9 Å²	68.9	40%	0.401	35%	0.347	S	S	.	.	H	α-helix	trans	-65.2	-38.6	176.6	-92.7	-40.6	0	0	0	112.8	L44 W45 T46 K51	L44-D48 PolarHBondContact O-N 2.93Å; W45-D48 PolarHBondContact O-N 3.18Å; W45-D48 VanDerWaalsContact O-N 3.15Å; T46-D48 VanDerWaalsContact C-N 3.33Å; T46-D48 PolarHBondContact O-N 2.94Å; D48-K51 WeakPolarHBondContact O-CE 3.48Å; D48-K51 VanDerWaalsContact O-CG 3.32Å; D48-K51 WeakPolarHBondContact O-CG 3.36Å; D48-K51 IonicContact OD1-NZ 2.74Å; D48-K51 PolarHBondContact OD1-NZ 3.21Å
49	Q	89.8	Confident	88.8	Confident	95 Å²	95	65.2 Å²	65.2	44%	0.444	33%	0.327	S	S	.	.	H	α-helix	trans	-69.2	-32.8	178.5	-67.2	-50.7	-48.1	0	0	113	I17 W45 T46	I17-Q49 HydrophobicContact CB-CB 4.16Å; I17-Q49 HydrophobicContact CB-CG 4.45Å; I17-Q49 HydrophobicContact CD1-CB 3.82Å; I17-Q49 HydrophobicContact CD1-CG 4.19Å; I17-Q49 HydrophobicContact CG1-CB 3.89Å; W45-Q49 HydrophobicContact CD2-CG 3.73Å; W45-Q49 HydrophobicContact CE3-CG 3.84Å; W45-Q49 HydrophobicContact CG-CG 4.5Å; W45-Q49 HydrophobicContact CH2-CG 3.72Å; W45-Q49 HydrophobicContact CZ2-CG 3.58Å; W45-Q49 HydrophobicContact CZ3-CG 3.84Å; W45-Q49 WeakPolarHBondContact O-CG 3.4Å; W45-Q49 PolarHBondContact O-N 3.44Å; T46-Q49 PolarHBondContact O-N 3.1Å
50	I	90.8	Very high	89.5	Confident	5 Å²	5	59.3 Å²	59.3	3%	0.026	30%	0.3	C	S	.	.	H	α-helix	trans	-96.2	-3.6	-177.1	70	-176.6	0	0	0	113.1	I17 T46 N47 D52 D53 K56 Q57 V60	I17-I50 HydrophobicContact CD1-CG2 4.44Å; I17-I50 HydrophobicContact CG1-CG2 4.04Å; T46-I50 HydrophobicContact CG2-CD1 4.49Å; T46-I50 WeakPolarHBondContact O-CG1 3.33Å; T46-I50 PolarHBondContact O-N 3.23Å; T46-I50 VanDerWaalsContact O-N 3.16Å; N47-I50 PolarHBondContact O-N 2.97Å; I50-D52 PolarHBondContact O-N 3.19Å; I50-D52 VanDerWaalsContact O-N 3.1Å; I50-D53 CarbonylContact O-C 3.49Å; I50-D53 PolarHBondContact O-N 2.96Å; I50-K56 HydrophobicContact CB-CB 4.06Å; I50-K56 HydrophobicContact CG2-CB 3.99Å; I50-K56 HydrophobicContact CG2-CD 4.34Å; I50-Q57 HydrophobicContact CB-CG 4.33Å; I50-Q57 HydrophobicContact CD1-CG 4.07Å; I50-Q57 HydrophobicContact CG1-CG 3.77Å; I50-Q57 WeakPolarHBondContact O-CG 3.49Å; I50-V60 HydrophobicContact CD1-CB 3.89Å; I50-V60 HydrophobicContact CD1-CG1 4.04Å; I50-V60 HydrophobicContact CD1-CG2 3.82Å
51	K	88.8	Confident	90.1	Very high	107 Å²	107	54.1 Å²	54.1	47%	0.465	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-31.3	-168.4	71.7	-169.8	159.7	-163.6	0	115.4	N47 D48 Q57	N47-K51 WeakPolarHBondContact O-CB 3.39Å; N47-K51 PolarHBondContact O-N 3.1Å; N47-K51 VanDerWaalsContact O-N 3.09Å; D48-K51 WeakPolarHBondContact O-CE 3.48Å; D48-K51 VanDerWaalsContact O-CG 3.32Å; D48-K51 WeakPolarHBondContact O-CG 3.36Å; D48-K51 IonicContact OD1-NZ 2.74Å; D48-K51 PolarHBondContact OD1-NZ 3.21Å; K51-Q57 VanDerWaalsContact CA-NE2 3.34Å; K51-Q57 PolarHBondContact O-NE2 2.97Å
52	D	89.8	Confident	90.8	Very high	143 Å²	143	49.7 Å²	49.7	77%	0.765	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-3.6	-178.2	-60.4	-48.6	0	0	0	112.9	I50 P54	I50-D52 PolarHBondContact O-N 3.19Å; I50-D52 VanDerWaalsContact O-N 3.1Å; D52-P54 WeakPolarHBondContact O-CD 3.17Å
53	D	94.1	Very high	91.5	Very high	57 Å²	57	50.7 Å²	50.7	31%	0.305	25%	0.254	S	S	.	.			trans	-112.3	95.3	176.2	-172.4	-21.2	0	0	0	110.5	I50 K55 K56 Q57	I50-D53 CarbonylContact O-C 3.49Å; I50-D53 PolarHBondContact O-N 2.96Å; D53-K55 PolarHBondContact O-N 3.46Å; D53-K55 WeakPolarHBondContact OD1-CA 3.48Å; D53-K55 WeakPolarHBondContact OD1-CB 3.35Å; D53-K55 PolarHBondContact OD1-N 3.44Å; D53-K56 HydrophobicContact CB-CB 4.05Å; D53-K56 HydrophobicContact CB-CD 4.37Å; D53-K56 HydrophobicContact CB-CG 4.3Å; D53-K56 PolarHBondContact O-N 3.16Å; D53-K56 PolarHBondContact OD1-N 3.44Å; D53-K56 VanDerWaalsContact OD1-N 3.1Å; D53-K56 WeakPolarHBondContact OD2-CD 3.47Å; D53-K56 WeakPolarHBondContact OD2-CG 3.36Å; D53-Q57 PolarHBondContact O-N 3.26Å
54	P	94.2	Very high	92	Very high	49 Å²	49	52.9 Å²	52.9	32%	0.318	27%	0.266	S	S	.	.	H	α-helix	trans	-62.6	-26.3	-178.9	24.4	-33.2	0	0	0	112.5	D52 F58 L73 L91	D52-P54 WeakPolarHBondContact O-CD 3.17Å; P54-F58 WeakPolarHBondContact O-CB 3.33Å; P54-F58 PolarHBondContact O-N 3.01Å; P54-L73 HydrophobicContact CB-CD2 3.98Å; P54-L91 HydrophobicContact CB-CD1 4.49Å; P54-L91 WeakPolarHBondContact O-CD1 3.36Å
55	K	95.5	Very high	92.5	Very high	80 Å²	80	51.3 Å²	51.3	35%	0.348	26%	0.258	S	S	.	.	H	α-helix	trans	-72.2	-45	178.6	-66.4	175.4	-177.2	176	0	110.4	D53 F58 I59 E90 L91 A94	D53-K55 PolarHBondContact O-N 3.46Å; D53-K55 WeakPolarHBondContact OD1-CA 3.48Å; D53-K55 WeakPolarHBondContact OD1-CB 3.35Å; D53-K55 PolarHBondContact OD1-N 3.44Å; K55-F58 PolarHBondContact O-N 3.23Å; K55-I59 WeakPolarHBondContact O-CG1 3.4Å; K55-I59 PolarHBondContact O-N 3.44Å; K55-E90 IonicContact NZ-OE2 3.48Å; K55-E90 PolarHBondContact NZ-OE2 2.84Å; K55-L91 HydrophobicContact CG-CD1 4.16Å; K55-A94 HydrophobicContact CB-CB 3.8Å; K55-A94 HydrophobicContact CD-CB 4.12Å; K55-A94 HydrophobicContact CG-CB 3.92Å
56	K	93.4	Very high	93	Very high	63 Å²	63	52.3 Å²	52.3	27%	0.274	27%	0.266	S	S	.	.	H	α-helix	trans	-62.3	-50.1	173.1	-75.1	-174.8	178.5	-155.3	0	110.8	D18 I50 D53 F58 I59 V60	D18-K56 IonicContact OD1-NZ 2.78Å; D18-K56 IonicContact OD2-NZ 3.86Å; D18-K56 PolarHBondContact OD2-NZ 3.25Å; I50-K56 HydrophobicContact CB-CB 4.06Å; I50-K56 HydrophobicContact CG2-CB 3.99Å; I50-K56 HydrophobicContact CG2-CD 4.34Å; D53-K56 HydrophobicContact CB-CB 4.05Å; D53-K56 HydrophobicContact CB-CD 4.37Å; D53-K56 HydrophobicContact CB-CG 4.3Å; D53-K56 PolarHBondContact O-N 3.16Å; D53-K56 PolarHBondContact OD1-N 3.44Å; D53-K56 VanDerWaalsContact OD1-N 3.1Å; D53-K56 WeakPolarHBondContact OD2-CD 3.47Å; D53-K56 WeakPolarHBondContact OD2-CG 3.36Å; K56-F58 PolarHBondContact O-N 3.12Å; K56-I59 PolarHBondContact O-N 3.09Å; K56-I59 VanDerWaalsContact O-N 3.15Å; K56-V60 VanDerWaalsContact O-CG2 3.32Å; K56-V60 WeakPolarHBondContact O-CG2 3.42Å; K56-V60 PolarHBondContact O-N 2.95Å
57	Q	95.3	Very high	93.6	Very high	50 Å²	50	53 Å²	53	23%	0.234	27%	0.269	C	S	.	.	H	α-helix	trans	-51.4	-45	174.8	-83.7	-172.2	-11.2	0	0	112.7	I50 K51 D53 I59 V60 A61 L73	I50-Q57 HydrophobicContact CB-CG 4.33Å; I50-Q57 HydrophobicContact CD1-CG 4.07Å; I50-Q57 HydrophobicContact CG1-CG 3.77Å; I50-Q57 WeakPolarHBondContact O-CG 3.49Å; K51-Q57 VanDerWaalsContact CA-NE2 3.34Å; K51-Q57 PolarHBondContact O-NE2 2.97Å; D53-Q57 PolarHBondContact O-N 3.26Å; Q57-I59 PolarHBondContact O-N 3.29Å; Q57-V60 PolarHBondContact O-N 3.39Å; Q57-A61 WeakPolarHBondContact O-CB 3.33Å; Q57-A61 PolarHBondContact O-N 3.04Å; Q57-L73 HydrophobicContact CB-CD1 3.93Å
58	F	96.7	Very high	94.1	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63	-41.5	-177.7	-166.2	-106.8	0	0	0	112.9	P54 K55 K56 A62 I70 L73 I74 L91 L92 A102 L118	P54-F58 WeakPolarHBondContact O-CB 3.33Å; P54-F58 PolarHBondContact O-N 3.01Å; K55-F58 PolarHBondContact O-N 3.23Å; K56-F58 PolarHBondContact O-N 3.12Å; F58-A62 PolarHBondContact O-N 2.9Å; F58-I70 HydrophobicContact CD2-CG1 4.44Å; F58-I70 HydrophobicContact CE2-CB 4.22Å; F58-I70 HydrophobicContact CE2-CG1 4.33Å; F58-I70 HydrophobicContact CE2-CG2 3.71Å; F58-I70 HydrophobicContact CZ-CG2 4.1Å; F58-L73 HydrophobicContact CB-CD1 3.98Å; F58-L73 HydrophobicContact CD2-CB 4.03Å; F58-L73 HydrophobicContact CD2-CD1 3.91Å; F58-L73 HydrophobicContact CG-CD1 4.48Å; F58-I74 HydrophobicContact CE2-CD1 3.96Å; F58-I74 HydrophobicContact CE2-CG1 3.78Å; F58-I74 HydrophobicContact CZ-CD1 3.97Å; F58-I74 HydrophobicContact CZ-CG1 4.08Å; F58-L91 HydrophobicContact CB-CD1 3.68Å; F58-L91 HydrophobicContact CB-CD2 4.49Å; F58-L91 HydrophobicContact CB-CG 4Å; F58-L91 HydrophobicContact CD1-CD1 4.31Å; F58-L91 HydrophobicContact CD1-CD2 4.32Å; F58-L91 HydrophobicContact CD1-CG 3.73Å; F58-L91 HydrophobicContact CD2-CD1 4.23Å; F58-L91 HydrophobicContact CD2-CD2 3.49Å; F58-L91 VanDerWaalsContact CD2-CD2 3.49Å; F58-L91 HydrophobicContact CD2-CG 3.76Å; F58-L91 HydrophobicContact CE1-CD2 4.39Å; F58-L91 HydrophobicContact CE1-CG 4.05Å; F58-L91 HydrophobicContact CE2-CD2 3.58Å; F58-L91 HydrophobicContact CE2-CG 4.08Å; F58-L91 HydrophobicContact CG-CD1 3.85Å; F58-L91 HydrophobicContact CG-CD2 3.87Å; F58-L91 HydrophobicContact CG-CG 3.56Å; F58-L91 HydrophobicContact CZ-CD2 4.04Å; F58-L91 HydrophobicContact CZ-CG 4.2Å; F58-L92 HydrophobicContact CE1-CD2 4.14Å; F58-L92 HydrophobicContact CZ-CD2 4.05Å; F58-A102 HydrophobicContact CD1-CB 3.67Å; F58-A102 HydrophobicContact CE1-CB 3.72Å; F58-L118 HydrophobicContact CE1-CD2 3.61Å; F58-L118 HydrophobicContact CE2-CD2 4.4Å; F58-L118 HydrophobicContact CZ-CD2 3.38Å
59	I	95.8	Very high	94.4	Very high	4 Å²	4	50.8 Å²	50.8	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-69.5	-44.5	178.1	-63.2	169.8	0	0	0	110.5	K55 K56 Q57 A62 E63 A94 D96 A102 R105	K55-I59 WeakPolarHBondContact O-CG1 3.4Å; K55-I59 PolarHBondContact O-N 3.44Å; K56-I59 PolarHBondContact O-N 3.09Å; K56-I59 VanDerWaalsContact O-N 3.15Å; Q57-I59 PolarHBondContact O-N 3.29Å; I59-A62 PolarHBondContact O-N 3.33Å; I59-E63 PolarHBondContact O-N 2.92Å; I59-A94 HydrophobicContact CD1-CB 4.21Å; I59-D96 HydrophobicContact CD1-CB 4.23Å; I59-D96 HydrophobicContact CG2-CB 4.35Å; I59-A102 HydrophobicContact CG1-CB 4.45Å; I59-R105 HydrophobicContact CG2-CG 3.76Å
60	V	93	Very high	94.8	Very high	11 Å²	11	46.3 Å²	46.3	7%	0.067	25%	0.245	C	C	.	.	H	α-helix	trans	-63.6	-42.5	178.2	176.4	0	0	0	0	111.6	M21 I50 K56 Q57 A62 E63 N64	M21-V60 HydrophobicContact CE-CB 4.09Å; M21-V60 HydrophobicContact CE-CG1 3.89Å; M21-V60 HydrophobicContact CE-CG2 3.21Å; M21-V60 HydrophobicContact SD-CG2 4.41Å; I50-V60 HydrophobicContact CD1-CB 3.89Å; I50-V60 HydrophobicContact CD1-CG1 4.04Å; I50-V60 HydrophobicContact CD1-CG2 3.82Å; K56-V60 VanDerWaalsContact O-CG2 3.32Å; K56-V60 WeakPolarHBondContact O-CG2 3.42Å; K56-V60 PolarHBondContact O-N 2.95Å; Q57-V60 PolarHBondContact O-N 3.39Å; V60-A62 VanDerWaalsContact C-N 3.27Å; V60-A62 PolarHBondContact O-N 2.61Å; V60-E63 WeakPolarHBondContact O-CB 3.11Å; V60-E63 PolarHBondContact O-N 3.4Å; V60-E63 VanDerWaalsContact O-N 3.13Å; V60-N64 WeakPolarHBondContact CG1-ND2 3.39Å; V60-N64 WeakPolarHBondContact O-CB 3.36Å; V60-N64 PolarHBondContact O-N 3.41Å
61	A	95.9	Very high	95.1	Very high	5 Å²	5	50.6 Å²	50.6	4%	0.041	26%	0.261	C	S	.	.	H	α-helix	trans	-60.4	-39.3	175.8	0	0	0	0	0	111.4	Q57 E63 N64 N65 D66 T69 I70	Q57-A61 WeakPolarHBondContact O-CB 3.33Å; Q57-A61 PolarHBondContact O-N 3.04Å; A61-E63 VanDerWaalsContact C-N 3.34Å; A61-E63 PolarHBondContact O-N 2.92Å; A61-N64 PolarHBondContact O-N 3.17Å; A61-N65 PolarHBondContact O-N 2.58Å; A61-D66 HydrophobicContact CB-CB 4.09Å; A61-D66 PolarHBondContact O-N 3.33Å; A61-T69 HydrophobicContact CB-CG2 3.85Å; A61-I70 HydrophobicContact CB-CD1 4.42Å; A61-I70 HydrophobicContact CB-CG1 3.8Å
62	A	97.4	Very high	95.5	Very high	0 Å²	0	49 Å²	49	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-68.8	-31.1	175.9	0	0	0	0	0	113.5	F58 I59 V60 I70 A102 A106 H111 V114 L118	F58-A62 PolarHBondContact O-N 2.9Å; I59-A62 PolarHBondContact O-N 3.33Å; V60-A62 VanDerWaalsContact C-N 3.27Å; V60-A62 PolarHBondContact O-N 2.61Å; A62-I70 HydrophobicContact CB-CD1 3.91Å; A62-A102 HydrophobicContact CB-CB 3.68Å; A62-A102 WeakPolarHBondContact CB-O 3.41Å; A62-A106 HydrophobicContact CB-CB 4.44Å; A62-H111 PolarHBondContact O-CD2 3.45Å; A62-H111 VanDerWaalsContact O-CD2 3.31Å; A62-V114 HydrophobicContact CB-CG1 4.11Å; A62-L118 HydrophobicContact CB-CD1 4.31Å
63	E	93.5	Very high	95.8	Very high	23 Å²	23	43.3 Å²	43.3	11%	0.107	23%	0.232	C	C	.	.	H	α-helix	trans	-69.5	-39.5	173.4	-170.8	168.8	-174.6	0	0	112.2	R25 I59 V60 A61 N65 R105 H111	R25-E63 WeakPolarHBondContact CD-OE1 3.19Å; R25-E63 WeakPolarHBondContact CG-OE1 3.4Å; R25-E63 IonicContact CZ-OE1 3.21Å; R25-E63 IonicContact CZ-OE2 2.87Å; R25-E63 IonicContact NE-OE1 2.71Å; R25-E63 PolarHBondContact NE-OE1 3.17Å; R25-E63 IonicContact NE-OE2 3.93Å; R25-E63 PolarHBondContact NE-OE2 3.16Å; R25-E63 IonicContact NH2-OE1 3.26Å; R25-E63 IonicContact NH2-OE2 3.54Å; R25-E63 PolarHBondContact NH2-OE2 3.14Å; I59-E63 PolarHBondContact O-N 2.92Å; V60-E63 WeakPolarHBondContact O-CB 3.11Å; V60-E63 PolarHBondContact O-N 3.4Å; V60-E63 VanDerWaalsContact O-N 3.13Å; A61-E63 VanDerWaalsContact C-N 3.34Å; A61-E63 PolarHBondContact O-N 2.92Å; E63-N65 PolarHBondContact O-N 3.25Å; E63-R105 HydrophobicContact CB-CB 3.97Å; E63-R105 HydrophobicContact CB-CG 4.44Å; E63-R105 HydrophobicContact CG-CB 4.5Å; E63-H111 PolarHBondContact O-CD2 2.8Å; E63-H111 PolarHBondContact O-NE2 3Å
64	N	92.7	Very high	95.9	Very high	97 Å²	97	40.6 Å²	40.6	52%	0.519	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	10.8	-174.5	-67.3	-22.5	0	0	0	114.4	V60 A61 D66	V60-N64 WeakPolarHBondContact CG1-ND2 3.39Å; V60-N64 WeakPolarHBondContact O-CB 3.36Å; V60-N64 PolarHBondContact O-N 3.41Å; A61-N64 PolarHBondContact O-N 3.17Å; N64-D66 PolarHBondContact O-N 2.87Å
65	N	96.8	Very high	96	Very high	82 Å²	82	43 Å²	43	44%	0.439	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	29.2	-175.3	-162.6	31.4	0	0	0	114.1	A61 E63 L67 H111 V114	A61-N65 PolarHBondContact O-N 2.58Å; E63-N65 PolarHBondContact O-N 3.25Å; N65-L67 PolarHBondContact O-N 3.07Å; N65-H111 HydrophobicContact CB-CB 4.36Å; N65-H111 WeakPolarHBondContact OD1-CB 3.41Å; N65-V114 WeakPolarHBondContact OD1-CG2 3.21Å
66	D	96.7	Very high	95.9	Very high	55 Å²	55	41.8 Å²	41.8	29%	0.294	23%	0.226	S	C	.	.			trans	-89.8	81	178.9	-175.6	2.5	0	0	0	111.1	A61 N64 S68 T69 I70	A61-D66 HydrophobicContact CB-CB 4.09Å; A61-D66 PolarHBondContact O-N 3.33Å; N64-D66 PolarHBondContact O-N 2.87Å; D66-S68 PolarHBondContact O-N 3.15Å; D66-S68 WeakPolarHBondContact OD1-CB 3.4Å; D66-S68 PolarHBondContact OD1-N 3.17Å; D66-S68 PolarHBondContact OD1-OG 3.45Å; D66-T69 PolarHBondContact OD1-N 2.98Å; D66-T69 VanDerWaalsContact OD1-N 3.09Å; D66-T69 WeakPolarHBondContact OD2-CB 3.42Å; D66-T69 PolarHBondContact OD2-OG1 3.22Å; D66-I70 WeakPolarHBondContact O-CG1 3.33Å; D66-I70 PolarHBondContact O-N 3.33Å
67	L	97.8	Very high	95.9	Very high	17 Å²	17	38.8 Å²	38.8	9%	0.089	21%	0.213	C	C	.	.	H	α-helix	trans	-65.5	-23.6	176.5	-174.4	55.6	0	0	0	112.8	N65 I70 R71 E113 V114 Y117	N65-L67 PolarHBondContact O-N 3.07Å; L67-I70 HydrophobicContact CD1-CB 4.45Å; L67-I70 HydrophobicContact CD1-CG2 4.38Å; L67-R71 HydrophobicContact CD1-CG 4.22Å; L67-R71 HydrophobicContact CG-CG 4.28Å; L67-R71 WeakPolarHBondContact O-CB 3.5Å; L67-R71 WeakPolarHBondContact O-CG 3.48Å; L67-R71 PolarHBondContact O-N 3.39Å; L67-E113 HydrophobicContact CD2-CB 4.41Å; L67-E113 HydrophobicContact CD2-CG 3.6Å; L67-E113 WeakPolarHBondContact CD2-OE1 3.5Å; L67-V114 HydrophobicContact CB-CG2 4.1Å; L67-V114 HydrophobicContact CD1-CG2 4.33Å; L67-Y117 HydrophobicContact CD1-CD1 4.01Å; L67-Y117 HydrophobicContact CD1-CD2 4.22Å; L67-Y117 HydrophobicContact CD1-CG 3.76Å
68	S	97.8	Very high	95.6	Very high	82 Å²	82	42.1 Å²	42.1	57%	0.573	23%	0.227	S	C	*	.	H	α-helix	trans	-68.7	-46	-178.2	76.4	0	0	0	0	111.1	D66 R71 S72	D66-S68 PolarHBondContact O-N 3.15Å; D66-S68 WeakPolarHBondContact OD1-CB 3.4Å; D66-S68 PolarHBondContact OD1-N 3.17Å; D66-S68 PolarHBondContact OD1-OG 3.45Å; S68-R71 PolarHBondContact O-N 2.96Å; S68-S72 WeakPolarHBondContact O-CB 3.26Å; S68-S72 PolarHBondContact O-N 2.96Å
69	T	96.8	Very high	95.3	Very high	42 Å²	42	50 Å²	50	26%	0.258	26%	0.264	S	S	.	.	H	α-helix	trans	-65.9	-41.9	175.6	-64.3	0	0	0	0	111.3	A61 D66 R71 S72 L73	A61-T69 HydrophobicContact CB-CG2 3.85Å; D66-T69 PolarHBondContact OD1-N 2.98Å; D66-T69 VanDerWaalsContact OD1-N 3.09Å; D66-T69 WeakPolarHBondContact OD2-CB 3.42Å; D66-T69 PolarHBondContact OD2-OG1 3.22Å; T69-R71 VanDerWaalsContact C-N 3.34Å; T69-R71 PolarHBondContact O-N 3.01Å; T69-S72 PolarHBondContact O-N 3.09Å; T69-L73 HydrophobicContact CG2-CD1 3.89Å; T69-L73 HydrophobicContact CG2-CG 4.4Å; T69-L73 WeakPolarHBondContact O-CG 3.46Å; T69-L73 PolarHBondContact O-N 3.46Å
70	I	98	Very high	94.9	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-58.4	-45.9	175.1	-68.6	172.7	0	0	0	111.4	F58 A61 A62 D66 L67 I74 V114 Y117 L118	F58-I70 HydrophobicContact CD2-CG1 4.44Å; F58-I70 HydrophobicContact CE2-CB 4.22Å; F58-I70 HydrophobicContact CE2-CG1 4.33Å; F58-I70 HydrophobicContact CE2-CG2 3.71Å; F58-I70 HydrophobicContact CZ-CG2 4.1Å; A61-I70 HydrophobicContact CB-CD1 4.42Å; A61-I70 HydrophobicContact CB-CG1 3.8Å; A62-I70 HydrophobicContact CB-CD1 3.91Å; D66-I70 WeakPolarHBondContact O-CG1 3.33Å; D66-I70 PolarHBondContact O-N 3.33Å; L67-I70 HydrophobicContact CD1-CB 4.45Å; L67-I70 HydrophobicContact CD1-CG2 4.38Å; I70-I74 HydrophobicContact CG2-CD1 3.86Å; I70-I74 WeakPolarHBondContact O-CG1 3.4Å; I70-I74 PolarHBondContact O-N 3.35Å; I70-V114 HydrophobicContact CD1-CB 4.39Å; I70-V114 HydrophobicContact CD1-CG1 3.4Å; I70-V114 VanDerWaalsContact CD1-CG1 3.4Å; I70-V114 HydrophobicContact CD1-CG2 4.13Å; I70-Y117 HydrophobicContact CG2-CD1 4.14Å; I70-L118 HydrophobicContact CG2-CD2 4.11Å
71	R	97.8	Very high	94.6	Very high	96 Å²	96	56.4 Å²	56.4	36%	0.362	30%	0.304	S	S	.	.	H	α-helix	trans	-61.1	-49.4	177.1	-77.9	177	-178	173.9	8.2	111	L67 S68 T69 L73 I74 E75 E113 Y117	L67-R71 HydrophobicContact CD1-CG 4.22Å; L67-R71 HydrophobicContact CG-CG 4.28Å; L67-R71 WeakPolarHBondContact O-CB 3.5Å; L67-R71 WeakPolarHBondContact O-CG 3.48Å; L67-R71 PolarHBondContact O-N 3.39Å; S68-R71 PolarHBondContact O-N 2.96Å; T69-R71 VanDerWaalsContact C-N 3.34Å; T69-R71 PolarHBondContact O-N 3.01Å; R71-L73 VanDerWaalsContact C-N 3.35Å; R71-L73 PolarHBondContact O-N 3.41Å; R71-I74 PolarHBondContact O-N 2.75Å; R71-E75 WeakPolarHBondContact O-CB 3.2Å; R71-E75 VanDerWaalsContact O-CG 3.29Å; R71-E75 WeakPolarHBondContact O-CG 3.21Å; R71-E75 PolarHBondContact O-N 2.92Å; R71-E113 IonicContact NH2-OE1 2.8Å; R71-E113 PolarHBondContact NH2-OE1 3.2Å; R71-Y117 HydrophobicContact CG-CD1 4.5Å; R71-Y117 HydrophobicContact CG-CE1 3.77Å; R71-Y117 HydrophobicContact CG-CE2 4.1Å
72	S	96.9	Very high	94.2	Very high	72 Å²	72	60 Å²	60	50%	0.503	33%	0.334	S	S	.	.	H	α-helix	trans	-56.2	-47.4	179.3	-175.7	0	0	0	0	112	S68 T69 E75 S76	S68-S72 WeakPolarHBondContact O-CB 3.26Å; S68-S72 PolarHBondContact O-N 2.96Å; T69-S72 PolarHBondContact O-N 3.09Å; S72-E75 PolarHBondContact O-N 2.81Å; S72-S76 VanDerWaalsContact O-CB 3.31Å; S72-S76 WeakPolarHBondContact O-CB 3.37Å; S72-S76 PolarHBondContact O-N 2.89Å
73	L	96.7	Very high	93.8	Very high	24 Å²	24	66 Å²	66	13%	0.126	37%	0.366	C	S	.	.	H	α-helix	trans	-66.3	-41.9	-179.9	-70.6	170.3	0	0	0	112.5	P54 Q57 F58 T69 R71 S76 A77 L91	P54-L73 HydrophobicContact CB-CD2 3.98Å; Q57-L73 HydrophobicContact CB-CD1 3.93Å; F58-L73 HydrophobicContact CB-CD1 3.98Å; F58-L73 HydrophobicContact CD2-CB 4.03Å; F58-L73 HydrophobicContact CD2-CD1 3.91Å; F58-L73 HydrophobicContact CG-CD1 4.48Å; T69-L73 HydrophobicContact CG2-CD1 3.89Å; T69-L73 HydrophobicContact CG2-CG 4.4Å; T69-L73 WeakPolarHBondContact O-CG 3.46Å; T69-L73 PolarHBondContact O-N 3.46Å; R71-L73 VanDerWaalsContact C-N 3.35Å; R71-L73 PolarHBondContact O-N 3.41Å; L73-S76 PolarHBondContact O-N 2.85Å; L73-A77 PolarHBondContact O-N 3.26Å; L73-L91 HydrophobicContact CB-CD2 4.13Å
74	I	96	Very high	93.6	Very high	0 Å²	0	65 Å²	65	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-64.4	-43.1	175.4	-72.8	168.3	0	0	0	111	F58 I70 R71 A77 K78 L88 Y117 Y121	F58-I74 HydrophobicContact CE2-CD1 3.96Å; F58-I74 HydrophobicContact CE2-CG1 3.78Å; F58-I74 HydrophobicContact CZ-CD1 3.97Å; F58-I74 HydrophobicContact CZ-CG1 4.08Å; I70-I74 HydrophobicContact CG2-CD1 3.86Å; I70-I74 WeakPolarHBondContact O-CG1 3.4Å; I70-I74 PolarHBondContact O-N 3.35Å; R71-I74 PolarHBondContact O-N 2.75Å; I74-A77 PolarHBondContact O-N 3.16Å; I74-K78 HydrophobicContact CG2-CD 4.1Å; I74-K78 WeakPolarHBondContact O-CG 3.37Å; I74-K78 PolarHBondContact O-N 3.28Å; I74-L88 HydrophobicContact CB-CD1 4.41Å; I74-L88 HydrophobicContact CG1-CD1 3.88Å; I74-L88 HydrophobicContact CG2-CD1 4.11Å; I74-Y117 HydrophobicContact CD1-CD1 4.06Å; I74-Y117 HydrophobicContact CD1-CE1 3.83Å; I74-Y121 HydrophobicContact CD1-CD2 4.06Å; I74-Y121 HydrophobicContact CD1-CG 4.22Å; I74-Y121 HydrophobicContact CG2-CD1 3.78Å; I74-Y121 HydrophobicContact CG2-CD2 4.44Å; I74-Y121 HydrophobicContact CG2-CE1 3.69Å; I74-Y121 HydrophobicContact CG2-CE2 4.41Å; I74-Y121 HydrophobicContact CG2-CG 4.15Å
75	E	94.7	Very high	93.6	Very high	101 Å²	101	66.1 Å²	66.1	47%	0.472	36%	0.364	S	S	.	.	H	α-helix	trans	-65.6	-41.7	179.2	-74.1	174.2	-175.5	0	0	111.5	R71 S72 K78 Q79	R71-E75 WeakPolarHBondContact O-CB 3.2Å; R71-E75 VanDerWaalsContact O-CG 3.29Å; R71-E75 WeakPolarHBondContact O-CG 3.21Å; R71-E75 PolarHBondContact O-N 2.92Å; S72-E75 PolarHBondContact O-N 2.81Å; E75-K78 PolarHBondContact O-N 3.15Å; E75-Q79 WeakPolarHBondContact O-CG 3.44Å; E75-Q79 PolarHBondContact O-N 3.45Å; E75-Q79 VanDerWaalsContact O-N 3.12Å
76	S	94.1	Very high	93.4	Very high	54 Å²	54	66 Å²	66	38%	0.378	37%	0.366	S	S	.	.	H	α-helix	trans	-59.2	-47.2	173.5	-179.1	0	0	0	0	111.8	S72 L73 K78 Q79	S72-S76 VanDerWaalsContact O-CB 3.31Å; S72-S76 WeakPolarHBondContact O-CB 3.37Å; S72-S76 PolarHBondContact O-N 2.89Å; L73-S76 PolarHBondContact O-N 2.85Å; S76-K78 VanDerWaalsContact C-N 3.35Å; S76-K78 PolarHBondContact O-N 2.95Å; S76-Q79 PolarHBondContact O-N 3.45Å
77	A	93.6	Very high	93.3	Very high	0 Å²	0	65.9 Å²	65.9	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-58.7	-46.4	175.7	0	0	0	0	0	111.1	L73 I74 Q79 K80 G84 E87 L88	L73-A77 PolarHBondContact O-N 3.26Å; I74-A77 PolarHBondContact O-N 3.16Å; A77-Q79 VanDerWaalsContact C-N 3.26Å; A77-Q79 PolarHBondContact O-N 3.39Å; A77-K80 WeakPolarHBondContact O-CB 3.43Å; A77-K80 PolarHBondContact O-N 2.95Å; A77-K80 VanDerWaalsContact O-N 3.16Å; A77-G84 WeakPolarHBondContact O-CA 3.5Å; A77-E87 HydrophobicContact CB-CB 4.37Å; A77-E87 HydrophobicContact CB-CG 4.15Å; A77-L88 HydrophobicContact CB-CB 4.38Å
78	K	88.9	Confident	93.2	Very high	120 Å²	120	66.1 Å²	66.1	52%	0.522	37%	0.365	S	S	.	.	H	α-helix	trans	-63.8	-26.4	-179.4	-74.3	179.1	68.7	-175.3	0	114.5	I74 E75 S76 K80 Y121	I74-K78 HydrophobicContact CG2-CD 4.1Å; I74-K78 WeakPolarHBondContact O-CG 3.37Å; I74-K78 PolarHBondContact O-N 3.28Å; E75-K78 PolarHBondContact O-N 3.15Å; S76-K78 VanDerWaalsContact C-N 3.35Å; S76-K78 PolarHBondContact O-N 2.95Å; K78-K80 PolarHBondContact O-N 2.72Å; K78-Y121 HydrophobicContact CD-CE1 4.1Å
79	Q	90.2	Very high	93.1	Very high	166 Å²	166	70.5 Å²	70.5	78%	0.776	37%	0.369	S	S	*	.	H	α-helix	trans	-68.5	-17.6	178.6	-74.1	174.5	24.8	0	0	112.9	E75 S76 A77 G81	E75-Q79 WeakPolarHBondContact O-CG 3.44Å; E75-Q79 PolarHBondContact O-N 3.45Å; E75-Q79 VanDerWaalsContact O-N 3.12Å; S76-Q79 PolarHBondContact O-N 3.45Å; A77-Q79 VanDerWaalsContact C-N 3.26Å; A77-Q79 PolarHBondContact O-N 3.39Å; Q79-G81 VanDerWaalsContact C-N 3.26Å; Q79-G81 PolarHBondContact O-N 3.12Å
80	K	88.6	Confident	93	Very high	101 Å²	101	72.8 Å²	72.8	44%	0.439	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	11.6	-177.8	-63.6	169.5	175.3	177.2	0	114.4	A77 K78 A82 E87	A77-K80 WeakPolarHBondContact O-CB 3.43Å; A77-K80 PolarHBondContact O-N 2.95Å; A77-K80 VanDerWaalsContact O-N 3.16Å; K78-K80 PolarHBondContact O-N 2.72Å; K80-A82 PolarHBondContact O-N 3.33Å; K80-E87 WeakPolarHBondContact CD-OE2 3.32Å; K80-E87 WeakPolarHBondContact CE-OE2 3.38Å; K80-E87 IonicContact NZ-OE1 2.66Å; K80-E87 PolarHBondContact NZ-OE1 3.35Å; K80-E87 IonicContact NZ-OE2 2.67Å; K80-E87 PolarHBondContact NZ-OE2 3.28Å
81	G	86.3	Confident	93	Very high	47 Å²	47	73.2 Å²	73.2	49%	0.485	38%	0.379	S	S	.	.	H	α-helix	trans	65.6	-132	176.4	0	0	0	0	0	112.7	Q79 D83 G84 E85	Q79-G81 VanDerWaalsContact C-N 3.26Å; Q79-G81 PolarHBondContact O-N 3.12Å; G81-D83 PolarHBondContact O-N 3.3Å; G81-G84 WeakPolarHBondContact O-CA 3.41Å; G81-G84 PolarHBondContact O-N 3.49Å; G81-E85 PolarHBondContact O-N 3.45Å
82	A	86.7	Confident	92.9	Very high	81 Å²	81	69.2 Å²	69.2	67%	0.669	37%	0.365	S	S	*	.	H	α-helix	trans	-63.4	-39.4	-177.9	0	0	0	0	0	112.8	K80 G84 E85	K80-A82 PolarHBondContact O-N 3.33Å; A82-G84 PolarHBondContact O-N 3.27Å; A82-E85 PolarHBondContact O-N 2.9Å
83	D	89.2	Confident	92.9	Very high	125 Å²	125	68.9 Å²	68.9	67%	0.668	36%	0.362	S	S	*	.	H	α-helix	trans	-63.8	-29.6	174.6	-61.8	-29.7	0	0	0	111	G81 E85 V86 E87	G81-D83 PolarHBondContact O-N 3.3Å; D83-E85 PolarHBondContact O-N 2.89Å; D83-V86 PolarHBondContact O-N 3.26Å; D83-E87 PolarHBondContact O-N 3.17Å
84	G	89.9	Confident	92.9	Very high	2 Å²	2	68.3 Å²	68.3	2%	0.021	36%	0.361	C	S	.	.	H	α-helix	trans	-63.9	-33.2	176	0	0	0	0	0	114.8	A77 G81 A82 E87 L88	A77-G84 WeakPolarHBondContact O-CA 3.5Å; G81-G84 WeakPolarHBondContact O-CA 3.41Å; G81-G84 PolarHBondContact O-N 3.49Å; A82-G84 PolarHBondContact O-N 3.27Å; G84-E87 PolarHBondContact O-N 3Å; G84-L88 VanDerWaalsContact O-CB 3.32Å; G84-L88 WeakPolarHBondContact O-CB 3.32Å; G84-L88 PolarHBondContact O-N 3.32Å
85	E	91.4	Very high	92.9	Very high	121 Å²	121	73 Å²	73	57%	0.565	38%	0.382	S	S	*	.	H	α-helix	trans	-68.3	-38	174.7	-69.5	-170	176.4	0	0	111.8	G81 A82 D83 R89	G81-E85 PolarHBondContact O-N 3.45Å; A82-E85 PolarHBondContact O-N 2.9Å; D83-E85 PolarHBondContact O-N 2.89Å; E85-R89 VanDerWaalsContact O-CG 3.29Å; E85-R89 WeakPolarHBondContact O-CG 3.45Å; E85-R89 PolarHBondContact O-N 2.89Å; E85-R89 VanDerWaalsContact O-N 3.08Å
86	V	93.7	Very high	92.8	Very high	80 Å²	80	69.3 Å²	69.3	49%	0.485	37%	0.365	S	S	.	.	H	α-helix	trans	-65.1	-48.2	175.2	179.2	0	0	0	0	109.4	D83 L88 R89 E90	D83-V86 PolarHBondContact O-N 3.26Å; V86-L88 PolarHBondContact O-N 2.82Å; V86-R89 PolarHBondContact O-N 3.13Å; V86-R89 VanDerWaalsContact O-N 3.16Å; V86-E90 WeakPolarHBondContact O-CG 3.37Å; V86-E90 PolarHBondContact O-N 3.06Å
87	E	93.9	Very high	92.5	Very high	52 Å²	52	70.4 Å²	70.4	24%	0.243	36%	0.364	C	S	.	.	H	α-helix	trans	-60.4	-43.2	178.2	-172.6	169.8	163.1	0	0	112.2	A77 K80 D83 G84 R89 E90 L91	A77-E87 HydrophobicContact CB-CB 4.37Å; A77-E87 HydrophobicContact CB-CG 4.15Å; K80-E87 WeakPolarHBondContact CD-OE2 3.32Å; K80-E87 WeakPolarHBondContact CE-OE2 3.38Å; K80-E87 IonicContact NZ-OE1 2.66Å; K80-E87 PolarHBondContact NZ-OE1 3.35Å; K80-E87 IonicContact NZ-OE2 2.67Å; K80-E87 PolarHBondContact NZ-OE2 3.28Å; D83-E87 PolarHBondContact O-N 3.17Å; G84-E87 PolarHBondContact O-N 3Å; E87-R89 VanDerWaalsContact C-N 3.34Å; E87-R89 PolarHBondContact O-N 3.34Å; E87-E90 PolarHBondContact O-N 3.05Å; E87-L91 VanDerWaalsContact O-CB 3.3Å; E87-L91 WeakPolarHBondContact O-CB 3.42Å; E87-L91 PolarHBondContact O-N 2.93Å
88	L	95.9	Very high	92.1	Very high	23 Å²	23	73.4 Å²	73.4	12%	0.12	38%	0.38	C	S	.	.	H	α-helix	trans	-61	-42.5	175.7	178	60	0	0	0	111.8	I74 A77 G84 V86 L91 L92 Y121	I74-L88 HydrophobicContact CB-CD1 4.41Å; I74-L88 HydrophobicContact CG1-CD1 3.88Å; I74-L88 HydrophobicContact CG2-CD1 4.11Å; A77-L88 HydrophobicContact CB-CB 4.38Å; G84-L88 VanDerWaalsContact O-CB 3.32Å; G84-L88 WeakPolarHBondContact O-CB 3.32Å; G84-L88 PolarHBondContact O-N 3.32Å; V86-L88 PolarHBondContact O-N 2.82Å; L88-L91 PolarHBondContact O-N 3.27Å; L88-L92 HydrophobicContact CD1-CD1 3.83Å; L88-L92 HydrophobicContact CD1-CG 4.01Å; L88-L92 HydrophobicContact CG-CD1 3.83Å; L88-L92 HydrophobicContact CG-CG 4.44Å; L88-L92 WeakPolarHBondContact O-CB 3.4Å; L88-L92 WeakPolarHBondContact O-CD1 3.32Å; L88-L92 VanDerWaalsContact O-CG 3.23Å; L88-L92 WeakPolarHBondContact O-CG 3.38Å; L88-L92 PolarHBondContact O-N 3.27Å; L88-Y121 HydrophobicContact CD2-CD1 4.37Å
89	R	95.3	Very high	92.4	Very high	173 Å²	173	67.7 Å²	67.7	65%	0.653	36%	0.356	S	S	*	.	H	α-helix	trans	-64.5	-42.9	176.6	-72.8	173.7	-173.9	-178.2	7.4	111.6	E85 V86 E87 L91 L92 S93	E85-R89 VanDerWaalsContact O-CG 3.29Å; E85-R89 WeakPolarHBondContact O-CG 3.45Å; E85-R89 PolarHBondContact O-N 2.89Å; E85-R89 VanDerWaalsContact O-N 3.08Å; V86-R89 PolarHBondContact O-N 3.13Å; V86-R89 VanDerWaalsContact O-N 3.16Å; E87-R89 VanDerWaalsContact C-N 3.34Å; E87-R89 PolarHBondContact O-N 3.34Å; R89-L91 VanDerWaalsContact C-N 3.3Å; R89-L91 PolarHBondContact O-N 3.45Å; R89-L92 PolarHBondContact O-N 2.93Å; R89-S93 WeakPolarHBondContact O-CB 3.42Å; R89-S93 PolarHBondContact O-N 3.23Å; R89-S93 PolarHBondContact O-OG 3.32Å
90	E	95.9	Very high	92.6	Very high	91 Å²	91	61.4 Å²	61.4	43%	0.425	33%	0.325	S	S	.	.	H	α-helix	trans	-62.6	-38.9	175.2	-72.7	-170.4	-170.6	0	0	111.8	K55 V86 E87 S93 A94	K55-E90 IonicContact NZ-OE2 3.48Å; K55-E90 PolarHBondContact NZ-OE2 2.84Å; V86-E90 WeakPolarHBondContact O-CG 3.37Å; V86-E90 PolarHBondContact O-N 3.06Å; E87-E90 PolarHBondContact O-N 3.05Å; E90-S93 PolarHBondContact O-OG 3.24Å; E90-A94 WeakPolarHBondContact O-CA 3.44Å; E90-A94 WeakPolarHBondContact O-CB 3.32Å; E90-A94 PolarHBondContact O-N 3.49Å
91	L	96.5	Very high	93.1	Very high	8 Å²	8	56.7 Å²	56.7	4%	0.042	31%	0.305	C	S	.	.	H	α-helix	trans	-65.7	-46.7	178.2	-163.8	69.8	0	0	0	111.7	P54 K55 F58 L73 E87 L88 R89 S93 A94	P54-L91 HydrophobicContact CB-CD1 4.49Å; P54-L91 WeakPolarHBondContact O-CD1 3.36Å; K55-L91 HydrophobicContact CG-CD1 4.16Å; F58-L91 HydrophobicContact CB-CD1 3.68Å; F58-L91 HydrophobicContact CB-CD2 4.49Å; F58-L91 HydrophobicContact CB-CG 4Å; F58-L91 HydrophobicContact CD1-CD1 4.31Å; F58-L91 HydrophobicContact CD1-CD2 4.32Å; F58-L91 HydrophobicContact CD1-CG 3.73Å; F58-L91 HydrophobicContact CD2-CD1 4.23Å; F58-L91 HydrophobicContact CD2-CD2 3.49Å; F58-L91 VanDerWaalsContact CD2-CD2 3.49Å; F58-L91 HydrophobicContact CD2-CG 3.76Å; F58-L91 HydrophobicContact CE1-CD2 4.39Å; F58-L91 HydrophobicContact CE1-CG 4.05Å; F58-L91 HydrophobicContact CE2-CD2 3.58Å; F58-L91 HydrophobicContact CE2-CG 4.08Å; F58-L91 HydrophobicContact CG-CD1 3.85Å; F58-L91 HydrophobicContact CG-CD2 3.87Å; F58-L91 HydrophobicContact CG-CG 3.56Å; F58-L91 HydrophobicContact CZ-CD2 4.04Å; F58-L91 HydrophobicContact CZ-CG 4.2Å; L73-L91 HydrophobicContact CB-CD2 4.13Å; E87-L91 VanDerWaalsContact O-CB 3.3Å; E87-L91 WeakPolarHBondContact O-CB 3.42Å; E87-L91 PolarHBondContact O-N 2.93Å; L88-L91 PolarHBondContact O-N 3.27Å; R89-L91 VanDerWaalsContact C-N 3.3Å; R89-L91 PolarHBondContact O-N 3.45Å; L91-S93 VanDerWaalsContact C-N 3.31Å; L91-S93 PolarHBondContact O-N 2.92Å; L91-A94 WeakPolarHBondContact O-CB 3.35Å; L91-A94 PolarHBondContact O-N 3.49Å
92	L	97.3	Very high	93.6	Very high	13 Å²	13	54.6 Å²	54.6	7%	0.068	28%	0.282	C	S	.	.	H	α-helix	trans	-70.3	-26.9	-179.8	-66.6	166.1	0	0	0	113.2	F58 L88 R89 L118 Y121 A123	F58-L92 HydrophobicContact CE1-CD2 4.14Å; F58-L92 HydrophobicContact CZ-CD2 4.05Å; L88-L92 HydrophobicContact CD1-CD1 3.83Å; L88-L92 HydrophobicContact CD1-CG 4.01Å; L88-L92 HydrophobicContact CG-CD1 3.83Å; L88-L92 HydrophobicContact CG-CG 4.44Å; L88-L92 WeakPolarHBondContact O-CB 3.4Å; L88-L92 WeakPolarHBondContact O-CD1 3.32Å; L88-L92 VanDerWaalsContact O-CG 3.23Å; L88-L92 WeakPolarHBondContact O-CG 3.38Å; L88-L92 PolarHBondContact O-N 3.27Å; R89-L92 PolarHBondContact O-N 2.93Å; L92-L118 HydrophobicContact CD2-CD2 4.15Å; L92-Y121 WeakPolarHBondContact CD1-O 3.48Å; L92-A123 HydrophobicContact CD2-CB 4.1Å
93	S	96.9	Very high	94.2	Very high	64 Å²	64	50.8 Å²	50.8	45%	0.448	25%	0.251	S	S	.	.	H	α-helix	trans	-96.7	-6.3	177.9	63.3	0	0	0	0	113.8	R89 E90 L91	R89-S93 WeakPolarHBondContact O-CB 3.42Å; R89-S93 PolarHBondContact O-N 3.23Å; R89-S93 PolarHBondContact O-OG 3.32Å; E90-S93 PolarHBondContact O-OG 3.24Å; L91-S93 VanDerWaalsContact C-N 3.31Å; L91-S93 PolarHBondContact O-N 2.92Å
94	A	96.9	Very high	94.6	Very high	12 Å²	12	44.9 Å²	44.9	10%	0.099	22%	0.219	C	C	.	.			trans	-54.9	142.5	176.8	0	0	0	0	0	110.8	K55 I59 E90 L91 T101	K55-A94 HydrophobicContact CB-CB 3.8Å; K55-A94 HydrophobicContact CD-CB 4.12Å; K55-A94 HydrophobicContact CG-CB 3.92Å; I59-A94 HydrophobicContact CD1-CB 4.21Å; E90-A94 WeakPolarHBondContact O-CA 3.44Å; E90-A94 WeakPolarHBondContact O-CB 3.32Å; E90-A94 PolarHBondContact O-N 3.49Å; L91-A94 WeakPolarHBondContact O-CB 3.35Å; L91-A94 PolarHBondContact O-N 3.49Å; A94-T101 WeakPolarHBondContact O-CA 3.36Å; A94-T101 WeakPolarHBondContact O-CB 3.46Å; A94-T101 WeakPolarHBondContact O-CG2 3.38Å
95	K	95.6	Very high	94.9	Very high	100 Å²	100	45.3 Å²	45.3	44%	0.435	22%	0.22	S	C	.	.			trans	-123	143.1	179.3	-69.5	178.9	168.6	-170.1	0	109	G99 Y100 T101 R128	K95-G99 WeakPolarHBondContact CD-O 3.47Å; K95-G99 WeakPolarHBondContact CG-O 3.26Å; K95-Y100 VanDerWaalsContact CA-O 3.32Å; K95-Y100 WeakPolarHBondContact CA-O 3.39Å; K95-T101 HydrophobicContact CG-CG2 3.99Å; K95-R128 WeakPolarHBondContact CE-O 3.41Å; K95-R128 PolarHBondContact NZ-O 3.18Å
96	D	92.4	Very high	95.3	Very high	23 Å²	23	39.5 Å²	39.5	12%	0.123	19%	0.193	C	C	.	.			trans	-76.9	179.5	163.9	60.3	29.6	0	0	0	110.8	I59 D98 G99 Y100 R105	I59-D96 HydrophobicContact CD1-CB 4.23Å; I59-D96 HydrophobicContact CG2-CB 4.35Å; D96-D98 PolarHBondContact O-N 3.38Å; D96-D98 VanDerWaalsContact O-N 3.15Å; D96-D98 WeakPolarHBondContact OD1-CB 3.45Å; D96-D98 PolarHBondContact OD1-N 3.5Å; D96-G99 WeakPolarHBondContact O-CA 3.34Å; D96-G99 PolarHBondContact O-N 2.96Å; D96-G99 PolarHBondContact OD1-N 3.13Å; D96-Y100 PolarHBondContact N-O 2.83Å; D96-Y100 WeakPolarHBondContact OD1-CB 3.21Å; D96-Y100 PolarHBondContact OD1-N 3.21Å; D96-R105 IonicContact OD1-NH2 2.79Å; D96-R105 PolarHBondContact OD1-NH2 2.82Å; D96-R105 IonicContact OD2-CZ 2.81Å; D96-R105 IonicContact OD2-NE 3.23Å; D96-R105 PolarHBondContact OD2-NE 3.2Å; D96-R105 IonicContact OD2-NH2 3.79Å; D96-R105 PolarHBondContact OD2-NH2 3.3Å
97	Q	88.1	Confident	95.5	Very high	77 Å²	77	35.7 Å²	35.7	36%	0.36	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-28.8	174.8	64.8	-172.4	-60.4	0	0	115.1	D18 G99	D18-Q97 VanDerWaalsContact C-NE2 3.27Å; D18-Q97 HydrophobicContact CB-CG 4.45Å; D18-Q97 PolarHBondContact O-NE2 3.03Å; D18-Q97 PolarHBondContact O-OE1 3.36Å; D18-Q97 PolarHBondContact OD1-NE2 3.31Å; Q97-G99 VanDerWaalsContact C-N 3.27Å
98	D	85.5	Confident	95.5	Very high	62 Å²	62	35.8 Å²	35.8	33%	0.332	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	0.2	-179.8	-59.6	-42.7	0	0	0	110.8	R25 D96 Y100 R105	R25-D98 IonicContact NH1-OD2 3.33Å; D96-D98 PolarHBondContact O-N 3.38Å; D96-D98 VanDerWaalsContact O-N 3.15Å; D96-D98 WeakPolarHBondContact OD1-CB 3.45Å; D96-D98 PolarHBondContact OD1-N 3.5Å; D98-Y100 HydrophobicContact CB-CD2 3.51Å; D98-Y100 HydrophobicContact CB-CE2 3.89Å; D98-Y100 VanDerWaalsContact O-CD2 3.29Å; D98-Y100 WeakPolarHBondContact O-CD2 3.45Å; D98-R105 IonicContact OD2-CZ 2.85Å; D98-R105 IonicContact OD2-NH2 3.46Å; D98-R105 PolarHBondContact OD2-NH2 2.94Å
99	G	93.7	Very high	95.4	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.01	17%	0.173	C	C	.	.	S	Bend	trans	81.5	9.6	-175.8	0	0	0	0	0	114.5	K95 D96 Q97 T129	K95-G99 WeakPolarHBondContact CD-O 3.47Å; K95-G99 WeakPolarHBondContact CG-O 3.26Å; D96-G99 WeakPolarHBondContact O-CA 3.34Å; D96-G99 PolarHBondContact O-N 2.96Å; D96-G99 PolarHBondContact OD1-N 3.13Å; Q97-G99 VanDerWaalsContact C-N 3.27Å; G99-T129 WeakPolarHBondContact O-CA 3.23Å
100	Y	95.6	Very high	95.5	Very high	34 Å²	34	28.7 Å²	28.7	13%	0.133	16%	0.155	C	C	.	.			trans	-86	135	-176.3	-75.2	-115.1	0	0	0	111	K95 D96 D98 H104 T129	K95-Y100 VanDerWaalsContact CA-O 3.32Å; K95-Y100 WeakPolarHBondContact CA-O 3.39Å; D96-Y100 PolarHBondContact N-O 2.83Å; D96-Y100 WeakPolarHBondContact OD1-CB 3.21Å; D96-Y100 PolarHBondContact OD1-N 3.21Å; D98-Y100 HydrophobicContact CB-CD2 3.51Å; D98-Y100 HydrophobicContact CB-CE2 3.89Å; D98-Y100 VanDerWaalsContact O-CD2 3.29Å; D98-Y100 WeakPolarHBondContact O-CD2 3.45Å; Y100-H104 HydrophobicContact CD1-CB 3.47Å; Y100-H104 VanDerWaalsContact CD1-CB 3.47Å; Y100-H104 HydrophobicContact CE1-CB 4.31Å; Y100-H104 HydrophobicContact CG-CB 4.18Å; Y100-T129 HydrophobicContact CD1-CG2 4.16Å; Y100-T129 HydrophobicContact CD2-CG2 3.77Å; Y100-T129 HydrophobicContact CE1-CG2 4.22Å; Y100-T129 HydrophobicContact CE2-CG2 3.88Å; Y100-T129 HydrophobicContact CG-CG2 3.89Å
101	T	97.9	Very high	95.6	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.012	14%	0.143	C	C	.	.			trans	-88.2	167.4	170.7	70.5	0	0	0	0	111.5	A94 K95 L103 H104 R105 N127	A94-T101 WeakPolarHBondContact O-CA 3.36Å; A94-T101 WeakPolarHBondContact O-CB 3.46Å; A94-T101 WeakPolarHBondContact O-CG2 3.38Å; K95-T101 HydrophobicContact CG-CG2 3.99Å; T101-L103 PolarHBondContact O-N 3.17Å; T101-L103 VanDerWaalsContact O-N 3.14Å; T101-L103 PolarHBondContact OG1-N 2.84Å; T101-H104 PolarHBondContact N-ND1 3.1Å; T101-H104 WeakPolarHBondContact O-CA 3.49Å; T101-H104 WeakPolarHBondContact O-CB 3.47Å; T101-H104 PolarHBondContact O-N 3.12Å; T101-H104 PolarHBondContact OG1-ND1 2.79Å; T101-R105 PolarHBondContact O-N 3.35Å; T101-R105 VanDerWaalsContact O-N 3.07Å; T101-N127 HydrophobicContact CG2-CB 4.42Å
102	A	98.1	Very high	95.7	Very high	2 Å²	2	27.8 Å²	27.8	2%	0.017	15%	0.153	C	C	.	.	H	α-helix	trans	-50.3	-38.6	171.3	0	0	0	0	0	112.7	F58 I59 A62 H104 R105 A106 L118	F58-A102 HydrophobicContact CD1-CB 3.67Å; F58-A102 HydrophobicContact CE1-CB 3.72Å; I59-A102 HydrophobicContact CG1-CB 4.45Å; A62-A102 HydrophobicContact CB-CB 3.68Å; A62-A102 WeakPolarHBondContact CB-O 3.41Å; A102-H104 VanDerWaalsContact C-N 3.34Å; A102-H104 PolarHBondContact O-N 3.11Å; A102-R105 PolarHBondContact O-N 3.06Å; A102-A106 WeakPolarHBondContact O-CB 3.35Å; A102-A106 PolarHBondContact O-N 3.45Å; A102-L118 HydrophobicContact CB-CD1 3.95Å; A102-L118 HydrophobicContact CB-CD2 4.35Å
103	L	98.5	Very high	95.7	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-66.4	-35.3	178.1	-164.7	71	0	0	0	112.3	T101 A107 L115 L118 M119 A123 P135	T101-L103 PolarHBondContact O-N 3.17Å; T101-L103 VanDerWaalsContact O-N 3.14Å; T101-L103 PolarHBondContact OG1-N 2.84Å; L103-A107 VanDerWaalsContact O-CB 3.23Å; L103-A107 WeakPolarHBondContact O-CB 3.35Å; L103-A107 PolarHBondContact O-N 2.84Å; L103-L115 HydrophobicContact CD1-CD1 3.44Å; L103-L115 VanDerWaalsContact CD1-CD1 3.44Å; L103-L115 HydrophobicContact CD1-CG 3.94Å; L103-L115 HydrophobicContact CG-CD1 3.95Å; L103-L115 WeakPolarHBondContact O-CD1 3.44Å; L103-L118 HydrophobicContact CB-CD1 4.44Å; L103-L118 HydrophobicContact CD1-CB 3.73Å; L103-L118 HydrophobicContact CD1-CD1 4.16Å; L103-M119 HydrophobicContact CD1-CG 3.84Å; L103-M119 HydrophobicContact CD2-CG 4.38Å; L103-A123 HydrophobicContact CB-CB 4.33Å; L103-A123 HydrophobicContact CD1-CB 4.25Å; L103-A123 HydrophobicContact CD2-CB 4.03Å; L103-A123 HydrophobicContact CG-CB 4.45Å; L103-P135 HydrophobicContact CB-CG 4.34Å; L103-P135 HydrophobicContact CD2-CB 4.35Å; L103-P135 HydrophobicContact CD2-CG 3.84Å; L103-P135 HydrophobicContact CG-CB 4.24Å; L103-P135 HydrophobicContact CG-CG 4.02Å
104	H	98.3	Very high	95.8	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-68.1	-44.1	173.8	-65.4	82.3	0	0	0	111.8	Y100 T101 A102 A107 Y108 N127 W133 T134 P135	Y100-H104 HydrophobicContact CD1-CB 3.47Å; Y100-H104 VanDerWaalsContact CD1-CB 3.47Å; Y100-H104 HydrophobicContact CE1-CB 4.31Å; Y100-H104 HydrophobicContact CG-CB 4.18Å; T101-H104 PolarHBondContact N-ND1 3.1Å; T101-H104 WeakPolarHBondContact O-CA 3.49Å; T101-H104 WeakPolarHBondContact O-CB 3.47Å; T101-H104 PolarHBondContact O-N 3.12Å; T101-H104 PolarHBondContact OG1-ND1 2.79Å; A102-H104 VanDerWaalsContact C-N 3.34Å; A102-H104 PolarHBondContact O-N 3.11Å; H104-A107 WeakPolarHBondContact O-CB 3.49Å; H104-A107 PolarHBondContact O-N 3.16Å; H104-Y108 WeakPolarHBondContact O-CB 3.41Å; H104-Y108 PolarHBondContact O-N 2.9Å; H104-N127 PolarHBondContact CE1-O 3.38Å; H104-N127 PolarHBondContact NE2-O 3.06Å; H104-W133 PolarHBondContact NE2-O 3.41Å; H104-W133 VanDerWaalsContact NE2-O 3.1Å; H104-T134 VanDerWaalsContact CD2-C 3.43Å; H104-T134 WeakPolarHBondContact NE2-CA 3.45Å; H104-P135 WeakPolarHBondContact NE2-CD 3.44Å
105	R	96.7	Very high	95.9	Very high	11 Å²	11	29 Å²	29	4%	0.042	15%	0.149	C	C	.	.	H	α-helix	trans	-65.1	-40.7	179.9	-65.3	-65.1	179.5	-168	-1.3	111.8	I59 E63 D96 D98 T101 A102 A107 Y108 G109	I59-R105 HydrophobicContact CG2-CG 3.76Å; E63-R105 HydrophobicContact CB-CB 3.97Å; E63-R105 HydrophobicContact CB-CG 4.44Å; E63-R105 HydrophobicContact CG-CB 4.5Å; D96-R105 IonicContact OD1-NH2 2.79Å; D96-R105 PolarHBondContact OD1-NH2 2.82Å; D96-R105 IonicContact OD2-CZ 2.81Å; D96-R105 IonicContact OD2-NE 3.23Å; D96-R105 PolarHBondContact OD2-NE 3.2Å; D96-R105 IonicContact OD2-NH2 3.79Å; D96-R105 PolarHBondContact OD2-NH2 3.3Å; D98-R105 IonicContact OD2-CZ 2.85Å; D98-R105 IonicContact OD2-NH2 3.46Å; D98-R105 PolarHBondContact OD2-NH2 2.94Å; T101-R105 PolarHBondContact O-N 3.35Å; T101-R105 VanDerWaalsContact O-N 3.07Å; A102-R105 PolarHBondContact O-N 3.06Å; R105-A107 PolarHBondContact O-N 2.91Å; R105-Y108 WeakPolarHBondContact O-CB 3.43Å; R105-Y108 PolarHBondContact O-N 3.4Å; R105-G109 PolarHBondContact O-N 3.1Å
106	A	98.3	Very high	96	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-63.6	-40.1	172.3	0	0	0	0	0	112.5	A62 A102 G109 G110 H111 V114 L115 L118	A62-A106 HydrophobicContact CB-CB 4.44Å; A102-A106 WeakPolarHBondContact O-CB 3.35Å; A102-A106 PolarHBondContact O-N 3.45Å; A106-G109 PolarHBondContact O-N 3.3Å; A106-G110 PolarHBondContact O-N 3.35Å; A106-H111 PolarHBondContact O-N 3.48Å; A106-V114 HydrophobicContact CB-CB 4.29Å; A106-V114 HydrophobicContact CB-CG1 3.69Å; A106-L115 HydrophobicContact CB-CB 4.5Å; A106-L115 HydrophobicContact CB-CD1 3.87Å; A106-L118 HydrophobicContact CB-CD1 4.21Å
107	A	98.2	Very high	96.3	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-66	-43.8	177.5	0	0	0	0	0	112.1	L103 H104 R105 G110 L115 P135 A139 K144 L151	L103-A107 VanDerWaalsContact O-CB 3.23Å; L103-A107 WeakPolarHBondContact O-CB 3.35Å; L103-A107 PolarHBondContact O-N 2.84Å; H104-A107 WeakPolarHBondContact O-CB 3.49Å; H104-A107 PolarHBondContact O-N 3.16Å; R105-A107 PolarHBondContact O-N 2.91Å; A107-G110 PolarHBondContact O-N 2.89Å; A107-L115 HydrophobicContact CB-CD1 3.86Å; A107-P135 HydrophobicContact CB-CB 4.09Å; A107-P135 WeakPolarHBondContact CB-O 3.14Å; A107-A139 HydrophobicContact CB-CB 4.14Å; A107-K144 WeakPolarHBondContact O-CG 3.23Å; A107-L151 HydrophobicContact CB-CD1 4.27Å
108	Y	94	Very high	96.8	Very high	53 Å²	53	25.7 Å²	25.7	21%	0.208	13%	0.134	C	C	.	.	H	α-helix	trans	-57.2	-47.9	171.4	163.6	-84.9	0	0	0	111.9	H104 R105 G110 W142 K144	H104-Y108 WeakPolarHBondContact O-CB 3.41Å; H104-Y108 PolarHBondContact O-N 2.9Å; R105-Y108 WeakPolarHBondContact O-CB 3.43Å; R105-Y108 PolarHBondContact O-N 3.4Å; Y108-G110 VanDerWaalsContact C-N 3.28Å; Y108-G110 PolarHBondContact O-N 2.67Å; Y108-W142 AromaticContact CD2-CD1 3.21Å; Y108-W142 AromaticContact CD2-CD2 3.99Å; Y108-W142 HydrophobicContact CD2-CD2 3.99Å; Y108-W142 AromaticContact CD2-CE2 3.59Å; Y108-W142 AromaticContact CD2-CG 3.8Å; Y108-W142 HydrophobicContact CD2-CG 3.8Å; Y108-W142 HydrophobicContact CD2-CZ2 4.31Å; Y108-W142 AromaticContact CD2-NE1 3.09Å; Y108-W142 AromaticContact CE2-CD1 3.69Å; Y108-W142 AromaticContact CE2-CD2 3.65Å; Y108-W142 HydrophobicContact CE2-CD2 3.65Å; Y108-W142 AromaticContact CE2-CE2 3.17Å; Y108-W142 HydrophobicContact CE2-CE3 4.36Å; Y108-W142 AromaticContact CE2-CG 3.98Å; Y108-W142 HydrophobicContact CE2-CG 3.98Å; Y108-W142 HydrophobicContact CE2-CH2 4.21Å; Y108-W142 AromaticContact CE2-CZ2 3.51Å; Y108-W142 HydrophobicContact CE2-CZ2 3.51Å; Y108-W142 AromaticContact CE2-NE1 3.22Å; Y108-K144 WeakPolarHBondContact O-CE 3.42Å; Y108-K144 WeakPolarHBondContact O-CG 3.35Å
109	G	94	Very high	97.4	Very high	21 Å²	21	24.2 Å²	24.2	22%	0.216	13%	0.125	C	C	.	.	H	α-helix	trans	-71.1	-22	-176.7	0	0	0	0	0	113.8	R105 A106	R105-G109 PolarHBondContact O-N 3.1Å; A106-G109 PolarHBondContact O-N 3.3Å
110	G	96.6	Very high	97.6	Very high	26 Å²	26	31.8 Å²	31.8	27%	0.268	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.6	21.2	-173.7	0	0	0	0	0	113.4	A106 A107 Y108 V112 C147	A106-G110 PolarHBondContact O-N 3.35Å; A107-G110 PolarHBondContact O-N 2.89Å; Y108-G110 VanDerWaalsContact C-N 3.28Å; Y108-G110 PolarHBondContact O-N 2.67Å; G110-V112 PolarHBondContact O-N 3.26Å; G110-C147 VanDerWaalsContact CA-SG 3.56Å
111	H	98.3	Very high	97.6	Very high	37 Å²	37	32.6 Å²	32.6	17%	0.171	16%	0.161	C	C	.	.			trans	-86.4	78.5	-170.9	-57.3	-34.2	0	0	0	111.1	A62 E63 N65 A106 E113 V114 L115	A62-H111 PolarHBondContact O-CD2 3.45Å; A62-H111 VanDerWaalsContact O-CD2 3.31Å; E63-H111 PolarHBondContact O-CD2 2.8Å; E63-H111 PolarHBondContact O-NE2 3Å; N65-H111 HydrophobicContact CB-CB 4.36Å; N65-H111 WeakPolarHBondContact OD1-CB 3.41Å; A106-H111 PolarHBondContact O-N 3.48Å; H111-E113 PolarHBondContact O-N 2.94Å; H111-V114 HydrophobicContact CB-CB 4.03Å; H111-V114 HydrophobicContact CB-CG2 4.3Å; H111-V114 PolarHBondContact O-N 2.85Å; H111-L115 WeakPolarHBondContact O-CB 3.41Å; H111-L115 PolarHBondContact O-N 3.44Å
112	V	98.4	Very high	97.5	Very high	43 Å²	43	35.2 Å²	35.2	26%	0.261	19%	0.188	S	C	.	.	H	α-helix	trans	-56.4	-45.3	-171.4	-179.4	0	0	0	0	112.7	G110 L115 Q116 S146 L150	G110-V112 PolarHBondContact O-N 3.26Å; V112-L115 PolarHBondContact O-N 3.46Å; V112-Q116 HydrophobicContact CG1-CG 4.4Å; V112-Q116 WeakPolarHBondContact O-CG 3.4Å; V112-Q116 PolarHBondContact O-N 3.15Å; V112-S146 VanDerWaalsContact CG2-CB 3.47Å; V112-L150 HydrophobicContact CG1-CD2 4.02Å
113	E	98.4	Very high	97.5	Very high	114 Å²	114	35.5 Å²	35.5	53%	0.533	19%	0.191	S	C	.	.	H	α-helix	trans	-65.2	-42.8	-178	-165.8	-176.4	170.2	0	0	111.5	L67 R71 H111 Q116 Y117	L67-E113 HydrophobicContact CD2-CB 4.41Å; L67-E113 HydrophobicContact CD2-CG 3.6Å; L67-E113 WeakPolarHBondContact CD2-OE1 3.5Å; R71-E113 IonicContact NH2-OE1 2.8Å; R71-E113 PolarHBondContact NH2-OE1 3.2Å; H111-E113 PolarHBondContact O-N 2.94Å; E113-Q116 PolarHBondContact O-N 3.36Å; E113-Y117 WeakPolarHBondContact O-CB 3.34Å; E113-Y117 PolarHBondContact O-N 2.81Å
114	V	98.7	Very high	97.5	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60.8	-46.8	173.5	171.7	0	0	0	0	110.6	A62 N65 L67 I70 A106 H111 Q116 Y117 L118	A62-V114 HydrophobicContact CB-CG1 4.11Å; N65-V114 WeakPolarHBondContact OD1-CG2 3.21Å; L67-V114 HydrophobicContact CB-CG2 4.1Å; L67-V114 HydrophobicContact CD1-CG2 4.33Å; I70-V114 HydrophobicContact CD1-CB 4.39Å; I70-V114 HydrophobicContact CD1-CG1 3.4Å; I70-V114 VanDerWaalsContact CD1-CG1 3.4Å; I70-V114 HydrophobicContact CD1-CG2 4.13Å; A106-V114 HydrophobicContact CB-CB 4.29Å; A106-V114 HydrophobicContact CB-CG1 3.69Å; H111-V114 HydrophobicContact CB-CB 4.03Å; H111-V114 HydrophobicContact CB-CG2 4.3Å; H111-V114 PolarHBondContact O-N 2.85Å; V114-Q116 PolarHBondContact O-N 2.73Å; V114-Y117 PolarHBondContact O-N 3.07Å; V114-Y117 VanDerWaalsContact O-N 3.16Å; V114-L118 HydrophobicContact CG1-CD1 3.84Å; V114-L118 HydrophobicContact CG1-CG 4.22Å; V114-L118 WeakPolarHBondContact O-CG 3.48Å; V114-L118 PolarHBondContact O-N 2.94Å
115	L	98.3	Very high	97.4	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-58.1	-48.3	179.2	-158.3	78.3	0	0	0	111.4	L103 A106 A107 H111 V112 Y117 L118 M119 C147 L150 L151	L103-L115 HydrophobicContact CD1-CD1 3.44Å; L103-L115 VanDerWaalsContact CD1-CD1 3.44Å; L103-L115 HydrophobicContact CD1-CG 3.94Å; L103-L115 HydrophobicContact CG-CD1 3.95Å; L103-L115 WeakPolarHBondContact O-CD1 3.44Å; A106-L115 HydrophobicContact CB-CB 4.5Å; A106-L115 HydrophobicContact CB-CD1 3.87Å; A107-L115 HydrophobicContact CB-CD1 3.86Å; H111-L115 WeakPolarHBondContact O-CB 3.41Å; H111-L115 PolarHBondContact O-N 3.44Å; V112-L115 PolarHBondContact O-N 3.46Å; L115-Y117 VanDerWaalsContact C-N 3.32Å; L115-Y117 PolarHBondContact O-N 2.82Å; L115-L118 PolarHBondContact O-N 2.88Å; L115-M119 HydrophobicContact CD2-CE 4.28Å; L115-M119 HydrophobicContact CG-CE 4.03Å; L115-M119 WeakPolarHBondContact O-CE 3.38Å; L115-M119 WeakPolarHBondContact O-CG 3.4Å; L115-M119 PolarHBondContact O-N 3.37Å; L115-C147 HydrophobicContact CD2-CB 3.87Å; L115-L150 HydrophobicContact CB-CD2 4.29Å; L115-L150 HydrophobicContact CD2-CD2 3.95Å; L115-L150 HydrophobicContact CG-CD2 4.45Å; L115-L151 HydrophobicContact CD2-CD1 4.18Å; L115-L151 HydrophobicContact CD2-CD2 4.02Å; L115-L151 HydrophobicContact CD2-CG 3.81Å
116	Q	98.3	Very high	97.5	Very high	100 Å²	100	42.7 Å²	42.7	47%	0.467	23%	0.229	S	C	.	.	H	α-helix	trans	-57.4	-45.3	175.1	-72.4	-178.7	7.5	0	0	111.7	V112 E113 V114 M119 K120 L150	V112-Q116 HydrophobicContact CG1-CG 4.4Å; V112-Q116 WeakPolarHBondContact O-CG 3.4Å; V112-Q116 PolarHBondContact O-N 3.15Å; E113-Q116 PolarHBondContact O-N 3.36Å; V114-Q116 PolarHBondContact O-N 2.73Å; Q116-M119 PolarHBondContact O-N 3.36Å; Q116-K120 WeakPolarHBondContact O-CB 3.29Å; Q116-K120 PolarHBondContact O-N 2.86Å; Q116-L150 HydrophobicContact CB-CD2 4.38Å; Q116-L150 HydrophobicContact CG-CD1 4.02Å; Q116-L150 HydrophobicContact CG-CD2 3.24Å; Q116-L150 HydrophobicContact CG-CG 4.26Å
117	Y	98.3	Very high	97.4	Very high	31 Å²	31	44.2 Å²	44.2	12%	0.122	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-47.2	-178.8	-156.8	-93.9	0	0	0	111.1	L67 I70 R71 I74 E113 V114 L115 M119 K120 Y121	L67-Y117 HydrophobicContact CD1-CD1 4.01Å; L67-Y117 HydrophobicContact CD1-CD2 4.22Å; L67-Y117 HydrophobicContact CD1-CG 3.76Å; I70-Y117 HydrophobicContact CG2-CD1 4.14Å; R71-Y117 HydrophobicContact CG-CD1 4.5Å; R71-Y117 HydrophobicContact CG-CE1 3.77Å; R71-Y117 HydrophobicContact CG-CE2 4.1Å; I74-Y117 HydrophobicContact CD1-CD1 4.06Å; I74-Y117 HydrophobicContact CD1-CE1 3.83Å; E113-Y117 WeakPolarHBondContact O-CB 3.34Å; E113-Y117 PolarHBondContact O-N 2.81Å; V114-Y117 PolarHBondContact O-N 3.07Å; V114-Y117 VanDerWaalsContact O-N 3.16Å; L115-Y117 VanDerWaalsContact C-N 3.32Å; L115-Y117 PolarHBondContact O-N 2.82Å; Y117-M119 PolarHBondContact O-N 3.02Å; Y117-K120 WeakPolarHBondContact O-CB 3.46Å; Y117-K120 PolarHBondContact O-N 3.13Å; Y117-Y121 AromaticContact CD1-CD2 3.86Å; Y117-Y121 HydrophobicContact CD1-CD2 3.86Å; Y117-Y121 AromaticContact CD1-CE2 3.79Å; Y117-Y121 HydrophobicContact CD1-CE2 3.79Å; Y117-Y121 HydrophobicContact CD2-CE2 4.42Å; Y117-Y121 AromaticContact CE1-CD2 3.67Å; Y117-Y121 HydrophobicContact CE1-CD2 3.67Å; Y117-Y121 AromaticContact CE1-CE2 3.2Å; Y117-Y121 HydrophobicContact CE1-CE2 3.2Å; Y117-Y121 AromaticContact CE2-CE2 3.95Å; Y117-Y121 HydrophobicContact CE2-CE2 3.95Å; Y117-Y121 HydrophobicContact CG-CE2 4.35Å; Y117-Y121 AromaticContact CZ-CE2 3.28Å; Y117-Y121 AromaticContact CZ-CZ 3.95Å; Y117-Y121 VanDerWaalsContact O-CD2 3.3Å; Y117-Y121 WeakPolarHBondContact O-CD2 3.46Å; Y117-Y121 PolarHBondContact O-N 2.91Å; Y117-Y121 WeakPolarHBondContact OH-CE2 3.16Å; Y117-Y121 PolarHBondContact OH-OH 3.2Å
118	L	98.4	Very high	97.4	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-59.7	-44.9	177.9	-68.2	173.8	0	0	0	112.1	F58 A62 I70 L92 A102 L103 A106 V114 L115 K120 Y121 G122 A123	F58-L118 HydrophobicContact CE1-CD2 3.61Å; F58-L118 HydrophobicContact CE2-CD2 4.4Å; F58-L118 HydrophobicContact CZ-CD2 3.38Å; A62-L118 HydrophobicContact CB-CD1 4.31Å; I70-L118 HydrophobicContact CG2-CD2 4.11Å; L92-L118 HydrophobicContact CD2-CD2 4.15Å; A102-L118 HydrophobicContact CB-CD1 3.95Å; A102-L118 HydrophobicContact CB-CD2 4.35Å; L103-L118 HydrophobicContact CB-CD1 4.44Å; L103-L118 HydrophobicContact CD1-CB 3.73Å; L103-L118 HydrophobicContact CD1-CD1 4.16Å; A106-L118 HydrophobicContact CB-CD1 4.21Å; V114-L118 HydrophobicContact CG1-CD1 3.84Å; V114-L118 HydrophobicContact CG1-CG 4.22Å; V114-L118 WeakPolarHBondContact O-CG 3.48Å; V114-L118 PolarHBondContact O-N 2.94Å; L115-L118 PolarHBondContact O-N 2.88Å; L118-K120 VanDerWaalsContact C-N 3.34Å; L118-K120 PolarHBondContact O-N 3.24Å; L118-Y121 PolarHBondContact O-N 2.92Å; L118-G122 PolarHBondContact O-N 3.41Å; L118-A123 HydrophobicContact CB-CB 4.02Å; L118-A123 VanDerWaalsContact O-CB 3.24Å; L118-A123 WeakPolarHBondContact O-CB 3.5Å; L118-A123 PolarHBondContact O-N 3.33Å; L118-A123 VanDerWaalsContact O-N 3.09Å
119	M	97.9	Very high	97.5	Very high	31 Å²	31	47 Å²	47	15%	0.153	25%	0.249	C	C	.	.	H	α-helix	trans	-63.5	-39.1	177.6	-69.7	-176.4	-70.5	0	0	112.1	L103 L115 Q116 Y117 Y121 G122 I125 L150 L151 A154	L103-M119 HydrophobicContact CD1-CG 3.84Å; L103-M119 HydrophobicContact CD2-CG 4.38Å; L115-M119 HydrophobicContact CD2-CE 4.28Å; L115-M119 HydrophobicContact CG-CE 4.03Å; L115-M119 WeakPolarHBondContact O-CE 3.38Å; L115-M119 WeakPolarHBondContact O-CG 3.4Å; L115-M119 PolarHBondContact O-N 3.37Å; Q116-M119 PolarHBondContact O-N 3.36Å; Y117-M119 PolarHBondContact O-N 3.02Å; M119-Y121 PolarHBondContact O-N 3.06Å; M119-G122 PolarHBondContact O-N 3.15Å; M119-I125 HydrophobicContact CG-CD1 4.39Å; M119-I125 HydrophobicContact CG-CG1 3.96Å; M119-I125 HydrophobicContact SD-CD1 4.03Å; M119-I125 HydrophobicContact SD-CG1 3.89Å; M119-L150 HydrophobicContact CE-CD1 4.01Å; M119-L150 HydrophobicContact CE-CD2 3.46Å; M119-L150 VanDerWaalsContact CE-CD2 3.46Å; M119-L150 HydrophobicContact CE-CG 3.48Å; M119-L150 VanDerWaalsContact CE-CG 3.48Å; M119-L151 HydrophobicContact SD-CD2 4.2Å; M119-A154 HydrophobicContact SD-CB 3.91Å
120	K	97.3	Very high	97.5	Very high	160 Å²	160	52.7 Å²	52.7	70%	0.696	27%	0.27	S	S	*	.	H	α-helix	trans	-58	-32.8	176.3	177.7	-176.2	175	-176.7	0	112.7	Q116 Y117 L118 G122	Q116-K120 WeakPolarHBondContact O-CB 3.29Å; Q116-K120 PolarHBondContact O-N 2.86Å; Y117-K120 WeakPolarHBondContact O-CB 3.46Å; Y117-K120 PolarHBondContact O-N 3.13Å; L118-K120 VanDerWaalsContact C-N 3.34Å; L118-K120 PolarHBondContact O-N 3.24Å; K120-G122 VanDerWaalsContact C-N 3.34Å
121	Y	96.5	Very high	97.3	Very high	51 Å²	51	56 Å²	56	20%	0.2	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	7	178.5	-75.1	-83.1	0	0	0	114	I74 K78 L88 L92 Y117 L118 M119	I74-Y121 HydrophobicContact CD1-CD2 4.06Å; I74-Y121 HydrophobicContact CD1-CG 4.22Å; I74-Y121 HydrophobicContact CG2-CD1 3.78Å; I74-Y121 HydrophobicContact CG2-CD2 4.44Å; I74-Y121 HydrophobicContact CG2-CE1 3.69Å; I74-Y121 HydrophobicContact CG2-CE2 4.41Å; I74-Y121 HydrophobicContact CG2-CG 4.15Å; K78-Y121 HydrophobicContact CD-CE1 4.1Å; L88-Y121 HydrophobicContact CD2-CD1 4.37Å; L92-Y121 WeakPolarHBondContact CD1-O 3.48Å; Y117-Y121 AromaticContact CD1-CD2 3.86Å; Y117-Y121 HydrophobicContact CD1-CD2 3.86Å; Y117-Y121 AromaticContact CD1-CE2 3.79Å; Y117-Y121 HydrophobicContact CD1-CE2 3.79Å; Y117-Y121 HydrophobicContact CD2-CE2 4.42Å; Y117-Y121 AromaticContact CE1-CD2 3.67Å; Y117-Y121 HydrophobicContact CE1-CD2 3.67Å; Y117-Y121 AromaticContact CE1-CE2 3.2Å; Y117-Y121 HydrophobicContact CE1-CE2 3.2Å; Y117-Y121 AromaticContact CE2-CE2 3.95Å; Y117-Y121 HydrophobicContact CE2-CE2 3.95Å; Y117-Y121 HydrophobicContact CG-CE2 4.35Å; Y117-Y121 AromaticContact CZ-CE2 3.28Å; Y117-Y121 AromaticContact CZ-CZ 3.95Å; Y117-Y121 VanDerWaalsContact O-CD2 3.3Å; Y117-Y121 WeakPolarHBondContact O-CD2 3.46Å; Y117-Y121 PolarHBondContact O-N 2.91Å; Y117-Y121 WeakPolarHBondContact OH-CE2 3.16Å; Y117-Y121 PolarHBondContact OH-OH 3.2Å; L118-Y121 PolarHBondContact O-N 2.92Å; M119-Y121 PolarHBondContact O-N 3.06Å
122	G	96.1	Very high	97.3	Very high	57 Å²	57	54.4 Å²	54.4	59%	0.588	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.1	20.9	172.9	0	0	0	0	0	114.6	L118 M119 K120 N124	L118-G122 PolarHBondContact O-N 3.41Å; M119-G122 PolarHBondContact O-N 3.15Å; K120-G122 VanDerWaalsContact C-N 3.34Å; G122-N124 PolarHBondContact O-N 2.81Å
123	A	97.8	Very high	97.2	Very high	8 Å²	8	54.1 Å²	54.1	7%	0.066	27%	0.269	C	S	.	.			trans	-56.5	128.9	166.4	0	0	0	0	0	109.9	L92 L103 L118 I125	L92-A123 HydrophobicContact CD2-CB 4.1Å; L103-A123 HydrophobicContact CB-CB 4.33Å; L103-A123 HydrophobicContact CD1-CB 4.25Å; L103-A123 HydrophobicContact CD2-CB 4.03Å; L103-A123 HydrophobicContact CG-CB 4.45Å; L118-A123 HydrophobicContact CB-CB 4.02Å; L118-A123 VanDerWaalsContact O-CB 3.24Å; L118-A123 WeakPolarHBondContact O-CB 3.5Å; L118-A123 PolarHBondContact O-N 3.33Å; L118-A123 VanDerWaalsContact O-N 3.09Å; A123-I125 PolarHBondContact O-N 2.91Å; A123-I125 VanDerWaalsContact O-N 3.15Å
124	N	97.8	Very high	97.2	Very high	83 Å²	83	48.7 Å²	48.7	44%	0.444	24%	0.243	S	C	.	.			trans	-70.9	112.6	-179.7	-178.9	2.5	0	0	0	110.6	G122 N126 N127	G122-N124 PolarHBondContact O-N 2.81Å; N124-N126 PolarHBondContact O-N 3.01Å; N124-N126 PolarHBondContact OD1-N 2.97Å; N124-N127 HydrophobicContact CB-CB 4.31Å; N124-N127 WeakPolarHBondContact CB-OD1 3.24Å; N124-N127 PolarHBondContact ND2-OD1 3.43Å; N124-N127 PolarHBondContact O-N 3.13Å; N124-N127 VanDerWaalsContact O-N 3.16Å
125	I	98	Very high	97.2	Very high	30 Å²	30	48.7 Å²	48.7	15%	0.154	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-25.8	-179.1	-63.6	163.7	0	0	0	112.4	M119 A123 P135 L151 A154 A156	M119-I125 HydrophobicContact CG-CD1 4.39Å; M119-I125 HydrophobicContact CG-CG1 3.96Å; M119-I125 HydrophobicContact SD-CD1 4.03Å; M119-I125 HydrophobicContact SD-CG1 3.89Å; A123-I125 PolarHBondContact O-N 2.91Å; A123-I125 VanDerWaalsContact O-N 3.15Å; I125-P135 VanDerWaalsContact O-CD 3.26Å; I125-P135 WeakPolarHBondContact O-CD 3.4Å; I125-P135 WeakPolarHBondContact O-CG 3.29Å; I125-L151 HydrophobicContact CG2-CD2 4.03Å; I125-A154 HydrophobicContact CD1-CB 3.6Å; I125-A154 WeakPolarHBondContact CD1-O 3.46Å; I125-A156 HydrophobicContact CG2-CB 3.66Å
126	N	97.8	Very high	97.2	Very high	50 Å²	50	48.7 Å²	48.7	27%	0.267	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.1	19.9	-177.6	-63.9	-52	0	0	0	112.8	N124 D157	N124-N126 PolarHBondContact O-N 3.01Å; N124-N126 PolarHBondContact OD1-N 2.97Å; N126-D157 PolarHBondContact OD1-N 2.79Å
127	N	96.9	Very high	97.2	Very high	32 Å²	32	44 Å²	44	17%	0.171	22%	0.221	C	C	.	.			trans	-56.5	144.5	172.3	-107.3	22.2	0	0	0	110.2	T101 H104 N124 T134	T101-N127 HydrophobicContact CG2-CB 4.42Å; H104-N127 PolarHBondContact CE1-O 3.38Å; H104-N127 PolarHBondContact NE2-O 3.06Å; N124-N127 HydrophobicContact CB-CB 4.31Å; N124-N127 WeakPolarHBondContact CB-OD1 3.24Å; N124-N127 PolarHBondContact ND2-OD1 3.43Å; N124-N127 PolarHBondContact O-N 3.13Å; N124-N127 VanDerWaalsContact O-N 3.16Å; N127-T134 WeakPolarHBondContact O-CA 3.33Å
128	R	96.7	Very high	97.1	Very high	106 Å²	106	42.6 Å²	42.6	40%	0.4	22%	0.216	S	C	.	.			trans	-113	133.9	-179.2	-74.7	-175.9	165	88.9	-1.4	111.7	K95 W133 T134 A160	K95-R128 WeakPolarHBondContact CE-O 3.41Å; K95-R128 PolarHBondContact NZ-O 3.18Å; R128-W133 CarbonylContact C-O 3.59Å; R128-W133 WeakPolarHBondContact CA-O 3.48Å; R128-T134 HydrophobicContact CG-CG2 3.99Å; R128-A160 VanDerWaalsContact NH2-CB 3.35Å
129	T	96.6	Very high	97	Very high	7 Å²	7	42.5 Å²	42.5	4%	0.043	22%	0.216	C	C	.	.			trans	-69.2	177.3	165.8	73.5	0	0	0	0	110.6	G99 Y100 D131 G132 W133	G99-T129 WeakPolarHBondContact O-CA 3.23Å; Y100-T129 HydrophobicContact CD1-CG2 4.16Å; Y100-T129 HydrophobicContact CD2-CG2 3.77Å; Y100-T129 HydrophobicContact CE1-CG2 4.22Å; Y100-T129 HydrophobicContact CE2-CG2 3.88Å; Y100-T129 HydrophobicContact CG-CG2 3.89Å; T129-D131 PolarHBondContact O-N 3.14Å; T129-D131 PolarHBondContact OG1-N 2.89Å; T129-G132 PolarHBondContact O-N 3.41Å; T129-W133 HydrophobicContact CG2-CB 3.94Å; T129-W133 PolarHBondContact N-O 2.96Å; T129-W133 WeakPolarHBondContact OG1-CB 3.41Å; T129-W133 PolarHBondContact OG1-N 3.32Å; T129-W133 VanDerWaalsContact OG1-N 3.1Å
130	E	93.5	Very high	96.8	Very high	140 Å²	140	41.1 Å²	41.1	65%	0.654	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-34.7	175.6	-60.7	-169.1	167.1	0	0	112.1	G132 N163	E130-G132 PolarHBondContact O-N 3.35Å; E130-N163 PolarHBondContact O-ND2 2.99Å
131	D	94.1	Very high	96.6	Very high	95 Å²	95	35.5 Å²	35.5	51%	0.508	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	5.9	172.9	-69.7	-43.3	0	0	0	114	T129 W133 N163	T129-D131 PolarHBondContact O-N 3.14Å; T129-D131 PolarHBondContact OG1-N 2.89Å; D131-W133 VanDerWaalsContact C-N 3.27Å; D131-W133 PolarHBondContact O-N 3.23Å; D131-N163 VanDerWaalsContact C-CG 3.4Å; D131-N163 WeakPolarHBondContact CA-ND2 3.46Å; D131-N163 WeakPolarHBondContact O-CB 3.45Å; D131-N163 PolarHBondContact O-N 3.47Å
132	G	96.8	Very high	96.4	Very high	3 Å²	3	37 Å²	37	3%	0.031	19%	0.19	C	C	.	.			trans	75.7	11.5	179	0	0	0	0	0	114.4	T129 E130	T129-G132 PolarHBondContact O-N 3.41Å; E130-G132 PolarHBondContact O-N 3.35Å
133	W	97.8	Very high	96.3	Very high	37 Å²	37	36 Å²	36	14%	0.14	17%	0.171	C	C	.	.			trans	-69.1	144.2	177	-73.2	56.6	0	0	0	110.4	H104 R128 T129 D131 H137 F141 T162 L171	H104-W133 PolarHBondContact NE2-O 3.41Å; H104-W133 VanDerWaalsContact NE2-O 3.1Å; R128-W133 CarbonylContact C-O 3.59Å; R128-W133 WeakPolarHBondContact CA-O 3.48Å; T129-W133 HydrophobicContact CG2-CB 3.94Å; T129-W133 PolarHBondContact N-O 2.96Å; T129-W133 WeakPolarHBondContact OG1-CB 3.41Å; T129-W133 PolarHBondContact OG1-N 3.32Å; T129-W133 VanDerWaalsContact OG1-N 3.1Å; D131-W133 VanDerWaalsContact C-N 3.27Å; D131-W133 PolarHBondContact O-N 3.23Å; W133-H137 HydrophobicContact CB-CB 4.31Å; W133-H137 HydrophobicContact CD2-CB 4.13Å; W133-H137 HydrophobicContact CE3-CB 3.67Å; W133-H137 HydrophobicContact CG-CB 4.43Å; W133-H137 HydrophobicContact CZ3-CB 4.35Å; W133-F141 HydrophobicContact CH2-CB 3.92Å; W133-F141 HydrophobicContact CH2-CD1 4.15Å; W133-F141 AromaticContact CH2-CD2 3.83Å; W133-F141 HydrophobicContact CH2-CD2 3.83Å; W133-F141 HydrophobicContact CH2-CE2 4.36Å; W133-F141 AromaticContact CH2-CG 3.7Å; W133-F141 HydrophobicContact CH2-CG 3.7Å; W133-F141 HydrophobicContact CZ3-CB 3.74Å; W133-F141 HydrophobicContact CZ3-CD1 4.48Å; W133-F141 HydrophobicContact CZ3-CG 4.02Å; W133-T162 HydrophobicContact CD2-CG2 4.45Å; W133-T162 HydrophobicContact CG-CG2 4.17Å; W133-L171 HydrophobicContact CD2-CD1 4.31Å; W133-L171 HydrophobicContact CE3-CD1 4.03Å; W133-L171 HydrophobicContact CH2-CD1 3.7Å; W133-L171 HydrophobicContact CH2-CD2 4.29Å; W133-L171 HydrophobicContact CZ2-CD1 3.97Å; W133-L171 HydrophobicContact CZ2-CD2 4.25Å; W133-L171 HydrophobicContact CZ3-CD1 3.72Å
134	T	98.3	Very high	96.1	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.183	C	C	.	.			trans	-109.3	165.6	170.4	66.8	0	0	0	0	109.3	H104 N127 R128 L136 H137 S138 A160	H104-T134 VanDerWaalsContact CD2-C 3.43Å; H104-T134 WeakPolarHBondContact NE2-CA 3.45Å; N127-T134 WeakPolarHBondContact O-CA 3.33Å; R128-T134 HydrophobicContact CG-CG2 3.99Å; T134-L136 PolarHBondContact O-N 3.45Å; T134-L136 VanDerWaalsContact O-N 3.13Å; T134-H137 PolarHBondContact N-ND1 2.87Å; T134-H137 VanDerWaalsContact N-ND1 3.12Å; T134-H137 WeakPolarHBondContact O-CA 3.49Å; T134-H137 WeakPolarHBondContact O-CB 3.32Å; T134-H137 PolarHBondContact O-N 2.81Å; T134-H137 PolarHBondContact OG1-N 3.37Å; T134-H137 PolarHBondContact OG1-ND1 3.37Å; T134-S138 PolarHBondContact O-N 3.5Å; T134-S138 VanDerWaalsContact O-N 3.11Å; T134-A160 HydrophobicContact CG2-CB 3.91Å
135	P	98.5	Very high	96	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-53.3	-34.3	173	-27.1	35	0	0	0	113.1	L103 H104 A107 I125 S138 A139 L151	L103-P135 HydrophobicContact CB-CG 4.34Å; L103-P135 HydrophobicContact CD2-CB 4.35Å; L103-P135 HydrophobicContact CD2-CG 3.84Å; L103-P135 HydrophobicContact CG-CB 4.24Å; L103-P135 HydrophobicContact CG-CG 4.02Å; H104-P135 WeakPolarHBondContact NE2-CD 3.44Å; A107-P135 HydrophobicContact CB-CB 4.09Å; A107-P135 WeakPolarHBondContact CB-O 3.14Å; I125-P135 VanDerWaalsContact O-CD 3.26Å; I125-P135 WeakPolarHBondContact O-CD 3.4Å; I125-P135 WeakPolarHBondContact O-CG 3.29Å; P135-S138 PolarHBondContact O-N 3.48Å; P135-A139 PolarHBondContact O-N 3.26Å; P135-L151 HydrophobicContact CB-CD1 4.18Å; P135-L151 HydrophobicContact CB-CD2 4.1Å
136	L	98.2	Very high	95.9	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-65.7	-40.7	175.3	-177.6	64.5	0	0	0	112.3	T134 S138 A139 A140 V148 L151 I152 A156 L158 A168	T134-L136 PolarHBondContact O-N 3.45Å; T134-L136 VanDerWaalsContact O-N 3.13Å; L136-S138 VanDerWaalsContact C-N 3.34Å; L136-S138 PolarHBondContact O-N 3.4Å; L136-A139 PolarHBondContact O-N 2.92Å; L136-A140 WeakPolarHBondContact O-CB 3.38Å; L136-A140 PolarHBondContact O-N 3.26Å; L136-V148 HydrophobicContact CD1-CG1 3.93Å; L136-L151 HydrophobicContact CB-CD1 4.44Å; L136-L151 HydrophobicContact CD1-CB 4.24Å; L136-L151 HydrophobicContact CD1-CD1 4.5Å; L136-I152 HydrophobicContact CD1-CG1 4.17Å; L136-A156 HydrophobicContact CB-CB 4.25Å; L136-A156 HydrophobicContact CD2-CB 4.14Å; L136-L158 HydrophobicContact CD2-CD2 3.99Å; L136-A168 HydrophobicContact CD2-CB 4Å; L136-A168 HydrophobicContact CG-CB 3.79Å
137	H	97.2	Very high	95.9	Very high	1 Å²	1	37 Å²	37	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-59.5	-45.3	173.2	-70.3	106.8	0	0	0	111.4	W133 T134 A140 F141 A160 Q166 T167 A168 L171	W133-H137 HydrophobicContact CB-CB 4.31Å; W133-H137 HydrophobicContact CD2-CB 4.13Å; W133-H137 HydrophobicContact CE3-CB 3.67Å; W133-H137 HydrophobicContact CG-CB 4.43Å; W133-H137 HydrophobicContact CZ3-CB 4.35Å; T134-H137 PolarHBondContact N-ND1 2.87Å; T134-H137 VanDerWaalsContact N-ND1 3.12Å; T134-H137 WeakPolarHBondContact O-CA 3.49Å; T134-H137 WeakPolarHBondContact O-CB 3.32Å; T134-H137 PolarHBondContact O-N 2.81Å; T134-H137 PolarHBondContact OG1-N 3.37Å; T134-H137 PolarHBondContact OG1-ND1 3.37Å; H137-A140 PolarHBondContact O-N 3.14Å; H137-F141 WeakPolarHBondContact O-CB 3.46Å; H137-F141 PolarHBondContact O-N 2.92Å; H137-A160 PolarHBondContact CE1-O 3.28Å; H137-A160 PolarHBondContact NE2-O 3.08Å; H137-Q166 PolarHBondContact NE2-O 2.95Å; H137-T167 VanDerWaalsContact CD2-C 3.5Å; H137-A168 PolarHBondContact CD2-N 3.04Å; H137-A168 VanDerWaalsContact CD2-N 3.26Å; H137-A168 PolarHBondContact NE2-N 3.22Å; H137-L171 HydrophobicContact CB-CD1 3.6Å; H137-L171 VanDerWaalsContact CD2-CD1 3.47Å; H137-L171 WeakPolarHBondContact CD2-CD1 3.16Å
138	S	96.1	Very high	95.9	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.007	17%	0.169	C	C	.	.	H	α-helix	trans	-61.6	-51.6	177.5	-55.8	0	0	0	0	111.6	T134 P135 L136 A140 W142	T134-S138 PolarHBondContact O-N 3.5Å; T134-S138 VanDerWaalsContact O-N 3.11Å; P135-S138 PolarHBondContact O-N 3.48Å; L136-S138 VanDerWaalsContact C-N 3.34Å; L136-S138 PolarHBondContact O-N 3.4Å; S138-A140 VanDerWaalsContact C-N 3.27Å; S138-A140 PolarHBondContact O-N 3.04Å; S138-W142 PolarHBondContact O-N 3.31Å
139	A	96.7	Very high	96	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-59.9	-39.1	177.7	0	0	0	0	0	112.1	A107 P135 L136 N143 K144 C147 V148 L151	A107-A139 HydrophobicContact CB-CB 4.14Å; P135-A139 PolarHBondContact O-N 3.26Å; L136-A139 PolarHBondContact O-N 2.92Å; A139-N143 PolarHBondContact O-N 3.26Å; A139-K144 HydrophobicContact CB-CB 4.31Å; A139-K144 PolarHBondContact O-N 3.09Å; A139-C147 HydrophobicContact CB-CB 3.99Å; A139-V148 HydrophobicContact CB-CG2 3.65Å; A139-L151 HydrophobicContact CB-CD1 3.97Å
140	A	94.8	Very high	96	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-71.2	-45.9	-177	0	0	0	0	0	112.9	L136 H137 S138 W142 N143 A168 A172 T181 L185	L136-A140 WeakPolarHBondContact O-CB 3.38Å; L136-A140 PolarHBondContact O-N 3.26Å; H137-A140 PolarHBondContact O-N 3.14Å; S138-A140 VanDerWaalsContact C-N 3.27Å; S138-A140 PolarHBondContact O-N 3.04Å; A140-W142 PolarHBondContact O-N 3.22Å; A140-N143 PolarHBondContact O-N 3.4Å; A140-A168 HydrophobicContact CB-CB 3.89Å; A140-A172 HydrophobicContact CB-CB 4.47Å; A140-T181 HydrophobicContact CB-CG2 3.97Å; A140-L185 HydrophobicContact CB-CD1 4.12Å
141	F	93.3	Very high	96.3	Very high	42 Å²	42	29.4 Å²	29.4	18%	0.184	15%	0.146	C	C	.	.	H	α-helix	trans	-60.6	-33.7	178.2	-173.5	-94.9	0	0	0	112.1	W133 H137 L171 S174 N175	W133-F141 HydrophobicContact CH2-CB 3.92Å; W133-F141 HydrophobicContact CH2-CD1 4.15Å; W133-F141 AromaticContact CH2-CD2 3.83Å; W133-F141 HydrophobicContact CH2-CD2 3.83Å; W133-F141 HydrophobicContact CH2-CE2 4.36Å; W133-F141 AromaticContact CH2-CG 3.7Å; W133-F141 HydrophobicContact CH2-CG 3.7Å; W133-F141 HydrophobicContact CZ3-CB 3.74Å; W133-F141 HydrophobicContact CZ3-CD1 4.48Å; W133-F141 HydrophobicContact CZ3-CG 4.02Å; H137-F141 WeakPolarHBondContact O-CB 3.46Å; H137-F141 PolarHBondContact O-N 2.92Å; F141-L171 HydrophobicContact CB-CB 4.08Å; F141-L171 HydrophobicContact CB-CD1 4.47Å; F141-L171 HydrophobicContact CD2-CB 3.99Å; F141-L171 HydrophobicContact CD2-CD2 4.07Å; F141-L171 HydrophobicContact CD2-CG 4.46Å; F141-S174 WeakPolarHBondContact CE2-OG 3.37Å; F141-N175 HydrophobicContact CD1-CB 4.17Å; F141-N175 WeakPolarHBondContact CD1-ND2 3.4Å; F141-N175 HydrophobicContact CD2-CB 3.91Å; F141-N175 HydrophobicContact CE1-CB 3.99Å; F141-N175 WeakPolarHBondContact CE1-ND2 3.49Å; F141-N175 HydrophobicContact CE2-CB 3.72Å; F141-N175 HydrophobicContact CG-CB 4.15Å; F141-N175 HydrophobicContact CZ-CB 3.76Å; F141-N175 VanDerWaalsContact CZ-CG 3.46Å; F141-N175 VanDerWaalsContact O-CB 3.23Å; F141-N175 WeakPolarHBondContact O-CB 2.91Å; F141-N175 PolarHBondContact O-ND2 2.87Å
142	W	91.8	Very high	96.4	Very high	84 Å²	84	26.2 Å²	26.2	32%	0.318	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	14.4	-179.4	-64.8	102.1	0	0	0	114.3	Y108 S138 A140 K144	Y108-W142 AromaticContact CD2-CD1 3.21Å; Y108-W142 AromaticContact CD2-CD2 3.99Å; Y108-W142 HydrophobicContact CD2-CD2 3.99Å; Y108-W142 AromaticContact CD2-CE2 3.59Å; Y108-W142 AromaticContact CD2-CG 3.8Å; Y108-W142 HydrophobicContact CD2-CG 3.8Å; Y108-W142 HydrophobicContact CD2-CZ2 4.31Å; Y108-W142 AromaticContact CD2-NE1 3.09Å; Y108-W142 AromaticContact CE2-CD1 3.69Å; Y108-W142 AromaticContact CE2-CD2 3.65Å; Y108-W142 HydrophobicContact CE2-CD2 3.65Å; Y108-W142 AromaticContact CE2-CE2 3.17Å; Y108-W142 HydrophobicContact CE2-CE3 4.36Å; Y108-W142 AromaticContact CE2-CG 3.98Å; Y108-W142 HydrophobicContact CE2-CG 3.98Å; Y108-W142 HydrophobicContact CE2-CH2 4.21Å; Y108-W142 AromaticContact CE2-CZ2 3.51Å; Y108-W142 HydrophobicContact CE2-CZ2 3.51Å; Y108-W142 AromaticContact CE2-NE1 3.22Å; S138-W142 PolarHBondContact O-N 3.31Å; A140-W142 PolarHBondContact O-N 3.22Å; W142-K144 VanDerWaalsContact C-N 3.26Å; W142-K144 HydrophobicContact CB-CD 4.5Å; W142-K144 HydrophobicContact CB-CG 4.11Å; W142-K144 WeakPolarHBondContact O-CD 3.45Å; W142-K144 WeakPolarHBondContact O-CE 3.5Å; W142-K144 PolarHBondContact O-N 2.96Å
143	N	92.9	Very high	96.4	Very high	34 Å²	34	30.6 Å²	30.6	18%	0.182	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	41	179.8	-163.1	25.5	0	0	0	114	A139 A140 L145 Q177 E180 T181	A139-N143 PolarHBondContact O-N 3.26Å; A140-N143 PolarHBondContact O-N 3.4Å; N143-L145 VanDerWaalsContact C-N 3.28Å; N143-L145 PolarHBondContact O-N 3.47Å; N143-Q177 HydrophobicContact CB-CB 3.54Å; N143-Q177 PolarHBondContact ND2-O 2.63Å; N143-E180 PolarHBondContact ND2-OE2 3.07Å; N143-E180 VanDerWaalsContact ND2-OE2 3.08Å; N143-T181 WeakPolarHBondContact OD1-CB 3.24Å; N143-T181 PolarHBondContact OD1-N 3.24Å; N143-T181 PolarHBondContact OD1-OG1 3.2Å
144	K	95.1	Very high	96.3	Very high	72 Å²	72	30.9 Å²	30.9	31%	0.313	17%	0.169	S	C	.	.			trans	-85.4	69.8	178.9	-56.4	-50	-173.9	-168.9	0	110.7	A107 Y108 A139 W142 S146 C147 V148	A107-K144 WeakPolarHBondContact O-CG 3.23Å; Y108-K144 WeakPolarHBondContact O-CE 3.42Å; Y108-K144 WeakPolarHBondContact O-CG 3.35Å; A139-K144 HydrophobicContact CB-CB 4.31Å; A139-K144 PolarHBondContact O-N 3.09Å; W142-K144 VanDerWaalsContact C-N 3.26Å; W142-K144 HydrophobicContact CB-CD 4.5Å; W142-K144 HydrophobicContact CB-CG 4.11Å; W142-K144 WeakPolarHBondContact O-CD 3.45Å; W142-K144 WeakPolarHBondContact O-CE 3.5Å; W142-K144 PolarHBondContact O-N 2.96Å; K144-S146 VanDerWaalsContact C-N 3.32Å; K144-S146 PolarHBondContact O-N 3.24Å; K144-S146 VanDerWaalsContact O-N 3.15Å; K144-C147 HydrophobicContact CB-CB 4.07Å; K144-C147 WeakPolarHBondContact O-CA 3.34Å; K144-C147 WeakPolarHBondContact O-CB 3.49Å; K144-C147 PolarHBondContact O-N 3.4Å; K144-V148 PolarHBondContact O-N 3.49Å
145	L	94.6	Very high	96.2	Very high	56 Å²	56	33.4 Å²	33.4	29%	0.293	20%	0.195	S	C	.	.	H	α-helix	trans	-46.5	-48.9	-169.6	-173.4	66.4	0	0	0	114.1	N143 C147 V148 Q149 E180 L184	N143-L145 VanDerWaalsContact C-N 3.28Å; N143-L145 PolarHBondContact O-N 3.47Å; L145-C147 VanDerWaalsContact C-N 3.33Å; L145-C147 PolarHBondContact O-N 3.16Å; L145-V148 WeakPolarHBondContact O-CB 3.47Å; L145-V148 PolarHBondContact O-N 2.83Å; L145-Q149 WeakPolarHBondContact O-CG 3.34Å; L145-Q149 PolarHBondContact O-N 3.08Å; L145-E180 HydrophobicContact CD1-CB 4.2Å; L145-E180 HydrophobicContact CD2-CB 4.18Å; L145-L184 HydrophobicContact CD1-CB 3.97Å; L145-L184 HydrophobicContact CD1-CD1 3.76Å; L145-L184 HydrophobicContact CD1-CG 4.34Å
146	S	97	Very high	96.2	Very high	66 Å²	66	33.9 Å²	33.9	46%	0.462	20%	0.198	S	C	.	.	H	α-helix	trans	-64.7	-35.2	-179.5	-52.7	0	0	0	0	112.9	V112 K144 L150	V112-S146 VanDerWaalsContact CG2-CB 3.47Å; K144-S146 VanDerWaalsContact C-N 3.32Å; K144-S146 PolarHBondContact O-N 3.24Å; K144-S146 VanDerWaalsContact O-N 3.15Å; S146-L150 WeakPolarHBondContact O-CB 3.47Å; S146-L150 PolarHBondContact O-N 2.72Å; S146-L150 VanDerWaalsContact O-N 3.12Å
147	C	98	Very high	96.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-70.9	-39.8	173.7	-69.7	0	0	0	0	111.3	G110 L115 A139 K144 L145 L150 L151	G110-C147 VanDerWaalsContact CA-SG 3.56Å; L115-C147 HydrophobicContact CD2-CB 3.87Å; A139-C147 HydrophobicContact CB-CB 3.99Å; K144-C147 HydrophobicContact CB-CB 4.07Å; K144-C147 WeakPolarHBondContact O-CA 3.34Å; K144-C147 WeakPolarHBondContact O-CB 3.49Å; K144-C147 PolarHBondContact O-N 3.4Å; L145-C147 VanDerWaalsContact C-N 3.33Å; L145-C147 PolarHBondContact O-N 3.16Å; C147-L150 PolarHBondContact O-N 2.67Å; C147-L151 WeakPolarHBondContact O-CB 3.49Å; C147-L151 WeakPolarHBondContact O-CD1 3.5Å; C147-L151 WeakPolarHBondContact O-CG 3.48Å; C147-L151 PolarHBondContact O-N 3.31Å
148	V	97.1	Very high	95.9	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-59.6	-49.8	175.4	177.7	0	0	0	0	110.3	L136 A139 K144 L145 L150 L151 I152 T181 L184 L185	L136-V148 HydrophobicContact CD1-CG1 3.93Å; A139-V148 HydrophobicContact CB-CG2 3.65Å; K144-V148 PolarHBondContact O-N 3.49Å; L145-V148 WeakPolarHBondContact O-CB 3.47Å; L145-V148 PolarHBondContact O-N 2.83Å; V148-L150 VanDerWaalsContact C-N 3.32Å; V148-L150 PolarHBondContact O-N 3.23Å; V148-L151 PolarHBondContact O-N 3.14Å; V148-I152 HydrophobicContact CG1-CD1 3.63Å; V148-I152 HydrophobicContact CG1-CG1 4.47Å; V148-I152 WeakPolarHBondContact O-CD1 3.01Å; V148-I152 VanDerWaalsContact O-CG1 3.26Å; V148-I152 WeakPolarHBondContact O-CG1 3.4Å; V148-I152 PolarHBondContact O-N 3.38Å; V148-T181 HydrophobicContact CG1-CG2 4.38Å; V148-T181 HydrophobicContact CG2-CG2 3.99Å; V148-L184 HydrophobicContact CB-CD2 4.33Å; V148-L184 HydrophobicContact CG1-CD2 3.51Å; V148-L185 HydrophobicContact CG1-CD2 4.04Å; V148-L185 HydrophobicContact CG1-CG 4.29Å
149	Q	96.7	Very high	95.8	Very high	96 Å²	96	41.9 Å²	41.9	45%	0.449	24%	0.241	S	C	.	.	H	α-helix	trans	-53.9	-49.7	176.1	-78.7	175.8	-4.5	0	0	112	L145 I152 S153 L184	L145-Q149 WeakPolarHBondContact O-CG 3.34Å; L145-Q149 PolarHBondContact O-N 3.08Å; Q149-I152 PolarHBondContact O-N 2.85Å; Q149-S153 WeakPolarHBondContact O-CB 3.45Å; Q149-S153 PolarHBondContact O-N 3.24Å; Q149-S153 PolarHBondContact O-OG 3.31Å; Q149-L184 HydrophobicContact CG-CD1 3.3Å; Q149-L184 HydrophobicContact CG-CD2 4.1Å; Q149-L184 HydrophobicContact CG-CG 4.32Å
150	L	98.1	Very high	95.8	Very high	29 Å²	29	42 Å²	42	15%	0.152	24%	0.242	C	C	.	.	H	α-helix	trans	-63.7	-46.3	-178.4	177.9	62.1	0	0	0	111.9	V112 L115 Q116 M119 S146 C147 V148 I152 S153 A154	V112-L150 HydrophobicContact CG1-CD2 4.02Å; L115-L150 HydrophobicContact CB-CD2 4.29Å; L115-L150 HydrophobicContact CD2-CD2 3.95Å; L115-L150 HydrophobicContact CG-CD2 4.45Å; Q116-L150 HydrophobicContact CB-CD2 4.38Å; Q116-L150 HydrophobicContact CG-CD1 4.02Å; Q116-L150 HydrophobicContact CG-CD2 3.24Å; Q116-L150 HydrophobicContact CG-CG 4.26Å; M119-L150 HydrophobicContact CE-CD1 4.01Å; M119-L150 HydrophobicContact CE-CD2 3.46Å; M119-L150 VanDerWaalsContact CE-CD2 3.46Å; M119-L150 HydrophobicContact CE-CG 3.48Å; M119-L150 VanDerWaalsContact CE-CG 3.48Å; S146-L150 WeakPolarHBondContact O-CB 3.47Å; S146-L150 PolarHBondContact O-N 2.72Å; S146-L150 VanDerWaalsContact O-N 3.12Å; C147-L150 PolarHBondContact O-N 2.67Å; V148-L150 VanDerWaalsContact C-N 3.32Å; V148-L150 PolarHBondContact O-N 3.23Å; L150-I152 VanDerWaalsContact C-N 3.35Å; L150-I152 PolarHBondContact O-N 3.33Å; L150-S153 PolarHBondContact O-N 2.72Å; L150-S153 PolarHBondContact O-OG 3.01Å; L150-A154 WeakPolarHBondContact O-CB 3.49Å; L150-A154 PolarHBondContact O-N 2.93Å
151	L	98.4	Very high	95.9	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.3	-43.3	179	-72.5	165.7	0	0	0	111.6	A107 L115 M119 I125 P135 L136 A139 C147 V148 A154 G155 A156	A107-L151 HydrophobicContact CB-CD1 4.27Å; L115-L151 HydrophobicContact CD2-CD1 4.18Å; L115-L151 HydrophobicContact CD2-CD2 4.02Å; L115-L151 HydrophobicContact CD2-CG 3.81Å; M119-L151 HydrophobicContact SD-CD2 4.2Å; I125-L151 HydrophobicContact CG2-CD2 4.03Å; P135-L151 HydrophobicContact CB-CD1 4.18Å; P135-L151 HydrophobicContact CB-CD2 4.1Å; L136-L151 HydrophobicContact CB-CD1 4.44Å; L136-L151 HydrophobicContact CD1-CB 4.24Å; L136-L151 HydrophobicContact CD1-CD1 4.5Å; A139-L151 HydrophobicContact CB-CD1 3.97Å; C147-L151 WeakPolarHBondContact O-CB 3.49Å; C147-L151 WeakPolarHBondContact O-CD1 3.5Å; C147-L151 WeakPolarHBondContact O-CG 3.48Å; C147-L151 PolarHBondContact O-N 3.31Å; V148-L151 PolarHBondContact O-N 3.14Å; L151-A154 CarbonylContact O-C 3.38Å; L151-A154 PolarHBondContact O-N 3.47Å; L151-G155 PolarHBondContact O-N 3.43Å; L151-A156 HydrophobicContact CB-CB 4.01Å; L151-A156 WeakPolarHBondContact O-CB 3.37Å; L151-A156 PolarHBondContact O-N 2.97Å
152	I	96.6	Very high	96.1	Very high	27 Å²	27	44 Å²	44	14%	0.138	25%	0.254	C	S	.	.	H	α-helix	trans	-62.6	-46.9	176	-66.7	164.1	0	0	0	110.5	L136 V148 Q149 L150 A154 G155 L158 L184 L185 Q188	L136-I152 HydrophobicContact CD1-CG1 4.17Å; V148-I152 HydrophobicContact CG1-CD1 3.63Å; V148-I152 HydrophobicContact CG1-CG1 4.47Å; V148-I152 WeakPolarHBondContact O-CD1 3.01Å; V148-I152 VanDerWaalsContact O-CG1 3.26Å; V148-I152 WeakPolarHBondContact O-CG1 3.4Å; V148-I152 PolarHBondContact O-N 3.38Å; Q149-I152 PolarHBondContact O-N 2.85Å; L150-I152 VanDerWaalsContact C-N 3.35Å; L150-I152 PolarHBondContact O-N 3.33Å; I152-A154 PolarHBondContact O-N 2.94Å; I152-G155 PolarHBondContact O-N 2.63Å; I152-L158 HydrophobicContact CD1-CD2 4.12Å; I152-L158 HydrophobicContact CG1-CD2 3.88Å; I152-L184 HydrophobicContact CD1-CD2 3.55Å; I152-L185 HydrophobicContact CD1-CD2 3.84Å; I152-Q188 HydrophobicContact CD1-CG 3.99Å; I152-Q188 HydrophobicContact CG2-CG 4.12Å
153	S	96.3	Very high	96.3	Very high	95 Å²	95	44 Å²	44	66%	0.664	26%	0.261	S	S	*	.	H	α-helix	trans	-61.8	-26.4	177.8	75.1	0	0	0	0	113.3	Q149 L150 G155	Q149-S153 WeakPolarHBondContact O-CB 3.45Å; Q149-S153 PolarHBondContact O-N 3.24Å; Q149-S153 PolarHBondContact O-OG 3.31Å; L150-S153 PolarHBondContact O-N 2.72Å; L150-S153 PolarHBondContact O-OG 3.01Å; S153-G155 VanDerWaalsContact C-N 3.33Å
154	A	97.1	Very high	96.4	Very high	44 Å²	44	44.2 Å²	44.2	36%	0.364	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	2.1	176.5	0	0	0	0	0	113.6	M119 I125 L150 L151 I152	M119-A154 HydrophobicContact SD-CB 3.91Å; I125-A154 HydrophobicContact CD1-CB 3.6Å; I125-A154 WeakPolarHBondContact CD1-O 3.46Å; L150-A154 WeakPolarHBondContact O-CB 3.49Å; L150-A154 PolarHBondContact O-N 2.93Å; L151-A154 CarbonylContact O-C 3.38Å; L151-A154 PolarHBondContact O-N 3.47Å; I152-A154 PolarHBondContact O-N 2.94Å
155	G	96.2	Very high	96.5	Very high	53 Å²	53	41.5 Å²	41.5	55%	0.546	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.3	28.9	176.2	0	0	0	0	0	114.8	L151 I152 S153	L151-G155 PolarHBondContact O-N 3.43Å; I152-G155 PolarHBondContact O-N 2.63Å; S153-G155 VanDerWaalsContact C-N 3.33Å
156	A	97.4	Very high	96.5	Very high	9 Å²	9	40.5 Å²	40.5	7%	0.074	25%	0.251	C	S	.	.			trans	-58.5	139.2	169.3	0	0	0	0	0	111.4	I125 L136 L151 L158	I125-A156 HydrophobicContact CG2-CB 3.66Å; L136-A156 HydrophobicContact CB-CB 4.25Å; L136-A156 HydrophobicContact CD2-CB 4.14Å; L151-A156 HydrophobicContact CB-CB 4.01Å; L151-A156 WeakPolarHBondContact O-CB 3.37Å; L151-A156 PolarHBondContact O-N 2.97Å; A156-L158 PolarHBondContact O-N 3.21Å; A156-L158 VanDerWaalsContact O-N 3.12Å
157	D	96.2	Very high	96.4	Very high	63 Å²	63	37.4 Å²	37.4	34%	0.337	23%	0.229	S	C	.	.			trans	-72.7	104.4	179.3	178.4	12.7	0	0	0	110.9	N126 N159 A160	N126-D157 PolarHBondContact OD1-N 2.79Å; D157-N159 PolarHBondContact O-N 3.29Å; D157-N159 WeakPolarHBondContact OD1-CA 3.46Å; D157-N159 WeakPolarHBondContact OD1-CB 2.92Å; D157-N159 PolarHBondContact OD1-N 2.88Å; D157-A160 HydrophobicContact CB-CB 4.19Å; D157-A160 WeakPolarHBondContact O-CB 3.38Å; D157-A160 PolarHBondContact O-N 2.8Å; D157-A160 PolarHBondContact OD1-N 2.93Å; D157-A160 PolarHBondContact OD2-N 3.07Å
158	L	94.2	Very high	96.3	Very high	26 Å²	26	37.5 Å²	37.5	14%	0.136	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-23.8	176.7	-70	173.3	0	0	0	113.2	L136 I152 A156 L185 Q188	L136-L158 HydrophobicContact CD2-CD2 3.99Å; I152-L158 HydrophobicContact CD1-CD2 4.12Å; I152-L158 HydrophobicContact CG1-CD2 3.88Å; A156-L158 PolarHBondContact O-N 3.21Å; A156-L158 VanDerWaalsContact O-N 3.12Å; L158-L185 HydrophobicContact CD2-CD2 3.87Å; L158-Q188 HydrophobicContact CD1-CB 3.62Å; L158-Q188 HydrophobicContact CD1-CG 4.2Å; L158-Q188 HydrophobicContact CD2-CG 4.46Å
159	N	94	Very high	96	Very high	83 Å²	83	37.7 Å²	37.7	44%	0.444	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	3.3	-176.7	-64.6	-58.5	0	0	0	112.9	D157 L161 P192	D157-N159 PolarHBondContact O-N 3.29Å; D157-N159 WeakPolarHBondContact OD1-CA 3.46Å; D157-N159 WeakPolarHBondContact OD1-CB 2.92Å; D157-N159 PolarHBondContact OD1-N 2.88Å; N159-L161 PolarHBondContact O-N 3.36Å; N159-P192 WeakPolarHBondContact OD1-CB 3.47Å; N159-P192 WeakPolarHBondContact OD1-CD 3.47Å; N159-P192 WeakPolarHBondContact OD1-CG 3.44Å
160	A	96.6	Very high	95.7	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.008	21%	0.209	C	C	.	.			trans	-56.2	134.2	175.5	0	0	0	0	0	110.1	R128 T134 H137 D157	R128-A160 VanDerWaalsContact NH2-CB 3.35Å; T134-A160 HydrophobicContact CG2-CB 3.91Å; H137-A160 PolarHBondContact CE1-O 3.28Å; H137-A160 PolarHBondContact NE2-O 3.08Å; D157-A160 HydrophobicContact CB-CB 4.19Å; D157-A160 WeakPolarHBondContact O-CB 3.38Å; D157-A160 PolarHBondContact O-N 2.8Å; D157-A160 PolarHBondContact OD1-N 2.93Å; D157-A160 PolarHBondContact OD2-N 3.07Å
161	L	96.6	Very high	95.4	Very high	79 Å²	79	31.9 Å²	31.9	41%	0.414	20%	0.203	S	C	.	.			trans	-106.3	137.9	175	-59.4	176.5	0	0	0	110.6	N159 Q166 T167 V196	N159-L161 PolarHBondContact O-N 3.36Å; L161-Q166 WeakPolarHBondContact CA-O 3.47Å; L161-T167 HydrophobicContact CD2-CG2 3.46Å; L161-T167 VanDerWaalsContact CD2-CG2 3.46Å; L161-V196 HydrophobicContact CD2-CG1 3.87Å
162	T	97.4	Very high	95	Very high	7 Å²	7	32.1 Å²	32.1	4%	0.043	21%	0.205	C	C	.	.			trans	-68.4	170.8	160.7	66	0	0	0	0	110.7	W133 S164 G165 Q166 L171	W133-T162 HydrophobicContact CD2-CG2 4.45Å; W133-T162 HydrophobicContact CG-CG2 4.17Å; T162-S164 PolarHBondContact O-N 3.05Å; T162-S164 VanDerWaalsContact O-N 3.16Å; T162-S164 PolarHBondContact OG1-N 3.46Å; T162-S164 PolarHBondContact OG1-OG 3.36Å; T162-G165 PolarHBondContact O-N 3.36Å; T162-Q166 HydrophobicContact CG2-CB 4.47Å; T162-Q166 PolarHBondContact N-O 3.22Å; T162-Q166 WeakPolarHBondContact OG1-CB 3.43Å; T162-Q166 PolarHBondContact OG1-N 3.41Å; T162-Q166 VanDerWaalsContact OG1-N 3.08Å; T162-Q166 PolarHBondContact OG1-O 2.95Å; T162-L171 HydrophobicContact CG2-CD1 4.21Å
163	N	96.5	Very high	94.5	Very high	85 Å²	85	30.8 Å²	30.8	46%	0.455	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-18.5	171.5	-70.2	-3.9	0	0	0	113	E130 D131 G165 K199	E130-N163 PolarHBondContact O-ND2 2.99Å; D131-N163 VanDerWaalsContact C-CG 3.4Å; D131-N163 WeakPolarHBondContact CA-ND2 3.46Å; D131-N163 WeakPolarHBondContact O-CB 3.45Å; D131-N163 PolarHBondContact O-N 3.47Å; N163-G165 VanDerWaalsContact C-N 3.28Å; N163-K199 WeakPolarHBondContact O-CD 3.43Å; N163-K199 WeakPolarHBondContact O-CE 3.45Å; N163-K199 PolarHBondContact O-NZ 3.31Å
164	S	95.1	Very high	93.9	Very high	38 Å²	38	28.3 Å²	28.3	27%	0.266	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	4.1	172	56.2	0	0	0	0	113.4	T162 Q166 K199	T162-S164 PolarHBondContact O-N 3.05Å; T162-S164 VanDerWaalsContact O-N 3.16Å; T162-S164 PolarHBondContact OG1-N 3.46Å; T162-S164 PolarHBondContact OG1-OG 3.36Å; S164-Q166 VanDerWaalsContact C-N 3.27Å; S164-Q166 PolarHBondContact O-N 2.64Å; S164-Q166 PolarHBondContact OG-OE1 3.39Å; S164-K199 WeakPolarHBondContact O-CB 3.37Å; S164-K199 PolarHBondContact O-N 3.38Å
165	G	95.9	Very high	92.9	Very high	14 Å²	14	28 Å²	28	14%	0.144	17%	0.173	C	C	.	.	S	Bend	trans	71.4	21.4	-177.6	0	0	0	0	0	113.1	T162 N163 N198	T162-G165 PolarHBondContact O-N 3.36Å; N163-G165 VanDerWaalsContact C-N 3.28Å; G165-N198 WeakPolarHBondContact O-CA 3.35Å
166	Q	94.9	Very high	91.6	Very high	36 Å²	36	29.5 Å²	29.5	17%	0.168	17%	0.168	C	C	.	.			trans	-96.1	137.9	-179.6	-66.2	177.3	-84	0	0	109.8	H137 L161 T162 S164 H170 L171 N198	H137-Q166 PolarHBondContact NE2-O 2.95Å; L161-Q166 WeakPolarHBondContact CA-O 3.47Å; T162-Q166 HydrophobicContact CG2-CB 4.47Å; T162-Q166 PolarHBondContact N-O 3.22Å; T162-Q166 WeakPolarHBondContact OG1-CB 3.43Å; T162-Q166 PolarHBondContact OG1-N 3.41Å; T162-Q166 VanDerWaalsContact OG1-N 3.08Å; T162-Q166 PolarHBondContact OG1-O 2.95Å; S164-Q166 VanDerWaalsContact C-N 3.27Å; S164-Q166 PolarHBondContact O-N 2.64Å; S164-Q166 PolarHBondContact OG-OE1 3.39Å; Q166-H170 HydrophobicContact CB-CB 3.82Å; Q166-H170 HydrophobicContact CG-CB 4.08Å; Q166-L171 HydrophobicContact CB-CD2 4.03Å; Q166-L171 HydrophobicContact CB-CG 4.26Å; Q166-L171 HydrophobicContact CG-CD2 4.47Å; Q166-N198 HydrophobicContact CG-CB 3.72Å
167	T	95.4	Very high	90.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.187	C	C	.	.			trans	-87.6	169.8	166.7	62.9	0	0	0	0	109.9	H137 L161 L169 H170 L171 P192 V196	H137-T167 VanDerWaalsContact CD2-C 3.5Å; L161-T167 HydrophobicContact CD2-CG2 3.46Å; L161-T167 VanDerWaalsContact CD2-CG2 3.46Å; T167-L169 PolarHBondContact O-N 3.5Å; T167-L169 VanDerWaalsContact O-N 3.14Å; T167-L169 PolarHBondContact OG1-N 2.96Å; T167-H170 PolarHBondContact N-ND1 2.9Å; T167-H170 WeakPolarHBondContact O-CB 3.3Å; T167-H170 PolarHBondContact O-N 3.13Å; T167-H170 PolarHBondContact OG1-N 3.27Å; T167-H170 PolarHBondContact OG1-ND1 3.47Å; T167-L171 PolarHBondContact O-N 2.61Å; T167-L171 VanDerWaalsContact O-N 3.14Å; T167-P192 HydrophobicContact CG2-CB 4.15Å; T167-P192 HydrophobicContact CG2-CG 3.58Å; T167-V196 HydrophobicContact CG2-CG1 3.99Å
168	A	94.7	Very high	89.2	Confident	2 Å²	2	31.5 Å²	31.5	2%	0.017	18%	0.178	C	C	.	.	H	α-helix	trans	-53.8	-33.8	171	0	0	0	0	0	112.2	L136 H137 A140 L171 A172 L185	L136-A168 HydrophobicContact CD2-CB 4Å; L136-A168 HydrophobicContact CG-CB 3.79Å; H137-A168 PolarHBondContact CD2-N 3.04Å; H137-A168 VanDerWaalsContact CD2-N 3.26Å; H137-A168 PolarHBondContact NE2-N 3.22Å; A140-A168 HydrophobicContact CB-CB 3.89Å; A168-L171 PolarHBondContact O-N 2.89Å; A168-A172 PolarHBondContact O-N 3.21Å; A168-L185 HydrophobicContact CB-CD1 4.26Å
169	L	91.5	Very high	88.5	Confident	4 Å²	4	31.8 Å²	31.8	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-66.3	-41.8	176.8	-170.5	65	0	0	0	112.7	T167 L171 A172 L182 L185 I186 V193 V204	T167-L169 PolarHBondContact O-N 3.5Å; T167-L169 VanDerWaalsContact O-N 3.14Å; T167-L169 PolarHBondContact OG1-N 2.96Å; L169-L171 VanDerWaalsContact C-N 3.28Å; L169-L171 PolarHBondContact O-N 3.43Å; L169-A172 PolarHBondContact O-N 3.29Å; L169-L182 HydrophobicContact CD1-CD1 3.36Å; L169-L182 HydrophobicContact CG-CD1 4.3Å; L169-L185 HydrophobicContact CD1-CB 3.69Å; L169-L185 HydrophobicContact CD1-CD1 4.36Å; L169-I186 HydrophobicContact CD1-CG1 3.83Å; L169-I186 HydrophobicContact CD2-CG1 4.5Å; L169-V193 HydrophobicContact CD2-CG2 4.23Å; L169-V204 HydrophobicContact CB-CG2 4.18Å; L169-V204 HydrophobicContact CD2-CB 4.44Å; L169-V204 HydrophobicContact CD2-CG1 4.25Å; L169-V204 HydrophobicContact CD2-CG2 3.86Å; L169-V204 HydrophobicContact CG-CB 4.43Å; L169-V204 HydrophobicContact CG-CG1 3.93Å; L169-V204 HydrophobicContact CG-CG2 3.76Å
170	H	91.1	Very high	88	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-62	-38	173.3	-72.5	86	0	0	0	111.8	Q166 T167 V173 S174 V196 D202 I207	Q166-H170 HydrophobicContact CB-CB 3.82Å; Q166-H170 HydrophobicContact CG-CB 4.08Å; T167-H170 PolarHBondContact N-ND1 2.9Å; T167-H170 WeakPolarHBondContact O-CB 3.3Å; T167-H170 PolarHBondContact O-N 3.13Å; T167-H170 PolarHBondContact OG1-N 3.27Å; T167-H170 PolarHBondContact OG1-ND1 3.47Å; H170-V173 WeakPolarHBondContact O-CG2 3.16Å; H170-S174 PolarHBondContact O-N 3.29Å; H170-V196 PolarHBondContact CE1-O 3.3Å; H170-V196 PolarHBondContact NE2-O 2.82Å; H170-D202 PolarHBondContact NE2-O 2.85Å; H170-I207 HydrophobicContact CB-CD1 4.15Å
171	L	91.8	Very high	87.6	Confident	2 Å²	2	32.3 Å²	32.3	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-73	-39.7	-178.4	-67.2	-174.4	0	0	0	112.5	W133 H137 F141 T162 Q166 T167 A168 L169 V173 S174	W133-L171 HydrophobicContact CD2-CD1 4.31Å; W133-L171 HydrophobicContact CE3-CD1 4.03Å; W133-L171 HydrophobicContact CH2-CD1 3.7Å; W133-L171 HydrophobicContact CH2-CD2 4.29Å; W133-L171 HydrophobicContact CZ2-CD1 3.97Å; W133-L171 HydrophobicContact CZ2-CD2 4.25Å; W133-L171 HydrophobicContact CZ3-CD1 3.72Å; H137-L171 HydrophobicContact CB-CD1 3.6Å; H137-L171 VanDerWaalsContact CD2-CD1 3.47Å; H137-L171 WeakPolarHBondContact CD2-CD1 3.16Å; F141-L171 HydrophobicContact CB-CB 4.08Å; F141-L171 HydrophobicContact CB-CD1 4.47Å; F141-L171 HydrophobicContact CD2-CB 3.99Å; F141-L171 HydrophobicContact CD2-CD2 4.07Å; F141-L171 HydrophobicContact CD2-CG 4.46Å; T162-L171 HydrophobicContact CG2-CD1 4.21Å; Q166-L171 HydrophobicContact CB-CD2 4.03Å; Q166-L171 HydrophobicContact CB-CG 4.26Å; Q166-L171 HydrophobicContact CG-CD2 4.47Å; T167-L171 PolarHBondContact O-N 2.61Å; T167-L171 VanDerWaalsContact O-N 3.14Å; A168-L171 PolarHBondContact O-N 2.89Å; L169-L171 VanDerWaalsContact C-N 3.28Å; L169-L171 PolarHBondContact O-N 3.43Å; L171-V173 PolarHBondContact O-N 3.43Å; L171-S174 WeakPolarHBondContact CA-OG 3.23Å; L171-S174 PolarHBondContact O-N 2.92Å; L171-S174 PolarHBondContact O-OG 3.26Å
172	A	90.1	Very high	87.1	Confident	5 Å²	5	28.6 Å²	28.6	4%	0.041	16%	0.162	C	C	.	.	H	α-helix	trans	-55.5	-36.7	178.2	0	0	0	0	0	112.8	A140 A168 L169 T181 L185	A140-A172 HydrophobicContact CB-CB 4.47Å; A168-A172 PolarHBondContact O-N 3.21Å; L169-A172 PolarHBondContact O-N 3.29Å; A172-T181 HydrophobicContact CB-CG2 3.85Å; A172-L185 HydrophobicContact CB-CD1 4.11Å
173	V	85.7	Confident	86.6	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-82.5	-24.5	178.4	-68	0	0	0	0	113.7	H170 L171 L182 V204 I207 V208 N211	H170-V173 WeakPolarHBondContact O-CG2 3.16Å; L171-V173 PolarHBondContact O-N 3.43Å; V173-L182 HydrophobicContact CG1-CD1 3.57Å; V173-L182 HydrophobicContact CG1-CD2 3.45Å; V173-L182 VanDerWaalsContact CG1-CD2 3.45Å; V173-L182 HydrophobicContact CG1-CG 4.03Å; V173-V204 HydrophobicContact CG1-CG1 4.23Å; V173-V204 HydrophobicContact CG2-CG1 4.27Å; V173-I207 HydrophobicContact CB-CG2 4.13Å; V173-I207 HydrophobicContact CG2-CB 3.81Å; V173-I207 HydrophobicContact CG2-CD1 4.16Å; V173-I207 HydrophobicContact CG2-CG2 3.53Å; V173-V208 HydrophobicContact CB-CG2 4.17Å; V173-V208 HydrophobicContact CG1-CG2 3.53Å; V173-N211 PolarHBondContact O-ND2 2.71Å
174	S	83	Confident	86.2	Confident	42 Å²	42	30.7 Å²	30.7	29%	0.294	17%	0.165	S	C	.	.	H	α-helix	trans	-75.5	-33.6	-171.7	67.5	0	0	0	0	113.9	F141 H170 L171	F141-S174 WeakPolarHBondContact CE2-OG 3.37Å; H170-S174 PolarHBondContact O-N 3.29Å; L171-S174 WeakPolarHBondContact CA-OG 3.23Å; L171-S174 PolarHBondContact O-N 2.92Å; L171-S174 PolarHBondContact O-OG 3.26Å
175	N	77.2	Confident	86	Confident	39 Å²	39	29 Å²	29	21%	0.209	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.5	1	-171.8	-158.6	23.7	0	0	0	114.2	F141 Q177	F141-N175 HydrophobicContact CD1-CB 4.17Å; F141-N175 WeakPolarHBondContact CD1-ND2 3.4Å; F141-N175 HydrophobicContact CD2-CB 3.91Å; F141-N175 HydrophobicContact CE1-CB 3.99Å; F141-N175 WeakPolarHBondContact CE1-ND2 3.49Å; F141-N175 HydrophobicContact CE2-CB 3.72Å; F141-N175 HydrophobicContact CG-CB 4.15Å; F141-N175 HydrophobicContact CZ-CB 3.76Å; F141-N175 VanDerWaalsContact CZ-CG 3.46Å; F141-N175 VanDerWaalsContact O-CB 3.23Å; F141-N175 WeakPolarHBondContact O-CB 2.91Å; F141-N175 PolarHBondContact O-ND2 2.87Å; N175-Q177 HydrophobicContact CB-CG 4.01Å; N175-Q177 WeakPolarHBondContact ND2-CG 3.09Å; N175-Q177 WeakPolarHBondContact O-CG 3.47Å; N175-Q177 PolarHBondContact O-N 3.38Å; N175-Q177 VanDerWaalsContact O-N 3.08Å; N175-Q177 PolarHBondContact O-NE2 3.31Å
176	N	69.3	Low	85.7	Confident	83 Å²	83	29.7 Å²	29.7	44%	0.444	15%	0.154	S	C	.	.			trans	52.5	31.3	177.1	-159.6	36.8	0	0	0	115.6	P213 Y214	N176-P213 VanDerWaalsContact CG-CG 3.47Å; N176-P213 WeakPolarHBondContact OD1-CB 3.5Å; N176-P213 WeakPolarHBondContact OD1-CG 3.47Å; N176-Y214 WeakPolarHBondContact CA-OH 3.41Å
177	Q	71.4	Confident	85.4	Confident	99 Å²	99	31.4 Å²	31.4	46%	0.463	17%	0.174	S	C	.	.	S	Bend	trans	-87.7	0.1	-174.6	-67.5	-62.4	-36.1	0	0	114.2	N143 N175	N143-Q177 HydrophobicContact CB-CB 3.54Å; N143-Q177 PolarHBondContact ND2-O 2.63Å; N175-Q177 HydrophobicContact CB-CG 4.01Å; N175-Q177 WeakPolarHBondContact ND2-CG 3.09Å; N175-Q177 WeakPolarHBondContact O-CG 3.47Å; N175-Q177 PolarHBondContact O-N 3.38Å; N175-Q177 VanDerWaalsContact O-N 3.08Å; N175-Q177 PolarHBondContact O-NE2 3.31Å
178	G	72	Confident	85.1	Confident	16 Å²	16	34 Å²	34	17%	0.165	19%	0.186	C	C	.	.			trans	124.4	155.4	-177.5	0	0	0	0	0	113	E180 Y214	G178-E180 WeakPolarHBondContact CA-OE2 3.19Å; G178-Y214 WeakPolarHBondContact CA-OH 3.37Å; G178-Y214 PolarHBondContact N-OH 3.42Å; G178-Y214 PolarHBondContact O-OH 2.78Å
179	P	77.6	Confident	84.7	Confident	32 Å²	32	39.6 Å²	39.6	21%	0.208	22%	0.222	C	C	.	.	S	Bend	trans	-86.6	-5.5	-173.2	37	-38.2	0	0	0	114.1	T181 L182 Y183 Y214 I217	P179-T181 PolarHBondContact O-N 2.84Å; P179-L182 VanDerWaalsContact O-CB 3.31Å; P179-L182 WeakPolarHBondContact O-CB 3.37Å; P179-L182 PolarHBondContact O-N 3.01Å; P179-L182 VanDerWaalsContact O-N 3.13Å; P179-Y183 HydrophobicContact CB-CD2 4.07Å; P179-Y183 HydrophobicContact CB-CE2 3.63Å; P179-Y183 HydrophobicContact CG-CD2 4.43Å; P179-Y183 HydrophobicContact CG-CE2 3.88Å; P179-Y183 VanDerWaalsContact O-CD2 3.26Å; P179-Y183 WeakPolarHBondContact O-CD2 3.33Å; P179-Y183 PolarHBondContact O-N 2.93Å; P179-Y214 HydrophobicContact CB-CD1 3.89Å; P179-Y214 HydrophobicContact CB-CE1 3.74Å; P179-Y214 HydrophobicContact CG-CE1 4.32Å; P179-I217 HydrophobicContact CB-CD1 3.44Å; P179-I217 VanDerWaalsContact CB-CD1 3.44Å
180	E	84.8	Confident	84.4	Confident	93 Å²	93	42.3 Å²	42.3	44%	0.435	25%	0.251	S	S	.	.	H	α-helix	trans	-62.9	-48.7	-170	-62.2	75.7	-164.7	0	0	111.9	N143 L145 G178 L182 Y183 L184	N143-E180 PolarHBondContact ND2-OE2 3.07Å; N143-E180 VanDerWaalsContact ND2-OE2 3.08Å; L145-E180 HydrophobicContact CD1-CB 4.2Å; L145-E180 HydrophobicContact CD2-CB 4.18Å; G178-E180 WeakPolarHBondContact CA-OE2 3.19Å; E180-L182 VanDerWaalsContact C-N 3.26Å; E180-L182 PolarHBondContact O-N 3.06Å; E180-Y183 PolarHBondContact O-N 3.42Å; E180-L184 WeakPolarHBondContact O-CB 3.33Å; E180-L184 PolarHBondContact O-N 3.12Å
181	T	87.8	Confident	84.1	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.006	26%	0.258	C	S	.	.	H	α-helix	trans	-62.6	-37	175.5	-71.3	0	0	0	0	111.5	A140 N143 V148 A172 P179 L184 L185	A140-T181 HydrophobicContact CB-CG2 3.97Å; N143-T181 WeakPolarHBondContact OD1-CB 3.24Å; N143-T181 PolarHBondContact OD1-N 3.24Å; N143-T181 PolarHBondContact OD1-OG1 3.2Å; V148-T181 HydrophobicContact CG1-CG2 4.38Å; V148-T181 HydrophobicContact CG2-CG2 3.99Å; A172-T181 HydrophobicContact CB-CG2 3.85Å; P179-T181 PolarHBondContact O-N 2.84Å; T181-L184 PolarHBondContact O-N 3.26Å; T181-L185 HydrophobicContact CG2-CD1 3.76Å; T181-L185 HydrophobicContact CG2-CG 4.3Å; T181-L185 WeakPolarHBondContact O-CB 3.34Å; T181-L185 VanDerWaalsContact O-CG 3.29Å; T181-L185 WeakPolarHBondContact O-CG 3.35Å; T181-L185 PolarHBondContact O-N 3.35Å
182	L	85.9	Confident	83.6	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-61.5	-52.1	177.1	172.3	60.7	0	0	0	110.9	L169 V173 P179 E180 L184 L185 I186 I217 F221	L169-L182 HydrophobicContact CD1-CD1 3.36Å; L169-L182 HydrophobicContact CG-CD1 4.3Å; V173-L182 HydrophobicContact CG1-CD1 3.57Å; V173-L182 HydrophobicContact CG1-CD2 3.45Å; V173-L182 VanDerWaalsContact CG1-CD2 3.45Å; V173-L182 HydrophobicContact CG1-CG 4.03Å; P179-L182 VanDerWaalsContact O-CB 3.31Å; P179-L182 WeakPolarHBondContact O-CB 3.37Å; P179-L182 PolarHBondContact O-N 3.01Å; P179-L182 VanDerWaalsContact O-N 3.13Å; E180-L182 VanDerWaalsContact C-N 3.26Å; E180-L182 PolarHBondContact O-N 3.06Å; L182-L184 VanDerWaalsContact C-N 3.27Å; L182-L184 PolarHBondContact O-N 3.23Å; L182-L185 PolarHBondContact O-N 2.95Å; L182-I186 HydrophobicContact CD1-CD1 3.64Å; L182-I186 HydrophobicContact CD1-CG1 4.02Å; L182-I186 HydrophobicContact CG-CD1 3.81Å; L182-I186 VanDerWaalsContact O-CG1 3.3Å; L182-I186 WeakPolarHBondContact O-CG1 3.37Å; L182-I186 PolarHBondContact O-N 3.32Å; L182-I217 HydrophobicContact CD2-CD1 3.59Å; L182-I217 HydrophobicContact CD2-CG2 3.78Å; L182-F221 HydrophobicContact CD1-CE2 4.49Å; L182-F221 HydrophobicContact CD1-CZ 4.34Å
183	Y	86.1	Confident	82.9	Confident	108 Å²	108	44.1 Å²	44.1	42%	0.424	26%	0.264	S	S	.	.	H	α-helix	trans	-59.3	-41.1	177.4	-66.8	-44.6	0	0	0	112.1	P179 E180 L185 I186 A187 I217	P179-Y183 HydrophobicContact CB-CD2 4.07Å; P179-Y183 HydrophobicContact CB-CE2 3.63Å; P179-Y183 HydrophobicContact CG-CD2 4.43Å; P179-Y183 HydrophobicContact CG-CE2 3.88Å; P179-Y183 VanDerWaalsContact O-CD2 3.26Å; P179-Y183 WeakPolarHBondContact O-CD2 3.33Å; P179-Y183 PolarHBondContact O-N 2.93Å; E180-Y183 PolarHBondContact O-N 3.42Å; Y183-L185 VanDerWaalsContact C-N 3.35Å; Y183-L185 PolarHBondContact O-N 2.7Å; Y183-I186 PolarHBondContact O-N 2.88Å; Y183-A187 WeakPolarHBondContact O-CB 3.45Å; Y183-A187 PolarHBondContact O-N 3.41Å; Y183-I217 HydrophobicContact CE1-CD1 4.1Å; Y183-I217 HydrophobicContact CE1-CG1 4.17Å; Y183-I217 HydrophobicContact CE1-CG2 4.06Å; Y183-I217 WeakPolarHBondContact OH-CG1 3.34Å
184	L	90.1	Very high	82.7	Confident	28 Å²	28	48 Å²	48	15%	0.147	28%	0.279	C	S	.	.	H	α-helix	trans	-61.8	-43.7	178.2	-171	123.5	0	0	0	112.3	L145 V148 Q149 I152 E180 T181 L182 Q188	L145-L184 HydrophobicContact CD1-CB 3.97Å; L145-L184 HydrophobicContact CD1-CD1 3.76Å; L145-L184 HydrophobicContact CD1-CG 4.34Å; V148-L184 HydrophobicContact CB-CD2 4.33Å; V148-L184 HydrophobicContact CG1-CD2 3.51Å; Q149-L184 HydrophobicContact CG-CD1 3.3Å; Q149-L184 HydrophobicContact CG-CD2 4.1Å; Q149-L184 HydrophobicContact CG-CG 4.32Å; I152-L184 HydrophobicContact CD1-CD2 3.55Å; E180-L184 WeakPolarHBondContact O-CB 3.33Å; E180-L184 PolarHBondContact O-N 3.12Å; T181-L184 PolarHBondContact O-N 3.26Å; L182-L184 VanDerWaalsContact C-N 3.27Å; L182-L184 PolarHBondContact O-N 3.23Å; L184-Q188 WeakPolarHBondContact O-CG 3.49Å; L184-Q188 PolarHBondContact O-NE2 3.19Å
185	L	90.6	Very high	82.7	Confident	4 Å²	4	49 Å²	49	2%	0.021	30%	0.296	C	S	.	.	H	α-helix	trans	-69	-43	179.3	-72.6	169.1	0	0	0	111.9	A140 V148 I152 L158 A168 L169 A172 T181 L182 Y183 A187 Q188 A191	A140-L185 HydrophobicContact CB-CD1 4.12Å; V148-L185 HydrophobicContact CG1-CD2 4.04Å; V148-L185 HydrophobicContact CG1-CG 4.29Å; I152-L185 HydrophobicContact CD1-CD2 3.84Å; L158-L185 HydrophobicContact CD2-CD2 3.87Å; A168-L185 HydrophobicContact CB-CD1 4.26Å; L169-L185 HydrophobicContact CD1-CB 3.69Å; L169-L185 HydrophobicContact CD1-CD1 4.36Å; A172-L185 HydrophobicContact CB-CD1 4.11Å; T181-L185 HydrophobicContact CG2-CD1 3.76Å; T181-L185 HydrophobicContact CG2-CG 4.3Å; T181-L185 WeakPolarHBondContact O-CB 3.34Å; T181-L185 VanDerWaalsContact O-CG 3.29Å; T181-L185 WeakPolarHBondContact O-CG 3.35Å; T181-L185 PolarHBondContact O-N 3.35Å; L182-L185 PolarHBondContact O-N 2.95Å; Y183-L185 VanDerWaalsContact C-N 3.35Å; Y183-L185 PolarHBondContact O-N 2.7Å; L185-A187 PolarHBondContact O-N 2.88Å; L185-Q188 WeakPolarHBondContact O-CB 3.26Å; L185-Q188 PolarHBondContact O-N 3.36Å; L185-Q188 VanDerWaalsContact O-N 3.13Å; L185-A191 WeakPolarHBondContact O-CB 3.47Å
186	I	87.9	Confident	83.4	Confident	28 Å²	28	49.1 Å²	49.1	14%	0.144	30%	0.298	C	S	.	.	H	α-helix	trans	-61.1	-36.7	177.1	-65.1	166.4	0	0	0	111.1	L169 L182 Y183 Q188 V193 F221 L228	L169-I186 HydrophobicContact CD1-CG1 3.83Å; L169-I186 HydrophobicContact CD2-CG1 4.5Å; L182-I186 HydrophobicContact CD1-CD1 3.64Å; L182-I186 HydrophobicContact CD1-CG1 4.02Å; L182-I186 HydrophobicContact CG-CD1 3.81Å; L182-I186 VanDerWaalsContact O-CG1 3.3Å; L182-I186 WeakPolarHBondContact O-CG1 3.37Å; L182-I186 PolarHBondContact O-N 3.32Å; Y183-I186 PolarHBondContact O-N 2.88Å; I186-Q188 PolarHBondContact O-N 2.88Å; I186-V193 HydrophobicContact CG2-CG2 4.37Å; I186-F221 HydrophobicContact CD1-CE1 4.4Å; I186-F221 HydrophobicContact CD1-CE2 3.53Å; I186-F221 HydrophobicContact CD1-CZ 3.36Å; I186-F221 HydrophobicContact CG1-CZ 3.98Å; I186-L228 HydrophobicContact CG2-CD1 4.08Å
187	A	89.1	Confident	84.4	Confident	72 Å²	72	51.5 Å²	51.5	60%	0.595	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-9.4	179.9	0	0	0	0	0	113.8	Y183 L185	Y183-A187 WeakPolarHBondContact O-CB 3.45Å; Y183-A187 PolarHBondContact O-N 3.41Å; L185-A187 PolarHBondContact O-N 2.88Å
188	Q	90.4	Very high	85.5	Confident	54 Å²	54	47.5 Å²	47.5	25%	0.252	28%	0.282	S	S	.	.	S	Bend	trans	-79.3	135.9	179	-59.1	-47	-60.3	0	0	111.9	I152 L158 L184 L185 I186 G190 A191	I152-Q188 HydrophobicContact CD1-CG 3.99Å; I152-Q188 HydrophobicContact CG2-CG 4.12Å; L158-Q188 HydrophobicContact CD1-CB 3.62Å; L158-Q188 HydrophobicContact CD1-CG 4.2Å; L158-Q188 HydrophobicContact CD2-CG 4.46Å; L184-Q188 WeakPolarHBondContact O-CG 3.49Å; L184-Q188 PolarHBondContact O-NE2 3.19Å; L185-Q188 WeakPolarHBondContact O-CB 3.26Å; L185-Q188 PolarHBondContact O-N 3.36Å; L185-Q188 VanDerWaalsContact O-N 3.13Å; I186-Q188 PolarHBondContact O-N 2.88Å; Q188-G190 PolarHBondContact O-N 3.07Å; Q188-A191 WeakPolarHBondContact O-CB 3.31Å; Q188-A191 PolarHBondContact O-N 3.21Å; Q188-A191 VanDerWaalsContact O-N 3.13Å
189	P	86.5	Confident	86.5	Confident	120 Å²	120	54.6 Å²	54.6	78%	0.779	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	129.7	170.5	-24	33.8	0	0	0	111.5	A191	P189-A191 VanDerWaalsContact C-N 3.31Å; P189-A191 PolarHBondContact O-N 3.01Å
190	G	83.6	Confident	87.2	Confident	60 Å²	60	59.8 Å²	59.8	62%	0.619	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.7	13.1	179.3	0	0	0	0	0	114.8	Q188	Q188-G190 PolarHBondContact O-N 3.07Å
191	A	85.1	Confident	87.5	Confident	19 Å²	19	57 Å²	57	16%	0.157	33%	0.329	C	S	.	.			trans	-57.2	133.8	170.1	0	0	0	0	0	110.6	L185 Q188 P189 V193	L185-A191 WeakPolarHBondContact O-CB 3.47Å; Q188-A191 WeakPolarHBondContact O-CB 3.31Å; Q188-A191 PolarHBondContact O-N 3.21Å; Q188-A191 VanDerWaalsContact O-N 3.13Å; P189-A191 VanDerWaalsContact C-N 3.31Å; P189-A191 PolarHBondContact O-N 3.01Å; A191-V193 HydrophobicContact CB-CG2 3.99Å; A191-V193 PolarHBondContact O-N 3.22Å
192	P	80.8	Confident	87.6	Confident	13 Å²	13	58 Å²	58	8%	0.084	34%	0.335	C	S	.	.			trans	-78.2	67.6	-179.1	30.3	-33.8	0	0	0	110.9	N159 T167 V196	N159-P192 WeakPolarHBondContact OD1-CB 3.47Å; N159-P192 WeakPolarHBondContact OD1-CD 3.47Å; N159-P192 WeakPolarHBondContact OD1-CG 3.44Å; T167-P192 HydrophobicContact CG2-CB 4.15Å; T167-P192 HydrophobicContact CG2-CG 3.58Å; P192-V196 HydrophobicContact CB-CB 4.46Å; P192-V196 HydrophobicContact CB-CG2 3.77Å
193	V	76.6	Confident	87.8	Confident	14 Å²	14	59.5 Å²	59.5	9%	0.085	34%	0.342	C	S	.	.			trans	-70.4	-39.1	-176.7	-176.5	0	0	0	0	111.3	L169 I186 A191 F221	L169-V193 HydrophobicContact CD2-CG2 4.23Å; I186-V193 HydrophobicContact CG2-CG2 4.37Å; A191-V193 HydrophobicContact CB-CG2 3.99Å; A191-V193 PolarHBondContact O-N 3.22Å; V193-F221 HydrophobicContact CG1-CD1 3.91Å; V193-F221 HydrophobicContact CG1-CE1 3.41Å; V193-F221 VanDerWaalsContact CG1-CE1 3.41Å; V193-F221 HydrophobicContact CG1-CZ 4.36Å
194	Y	80.4	Confident	87.7	Confident	83 Å²	83	54.4 Å²	54.4	33%	0.325	32%	0.322	S	S	.	.	S	Bend	trans	-129.5	156.7	-175.9	-58	-72.9	0	0	0	111.8	V196 F221 A225	Y194-V196 PolarHBondContact O-N 3.08Å; Y194-F221 HydrophobicContact CE1-CD1 4.28Å; Y194-A225 HydrophobicContact CD2-CB 4.34Å; Y194-A225 HydrophobicContact CE2-CB 4.32Å
195	G	84.4	Confident	87.3	Confident	63 Å²	63	53.4 Å²	53.4	65%	0.649	32%	0.318	S	S	*	.	S	Bend	trans	77.9	-7.3	170.3	0	0	0	0	0	115.9	E203	G195-E203 PolarHBondContact N-OE2 2.96Å
196	V	90.2	Very high	87.1	Confident	41 Å²	41	55.4 Å²	55.4	25%	0.248	33%	0.329	C	S	.	.			trans	-96.8	120.3	169.4	-178.3	0	0	0	0	108.8	L161 T167 H170 P192 Y194	L161-V196 HydrophobicContact CD2-CG1 3.87Å; T167-V196 HydrophobicContact CG2-CG1 3.99Å; H170-V196 PolarHBondContact CE1-O 3.3Å; H170-V196 PolarHBondContact NE2-O 2.82Å; P192-V196 HydrophobicContact CB-CB 4.46Å; P192-V196 HydrophobicContact CB-CG2 3.77Å; Y194-V196 PolarHBondContact O-N 3.08Å
197	R	92.2	Very high	86.9	Confident	133 Å²	133	54.5 Å²	54.5	50%	0.502	32%	0.324	S	S	.	.			trans	-111.1	137.8	176.5	-71.9	179.5	-177.5	-84.9	-9.6	110.7	G201 D202 E203 D206	R197-G201 WeakPolarHBondContact CD-O 3.38Å; R197-G201 PolarHBondContact NH1-O 3.16Å; R197-D202 WeakPolarHBondContact CA-O 3.22Å; R197-E203 HydrophobicContact CG-CG 3.53Å; R197-E203 IonicContact CZ-OE1 3.43Å; R197-E203 IonicContact NE-OE1 3.5Å; R197-E203 PolarHBondContact NE-OE1 3.5Å; R197-E203 IonicContact NH2-OE1 3.23Å; R197-E203 PolarHBondContact NH2-OE1 2.67Å; R197-D206 IonicContact NH1-OD2 3.2Å; R197-D206 PolarHBondContact NH1-OD2 3.22Å
198	N	92.9	Very high	86.5	Confident	14 Å²	14	51.1 Å²	51.1	8%	0.075	30%	0.296	C	S	.	.			trans	-73.1	178.8	171	72.9	13.5	0	0	0	111.5	G165 Q166 L200 G201 D202	G165-N198 WeakPolarHBondContact O-CA 3.35Å; Q166-N198 HydrophobicContact CG-CB 3.72Å; N198-L200 PolarHBondContact O-N 3Å; N198-L200 WeakPolarHBondContact OD1-CA 3.38Å; N198-L200 WeakPolarHBondContact OD1-CB 3.45Å; N198-L200 PolarHBondContact OD1-N 3.08Å; N198-G201 WeakPolarHBondContact O-CA 3.24Å; N198-G201 PolarHBondContact O-N 3.28Å; N198-G201 PolarHBondContact OD1-N 3.01Å; N198-G201 VanDerWaalsContact OD1-N 3.12Å; N198-D202 PolarHBondContact N-O 3.13Å; N198-D202 PolarHBondContact OD1-N 2.92Å
199	K	94.1	Very high	86	Confident	165 Å²	165	54.5 Å²	54.5	72%	0.717	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-18.7	177.5	-81.5	-169.8	173.8	165.5	0	114.9	N163 S164	N163-K199 WeakPolarHBondContact O-CD 3.43Å; N163-K199 WeakPolarHBondContact O-CE 3.45Å; N163-K199 PolarHBondContact O-NZ 3.31Å; S164-K199 WeakPolarHBondContact O-CB 3.37Å; S164-K199 PolarHBondContact O-N 3.38Å
200	L	90.9	Very high	85.6	Confident	142 Å²	142	55.1 Å²	55.1	74%	0.743	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-4.6	172.4	-59.8	174.6	0	0	0	112	N198 D202	N198-L200 PolarHBondContact O-N 3Å; N198-L200 WeakPolarHBondContact OD1-CA 3.38Å; N198-L200 WeakPolarHBondContact OD1-CB 3.45Å; N198-L200 PolarHBondContact OD1-N 3.08Å; L200-D202 VanDerWaalsContact C-N 3.34Å; L200-D202 WeakPolarHBondContact CB-OD2 3.45Å
201	G	92.2	Very high	85	Confident	33 Å²	33	54.5 Å²	54.5	34%	0.34	28%	0.279	S	S	.	.	S	Bend	trans	83.4	8.6	-176.1	0	0	0	0	0	113.4	R197 N198	R197-G201 WeakPolarHBondContact CD-O 3.38Å; R197-G201 PolarHBondContact NH1-O 3.16Å; N198-G201 WeakPolarHBondContact O-CA 3.24Å; N198-G201 PolarHBondContact O-N 3.28Å; N198-G201 PolarHBondContact OD1-N 3.01Å; N198-G201 VanDerWaalsContact OD1-N 3.12Å
202	D	89.4	Confident	84	Confident	24 Å²	24	59.2 Å²	59.2	13%	0.128	31%	0.306	C	S	.	.			trans	-88.5	137.6	-177.3	-58.8	-55.8	0	0	0	111.6	H170 R197 N198 L200 D206 I207 R210	H170-D202 PolarHBondContact NE2-O 2.85Å; R197-D202 WeakPolarHBondContact CA-O 3.22Å; N198-D202 PolarHBondContact N-O 3.13Å; N198-D202 PolarHBondContact OD1-N 2.92Å; L200-D202 VanDerWaalsContact C-N 3.34Å; L200-D202 WeakPolarHBondContact CB-OD2 3.45Å; D202-D206 HydrophobicContact CB-CB 4.1Å; D202-I207 HydrophobicContact CB-CG1 4.14Å; D202-R210 VanDerWaalsContact CG-CZ 3.49Å; D202-R210 IonicContact OD1-CZ 3.21Å; D202-R210 IonicContact OD1-NH1 2.96Å; D202-R210 PolarHBondContact OD1-NH1 2.87Å; D202-R210 IonicContact OD1-NH2 2.67Å; D202-R210 PolarHBondContact OD1-NH2 3.44Å; D202-R210 IonicContact OD2-CZ 2.82Å; D202-R210 IonicContact OD2-NH1 3.92Å; D202-R210 PolarHBondContact OD2-NH1 2.76Å; D202-R210 IonicContact OD2-NH2 3.14Å; D202-R210 PolarHBondContact OD2-NH2 3.1Å
203	E	89.6	Confident	83.2	Confident	31 Å²	31	62.2 Å²	62.2	15%	0.145	33%	0.326	C	S	.	.			trans	-86	170	160.5	-61.2	-175.7	-163.1	0	0	110.6	G195 R197 A205 D206 I207	G195-E203 PolarHBondContact N-OE2 2.96Å; R197-E203 HydrophobicContact CG-CG 3.53Å; R197-E203 IonicContact CZ-OE1 3.43Å; R197-E203 IonicContact NE-OE1 3.5Å; R197-E203 PolarHBondContact NE-OE1 3.5Å; R197-E203 IonicContact NH2-OE1 3.23Å; R197-E203 PolarHBondContact NH2-OE1 2.67Å; E203-A205 PolarHBondContact O-N 3.42Å; E203-D206 PolarHBondContact N-OD2 3.33Å; E203-D206 WeakPolarHBondContact O-CB 3.37Å; E203-D206 PolarHBondContact O-N 3.41Å; E203-I207 PolarHBondContact O-N 3.23Å; E203-I207 VanDerWaalsContact O-N 3.16Å
204	V	85.9	Confident	82.4	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.006	32%	0.324	C	S	.	.	H	α-helix	trans	-54.2	-43.8	174.9	177.7	0	0	0	0	111.1	L169 V173 D206 I207 V208 F221	L169-V204 HydrophobicContact CB-CG2 4.18Å; L169-V204 HydrophobicContact CD2-CB 4.44Å; L169-V204 HydrophobicContact CD2-CG1 4.25Å; L169-V204 HydrophobicContact CD2-CG2 3.86Å; L169-V204 HydrophobicContact CG-CB 4.43Å; L169-V204 HydrophobicContact CG-CG1 3.93Å; L169-V204 HydrophobicContact CG-CG2 3.76Å; V173-V204 HydrophobicContact CG1-CG1 4.23Å; V173-V204 HydrophobicContact CG2-CG1 4.27Å; V204-D206 VanDerWaalsContact C-N 3.26Å; V204-D206 PolarHBondContact O-N 2.96Å; V204-I207 PolarHBondContact O-N 3.1Å; V204-I207 VanDerWaalsContact O-N 3.13Å; V204-V208 HydrophobicContact CG1-CG2 4.29Å; V204-V208 WeakPolarHBondContact O-CG2 3.21Å; V204-V208 PolarHBondContact O-N 3.18Å; V204-F221 HydrophobicContact CB-CE1 4.34Å; V204-F221 HydrophobicContact CG1-CE1 3.92Å; V204-F221 HydrophobicContact CG1-CE2 4.46Å; V204-F221 HydrophobicContact CG1-CZ 3.66Å
205	A	81.6	Confident	81.4	Confident	8 Å²	8	60 Å²	60	7%	0.066	33%	0.328	C	S	.	.	H	α-helix	trans	-60.6	-34.5	178	0	0	0	0	0	112.9	E203 K209 F221	E203-A205 PolarHBondContact O-N 3.42Å; A205-K209 VanDerWaalsContact O-CG 3.27Å; A205-K209 WeakPolarHBondContact O-CG 3.46Å; A205-K209 PolarHBondContact O-N 3.4Å; A205-K209 VanDerWaalsContact O-N 3.11Å; A205-F221 HydrophobicContact CB-CB 3.99Å; A205-F221 HydrophobicContact CB-CD1 4.05Å; A205-F221 HydrophobicContact CB-CG 4.23Å
206	D	85.4	Confident	80.2	Confident	46 Å²	46	63.5 Å²	63.5	25%	0.246	33%	0.332	C	S	.	.	H	α-helix	trans	-71.7	-34	177.8	-60.7	-38.1	0	0	0	111.3	R197 D202 E203 V204 R210	R197-D206 IonicContact NH1-OD2 3.2Å; R197-D206 PolarHBondContact NH1-OD2 3.22Å; D202-D206 HydrophobicContact CB-CB 4.1Å; E203-D206 PolarHBondContact N-OD2 3.33Å; E203-D206 WeakPolarHBondContact O-CB 3.37Å; E203-D206 PolarHBondContact O-N 3.41Å; V204-D206 VanDerWaalsContact C-N 3.26Å; V204-D206 PolarHBondContact O-N 2.96Å; D206-R210 PolarHBondContact O-N 3.3Å; D206-R210 PolarHBondContact O-NE 3.34Å; D206-R210 VanDerWaalsContact O-NE 3.1Å
207	I	84.7	Confident	78.8	Confident	9 Å²	9	61.7 Å²	61.7	5%	0.046	32%	0.32	C	S	.	.	H	α-helix	trans	-69.9	-46.8	173.3	-57.6	166.7	0	0	0	110.7	H170 V173 D202 E203 V204 K209 R210 N211	H170-I207 HydrophobicContact CB-CD1 4.15Å; V173-I207 HydrophobicContact CB-CG2 4.13Å; V173-I207 HydrophobicContact CG2-CB 3.81Å; V173-I207 HydrophobicContact CG2-CD1 4.16Å; V173-I207 HydrophobicContact CG2-CG2 3.53Å; D202-I207 HydrophobicContact CB-CG1 4.14Å; E203-I207 PolarHBondContact O-N 3.23Å; E203-I207 VanDerWaalsContact O-N 3.16Å; V204-I207 PolarHBondContact O-N 3.1Å; V204-I207 VanDerWaalsContact O-N 3.13Å; I207-K209 VanDerWaalsContact C-N 3.29Å; I207-K209 PolarHBondContact O-N 2.83Å; I207-R210 VanDerWaalsContact CG1-NH2 3.34Å; I207-R210 PolarHBondContact O-N 3.18Å; I207-R210 VanDerWaalsContact O-N 3.09Å; I207-N211 PolarHBondContact O-N 3.01Å
208	V	80	Confident	77.1	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.006	31%	0.309	C	S	.	.	H	α-helix	trans	-56.6	-43.1	178.6	171.9	0	0	0	0	111.2	V173 V204 R210 N211 I217 F221	V173-V208 HydrophobicContact CB-CG2 4.17Å; V173-V208 HydrophobicContact CG1-CG2 3.53Å; V204-V208 HydrophobicContact CG1-CG2 4.29Å; V204-V208 WeakPolarHBondContact O-CG2 3.21Å; V204-V208 PolarHBondContact O-N 3.18Å; V208-R210 VanDerWaalsContact C-N 3.32Å; V208-R210 PolarHBondContact O-N 3.24Å; V208-N211 CarbonylContact O-C 3.52Å; V208-N211 PolarHBondContact O-N 3.02Å; V208-N211 VanDerWaalsContact O-O 3.09Å; V208-I217 HydrophobicContact CG1-CB 4.13Å; V208-F221 HydrophobicContact CG2-CD2 4.32Å; V208-F221 HydrophobicContact CG2-CE2 4.08Å
209	K	79.2	Confident	75.4	Confident	125 Å²	125	65.1 Å²	65.1	54%	0.543	34%	0.339	S	S	.	.	H	α-helix	trans	-63.4	-34.2	177.9	-73.4	168.9	-173	169.5	0	113.6	A205 I207	A205-K209 VanDerWaalsContact O-CG 3.27Å; A205-K209 WeakPolarHBondContact O-CG 3.46Å; A205-K209 PolarHBondContact O-N 3.4Å; A205-K209 VanDerWaalsContact O-N 3.11Å; I207-K209 VanDerWaalsContact C-N 3.29Å; I207-K209 PolarHBondContact O-N 2.83Å
210	R	78.7	Confident	73.6	Confident	132 Å²	132	60.3 Å²	60.3	50%	0.498	33%	0.33	S	S	.	.	H	α-helix	trans	-79	-35.5	177.8	-73.1	178.6	-67	166.8	6.6	111.9	D202 D206 I207 V208 T212	D202-R210 VanDerWaalsContact CG-CZ 3.49Å; D202-R210 IonicContact OD1-CZ 3.21Å; D202-R210 IonicContact OD1-NH1 2.96Å; D202-R210 PolarHBondContact OD1-NH1 2.87Å; D202-R210 IonicContact OD1-NH2 2.67Å; D202-R210 PolarHBondContact OD1-NH2 3.44Å; D202-R210 IonicContact OD2-CZ 2.82Å; D202-R210 IonicContact OD2-NH1 3.92Å; D202-R210 PolarHBondContact OD2-NH1 2.76Å; D202-R210 IonicContact OD2-NH2 3.14Å; D202-R210 PolarHBondContact OD2-NH2 3.1Å; D206-R210 PolarHBondContact O-N 3.3Å; D206-R210 PolarHBondContact O-NE 3.34Å; D206-R210 VanDerWaalsContact O-NE 3.1Å; I207-R210 VanDerWaalsContact CG1-NH2 3.34Å; I207-R210 PolarHBondContact O-N 3.18Å; I207-R210 VanDerWaalsContact O-N 3.09Å; V208-R210 VanDerWaalsContact C-N 3.32Å; V208-R210 PolarHBondContact O-N 3.24Å; R210-T212 VanDerWaalsContact C-N 3.33Å; R210-T212 PolarHBondContact O-N 3.46Å; R210-T212 VanDerWaalsContact O-N 3.12Å
211	N	71.2	Confident	72.2	Confident	48 Å²	48	54.3 Å²	54.3	26%	0.257	30%	0.298	S	S	.	.	S	Bend	trans	-86.2	77.4	175.1	-74.3	-10.5	0	0	0	109.8	V173 I207 V208 P213 Y214	V173-N211 PolarHBondContact O-ND2 2.71Å; I207-N211 PolarHBondContact O-N 3.01Å; V208-N211 CarbonylContact O-C 3.52Å; V208-N211 PolarHBondContact O-N 3.02Å; V208-N211 VanDerWaalsContact O-O 3.09Å; N211-P213 VanDerWaalsContact C-N 3.28Å; N211-P213 WeakPolarHBondContact O-CD 3.43Å; N211-Y214 HydrophobicContact CB-CD2 4.34Å; N211-Y214 PolarHBondContact O-N 3.1Å
212	T	63.5	Low	70.4	Confident	118 Å²	118	56.1 Å²	56.1	72%	0.724	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-41.6	-28.5	174.7	41.7	0	0	0	0	118.8	R210 Y214 G215	R210-T212 VanDerWaalsContact C-N 3.33Å; R210-T212 PolarHBondContact O-N 3.46Å; R210-T212 VanDerWaalsContact O-N 3.12Å; T212-Y214 PolarHBondContact O-N 3.3Å; T212-G215 PolarHBondContact O-N 3.31Å
213	P	63.8	Low	68.4	Low	75 Å²	75	60.7 Å²	60.7	49%	0.487	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-57.3	-14.8	175.4	12.3	-29.6	0	0	0	115.7	N176 N211	N176-P213 VanDerWaalsContact CG-CG 3.47Å; N176-P213 WeakPolarHBondContact OD1-CB 3.5Å; N176-P213 WeakPolarHBondContact OD1-CG 3.47Å; N211-P213 VanDerWaalsContact C-N 3.28Å; N211-P213 WeakPolarHBondContact O-CD 3.43Å
214	Y	60.9	Low	66.1	Low	12 Å²	12	64 Å²	64	5%	0.047	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-106.3	35.9	-178	-62.4	-57.1	0	0	0	113.8	N176 G178 P179 N211 T212 D216 I217 C218	N176-Y214 WeakPolarHBondContact CA-OH 3.41Å; G178-Y214 WeakPolarHBondContact CA-OH 3.37Å; G178-Y214 PolarHBondContact N-OH 3.42Å; G178-Y214 PolarHBondContact O-OH 2.78Å; P179-Y214 HydrophobicContact CB-CD1 3.89Å; P179-Y214 HydrophobicContact CB-CE1 3.74Å; P179-Y214 HydrophobicContact CG-CE1 4.32Å; N211-Y214 HydrophobicContact CB-CD2 4.34Å; N211-Y214 PolarHBondContact O-N 3.1Å; T212-Y214 PolarHBondContact O-N 3.3Å; Y214-D216 PolarHBondContact O-N 3.5Å; Y214-I217 HydrophobicContact CD1-CD1 3.4Å; Y214-I217 HydrophobicContact CD1-CG1 4.31Å; Y214-I217 HydrophobicContact CE1-CD1 4.32Å; Y214-I217 HydrophobicContact CG-CD1 3.71Å; Y214-I217 HydrophobicContact CG-CG1 4.38Å; Y214-I217 WeakPolarHBondContact O-CA 3.46Å; Y214-I217 WeakPolarHBondContact O-CB 3.33Å; Y214-I217 WeakPolarHBondContact O-CG1 2.85Å; Y214-I217 PolarHBondContact O-N 2.82Å; Y214-C218 PolarHBondContact O-N 3.01Å
215	G	58.4	Low	64.3	Low	40 Å²	40	67.4 Å²	67.4	41%	0.412	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-34.8	-176.1	0	0	0	0	0	115.2	T212 I217 C218	T212-G215 PolarHBondContact O-N 3.31Å; G215-I217 VanDerWaalsContact C-N 3.33Å; G215-I217 PolarHBondContact O-N 3.26Å; G215-C218 WeakPolarHBondContact O-CB 3.4Å
216	D	59.8	Low	62.4	Low	136 Å²	136	72.4 Å²	72.4	73%	0.727	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-28.9	177.2	-64	-20	0	0	0	112.8	Y214 Y219	Y214-D216 PolarHBondContact O-N 3.5Å; D216-Y219 WeakPolarHBondContact O-CB 3.36Å; D216-Y219 PolarHBondContact O-N 3.11Å
217	I	60	Low	59.7	Low	2 Å²	2	76.5 Å²	76.5	1%	0.01	43%	0.431	C	S	.	.	H	α-helix	trans	-80.5	-26.2	-176.3	-34.7	-169.3	0	0	0	110.8	P179 L182 Y183 V208 Y214 G215 Y219 A220 F221	P179-I217 HydrophobicContact CB-CD1 3.44Å; P179-I217 VanDerWaalsContact CB-CD1 3.44Å; L182-I217 HydrophobicContact CD2-CD1 3.59Å; L182-I217 HydrophobicContact CD2-CG2 3.78Å; Y183-I217 HydrophobicContact CE1-CD1 4.1Å; Y183-I217 HydrophobicContact CE1-CG1 4.17Å; Y183-I217 HydrophobicContact CE1-CG2 4.06Å; Y183-I217 WeakPolarHBondContact OH-CG1 3.34Å; V208-I217 HydrophobicContact CG1-CB 4.13Å; Y214-I217 HydrophobicContact CD1-CD1 3.4Å; Y214-I217 HydrophobicContact CD1-CG1 4.31Å; Y214-I217 HydrophobicContact CE1-CD1 4.32Å; Y214-I217 HydrophobicContact CG-CD1 3.71Å; Y214-I217 HydrophobicContact CG-CG1 4.38Å; Y214-I217 WeakPolarHBondContact O-CA 3.46Å; Y214-I217 WeakPolarHBondContact O-CB 3.33Å; Y214-I217 WeakPolarHBondContact O-CG1 2.85Å; Y214-I217 PolarHBondContact O-N 2.82Å; G215-I217 VanDerWaalsContact C-N 3.33Å; G215-I217 PolarHBondContact O-N 3.26Å; I217-Y219 PolarHBondContact O-N 3.34Å; I217-Y219 VanDerWaalsContact O-N 3.1Å; I217-A220 HydrophobicContact CG2-CB 4.49Å; I217-A220 PolarHBondContact O-N 2.9Å; I217-F221 HydrophobicContact CG2-CD2 3.91Å; I217-F221 HydrophobicContact CG2-CE2 3.73Å; I217-F221 WeakPolarHBondContact O-CD2 3.42Å; I217-F221 PolarHBondContact O-N 3.38Å
218	C	58	Low	57.4	Low	39 Å²	39	84.4 Å²	84.4	26%	0.264	47%	0.472	S	S	.	.	H	α-helix	trans	-50.1	-34.6	168	-74.3	0	0	0	0	111.4	Y214 G215 S222	Y214-C218 PolarHBondContact O-N 3.01Å; G215-C218 WeakPolarHBondContact O-CB 3.4Å; C218-S222 WeakPolarHBondContact O-CB 3.27Å; C218-S222 PolarHBondContact O-N 3.42Å; C218-S222 VanDerWaalsContact O-N 3.1Å; C218-S222 PolarHBondContact O-OG 3.1Å
219	Y	55.8	Low	56.2	Low	181 Å²	181	88.6 Å²	88.6	71%	0.71	50%	0.495	S	S	*	.	H	α-helix	trans	-68.2	-45.3	176.3	-82.6	-81.8	0	0	0	112.8	D216 I217 F221 S222	D216-Y219 WeakPolarHBondContact O-CB 3.36Å; D216-Y219 PolarHBondContact O-N 3.11Å; I217-Y219 PolarHBondContact O-N 3.34Å; I217-Y219 VanDerWaalsContact O-N 3.1Å; Y219-F221 PolarHBondContact O-N 3.09Å; Y219-S222 WeakPolarHBondContact CA-OG 3.42Å; Y219-S222 PolarHBondContact O-N 3.33Å; Y219-S222 PolarHBondContact O-OG 3.04Å
220	A	56.5	Low	55	Low	64 Å²	64	86.6 Å²	86.6	53%	0.529	49%	0.492	S	S	.	.	H	α-helix	trans	-60.2	-30.1	179.5	0	0	0	0	0	113	I217	I217-A220 HydrophobicContact CG2-CB 4.49Å; I217-A220 PolarHBondContact O-N 2.9Å
221	F	61	Low	53.7	Low	15 Å²	15	84.1 Å²	84.1	7%	0.066	49%	0.492	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-5.3	175.9	-72.7	-84.5	0	0	0	114.4	L182 I186 V193 Y194 V204 A205 V208 I217 Y219	L182-F221 HydrophobicContact CD1-CE2 4.49Å; L182-F221 HydrophobicContact CD1-CZ 4.34Å; I186-F221 HydrophobicContact CD1-CE1 4.4Å; I186-F221 HydrophobicContact CD1-CE2 3.53Å; I186-F221 HydrophobicContact CD1-CZ 3.36Å; I186-F221 HydrophobicContact CG1-CZ 3.98Å; V193-F221 HydrophobicContact CG1-CD1 3.91Å; V193-F221 HydrophobicContact CG1-CE1 3.41Å; V193-F221 VanDerWaalsContact CG1-CE1 3.41Å; V193-F221 HydrophobicContact CG1-CZ 4.36Å; Y194-F221 HydrophobicContact CE1-CD1 4.28Å; V204-F221 HydrophobicContact CB-CE1 4.34Å; V204-F221 HydrophobicContact CG1-CE1 3.92Å; V204-F221 HydrophobicContact CG1-CE2 4.46Å; V204-F221 HydrophobicContact CG1-CZ 3.66Å; A205-F221 HydrophobicContact CB-CB 3.99Å; A205-F221 HydrophobicContact CB-CD1 4.05Å; A205-F221 HydrophobicContact CB-CG 4.23Å; V208-F221 HydrophobicContact CG2-CD2 4.32Å; V208-F221 HydrophobicContact CG2-CE2 4.08Å; I217-F221 HydrophobicContact CG2-CD2 3.91Å; I217-F221 HydrophobicContact CG2-CE2 3.73Å; I217-F221 WeakPolarHBondContact O-CD2 3.42Å; I217-F221 PolarHBondContact O-N 3.38Å; Y219-F221 PolarHBondContact O-N 3.09Å
222	S	54.5	Low	52.7	Low	71 Å²	71	86.2 Å²	86.2	50%	0.497	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-18	-176.4	67.6	0	0	0	0	114.4	C218 Y219	C218-S222 WeakPolarHBondContact O-CB 3.27Å; C218-S222 PolarHBondContact O-N 3.42Å; C218-S222 VanDerWaalsContact O-N 3.1Å; C218-S222 PolarHBondContact O-OG 3.1Å; Y219-S222 WeakPolarHBondContact CA-OG 3.42Å; Y219-S222 PolarHBondContact O-N 3.33Å; Y219-S222 PolarHBondContact O-OG 3.04Å
223	E	47.2	Very low	52	Low	120 Å²	120	84.3 Å²	84.3	56%	0.561	49%	0.492	S	S	*	.	S	Bend	trans	-80.9	138.3	173.8	-65.2	-146.2	160.7	0	0	110.6
224	P	41.8	Very low	51.2	Low	101 Å²	101	84.9 Å²	84.9	66%	0.656	49%	0.493	S	S	*	.			trans	-59.6	150	175.2	25.7	-31.3	0	0	0	109.4	T226	P224-T226 PolarHBondContact O-N 3.39Å; P224-T226 PolarHBondContact O-OG1 3.12Å; P224-T226 VanDerWaalsContact O-OG1 3.07Å
225	A	49.3	Very low	50.5	Low	73 Å²	73	90.1 Å²	90.1	60%	0.603	53%	0.525	S	S	*	.	S	Bend	trans	-55.1	22.7	-167.8	0	0	0	0	0	118.1	Y194	Y194-A225 HydrophobicContact CD2-CB 4.34Å; Y194-A225 HydrophobicContact CE2-CB 4.32Å
226	T	40.4	Very low	49.9	Very low	113 Å²	113	93.9 Å²	93.9	69%	0.693	53%	0.533	S	S	*	.	S	Bend	trans	-87.9	-1.2	-176.9	28.9	0	0	0	0	115.4	P224	P224-T226 PolarHBondContact O-N 3.39Å; P224-T226 PolarHBondContact O-OG1 3.12Å; P224-T226 VanDerWaalsContact O-OG1 3.07Å
227	N	29.7	Very low	49.1	Very low	132 Å²	132	90.4 Å²	90.4	71%	0.706	52%	0.517	S	S	*	.			trans	-128.5	18.7	-174.3	-94.9	-15.9	0	0	0	116.5
228	L	34.9	Very low	48.1	Very low	174 Å²	174	98.5 Å²	98.5	91%	0.911	56%	0.563	S	S	*	*			trans	-127.3	0	163.9	-70.3	172.7	0	0	0	109.2	I186	I186-L228 HydrophobicContact CG2-CD1 4.08Å

Retrieved 228 of 228 residues in 51 ms (Link to these results)

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