G4VNK3_SCHMA Loading...

DUF4476 domain-containing protein

AlphaFold DB , UniProt , Accession G4VNK3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 275 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	43.3	Very low	82.9	Confident	244 Å²	244	99.9 Å²	99.9	100%	1.202	54%	0.537	S	S	*	.				0	129.8	0	-72.1	-177.4	170.1	0	0	108.2
2	T	67.7	Low	83.7	Confident	132 Å²	132	98.4 Å²	98.4	81%	0.81	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-70.4	135.3	174.1	41.5	0	0	0	0	109.2	I4	T2-I4 PolarHBondContact O-N 3.05Å
3	K	79.5	Confident	84.4	Confident	78 Å²	78	103.8 Å²	103.8	34%	0.339	54%	0.535	S	S	.	.	P	Polyproline II helix	trans	-72	124.7	175.2	-67.6	176.7	179.1	-174.2	0	108	Y38 K66 L68	K3-Y38 HydrophobicContact CB-CD1 3.94Å; K3-Y38 HydrophobicContact CB-CD2 3.96Å; K3-Y38 HydrophobicContact CB-CE1 4.33Å; K3-Y38 HydrophobicContact CB-CE2 4.34Å; K3-Y38 HydrophobicContact CB-CG 3.74Å; K3-Y38 HydrophobicContact CD-CD1 3.52Å; K3-Y38 HydrophobicContact CD-CE1 3.69Å; K3-Y38 HydrophobicContact CD-CG 4.19Å; K3-Y38 HydrophobicContact CG-CD1 3.74Å; K3-Y38 HydrophobicContact CG-CD2 4.35Å; K3-Y38 HydrophobicContact CG-CE1 3.72Å; K3-Y38 HydrophobicContact CG-CE2 4.33Å; K3-Y38 HydrophobicContact CG-CG 4.06Å; K3-K66 PolarHBondContact NZ-O 2.96Å; K3-L68 WeakPolarHBondContact CD-O 3.46Å; K3-L68 PolarHBondContact NZ-O 2.92Å
4	I	85.5	Confident	85	Confident	131 Å²	131	97.6 Å²	97.6	67%	0.672	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-87.9	122.3	178.8	-57.9	171.4	0	0	0	107.6	T2 Y38	T2-I4 PolarHBondContact O-N 3.05Å; I4-Y38 WeakPolarHBondContact O-CB 3.24Å; I4-Y38 WeakPolarHBondContact O-CD2 3.35Å
5	P	87.5	Confident	85.5	Confident	59 Å²	59	96.9 Å²	96.9	38%	0.383	49%	0.491	S	S	.	.	B	Isolated β-bridge	trans	-66.4	153.2	179.1	29.3	-34.7	0	0	0	111.3	Y38 T40	P5-Y38 CarbonylContact C-O 3.59Å; P5-T40 HydrophobicContact CB-CG2 3.52Å; P5-T40 HydrophobicContact CG-CG2 4.34Å
6	L	89.1	Confident	85.9	Confident	26 Å²	26	95.6 Å²	95.6	14%	0.136	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-64.7	136.9	174.4	-170.5	67.5	0	0	0	110.1	D10 F11 Y38 L39 Q43	L6-D10 HydrophobicContact CD1-CB 3.71Å; L6-D10 HydrophobicContact CD2-CB 4.24Å; L6-D10 HydrophobicContact CG-CB 3.86Å; L6-F11 HydrophobicContact CD2-CB 4.01Å; L6-F11 HydrophobicContact CG-CB 4.41Å; L6-Y38 WeakPolarHBondContact CB-O 3.16Å; L6-Y38 PolarHBondContact N-O 2.91Å; L6-L39 HydrophobicContact CD2-CD2 4.44Å; L6-Q43 PolarHBondContact O-NE2 3.43Å
7	N	92	Very high	86.2	Confident	107 Å²	107	92 Å²	92	57%	0.572	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-61.4	148.4	175.5	-73.1	-9.7	0	0	0	111	T9 D10 F11	N7-T9 VanDerWaalsContact C-N 3.26Å; N7-T9 PolarHBondContact O-N 2.61Å; N7-D10 PolarHBondContact O-N 3.45Å; N7-D10 VanDerWaalsContact O-N 3.14Å; N7-F11 WeakPolarHBondContact O-CB 3.41Å; N7-F11 PolarHBondContact O-N 3.12Å
8	D	90.6	Very high	86.4	Confident	122 Å²	122	86.9 Å²	86.9	65%	0.652	45%	0.447	S	S	*	.	H	α-helix	trans	-60.7	-33.7	-175.5	-66.3	-27.7	0	0	0	113	F11 E12	D8-F11 PolarHBondContact O-N 3.43Å; D8-E12 WeakPolarHBondContact O-CB 3.42Å; D8-E12 WeakPolarHBondContact O-CG 3.09Å; D8-E12 PolarHBondContact O-N 2.77Å
9	T	91.7	Very high	86.6	Confident	105 Å²	105	87.3 Å²	87.3	64%	0.644	45%	0.449	S	S	*	.	H	α-helix	trans	-64.4	-45.8	176	53.2	0	0	0	0	112.4	N7 F11 E12 Y13	N7-T9 VanDerWaalsContact C-N 3.26Å; N7-T9 PolarHBondContact O-N 2.61Å; T9-F11 VanDerWaalsContact C-N 3.32Å; T9-E12 PolarHBondContact O-N 3.05Å; T9-Y13 PolarHBondContact O-N 2.73Å
10	D	91.7	Very high	86.7	Confident	84 Å²	84	87.2 Å²	87.2	45%	0.449	46%	0.456	S	S	.	.	H	α-helix	trans	-71.6	-34.2	-179.3	-62.2	-13.7	0	0	0	110.4	L6 N7 L14	L6-D10 HydrophobicContact CD1-CB 3.71Å; L6-D10 HydrophobicContact CD2-CB 4.24Å; L6-D10 HydrophobicContact CG-CB 3.86Å; N7-D10 PolarHBondContact O-N 3.45Å; N7-D10 VanDerWaalsContact O-N 3.14Å; D10-L14 WeakPolarHBondContact O-CB 3.44Å; D10-L14 PolarHBondContact O-N 3.23Å
11	F	93.2	Very high	86.6	Confident	11 Å²	11	84.9 Å²	84.9	5%	0.048	44%	0.443	C	S	.	.	H	α-helix	trans	-64.6	-47.6	173.8	175.6	-101	0	0	0	111.9	L6 N7 D8 T9 Y13 L14 R15 L39 Q43 A46 I47	L6-F11 HydrophobicContact CD2-CB 4.01Å; L6-F11 HydrophobicContact CG-CB 4.41Å; N7-F11 WeakPolarHBondContact O-CB 3.41Å; N7-F11 PolarHBondContact O-N 3.12Å; D8-F11 PolarHBondContact O-N 3.43Å; T9-F11 VanDerWaalsContact C-N 3.32Å; F11-Y13 VanDerWaalsContact C-N 3.31Å; F11-Y13 PolarHBondContact O-N 2.85Å; F11-L14 PolarHBondContact O-N 2.77Å; F11-R15 VanDerWaalsContact O-CB 3.31Å; F11-R15 WeakPolarHBondContact O-CB 3.43Å; F11-R15 PolarHBondContact O-N 3.42Å; F11-L39 HydrophobicContact CD2-CD2 4.14Å; F11-L39 HydrophobicContact CE2-CD2 4.38Å; F11-Q43 HydrophobicContact CD1-CG 4.08Å; F11-Q43 HydrophobicContact CD2-CB 3.75Å; F11-Q43 HydrophobicContact CD2-CG 3.61Å; F11-Q43 HydrophobicContact CE1-CG 4.14Å; F11-Q43 HydrophobicContact CE2-CB 3.41Å; F11-Q43 VanDerWaalsContact CE2-CB 3.41Å; F11-Q43 HydrophobicContact CE2-CG 3.67Å; F11-Q43 WeakPolarHBondContact CE2-O 3.47Å; F11-Q43 HydrophobicContact CG-CB 4.46Å; F11-Q43 HydrophobicContact CG-CG 3.83Å; F11-Q43 HydrophobicContact CZ-CB 3.88Å; F11-Q43 HydrophobicContact CZ-CG 3.96Å; F11-Q43 WeakPolarHBondContact CZ-O 3.26Å; F11-A46 HydrophobicContact CE1-CB 4.42Å; F11-A46 HydrophobicContact CZ-CB 3.82Å; F11-I47 HydrophobicContact CD2-CD1 4.45Å; F11-I47 HydrophobicContact CE2-CD1 3.79Å; F11-I47 HydrophobicContact CE2-CG1 3.82Å; F11-I47 HydrophobicContact CZ-CG1 4.36Å
12	E	93	Very high	88.2	Confident	82 Å²	82	78 Å²	78	38%	0.383	42%	0.419	S	S	.	.	H	α-helix	trans	-65.4	-35.5	177.4	-75.7	-60.6	150	0	0	111.8	D8 T9 R15 T16	D8-E12 WeakPolarHBondContact O-CB 3.42Å; D8-E12 WeakPolarHBondContact O-CG 3.09Å; D8-E12 PolarHBondContact O-N 2.77Å; T9-E12 PolarHBondContact O-N 3.05Å; E12-R15 PolarHBondContact O-N 3.46Å; E12-R15 IonicContact OE1-NH1 3.89Å; E12-R15 PolarHBondContact OE1-NH1 2.99Å; E12-R15 VanDerWaalsContact OE1-NH1 3.16Å; E12-R15 IonicContact OE2-NH1 3.16Å; E12-T16 WeakPolarHBondContact O-CB 3.48Å; E12-T16 VanDerWaalsContact O-CG2 3.26Å; E12-T16 WeakPolarHBondContact O-CG2 3.5Å; E12-T16 PolarHBondContact O-N 3.45Å; E12-T16 PolarHBondContact O-OG1 2.77Å
13	Y	92.7	Very high	88.9	Confident	169 Å²	169	76.2 Å²	76.2	66%	0.663	42%	0.418	S	S	*	.	H	α-helix	trans	-61.8	-46	171	-178.8	-97.2	0	0	0	112.3	T9 F11 R15 T16 T17	T9-Y13 PolarHBondContact O-N 2.73Å; F11-Y13 VanDerWaalsContact C-N 3.31Å; F11-Y13 PolarHBondContact O-N 2.85Å; Y13-R15 PolarHBondContact O-N 3.28Å; Y13-T16 WeakPolarHBondContact CA-OG1 3.02Å; Y13-T16 PolarHBondContact O-OG1 3.26Å; Y13-T17 WeakPolarHBondContact O-CB 3.45Å; Y13-T17 PolarHBondContact O-N 3.2Å; Y13-T17 PolarHBondContact O-OG1 3.03Å
14	L	92	Very high	89.2	Confident	17 Å²	17	73.8 Å²	73.8	9%	0.089	41%	0.41	C	S	.	.	H	α-helix	trans	-61.9	-45.1	175.7	179.3	63.4	0	0	0	111.1	D10 F11 T17 L18 L32 I47	D10-L14 WeakPolarHBondContact O-CB 3.44Å; D10-L14 PolarHBondContact O-N 3.23Å; F11-L14 PolarHBondContact O-N 2.77Å; L14-T17 WeakPolarHBondContact O-CB 3.43Å; L14-T17 PolarHBondContact O-N 3.05Å; L14-L18 HydrophobicContact CD1-CD1 4.42Å; L14-L18 HydrophobicContact CD1-CG 4.45Å; L14-L18 HydrophobicContact CG-CD1 4.22Å; L14-L18 VanDerWaalsContact O-CG 3.32Å; L14-L18 WeakPolarHBondContact O-CG 3.4Å; L14-L18 PolarHBondContact O-N 3.08Å; L14-L32 HydrophobicContact CD2-CD1 4.26Å; L14-I47 HydrophobicContact CD2-CD1 4.13Å
15	R	92.6	Very high	89.2	Confident	87 Å²	87	70.9 Å²	70.9	33%	0.328	40%	0.399	S	S	.	.	H	α-helix	trans	-62.8	-48.3	-178.7	-174.6	-177.4	178.1	-163.9	-0.3	111.7	F11 E12 Y13 T17 L18 I19	F11-R15 VanDerWaalsContact O-CB 3.31Å; F11-R15 WeakPolarHBondContact O-CB 3.43Å; F11-R15 PolarHBondContact O-N 3.42Å; E12-R15 PolarHBondContact O-N 3.46Å; E12-R15 IonicContact OE1-NH1 3.89Å; E12-R15 PolarHBondContact OE1-NH1 2.99Å; E12-R15 VanDerWaalsContact OE1-NH1 3.16Å; E12-R15 IonicContact OE2-NH1 3.16Å; Y13-R15 PolarHBondContact O-N 3.28Å; R15-T17 VanDerWaalsContact C-N 3.3Å; R15-T17 PolarHBondContact O-N 2.95Å; R15-L18 PolarHBondContact O-N 3.5Å; R15-L18 VanDerWaalsContact O-N 3.16Å; R15-I19 HydrophobicContact CG-CD1 3.93Å; R15-I19 VanDerWaalsContact O-CG1 3.3Å; R15-I19 WeakPolarHBondContact O-CG1 3.48Å; R15-I19 PolarHBondContact O-N 2.56Å
16	T	92.3	Very high	89.3	Confident	75 Å²	75	71.1 Å²	71.1	46%	0.46	40%	0.402	S	S	.	.	H	α-helix	trans	-61.3	-39.5	176.4	51	0	0	0	0	111.7	E12 Y13 L18 I19 S20	E12-T16 WeakPolarHBondContact O-CB 3.48Å; E12-T16 VanDerWaalsContact O-CG2 3.26Å; E12-T16 WeakPolarHBondContact O-CG2 3.5Å; E12-T16 PolarHBondContact O-N 3.45Å; E12-T16 PolarHBondContact O-OG1 2.77Å; Y13-T16 WeakPolarHBondContact CA-OG1 3.02Å; Y13-T16 PolarHBondContact O-OG1 3.26Å; T16-L18 VanDerWaalsContact C-N 3.34Å; T16-L18 PolarHBondContact O-N 3.43Å; T16-I19 PolarHBondContact O-N 2.85Å; T16-S20 PolarHBondContact O-N 3.27Å; T16-S20 PolarHBondContact O-OG 2.88Å
17	T	90.5	Very high	89.2	Confident	35 Å²	35	73.6 Å²	73.6	22%	0.215	42%	0.415	C	S	.	.	H	α-helix	trans	-62.9	-37.2	174.3	-57.3	0	0	0	0	112.8	Y13 L14 R15 S20 E21 K31	Y13-T17 WeakPolarHBondContact O-CB 3.45Å; Y13-T17 PolarHBondContact O-N 3.2Å; Y13-T17 PolarHBondContact O-OG1 3.03Å; L14-T17 WeakPolarHBondContact O-CB 3.43Å; L14-T17 PolarHBondContact O-N 3.05Å; R15-T17 VanDerWaalsContact C-N 3.3Å; R15-T17 PolarHBondContact O-N 2.95Å; T17-S20 PolarHBondContact O-OG 3.28Å; T17-S20 VanDerWaalsContact O-OG 3.05Å; T17-E21 WeakPolarHBondContact O-CB 3.36Å; T17-E21 PolarHBondContact O-N 3.29Å; T17-K31 HydrophobicContact CG2-CD 3.93Å
18	L	90.8	Very high	89.2	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-75.4	-31.4	176.5	-69	174.8	0	0	0	112.4	L14 R15 T16 K28 K31 L32 I47	L14-L18 HydrophobicContact CD1-CD1 4.42Å; L14-L18 HydrophobicContact CD1-CG 4.45Å; L14-L18 HydrophobicContact CG-CD1 4.22Å; L14-L18 VanDerWaalsContact O-CG 3.32Å; L14-L18 WeakPolarHBondContact O-CG 3.4Å; L14-L18 PolarHBondContact O-N 3.08Å; R15-L18 PolarHBondContact O-N 3.5Å; R15-L18 VanDerWaalsContact O-N 3.16Å; T16-L18 VanDerWaalsContact C-N 3.34Å; T16-L18 PolarHBondContact O-N 3.43Å; L18-K28 HydrophobicContact CD2-CG 3.79Å; L18-K28 VanDerWaalsContact CD2-O 3.26Å; L18-K28 WeakPolarHBondContact CD2-O 2.95Å; L18-K28 WeakPolarHBondContact O-CE 3.41Å; L18-K28 PolarHBondContact O-NZ 2.7Å; L18-K31 HydrophobicContact CD2-CB 4.32Å; L18-L32 HydrophobicContact CD1-CB 4.49Å; L18-L32 HydrophobicContact CD1-CD1 4.19Å; L18-L32 HydrophobicContact CD2-CB 4.12Å; L18-I47 HydrophobicContact CD1-CG1 4.41Å; L18-I47 HydrophobicContact CD1-CG2 4.13Å
19	I	90	Very high	89.2	Confident	94 Å²	94	65 Å²	65	48%	0.482	37%	0.367	S	S	.	.	H	α-helix	trans	-72.8	-40.8	177.1	-69.1	166.9	0	0	0	110.5	R15 T16 E21	R15-I19 HydrophobicContact CG-CD1 3.93Å; R15-I19 VanDerWaalsContact O-CG1 3.3Å; R15-I19 WeakPolarHBondContact O-CG1 3.48Å; R15-I19 PolarHBondContact O-N 2.56Å; T16-I19 PolarHBondContact O-N 2.85Å; I19-E21 VanDerWaalsContact C-N 3.32Å
20	S	88.5	Confident	89.1	Confident	86 Å²	86	63.4 Å²	63.4	60%	0.601	36%	0.355	S	S	*	.	H	α-helix	trans	-67.4	-33.3	177.6	61.8	0	0	0	0	112.4	T16 T17 S22	T16-S20 PolarHBondContact O-N 3.27Å; T16-S20 PolarHBondContact O-OG 2.88Å; T17-S20 PolarHBondContact O-OG 3.28Å; T17-S20 VanDerWaalsContact O-OG 3.05Å; S20-S22 PolarHBondContact O-N 3.41Å
21	E	85.5	Confident	89	Confident	39 Å²	39	63.1 Å²	63.1	18%	0.182	35%	0.349	C	S	.	.			trans	-76.5	91.8	173.7	-162.9	58.5	-114.7	0	0	111.1	T17 I19 K28 K31	T17-E21 WeakPolarHBondContact O-CB 3.36Å; T17-E21 PolarHBondContact O-N 3.29Å; I19-E21 VanDerWaalsContact C-N 3.32Å; E21-K28 HydrophobicContact CB-CB 4.32Å; E21-K28 HydrophobicContact CB-CG 4.47Å; E21-K28 HydrophobicContact CG-CB 3.98Å; E21-K28 WeakPolarHBondContact O-CD 3.38Å; E21-K31 HydrophobicContact CB-CD 4.48Å; E21-K31 HydrophobicContact CG-CD 4.4Å; E21-K31 WeakPolarHBondContact OE2-CE 3.3Å; E21-K31 IonicContact OE2-NZ 2.56Å; E21-K31 PolarHBondContact OE2-NZ 2.78Å
22	S	77.1	Confident	88.8	Confident	98 Å²	98	62.7 Å²	62.7	69%	0.685	35%	0.348	S	S	*	.			trans	-116.6	-9.1	-180	60.8	0	0	0	0	114.1	S20	S20-S22 PolarHBondContact O-N 3.41Å
23	A	80.9	Confident	88.6	Confident	95 Å²	95	65.6 Å²	65.6	79%	0.785	36%	0.356	S	S	*	.	S	Bend	trans	-77.3	-47.4	-175.3	0	0	0	0	0	112.2
24	S	85.6	Confident	88.3	Confident	27 Å²	27	64.3 Å²	64.3	19%	0.189	35%	0.351	C	S	.	.			trans	-125	120.8	-177.5	52	0	0	0	0	111.5	S26 D27 K28	S24-S26 VanDerWaalsContact C-N 3.27Å; S24-S26 PolarHBondContact O-N 3.48Å; S24-D27 WeakPolarHBondContact CB-OD2 3.49Å; S24-D27 PolarHBondContact O-N 3.17Å; S24-D27 WeakPolarHBondContact OG-CB 3.4Å; S24-D27 PolarHBondContact OG-OD2 2.79Å; S24-K28 WeakPolarHBondContact O-CB 3.32Å; S24-K28 PolarHBondContact O-N 3.22Å; S24-K28 VanDerWaalsContact O-N 3.12Å
25	V	86.6	Confident	88.1	Confident	70 Å²	70	64.6 Å²	64.6	42%	0.424	36%	0.355	S	S	.	.	H	α-helix	trans	-66.2	-33.7	176.6	177.2	0	0	0	0	111.1	F29 E56	V25-F29 WeakPolarHBondContact O-CB 3.42Å; V25-F29 PolarHBondContact O-N 2.89Å; V25-E56 VanDerWaalsContact CG1-CD 3.49Å; V25-E56 HydrophobicContact CG1-CG 3.54Å
26	S	88.6	Confident	87.7	Confident	65 Å²	65	69.3 Å²	69.3	46%	0.455	38%	0.378	S	S	.	.	H	α-helix	trans	-60.2	-51.7	174.8	50.6	0	0	0	0	111.5	S24 K28 F29 D30	S24-S26 VanDerWaalsContact C-N 3.27Å; S24-S26 PolarHBondContact O-N 3.48Å; S26-K28 VanDerWaalsContact C-N 3.32Å; S26-K28 PolarHBondContact O-N 3.45Å; S26-F29 CarbonylContact O-C 3.58Å; S26-F29 WeakPolarHBondContact O-CA 3.41Å; S26-F29 WeakPolarHBondContact O-CB 3.46Å; S26-F29 PolarHBondContact O-N 3.34Å; S26-F29 VanDerWaalsContact O-N 3.08Å; S26-D30 PolarHBondContact O-N 3.39Å
27	D	88.4	Confident	87.4	Confident	78 Å²	78	67.2 Å²	67.2	42%	0.417	37%	0.371	S	S	.	.	H	α-helix	trans	-73.8	-33.2	-171.9	-48.2	-10	0	0	0	109.8	S24 F29 D30 K31	S24-D27 WeakPolarHBondContact CB-OD2 3.49Å; S24-D27 PolarHBondContact O-N 3.17Å; S24-D27 WeakPolarHBondContact OG-CB 3.4Å; S24-D27 PolarHBondContact OG-OD2 2.79Å; D27-F29 VanDerWaalsContact C-N 3.34Å; D27-F29 PolarHBondContact O-N 2.83Å; D27-D30 PolarHBondContact O-N 3.23Å; D27-K31 WeakPolarHBondContact O-CG 3.07Å; D27-K31 PolarHBondContact O-N 2.73Å
28	K	91.4	Very high	87.4	Confident	20 Å²	20	70.3 Å²	70.3	9%	0.087	38%	0.379	C	S	.	.	H	α-helix	trans	-57.5	-46.3	168.3	-173.7	-179.1	-175.1	139.5	0	111.8	L18 E21 S24 S26 L32 C50 Y51	L18-K28 HydrophobicContact CD2-CG 3.79Å; L18-K28 VanDerWaalsContact CD2-O 3.26Å; L18-K28 WeakPolarHBondContact CD2-O 2.95Å; L18-K28 WeakPolarHBondContact O-CE 3.41Å; L18-K28 PolarHBondContact O-NZ 2.7Å; E21-K28 HydrophobicContact CB-CB 4.32Å; E21-K28 HydrophobicContact CB-CG 4.47Å; E21-K28 HydrophobicContact CG-CB 3.98Å; E21-K28 WeakPolarHBondContact O-CD 3.38Å; S24-K28 WeakPolarHBondContact O-CB 3.32Å; S24-K28 PolarHBondContact O-N 3.22Å; S24-K28 VanDerWaalsContact O-N 3.12Å; S26-K28 VanDerWaalsContact C-N 3.32Å; S26-K28 PolarHBondContact O-N 3.45Å; K28-L32 PolarHBondContact O-N 3.05Å; K28-C50 WeakPolarHBondContact CE-O 3.46Å; K28-C50 PolarHBondContact NZ-O 3.05Å; K28-Y51 HydrophobicContact CD-CD1 4.22Å; K28-Y51 HydrophobicContact CD-CE1 3.79Å; K28-Y51 HydrophobicContact CG-CE1 4.01Å; K28-Y51 PolarHBondContact O-OH 3.41Å
29	F	90.7	Very high	87.4	Confident	27 Å²	27	70.3 Å²	70.3	12%	0.118	38%	0.379	C	S	.	.	H	α-helix	trans	-65	-40.1	176.2	-179.5	-92.9	0	0	0	111.7	V25 S26 D27 L32 Y33 K59 V60 A63	V25-F29 WeakPolarHBondContact O-CB 3.42Å; V25-F29 PolarHBondContact O-N 2.89Å; S26-F29 CarbonylContact O-C 3.58Å; S26-F29 WeakPolarHBondContact O-CA 3.41Å; S26-F29 WeakPolarHBondContact O-CB 3.46Å; S26-F29 PolarHBondContact O-N 3.34Å; S26-F29 VanDerWaalsContact O-N 3.08Å; D27-F29 VanDerWaalsContact C-N 3.34Å; D27-F29 PolarHBondContact O-N 2.83Å; F29-L32 CarbonylContact O-C 3.59Å; F29-L32 WeakPolarHBondContact O-CB 3.44Å; F29-L32 PolarHBondContact O-N 3.11Å; F29-Y33 HydrophobicContact CE1-CD2 4.44Å; F29-Y33 WeakPolarHBondContact O-CB 3.33Å; F29-Y33 PolarHBondContact O-N 3.04Å; F29-K59 HydrophobicContact CD2-CD 4.42Å; F29-K59 HydrophobicContact CD2-CG 4.44Å; F29-K59 HydrophobicContact CE2-CD 4.24Å; F29-K59 HydrophobicContact CE2-CG 3.87Å; F29-K59 HydrophobicContact CZ-CD 4.44Å; F29-K59 HydrophobicContact CZ-CG 4.16Å; F29-V60 HydrophobicContact CD2-CG2 3.95Å; F29-V60 HydrophobicContact CE2-CG2 4.26Å; F29-A63 HydrophobicContact CE2-CB 3.96Å; F29-A63 HydrophobicContact CZ-CB 3.82Å
30	D	89.3	Confident	87.6	Confident	72 Å²	72	67.7 Å²	67.7	39%	0.385	37%	0.368	S	S	.	.	H	α-helix	trans	-65.9	-40.4	178.9	-71.5	-13.4	0	0	0	111.9	S26 D27 L32 Y33 Y34	S26-D30 PolarHBondContact O-N 3.39Å; D27-D30 PolarHBondContact O-N 3.23Å; D30-L32 VanDerWaalsContact C-N 3.3Å; D30-L32 PolarHBondContact O-N 3.48Å; D30-Y33 PolarHBondContact O-N 3.15Å; D30-Y33 VanDerWaalsContact O-N 3.13Å; D30-Y34 HydrophobicContact CB-CD2 4.36Å; D30-Y34 HydrophobicContact CB-CE2 4.36Å; D30-Y34 WeakPolarHBondContact O-CD2 3.44Å; D30-Y34 PolarHBondContact O-N 3.36Å
31	K	89.1	Confident	87.7	Confident	78 Å²	78	63.6 Å²	63.6	34%	0.339	34%	0.339	S	S	.	.	H	α-helix	trans	-58.7	-42.6	171.9	-72.4	-178.2	-169.4	-173	0	111.6	T17 L18 E21 D27 S35	T17-K31 HydrophobicContact CG2-CD 3.93Å; L18-K31 HydrophobicContact CD2-CB 4.32Å; E21-K31 HydrophobicContact CB-CD 4.48Å; E21-K31 HydrophobicContact CG-CD 4.4Å; E21-K31 WeakPolarHBondContact OE2-CE 3.3Å; E21-K31 IonicContact OE2-NZ 2.56Å; E21-K31 PolarHBondContact OE2-NZ 2.78Å; D27-K31 WeakPolarHBondContact O-CG 3.07Å; D27-K31 PolarHBondContact O-N 2.73Å; K31-S35 WeakPolarHBondContact O-CB 3.44Å; K31-S35 PolarHBondContact O-N 3.24Å
32	L	89.9	Confident	88	Confident	3 Å²	3	69.1 Å²	69.1	2%	0.016	36%	0.358	C	S	.	.	H	α-helix	trans	-65.3	-42.9	173.7	178.6	64.5	0	0	0	111.4	L14 L18 K28 F29 D30 Y34 S35 I47 Y51 V60 L64 R67	L14-L32 HydrophobicContact CD2-CD1 4.26Å; L18-L32 HydrophobicContact CD1-CB 4.49Å; L18-L32 HydrophobicContact CD1-CD1 4.19Å; L18-L32 HydrophobicContact CD2-CB 4.12Å; K28-L32 PolarHBondContact O-N 3.05Å; F29-L32 CarbonylContact O-C 3.59Å; F29-L32 WeakPolarHBondContact O-CB 3.44Å; F29-L32 PolarHBondContact O-N 3.11Å; D30-L32 VanDerWaalsContact C-N 3.3Å; D30-L32 PolarHBondContact O-N 3.48Å; L32-Y34 PolarHBondContact O-N 2.99Å; L32-S35 WeakPolarHBondContact O-CB 3.49Å; L32-S35 PolarHBondContact O-N 3.29Å; L32-S35 PolarHBondContact O-OG 3.09Å; L32-I47 HydrophobicContact CD1-CD1 4.1Å; L32-I47 HydrophobicContact CD1-CG2 3.97Å; L32-I47 HydrophobicContact CD2-CG2 3.81Å; L32-Y51 HydrophobicContact CD2-CE2 4.31Å; L32-V60 HydrophobicContact CD2-CG1 3.56Å; L32-V60 HydrophobicContact CD2-CG2 4.29Å; L32-L64 HydrophobicContact CD1-CD2 4.38Å; L32-L64 HydrophobicContact CD2-CD2 4.36Å; L32-R67 PolarHBondContact O-NH1 3.28Å
33	Y	88.2	Confident	88.8	Confident	143 Å²	143	65 Å²	65	56%	0.561	33%	0.328	S	S	*	.	H	α-helix	trans	-63.4	-41	-178.1	-173.4	-97.1	0	0	0	112.3	F29 D30	F29-Y33 HydrophobicContact CE1-CD2 4.44Å; F29-Y33 WeakPolarHBondContact O-CB 3.33Å; F29-Y33 PolarHBondContact O-N 3.04Å; D30-Y33 PolarHBondContact O-N 3.15Å; D30-Y33 VanDerWaalsContact O-N 3.13Å
34	Y	87.1	Confident	89.4	Confident	141 Å²	141	60.5 Å²	60.5	55%	0.553	29%	0.291	S	S	*	.	H	α-helix	trans	-84.5	-10.4	178.3	-67.9	-60.1	0	0	0	114.3	D30 L32 R220	D30-Y34 HydrophobicContact CB-CD2 4.36Å; D30-Y34 HydrophobicContact CB-CE2 4.36Å; D30-Y34 WeakPolarHBondContact O-CD2 3.44Å; D30-Y34 PolarHBondContact O-N 3.36Å; L32-Y34 PolarHBondContact O-N 2.99Å; Y34-R220 PolarHBondContact OH-NH1 2.9Å
35	S	87	Confident	89.8	Confident	24 Å²	24	59.6 Å²	59.6	17%	0.168	29%	0.285	C	S	.	.			trans	-62	142.4	170.3	72.8	0	0	0	0	111.2	K31 L32 R67	K31-S35 WeakPolarHBondContact O-CB 3.44Å; K31-S35 PolarHBondContact O-N 3.24Å; L32-S35 WeakPolarHBondContact O-CB 3.49Å; L32-S35 PolarHBondContact O-N 3.29Å; L32-S35 PolarHBondContact O-OG 3.09Å; S35-R67 VanDerWaalsContact O-CZ 3.29Å; S35-R67 PolarHBondContact O-NH1 3.49Å; S35-R67 PolarHBondContact O-NH2 3.09Å; S35-R67 VanDerWaalsContact O-NH2 3.16Å; S35-R67 PolarHBondContact OG-NH1 3.16Å; S35-R67 PolarHBondContact OG-NH2 3.32Å
36	K	84	Confident	90.1	Very high	186 Å²	186	57.4 Å²	57.4	81%	0.809	27%	0.274	S	S	*	.			trans	-94.2	160.1	177.9	-64.8	-177.9	-178.1	176.9	0	110.7
37	G	86.3	Confident	90.3	Very high	31 Å²	31	54.3 Å²	54.3	32%	0.32	25%	0.253	S	S	.	.	S	Bend	trans	104.2	161.3	172.8	0	0	0	0	0	114.7	R67	G37-R67 PolarHBondContact O-NE 3.46Å; G37-R67 PolarHBondContact O-NH2 3.29Å; G37-R67 VanDerWaalsContact O-NH2 3.15Å
38	Y	90.7	Very high	90.5	Very high	100 Å²	100	50.6 Å²	50.6	39%	0.392	23%	0.233	S	C	.	.	B	Isolated β-bridge	trans	-97.1	151.3	174.6	-58.6	-82	0	0	0	110.3	K3 I4 P5 L6 R67 C69	K3-Y38 HydrophobicContact CB-CD1 3.94Å; K3-Y38 HydrophobicContact CB-CD2 3.96Å; K3-Y38 HydrophobicContact CB-CE1 4.33Å; K3-Y38 HydrophobicContact CB-CE2 4.34Å; K3-Y38 HydrophobicContact CB-CG 3.74Å; K3-Y38 HydrophobicContact CD-CD1 3.52Å; K3-Y38 HydrophobicContact CD-CE1 3.69Å; K3-Y38 HydrophobicContact CD-CG 4.19Å; K3-Y38 HydrophobicContact CG-CD1 3.74Å; K3-Y38 HydrophobicContact CG-CD2 4.35Å; K3-Y38 HydrophobicContact CG-CE1 3.72Å; K3-Y38 HydrophobicContact CG-CE2 4.33Å; K3-Y38 HydrophobicContact CG-CG 4.06Å; I4-Y38 WeakPolarHBondContact O-CB 3.24Å; I4-Y38 WeakPolarHBondContact O-CD2 3.35Å; P5-Y38 CarbonylContact C-O 3.59Å; L6-Y38 WeakPolarHBondContact CB-O 3.16Å; L6-Y38 PolarHBondContact N-O 2.91Å; Y38-R67 CarbonylContact C-O 3.49Å; Y38-R67 WeakPolarHBondContact CA-O 3.33Å; Y38-R67 WeakPolarHBondContact CB-O 3.46Å; Y38-R67 WeakPolarHBondContact CD1-O 3.31Å; Y38-C69 VanDerWaalsContact CB-SG 3.5Å
39	L	91.7	Very high	90.5	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-115.9	138.7	-174.6	-61.5	166.7	0	0	0	110.4	L6 F11 Q43 A44 I47 L64 R67 C69	L6-L39 HydrophobicContact CD2-CD2 4.44Å; F11-L39 HydrophobicContact CD2-CD2 4.14Å; F11-L39 HydrophobicContact CE2-CD2 4.38Å; L39-Q43 HydrophobicContact CB-CB 4.32Å; L39-Q43 HydrophobicContact CD2-CB 4.14Å; L39-A44 HydrophobicContact CB-CB 4.48Å; L39-I47 HydrophobicContact CD1-CD1 3.58Å; L39-I47 HydrophobicContact CD2-CD1 3.79Å; L39-I47 HydrophobicContact CG-CD1 4.34Å; L39-L64 HydrophobicContact CD1-CD1 3.93Å; L39-L64 HydrophobicContact CD1-CD2 3.59Å; L39-L64 HydrophobicContact CD1-CG 4.34Å; L39-R67 PolarHBondContact N-O 3.37Å; L39-C69 PolarHBondContact O-N 3.25Å
40	T	92.5	Very high	90.5	Very high	39 Å²	39	52.1 Å²	52.1	24%	0.239	25%	0.253	C	S	.	.			trans	-71.4	167.1	166.7	64.4	0	0	0	0	110.8	P5 R42 Q43 A44	P5-T40 HydrophobicContact CB-CG2 3.52Å; P5-T40 HydrophobicContact CG-CG2 4.34Å; T40-R42 VanDerWaalsContact C-N 3.29Å; T40-R42 PolarHBondContact O-N 3.28Å; T40-Q43 PolarHBondContact O-N 3.16Å; T40-Q43 WeakPolarHBondContact OG1-CB 3.25Å; T40-Q43 VanDerWaalsContact OG1-CG 3.26Å; T40-Q43 WeakPolarHBondContact OG1-CG 3.4Å; T40-Q43 PolarHBondContact OG1-N 2.96Å; T40-A44 WeakPolarHBondContact O-CB 3.48Å; T40-A44 PolarHBondContact O-N 3.32Å
41	G	90.4	Very high	90.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-57.8	-44.1	177.5	0	0	0	0	0	112.3	A44 A45 I79	G41-A44 PolarHBondContact O-N 3.05Å; G41-A45 PolarHBondContact O-N 2.81Å; G41-I79 WeakPolarHBondContact O-CG1 3.44Å
42	R	92.6	Very high	90.5	Very high	154 Å²	154	54 Å²	54	58%	0.581	26%	0.257	S	S	*	.	H	α-helix	trans	-62.6	-46.5	177.2	-59.3	-164.3	167.9	154.1	2.5	113.2	T40 A44 A45 A46 E75 E78	T40-R42 VanDerWaalsContact C-N 3.29Å; T40-R42 PolarHBondContact O-N 3.28Å; R42-A44 VanDerWaalsContact C-N 3.31Å; R42-A44 PolarHBondContact O-N 2.93Å; R42-A45 PolarHBondContact O-N 3.46Å; R42-A46 PolarHBondContact O-N 3.47Å; R42-E75 HydrophobicContact CG-CG 4.46Å; R42-E78 WeakPolarHBondContact CG-OE2 3.42Å; R42-E78 IonicContact NE-OE1 2.85Å; R42-E78 PolarHBondContact NE-OE1 2.93Å
43	Q	94.1	Very high	90.4	Very high	12 Å²	12	56.6 Å²	56.6	6%	0.056	27%	0.274	C	S	.	.	H	α-helix	trans	-62.1	-40.5	177.4	-75.9	176.2	-10.5	0	0	111.2	L6 F11 L39 T40 A46 I47	L6-Q43 PolarHBondContact O-NE2 3.43Å; F11-Q43 HydrophobicContact CD1-CG 4.08Å; F11-Q43 HydrophobicContact CD2-CB 3.75Å; F11-Q43 HydrophobicContact CD2-CG 3.61Å; F11-Q43 HydrophobicContact CE1-CG 4.14Å; F11-Q43 HydrophobicContact CE2-CB 3.41Å; F11-Q43 VanDerWaalsContact CE2-CB 3.41Å; F11-Q43 HydrophobicContact CE2-CG 3.67Å; F11-Q43 WeakPolarHBondContact CE2-O 3.47Å; F11-Q43 HydrophobicContact CG-CB 4.46Å; F11-Q43 HydrophobicContact CG-CG 3.83Å; F11-Q43 HydrophobicContact CZ-CB 3.88Å; F11-Q43 HydrophobicContact CZ-CG 3.96Å; F11-Q43 WeakPolarHBondContact CZ-O 3.26Å; L39-Q43 HydrophobicContact CB-CB 4.32Å; L39-Q43 HydrophobicContact CD2-CB 4.14Å; T40-Q43 PolarHBondContact O-N 3.16Å; T40-Q43 WeakPolarHBondContact OG1-CB 3.25Å; T40-Q43 VanDerWaalsContact OG1-CG 3.26Å; T40-Q43 WeakPolarHBondContact OG1-CG 3.4Å; T40-Q43 PolarHBondContact OG1-N 2.96Å; Q43-A46 PolarHBondContact O-N 3.17Å; Q43-I47 WeakPolarHBondContact O-CG1 3.26Å; Q43-I47 PolarHBondContact O-N 3.18Å
44	A	93.4	Very high	90.3	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.5	-43	175.9	0	0	0	0	0	112.1	L39 T40 G41 R42 A46 I47 L48 L64 L68 I79	L39-A44 HydrophobicContact CB-CB 4.48Å; T40-A44 WeakPolarHBondContact O-CB 3.48Å; T40-A44 PolarHBondContact O-N 3.32Å; G41-A44 PolarHBondContact O-N 3.05Å; R42-A44 VanDerWaalsContact C-N 3.31Å; R42-A44 PolarHBondContact O-N 2.93Å; A44-A46 VanDerWaalsContact C-N 3.34Å; A44-A46 PolarHBondContact O-N 3.48Å; A44-I47 PolarHBondContact O-N 2.88Å; A44-L48 WeakPolarHBondContact O-CG 3.32Å; A44-L48 PolarHBondContact O-N 2.73Å; A44-L64 HydrophobicContact CB-CD1 4.32Å; A44-L68 HydrophobicContact CB-CD2 3.54Å; A44-I79 HydrophobicContact CB-CD1 4.12Å; A44-I79 HydrophobicContact CB-CG1 4.48Å
45	A	93.3	Very high	90.3	Very high	8 Å²	8	48.4 Å²	48.4	7%	0.066	26%	0.257	C	S	.	.	H	α-helix	trans	-59.7	-43.5	175.3	0	0	0	0	0	111.8	G41 R42 I47 L48 A49 E78 I79 V82	G41-A45 PolarHBondContact O-N 2.81Å; R42-A45 PolarHBondContact O-N 3.46Å; A45-I47 PolarHBondContact O-N 2.93Å; A45-L48 PolarHBondContact O-N 3.2Å; A45-A49 PolarHBondContact O-N 3.13Å; A45-E78 HydrophobicContact CB-CB 4.3Å; A45-I79 HydrophobicContact CB-CG1 4.1Å; A45-V82 HydrophobicContact CB-CG2 4.22Å
46	A	93.5	Very high	90.5	Very high	24 Å²	24	49.1 Å²	49.1	20%	0.198	26%	0.257	C	S	.	.	H	α-helix	trans	-64.8	-37	176.4	0	0	0	0	0	113.2	F11 R42 Q43 A44 A49 C50	F11-A46 HydrophobicContact CE1-CB 4.42Å; F11-A46 HydrophobicContact CZ-CB 3.82Å; R42-A46 PolarHBondContact O-N 3.47Å; Q43-A46 PolarHBondContact O-N 3.17Å; A44-A46 VanDerWaalsContact C-N 3.34Å; A44-A46 PolarHBondContact O-N 3.48Å; A46-A49 PolarHBondContact O-N 3.2Å; A46-C50 PolarHBondContact O-N 3.48Å; A46-C50 PolarHBondContact O-SG 3.16Å
47	I	93.2	Very high	90.8	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-66.9	-43.6	173	-72.7	170.5	0	0	0	110.9	F11 L14 L18 L32 L39 Q43 A44 A45 A49 C50 Y51 V60 L64	F11-I47 HydrophobicContact CD2-CD1 4.45Å; F11-I47 HydrophobicContact CE2-CD1 3.79Å; F11-I47 HydrophobicContact CE2-CG1 3.82Å; F11-I47 HydrophobicContact CZ-CG1 4.36Å; L14-I47 HydrophobicContact CD2-CD1 4.13Å; L18-I47 HydrophobicContact CD1-CG1 4.41Å; L18-I47 HydrophobicContact CD1-CG2 4.13Å; L32-I47 HydrophobicContact CD1-CD1 4.1Å; L32-I47 HydrophobicContact CD1-CG2 3.97Å; L32-I47 HydrophobicContact CD2-CG2 3.81Å; L39-I47 HydrophobicContact CD1-CD1 3.58Å; L39-I47 HydrophobicContact CD2-CD1 3.79Å; L39-I47 HydrophobicContact CG-CD1 4.34Å; Q43-I47 WeakPolarHBondContact O-CG1 3.26Å; Q43-I47 PolarHBondContact O-N 3.18Å; A44-I47 PolarHBondContact O-N 2.88Å; A45-I47 PolarHBondContact O-N 2.93Å; I47-A49 VanDerWaalsContact C-N 3.26Å; I47-A49 PolarHBondContact O-N 2.87Å; I47-C50 VanDerWaalsContact O-CB 3.25Å; I47-C50 WeakPolarHBondContact O-CB 3.46Å; I47-C50 PolarHBondContact O-N 3.41Å; I47-Y51 HydrophobicContact CG2-CE2 4.24Å; I47-Y51 WeakPolarHBondContact O-CD2 3.35Å; I47-V60 HydrophobicContact CG2-CG1 4.29Å; I47-L64 HydrophobicContact CG2-CD1 4.48Å
48	L	92.7	Very high	91	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.5	-36.4	177.3	-71.7	170	0	0	0	112	A44 A45 C50 Y51 R57 V60 I61 I79 V82	A44-L48 WeakPolarHBondContact O-CG 3.32Å; A44-L48 PolarHBondContact O-N 2.73Å; A45-L48 PolarHBondContact O-N 3.2Å; L48-C50 PolarHBondContact O-N 2.8Å; L48-Y51 PolarHBondContact O-N 2.79Å; L48-Y51 VanDerWaalsContact O-N 3.11Å; L48-R57 HydrophobicContact CD2-CB 4.14Å; L48-R57 WeakPolarHBondContact CD2-O 3.15Å; L48-R57 PolarHBondContact O-NE 3.47Å; L48-V60 HydrophobicContact CD2-CB 3.85Å; L48-V60 HydrophobicContact CD2-CG1 3.61Å; L48-I61 HydrophobicContact CD1-CD1 4.3Å; L48-I61 HydrophobicContact CD2-CB 4.26Å; L48-I79 HydrophobicContact CD1-CG2 3.74Å; L48-V82 HydrophobicContact CB-CG1 3.73Å
49	A	91.3	Very high	91	Very high	60 Å²	60	43 Å²	43	50%	0.496	23%	0.225	S	C	.	.	H	α-helix	trans	-63.8	-21.4	175.6	0	0	0	0	0	113.1	A45 A46 I47 Y51 V82	A45-A49 PolarHBondContact O-N 3.13Å; A46-A49 PolarHBondContact O-N 3.2Å; I47-A49 VanDerWaalsContact C-N 3.26Å; I47-A49 PolarHBondContact O-N 2.87Å; A49-Y51 PolarHBondContact O-N 3.21Å; A49-V82 HydrophobicContact CB-CG1 4.4Å
50	C	90.3	Very high	91.1	Very high	20 Å²	20	43.1 Å²	43.1	14%	0.135	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-15.2	175.7	-60.7	0	0	0	0	113.2	K28 A46 I47 L48	K28-C50 WeakPolarHBondContact CE-O 3.46Å; K28-C50 PolarHBondContact NZ-O 3.05Å; A46-C50 PolarHBondContact O-N 3.48Å; A46-C50 PolarHBondContact O-SG 3.16Å; I47-C50 VanDerWaalsContact O-CB 3.25Å; I47-C50 WeakPolarHBondContact O-CB 3.46Å; I47-C50 PolarHBondContact O-N 3.41Å; L48-C50 PolarHBondContact O-N 2.8Å
51	Y	90.7	Very high	91.1	Very high	4 Å²	4	41.2 Å²	41.2	2%	0.016	21%	0.214	C	C	.	.			trans	-97.6	138.8	177.6	-67.7	-92.4	0	0	0	110.6	K28 L32 I47 L48 A49 E56 R57 V60	K28-Y51 HydrophobicContact CD-CD1 4.22Å; K28-Y51 HydrophobicContact CD-CE1 3.79Å; K28-Y51 HydrophobicContact CG-CE1 4.01Å; K28-Y51 PolarHBondContact O-OH 3.41Å; L32-Y51 HydrophobicContact CD2-CE2 4.31Å; I47-Y51 HydrophobicContact CG2-CE2 4.24Å; I47-Y51 WeakPolarHBondContact O-CD2 3.35Å; L48-Y51 PolarHBondContact O-N 2.79Å; L48-Y51 VanDerWaalsContact O-N 3.11Å; A49-Y51 PolarHBondContact O-N 3.21Å; Y51-E56 HydrophobicContact CD1-CB 3.95Å; Y51-E56 HydrophobicContact CD1-CG 4.46Å; Y51-E56 HydrophobicContact CG-CB 4.36Å; Y51-R57 VanDerWaalsContact O-CZ 3.28Å; Y51-R57 PolarHBondContact O-NE 3.25Å; Y51-R57 PolarHBondContact O-NH2 3.34Å; Y51-V60 HydrophobicContact CD1-CG2 4.11Å; Y51-V60 HydrophobicContact CD2-CG2 3.82Å; Y51-V60 HydrophobicContact CE1-CG2 3.79Å; Y51-V60 HydrophobicContact CE2-CB 4.4Å; Y51-V60 HydrophobicContact CE2-CG1 4.16Å; Y51-V60 HydrophobicContact CE2-CG2 3.5Å; Y51-V60 VanDerWaalsContact CE2-CG2 3.5Å; Y51-V60 HydrophobicContact CG-CG2 4.11Å; Y51-V60 VanDerWaalsContact CZ-CG2 3.46Å
52	K	87.2	Confident	91.1	Very high	184 Å²	184	47.6 Å²	47.6	80%	0.8	24%	0.242	S	C	*	.			trans	-86.8	-44	-171.1	-70	-178	-179	176.5	0	112	E56	K52-E56 PolarHBondContact N-OE2 2.97Å
53	T	88.5	Confident	91	Very high	59 Å²	59	42 Å²	42	36%	0.362	23%	0.229	S	C	.	.	S	Bend	trans	-93.3	149.5	-173.1	72.5	0	0	0	0	111.7	E56 R57	T53-E56 WeakPolarHBondContact CG2-OE1 3.15Å; T53-E56 WeakPolarHBondContact O-CB 3.4Å; T53-E56 PolarHBondContact O-N 2.93Å; T53-E56 WeakPolarHBondContact OG1-CB 3.12Å; T53-E56 WeakPolarHBondContact OG1-CG 3.47Å; T53-E56 PolarHBondContact OG1-OE1 3.01Å; T53-R57 WeakPolarHBondContact O-CG 3.49Å; T53-R57 PolarHBondContact O-N 3.45Å
54	A	86.3	Confident	90.8	Very high	16 Å²	16	41.5 Å²	41.5	13%	0.132	23%	0.226	C	C	.	.	H	α-helix	trans	-57	-49.1	174.6	0	0	0	0	0	114.1	E56 R57 V58 S85	A54-E56 VanDerWaalsContact C-N 3.26Å; A54-E56 PolarHBondContact O-N 3.16Å; A54-R57 PolarHBondContact O-N 3.33Å; A54-R57 VanDerWaalsContact O-N 3.09Å; A54-V58 WeakPolarHBondContact O-CG2 2.95Å; A54-V58 PolarHBondContact O-N 2.72Å; A54-S85 WeakPolarHBondContact CB-OG 3.47Å
55	P	87.3	Confident	90.6	Very high	95 Å²	95	44.8 Å²	44.8	62%	0.617	24%	0.242	S	C	*	.	H	α-helix	trans	-62.7	-32.2	-179.4	24.1	-35.6	0	0	0	112.9	V58 K59	P55-V58 PolarHBondContact O-N 2.83Å; P55-K59 PolarHBondContact O-N 3.25Å
56	E	89.7	Confident	90.2	Very high	40 Å²	40	52.7 Å²	52.7	19%	0.187	27%	0.274	C	S	.	.	H	α-helix	trans	-62.3	-48.7	172.2	-75.9	162.7	-142.7	0	0	111.5	V25 Y51 K52 T53 A54 V58 K59 V60	V25-E56 VanDerWaalsContact CG1-CD 3.49Å; V25-E56 HydrophobicContact CG1-CG 3.54Å; Y51-E56 HydrophobicContact CD1-CB 3.95Å; Y51-E56 HydrophobicContact CD1-CG 4.46Å; Y51-E56 HydrophobicContact CG-CB 4.36Å; K52-E56 PolarHBondContact N-OE2 2.97Å; T53-E56 WeakPolarHBondContact CG2-OE1 3.15Å; T53-E56 WeakPolarHBondContact O-CB 3.4Å; T53-E56 PolarHBondContact O-N 2.93Å; T53-E56 WeakPolarHBondContact OG1-CB 3.12Å; T53-E56 WeakPolarHBondContact OG1-CG 3.47Å; T53-E56 PolarHBondContact OG1-OE1 3.01Å; A54-E56 VanDerWaalsContact C-N 3.26Å; A54-E56 PolarHBondContact O-N 3.16Å; E56-V58 VanDerWaalsContact C-N 3.28Å; E56-V58 PolarHBondContact O-N 2.89Å; E56-K59 WeakPolarHBondContact O-CB 3.21Å; E56-K59 PolarHBondContact O-N 3.38Å; E56-K59 VanDerWaalsContact O-N 3.15Å; E56-V60 VanDerWaalsContact O-CG2 3.24Å; E56-V60 WeakPolarHBondContact O-CG2 3.17Å; E56-V60 PolarHBondContact O-N 3.07Å
57	R	91.5	Very high	90	Very high	42 Å²	42	53.4 Å²	53.4	16%	0.158	27%	0.272	C	S	.	.	H	α-helix	trans	-60	-39.7	178.2	-66.6	177.4	-177.3	164.3	11.1	111.5	L48 Y51 T53 A54 V60 I61 V82 L83	L48-R57 HydrophobicContact CD2-CB 4.14Å; L48-R57 WeakPolarHBondContact CD2-O 3.15Å; L48-R57 PolarHBondContact O-NE 3.47Å; Y51-R57 VanDerWaalsContact O-CZ 3.28Å; Y51-R57 PolarHBondContact O-NE 3.25Å; Y51-R57 PolarHBondContact O-NH2 3.34Å; T53-R57 WeakPolarHBondContact O-CG 3.49Å; T53-R57 PolarHBondContact O-N 3.45Å; A54-R57 PolarHBondContact O-N 3.33Å; A54-R57 VanDerWaalsContact O-N 3.09Å; R57-V60 PolarHBondContact O-N 3.19Å; R57-I61 PolarHBondContact O-N 3.12Å; R57-V82 PolarHBondContact NH1-O 3.35Å; R57-L83 HydrophobicContact CB-CD2 3.48Å; R57-L83 VanDerWaalsContact CB-CD2 3.48Å
58	V	91.1	Very high	89.9	Confident	26 Å²	26	53.4 Å²	53.4	16%	0.158	27%	0.272	C	S	.	.	H	α-helix	trans	-63.4	-42.5	175.2	172.6	0	0	0	0	111.8	A54 P55 E56 V60 I61 K62 L83 D89 F92	A54-V58 WeakPolarHBondContact O-CG2 2.95Å; A54-V58 PolarHBondContact O-N 2.72Å; P55-V58 PolarHBondContact O-N 2.83Å; E56-V58 VanDerWaalsContact C-N 3.28Å; E56-V58 PolarHBondContact O-N 2.89Å; V58-V60 VanDerWaalsContact C-N 3.32Å; V58-V60 PolarHBondContact O-N 3.48Å; V58-I61 VanDerWaalsContact O-CG2 3.25Å; V58-I61 WeakPolarHBondContact O-CG2 3.34Å; V58-K62 WeakPolarHBondContact O-CB 3.25Å; V58-K62 PolarHBondContact O-N 3.17Å; V58-L83 HydrophobicContact CG2-CD2 4.45Å; V58-D89 HydrophobicContact CG2-CB 3.8Å; V58-F92 HydrophobicContact CG1-CD1 3.62Å; V58-F92 HydrophobicContact CG1-CE1 3.62Å; V58-F92 HydrophobicContact CG1-CG 4.49Å
59	K	90.6	Very high	89.7	Confident	121 Å²	121	53.8 Å²	53.8	53%	0.526	27%	0.274	S	S	.	.	H	α-helix	trans	-63.7	-40	175.2	-171.3	-179.3	177.1	-176	0	111.5	F29 P55 E56 A63	F29-K59 HydrophobicContact CD2-CD 4.42Å; F29-K59 HydrophobicContact CD2-CG 4.44Å; F29-K59 HydrophobicContact CE2-CD 4.24Å; F29-K59 HydrophobicContact CE2-CG 3.87Å; F29-K59 HydrophobicContact CZ-CD 4.44Å; F29-K59 HydrophobicContact CZ-CG 4.16Å; P55-K59 PolarHBondContact O-N 3.25Å; E56-K59 WeakPolarHBondContact O-CB 3.21Å; E56-K59 PolarHBondContact O-N 3.38Å; E56-K59 VanDerWaalsContact O-N 3.15Å; K59-A63 PolarHBondContact O-N 3.19Å; K59-A63 VanDerWaalsContact O-N 3.17Å
60	V	92.7	Very high	89.7	Confident	1 Å²	1	60.6 Å²	60.6	1%	0.006	29%	0.287	C	S	.	.	H	α-helix	trans	-66.8	-49.4	179.1	171.5	0	0	0	0	111.4	F29 L32 I47 L48 Y51 E56 R57 V58 K62 A63 L64	F29-V60 HydrophobicContact CD2-CG2 3.95Å; F29-V60 HydrophobicContact CE2-CG2 4.26Å; L32-V60 HydrophobicContact CD2-CG1 3.56Å; L32-V60 HydrophobicContact CD2-CG2 4.29Å; I47-V60 HydrophobicContact CG2-CG1 4.29Å; L48-V60 HydrophobicContact CD2-CB 3.85Å; L48-V60 HydrophobicContact CD2-CG1 3.61Å; Y51-V60 HydrophobicContact CD1-CG2 4.11Å; Y51-V60 HydrophobicContact CD2-CG2 3.82Å; Y51-V60 HydrophobicContact CE1-CG2 3.79Å; Y51-V60 HydrophobicContact CE2-CB 4.4Å; Y51-V60 HydrophobicContact CE2-CG1 4.16Å; Y51-V60 HydrophobicContact CE2-CG2 3.5Å; Y51-V60 VanDerWaalsContact CE2-CG2 3.5Å; Y51-V60 HydrophobicContact CG-CG2 4.11Å; Y51-V60 VanDerWaalsContact CZ-CG2 3.46Å; E56-V60 VanDerWaalsContact O-CG2 3.24Å; E56-V60 WeakPolarHBondContact O-CG2 3.17Å; E56-V60 PolarHBondContact O-N 3.07Å; R57-V60 PolarHBondContact O-N 3.19Å; V58-V60 VanDerWaalsContact C-N 3.32Å; V58-V60 PolarHBondContact O-N 3.48Å; V60-K62 VanDerWaalsContact C-N 3.26Å; V60-K62 PolarHBondContact O-N 3.11Å; V60-A63 WeakPolarHBondContact O-CB 3.47Å; V60-A63 PolarHBondContact O-N 3.21Å; V60-L64 HydrophobicContact CG1-CD1 3.9Å; V60-L64 HydrophobicContact CG1-CG 4.15Å; V60-L64 WeakPolarHBondContact O-CG 3.5Å; V60-L64 PolarHBondContact O-N 2.91Å
61	I	92.6	Very high	89.7	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61.6	-37.2	-179.9	-169.6	58.3	0	0	0	111.7	L48 R57 V58 A63 L64 Q65 L68 I79 A93 C96 I97	L48-I61 HydrophobicContact CD1-CD1 4.3Å; L48-I61 HydrophobicContact CD2-CB 4.26Å; R57-I61 PolarHBondContact O-N 3.12Å; V58-I61 VanDerWaalsContact O-CG2 3.25Å; V58-I61 WeakPolarHBondContact O-CG2 3.34Å; I61-A63 VanDerWaalsContact C-N 3.34Å; I61-A63 PolarHBondContact O-N 2.98Å; I61-L64 PolarHBondContact O-N 3.38Å; I61-L64 VanDerWaalsContact O-N 3.17Å; I61-Q65 PolarHBondContact O-N 3.34Å; I61-L68 HydrophobicContact CD1-CD1 4.18Å; I61-I79 HydrophobicContact CD1-CG2 4.1Å; I61-A93 HydrophobicContact CG1-CB 4.31Å; I61-A93 HydrophobicContact CG2-CB 4.34Å; I61-C96 HydrophobicContact CG1-CB 4.17Å; I61-I97 HydrophobicContact CD1-CG2 3.88Å; I61-I97 HydrophobicContact CG1-CG2 4.33Å
62	K	91.3	Very high	89.8	Confident	134 Å²	134	62 Å²	62	58%	0.583	30%	0.296	S	S	*	.	H	α-helix	trans	-60.9	-41.8	173.8	-170	178.4	-174.2	173.1	0	112.1	V58 V60 L64 Q65 F92	V58-K62 WeakPolarHBondContact O-CB 3.25Å; V58-K62 PolarHBondContact O-N 3.17Å; V60-K62 VanDerWaalsContact C-N 3.26Å; V60-K62 PolarHBondContact O-N 3.11Å; K62-L64 VanDerWaalsContact C-N 3.34Å; K62-Q65 WeakPolarHBondContact O-CB 3.25Å; K62-F92 HydrophobicContact CB-CE1 4.33Å; K62-F92 HydrophobicContact CD-CZ 4.16Å; K62-F92 HydrophobicContact CG-CZ 4.44Å
63	A	88.9	Confident	90.1	Very high	37 Å²	37	53.3 Å²	53.3	31%	0.306	26%	0.258	S	S	.	.	H	α-helix	trans	-69.6	-32.8	175.8	0	0	0	0	0	112.4	F29 K59 V60 I61	F29-A63 HydrophobicContact CE2-CB 3.96Å; F29-A63 HydrophobicContact CZ-CB 3.82Å; K59-A63 PolarHBondContact O-N 3.19Å; K59-A63 VanDerWaalsContact O-N 3.17Å; V60-A63 WeakPolarHBondContact O-CB 3.47Å; V60-A63 PolarHBondContact O-N 3.21Å; I61-A63 VanDerWaalsContact C-N 3.34Å; I61-A63 PolarHBondContact O-N 2.98Å
64	L	90.3	Very high	90.3	Very high	1 Å²	1	52 Å²	52	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-77.5	-17.9	179.3	-67.3	-173.9	0	0	0	113.7	L32 L39 A44 I47 V60 I61 K62 K66 R67 L68	L32-L64 HydrophobicContact CD1-CD2 4.38Å; L32-L64 HydrophobicContact CD2-CD2 4.36Å; L39-L64 HydrophobicContact CD1-CD1 3.93Å; L39-L64 HydrophobicContact CD1-CD2 3.59Å; L39-L64 HydrophobicContact CD1-CG 4.34Å; A44-L64 HydrophobicContact CB-CD1 4.32Å; I47-L64 HydrophobicContact CG2-CD1 4.48Å; V60-L64 HydrophobicContact CG1-CD1 3.9Å; V60-L64 HydrophobicContact CG1-CG 4.15Å; V60-L64 WeakPolarHBondContact O-CG 3.5Å; V60-L64 PolarHBondContact O-N 2.91Å; I61-L64 PolarHBondContact O-N 3.38Å; I61-L64 VanDerWaalsContact O-N 3.17Å; K62-L64 VanDerWaalsContact C-N 3.34Å; L64-K66 VanDerWaalsContact C-N 3.27Å; L64-K66 PolarHBondContact O-N 3.28Å; L64-R67 CarbonylContact O-C 3.44Å; L64-R67 WeakPolarHBondContact O-CA 3.4Å; L64-R67 PolarHBondContact O-N 2.89Å; L64-L68 HydrophobicContact CB-CG 4.47Å; L64-L68 WeakPolarHBondContact O-CG 3.48Å; L64-L68 PolarHBondContact O-N 3.46Å
65	Q	89.7	Confident	90.6	Very high	69 Å²	69	53.5 Å²	53.5	32%	0.322	26%	0.257	S	S	.	.	G	3₁₀ helix	trans	-43.7	-47.3	-178	177.6	172.7	39	0	0	113.9	I61 K62 R67 C96	I61-Q65 PolarHBondContact O-N 3.34Å; K62-Q65 WeakPolarHBondContact O-CB 3.25Å; Q65-R67 VanDerWaalsContact C-N 3.34Å; Q65-C96 WeakPolarHBondContact CG-O 3.42Å; Q65-C96 PolarHBondContact NE2-O 3.11Å
66	K	86	Confident	90.9	Very high	174 Å²	174	49 Å²	49	76%	0.757	23%	0.228	S	C	*	.	G	3₁₀ helix	trans	-77	-20.3	179.6	-66.3	-173.8	179	-178.9	0	113.4	K3 L64	K3-K66 PolarHBondContact NZ-O 2.96Å; L64-K66 VanDerWaalsContact C-N 3.27Å; L64-K66 PolarHBondContact O-N 3.28Å
67	R	88.4	Confident	91.1	Very high	38 Å²	38	48 Å²	48	14%	0.143	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-97.4	-3.5	-176.7	-67.2	178.2	62.1	-167.9	-1.1	114	L32 S35 G37 Y38 L39 L64 Q65	L32-R67 PolarHBondContact O-NH1 3.28Å; S35-R67 VanDerWaalsContact O-CZ 3.29Å; S35-R67 PolarHBondContact O-NH1 3.49Å; S35-R67 PolarHBondContact O-NH2 3.09Å; S35-R67 VanDerWaalsContact O-NH2 3.16Å; S35-R67 PolarHBondContact OG-NH1 3.16Å; S35-R67 PolarHBondContact OG-NH2 3.32Å; G37-R67 PolarHBondContact O-NE 3.46Å; G37-R67 PolarHBondContact O-NH2 3.29Å; G37-R67 VanDerWaalsContact O-NH2 3.15Å; Y38-R67 CarbonylContact C-O 3.49Å; Y38-R67 WeakPolarHBondContact CA-O 3.33Å; Y38-R67 WeakPolarHBondContact CB-O 3.46Å; Y38-R67 WeakPolarHBondContact CD1-O 3.31Å; L39-R67 PolarHBondContact N-O 3.37Å; L64-R67 CarbonylContact O-C 3.44Å; L64-R67 WeakPolarHBondContact O-CA 3.4Å; L64-R67 PolarHBondContact O-N 2.89Å; Q65-R67 VanDerWaalsContact C-N 3.34Å
68	L	90.3	Very high	91.1	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-75.6	133.1	175.6	-72	174.4	0	0	0	111.9	K3 A44 I61 L64 M71 I97 T100	K3-L68 WeakPolarHBondContact CD-O 3.46Å; K3-L68 PolarHBondContact NZ-O 2.92Å; A44-L68 HydrophobicContact CB-CD2 3.54Å; I61-L68 HydrophobicContact CD1-CD1 4.18Å; L64-L68 HydrophobicContact CB-CG 4.47Å; L64-L68 WeakPolarHBondContact O-CG 3.48Å; L64-L68 PolarHBondContact O-N 3.46Å; L68-M71 HydrophobicContact CB-CE 4.13Å; L68-M71 HydrophobicContact CD1-CE 4.07Å; L68-M71 HydrophobicContact CD2-CE 3.87Å; L68-M71 HydrophobicContact CG-CE 4.23Å; L68-I97 HydrophobicContact CD1-CB 4.37Å; L68-I97 HydrophobicContact CD1-CG2 3.59Å; L68-T100 HydrophobicContact CB-CG2 3.84Å
69	C	90	Very high	91.2	Very high	8 Å²	8	48.1 Å²	48.1	5%	0.054	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-69.8	165.9	166.2	-70.9	0	0	0	0	110.8	Y38 L39 T100	Y38-C69 VanDerWaalsContact CB-SG 3.5Å; L39-C69 PolarHBondContact O-N 3.25Å; C69-T100 WeakPolarHBondContact O-CB 3.28Å
70	R	89.6	Confident	91.3	Very high	204 Å²	204	42.4 Å²	42.4	77%	0.77	20%	0.201	S	C	*	.	P	Polyproline II helix	trans	-63.8	138.1	168.3	-67.9	-173.9	170.4	-176.9	-4.7	109	T100 I102	R70-T100 CarbonylContact C-O 3.57Å; R70-T100 VanDerWaalsContact CA-O 3.29Å; R70-T100 WeakPolarHBondContact CA-O 3.48Å; R70-I102 HydrophobicContact CB-CD1 3.77Å; R70-I102 HydrophobicContact CB-CG1 3.84Å
71	M	91	Very high	91.2	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.01	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-140.4	162.1	-175.3	67.4	-177.8	72.9	0	0	111.2	L68 E75 A76 I79 T100 L101 I102	L68-M71 HydrophobicContact CB-CE 4.13Å; L68-M71 HydrophobicContact CD1-CE 4.07Å; L68-M71 HydrophobicContact CD2-CE 3.87Å; L68-M71 HydrophobicContact CG-CE 4.23Å; M71-E75 HydrophobicContact CB-CB 4.16Å; M71-E75 WeakPolarHBondContact CB-OE2 3.35Å; M71-A76 HydrophobicContact SD-CB 4.07Å; M71-I79 HydrophobicContact CE-CD1 3.93Å; M71-I79 HydrophobicContact SD-CD1 3.79Å; M71-T100 PolarHBondContact N-O 3.01Å; M71-L101 HydrophobicContact CG-CD2 4.07Å; M71-L101 WeakPolarHBondContact O-CA 3.36Å; M71-I102 WeakPolarHBondContact O-CG1 3.47Å; M71-I102 PolarHBondContact O-N 3.23Å
72	T	92.7	Very high	91.1	Very high	52 Å²	52	47.1 Å²	47.1	32%	0.319	23%	0.227	S	C	.	.			trans	-82.1	160.6	171.7	60.6	0	0	0	0	110.7	A74 E75 A76 D103	T72-A74 PolarHBondContact O-N 3.38Å; T72-E75 PolarHBondContact O-N 3.04Å; T72-E75 VanDerWaalsContact O-N 3.15Å; T72-E75 PolarHBondContact OG1-N 3.17Å; T72-A76 PolarHBondContact O-N 2.89Å; T72-D103 WeakPolarHBondContact CA-OD1 3.38Å
73	C	93.1	Very high	90.8	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.5	-34.3	174.3	-72.7	0	0	0	0	110.4	A76 T77 D103 G109 I113	C73-A76 WeakPolarHBondContact O-CB 3.43Å; C73-A76 PolarHBondContact O-N 3.44Å; C73-T77 WeakPolarHBondContact O-CG2 3.43Å; C73-T77 PolarHBondContact O-N 3.05Å; C73-D103 WeakPolarHBondContact CB-OD1 3.47Å; C73-D103 PolarHBondContact N-OD1 3.46Å; C73-D103 PolarHBondContact N-OD2 2.82Å; C73-D103 PolarHBondContact SG-OD1 3.49Å; C73-G109 VanDerWaalsContact CB-O 3.3Å; C73-G109 WeakPolarHBondContact CB-O 3.48Å; C73-I113 HydrophobicContact CB-CD1 4.09Å; C73-I113 HydrophobicContact CB-CG1 3.98Å
74	A	93.2	Very high	89.9	Confident	31 Å²	31	46 Å²	46	26%	0.256	22%	0.217	S	C	.	.	H	α-helix	trans	-58.3	-48.7	172.1	0	0	0	0	0	112.1	T72 A76 T77 Y112	T72-A74 PolarHBondContact O-N 3.38Å; A74-A76 VanDerWaalsContact C-N 3.31Å; A74-A76 PolarHBondContact O-N 3.21Å; A74-T77 PolarHBondContact O-N 3.45Å; A74-T77 PolarHBondContact O-OG1 3.21Å; A74-Y112 HydrophobicContact CB-CD1 4.29Å; A74-Y112 HydrophobicContact CB-CD2 4.32Å; A74-Y112 HydrophobicContact CB-CE1 4.35Å; A74-Y112 HydrophobicContact CB-CE2 4.39Å; A74-Y112 HydrophobicContact CB-CG 4.3Å
75	E	93.1	Very high	89	Confident	48 Å²	48	49.4 Å²	49.4	22%	0.224	24%	0.242	C	C	.	.	H	α-helix	trans	-64.2	-36.8	175.1	-72.1	-179.1	-171.1	0	0	112.3	R42 M71 T72 T77 E78	R42-E75 HydrophobicContact CG-CG 4.46Å; M71-E75 HydrophobicContact CB-CB 4.16Å; M71-E75 WeakPolarHBondContact CB-OE2 3.35Å; T72-E75 PolarHBondContact O-N 3.04Å; T72-E75 VanDerWaalsContact O-N 3.15Å; T72-E75 PolarHBondContact OG1-N 3.17Å; E75-T77 VanDerWaalsContact C-N 3.27Å; E75-T77 PolarHBondContact O-N 3.3Å; E75-E78 WeakPolarHBondContact O-CB 3.09Å; E75-E78 PolarHBondContact O-N 3.33Å; E75-E78 VanDerWaalsContact O-N 3.13Å
76	A	93.4	Very high	88.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.8	-34	176.1	0	0	0	0	0	112.4	M71 T72 C73 A74 E78 I79 L80 I97 L101 I113	M71-A76 HydrophobicContact SD-CB 4.07Å; T72-A76 PolarHBondContact O-N 2.89Å; C73-A76 WeakPolarHBondContact O-CB 3.43Å; C73-A76 PolarHBondContact O-N 3.44Å; A74-A76 VanDerWaalsContact C-N 3.31Å; A74-A76 PolarHBondContact O-N 3.21Å; A76-E78 PolarHBondContact O-N 2.84Å; A76-I79 WeakPolarHBondContact O-CB 3.48Å; A76-I79 PolarHBondContact O-N 3.16Å; A76-I79 VanDerWaalsContact O-N 3.16Å; A76-L80 WeakPolarHBondContact O-CG 3.43Å; A76-L80 PolarHBondContact O-N 3.15Å; A76-I97 HydrophobicContact CB-CD1 3.79Å; A76-L101 HydrophobicContact CB-CD2 3.42Å; A76-L101 VanDerWaalsContact CB-CD2 3.42Å; A76-I113 HydrophobicContact CB-CD1 3.95Å
77	T	92.9	Very high	88.6	Confident	21 Å²	21	42.5 Å²	42.5	13%	0.129	22%	0.218	C	C	.	.	H	α-helix	trans	-62.1	-33.2	174.1	65.6	0	0	0	0	112.7	C73 A74 E75 I79 L80 N81 Y112	C73-T77 WeakPolarHBondContact O-CG2 3.43Å; C73-T77 PolarHBondContact O-N 3.05Å; A74-T77 PolarHBondContact O-N 3.45Å; A74-T77 PolarHBondContact O-OG1 3.21Å; E75-T77 VanDerWaalsContact C-N 3.27Å; E75-T77 PolarHBondContact O-N 3.3Å; T77-I79 VanDerWaalsContact C-N 3.31Å; T77-I79 PolarHBondContact O-N 3.01Å; T77-L80 PolarHBondContact O-N 2.96Å; T77-N81 VanDerWaalsContact O-CB 3.27Å; T77-N81 WeakPolarHBondContact O-CB 3.36Å; T77-N81 PolarHBondContact O-N 3.29Å; T77-N81 PolarHBondContact O-ND2 3.06Å; T77-N81 VanDerWaalsContact O-ND2 3.16Å; T77-Y112 WeakPolarHBondContact CG2-O 3.26Å
78	E	92.6	Very high	88.6	Confident	70 Å²	70	49 Å²	49	33%	0.327	24%	0.243	S	C	.	.	H	α-helix	trans	-62.3	-41.3	175.8	-58.9	-178.7	-162.2	0	0	110.7	R42 A45 E75 A76 N81 V82	R42-E78 WeakPolarHBondContact CG-OE2 3.42Å; R42-E78 IonicContact NE-OE1 2.85Å; R42-E78 PolarHBondContact NE-OE1 2.93Å; A45-E78 HydrophobicContact CB-CB 4.3Å; E75-E78 WeakPolarHBondContact O-CB 3.09Å; E75-E78 PolarHBondContact O-N 3.33Å; E75-E78 VanDerWaalsContact O-N 3.13Å; A76-E78 PolarHBondContact O-N 2.84Å; E78-N81 PolarHBondContact O-N 3.35Å; E78-V82 WeakPolarHBondContact O-CG2 3.32Å; E78-V82 PolarHBondContact O-N 3.07Å
79	I	93.2	Very high	88.6	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.4	-48.5	174.9	-65.4	172.6	0	0	0	110.9	G41 A44 A45 L48 I61 M71 A76 T77 N81 V82 I97	G41-I79 WeakPolarHBondContact O-CG1 3.44Å; A44-I79 HydrophobicContact CB-CD1 4.12Å; A44-I79 HydrophobicContact CB-CG1 4.48Å; A45-I79 HydrophobicContact CB-CG1 4.1Å; L48-I79 HydrophobicContact CD1-CG2 3.74Å; I61-I79 HydrophobicContact CD1-CG2 4.1Å; M71-I79 HydrophobicContact CE-CD1 3.93Å; M71-I79 HydrophobicContact SD-CD1 3.79Å; A76-I79 WeakPolarHBondContact O-CB 3.48Å; A76-I79 PolarHBondContact O-N 3.16Å; A76-I79 VanDerWaalsContact O-N 3.16Å; T77-I79 VanDerWaalsContact C-N 3.31Å; T77-I79 PolarHBondContact O-N 3.01Å; I79-N81 VanDerWaalsContact C-N 3.28Å; I79-N81 PolarHBondContact O-N 3.44Å; I79-V82 PolarHBondContact O-N 3.13Å; I79-I97 HydrophobicContact CD1-CG2 4.5Å
80	L	92.3	Very high	88.6	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-63.4	-36.1	-178.5	-64.9	176.6	0	0	0	111.8	A76 T77 V82 L83 R90 A93 L94 I97 I113 A116 F117	A76-L80 WeakPolarHBondContact O-CG 3.43Å; A76-L80 PolarHBondContact O-N 3.15Å; T77-L80 PolarHBondContact O-N 2.96Å; L80-V82 VanDerWaalsContact C-N 3.27Å; L80-V82 PolarHBondContact O-N 3.31Å; L80-L83 PolarHBondContact O-N 2.6Å; L80-L83 VanDerWaalsContact O-N 3.11Å; L80-R90 WeakPolarHBondContact CD2-O 3.44Å; L80-R90 PolarHBondContact O-NE 3.34Å; L80-A93 HydrophobicContact CD2-CB 4.03Å; L80-L94 HydrophobicContact CD1-CD1 4.49Å; L80-L94 HydrophobicContact CD2-CB 4.34Å; L80-I97 HydrophobicContact CD2-CD1 4.29Å; L80-I97 HydrophobicContact CG-CD1 4.39Å; L80-I113 HydrophobicContact CD1-CD1 4.21Å; L80-A116 HydrophobicContact CB-CB 4.02Å; L80-A116 HydrophobicContact CD1-CB 3.93Å; L80-F117 HydrophobicContact CD1-CE2 4.46Å
81	N	90.7	Very high	88.8	Confident	72 Å²	72	42.3 Å²	42.3	39%	0.385	22%	0.22	S	C	.	.	H	α-helix	trans	-71.2	-19.5	178.8	-74.1	-24.8	0	0	0	113.5	T77 E78 I79 L83 Q84	T77-N81 VanDerWaalsContact O-CB 3.27Å; T77-N81 WeakPolarHBondContact O-CB 3.36Å; T77-N81 PolarHBondContact O-N 3.29Å; T77-N81 PolarHBondContact O-ND2 3.06Å; T77-N81 VanDerWaalsContact O-ND2 3.16Å; E78-N81 PolarHBondContact O-N 3.35Å; I79-N81 VanDerWaalsContact C-N 3.28Å; I79-N81 PolarHBondContact O-N 3.44Å; N81-L83 VanDerWaalsContact C-N 3.33Å; N81-Q84 WeakPolarHBondContact O-CG 3.27Å; N81-Q84 PolarHBondContact O-NE2 3.29Å; N81-Q84 VanDerWaalsContact O-NE2 3.12Å
82	V	90.2	Very high	88.8	Confident	29 Å²	29	45 Å²	45	18%	0.176	23%	0.232	C	C	.	.	H	α-helix	trans	-75.7	-25.1	171.3	175.2	0	0	0	0	111.1	A45 L48 A49 R57 E78 I79 L80 Q84	A45-V82 HydrophobicContact CB-CG2 4.22Å; L48-V82 HydrophobicContact CB-CG1 3.73Å; A49-V82 HydrophobicContact CB-CG1 4.4Å; R57-V82 PolarHBondContact NH1-O 3.35Å; E78-V82 WeakPolarHBondContact O-CG2 3.32Å; E78-V82 PolarHBondContact O-N 3.07Å; I79-V82 PolarHBondContact O-N 3.13Å; L80-V82 VanDerWaalsContact C-N 3.27Å; L80-V82 PolarHBondContact O-N 3.31Å; V82-Q84 PolarHBondContact O-N 3.45Å
83	L	85.5	Confident	88.7	Confident	4 Å²	4	42.6 Å²	42.6	2%	0.021	22%	0.217	C	C	.	.			trans	-88.7	71.5	175.6	-64.3	162.2	0	0	0	109.7	R57 V58 L80 N81 R90 A93	R57-L83 HydrophobicContact CB-CD2 3.48Å; R57-L83 VanDerWaalsContact CB-CD2 3.48Å; V58-L83 HydrophobicContact CG2-CD2 4.45Å; L80-L83 PolarHBondContact O-N 2.6Å; L80-L83 VanDerWaalsContact O-N 3.11Å; N81-L83 VanDerWaalsContact C-N 3.33Å; L83-R90 HydrophobicContact CB-CG 4.21Å; L83-R90 VanDerWaalsContact O-CG 3.25Å; L83-R90 WeakPolarHBondContact O-CG 3.35Å; L83-R90 PolarHBondContact O-NE 3.04Å; L83-A93 HydrophobicContact CD1-CB 3.11Å
84	Q	70.7	Confident	88.7	Confident	142 Å²	142	42.6 Å²	42.6	66%	0.664	22%	0.217	S	C	*	.			trans	-82.1	-12.6	-174	-62.1	-173.6	-10	0	0	115	N81 V82	N81-Q84 WeakPolarHBondContact O-CG 3.27Å; N81-Q84 PolarHBondContact O-NE2 3.29Å; N81-Q84 VanDerWaalsContact O-NE2 3.12Å; V82-Q84 PolarHBondContact O-N 3.45Å
85	S	70.4	Confident	88.6	Confident	74 Å²	74	44.1 Å²	44.1	52%	0.517	22%	0.22	S	C	.	.	S	Bend	trans	-77.5	-44.1	-162.9	-55.4	0	0	0	0	114	A54	A54-S85 WeakPolarHBondContact CB-OG 3.47Å
86	T	82.6	Confident	88.5	Confident	63 Å²	63	42.1 Å²	42.1	39%	0.387	21%	0.212	S	C	.	.			trans	-140.4	145.3	177.5	76.3	0	0	0	0	111.2	Y88 D89 R90	T86-Y88 PolarHBondContact O-N 2.84Å; T86-D89 PolarHBondContact O-N 3.29Å; T86-D89 WeakPolarHBondContact OG1-CB 3.45Å; T86-D89 PolarHBondContact OG1-N 3.49Å; T86-D89 PolarHBondContact OG1-OD1 3.3Å; T86-D89 PolarHBondContact OG1-OD2 3.19Å; T86-R90 PolarHBondContact O-N 3.39Å
87	N	84.9	Confident	88.4	Confident	35 Å²	35	42.1 Å²	42.1	19%	0.187	21%	0.212	C	C	.	.	H	α-helix	trans	-65	-27.5	173.7	-67.2	-50.2	0	0	0	112	R90 L91 Y119 D122	N87-R90 WeakPolarHBondContact O-CB 3.4Å; N87-R90 PolarHBondContact O-N 2.99Å; N87-L91 WeakPolarHBondContact O-CG 3.41Å; N87-L91 PolarHBondContact O-N 3.02Å; N87-Y119 WeakPolarHBondContact ND2-CD2 3.4Å; N87-Y119 WeakPolarHBondContact ND2-CE2 3.44Å; N87-D122 WeakPolarHBondContact CB-OD2 3.31Å; N87-D122 PolarHBondContact ND2-OD2 3.46Å
88	Y	88.3	Confident	88.2	Confident	173 Å²	173	42.5 Å²	42.5	68%	0.678	21%	0.212	S	C	*	.	H	α-helix	trans	-61.8	-44.4	174	-178.7	-97.8	0	0	0	111.7	T86 R90 L91 F92	T86-Y88 PolarHBondContact O-N 2.84Å; Y88-R90 VanDerWaalsContact C-N 3.28Å; Y88-R90 PolarHBondContact O-N 3.16Å; Y88-L91 PolarHBondContact O-N 3.4Å; Y88-F92 PolarHBondContact O-N 2.87Å
89	D	89.8	Confident	88	Confident	25 Å²	25	45.1 Å²	45.1	13%	0.134	22%	0.224	C	C	.	.	H	α-helix	trans	-64.1	-34.6	176.9	-62.4	-32.6	0	0	0	111.8	V58 T86 F92 A93	V58-D89 HydrophobicContact CG2-CB 3.8Å; T86-D89 PolarHBondContact O-N 3.29Å; T86-D89 WeakPolarHBondContact OG1-CB 3.45Å; T86-D89 PolarHBondContact OG1-N 3.49Å; T86-D89 PolarHBondContact OG1-OD1 3.3Å; T86-D89 PolarHBondContact OG1-OD2 3.19Å; D89-F92 PolarHBondContact O-N 3.39Å; D89-A93 WeakPolarHBondContact O-CB 3.46Å; D89-A93 PolarHBondContact O-N 3.49Å
90	R	91.2	Very high	87.7	Confident	31 Å²	31	45.7 Å²	45.7	12%	0.117	23%	0.227	C	C	.	.	H	α-helix	trans	-65.9	-43.6	173.5	-68.4	-176.6	-178.8	169.6	2.4	112.1	L80 L83 T86 N87 Y88 F92 A93 L94 A116 F117	L80-R90 WeakPolarHBondContact CD2-O 3.44Å; L80-R90 PolarHBondContact O-NE 3.34Å; L83-R90 HydrophobicContact CB-CG 4.21Å; L83-R90 VanDerWaalsContact O-CG 3.25Å; L83-R90 WeakPolarHBondContact O-CG 3.35Å; L83-R90 PolarHBondContact O-NE 3.04Å; T86-R90 PolarHBondContact O-N 3.39Å; N87-R90 WeakPolarHBondContact O-CB 3.4Å; N87-R90 PolarHBondContact O-N 2.99Å; Y88-R90 VanDerWaalsContact C-N 3.28Å; Y88-R90 PolarHBondContact O-N 3.16Å; R90-F92 VanDerWaalsContact C-N 3.33Å; R90-A93 PolarHBondContact O-N 3.44Å; R90-L94 WeakPolarHBondContact O-CB 3.39Å; R90-L94 PolarHBondContact O-N 2.86Å; R90-A116 PolarHBondContact NH1-O 3.16Å; R90-F117 HydrophobicContact CB-CD1 4.45Å; R90-F117 HydrophobicContact CB-CE1 3.59Å; R90-F117 HydrophobicContact CB-CZ 4.04Å
91	L	92.3	Very high	87.6	Confident	17 Å²	17	46.2 Å²	46.2	9%	0.089	23%	0.23	C	C	.	.	H	α-helix	trans	-62.8	-42.2	175.2	-72.1	172.7	0	0	0	111.3	N87 Y88 L94 D95 F117 D122 K125 A126 I129	N87-L91 WeakPolarHBondContact O-CG 3.41Å; N87-L91 PolarHBondContact O-N 3.02Å; Y88-L91 PolarHBondContact O-N 3.4Å; L91-L94 WeakPolarHBondContact O-CB 3.4Å; L91-L94 PolarHBondContact O-N 3.45Å; L91-D95 PolarHBondContact O-N 2.99Å; L91-F117 HydrophobicContact CD2-CD1 4.44Å; L91-F117 HydrophobicContact CD2-CE1 3.66Å; L91-F117 HydrophobicContact CD2-CZ 3.83Å; L91-F117 HydrophobicContact CG-CE1 3.82Å; L91-F117 HydrophobicContact CG-CZ 4.36Å; L91-D122 HydrophobicContact CD1-CB 4.44Å; L91-K125 HydrophobicContact CD1-CB 4.12Å; L91-K125 HydrophobicContact CD1-CD 3.8Å; L91-K125 HydrophobicContact CD2-CB 3.95Å; L91-A126 HydrophobicContact CD2-CB 4.16Å; L91-I129 HydrophobicContact CB-CD1 4.44Å; L91-I129 HydrophobicContact CD2-CD1 4.13Å
92	F	91.2	Very high	87.5	Confident	59 Å²	59	48 Å²	48	26%	0.259	24%	0.238	S	C	.	.	H	α-helix	trans	-63.3	-41.8	176	-178.8	-92.6	0	0	0	112.2	V58 K62 Y88 D89 R90 D95 C96	V58-F92 HydrophobicContact CG1-CD1 3.62Å; V58-F92 HydrophobicContact CG1-CE1 3.62Å; V58-F92 HydrophobicContact CG1-CG 4.49Å; K62-F92 HydrophobicContact CB-CE1 4.33Å; K62-F92 HydrophobicContact CD-CZ 4.16Å; K62-F92 HydrophobicContact CG-CZ 4.44Å; Y88-F92 PolarHBondContact O-N 2.87Å; D89-F92 PolarHBondContact O-N 3.39Å; R90-F92 VanDerWaalsContact C-N 3.33Å; F92-D95 PolarHBondContact O-N 3.28Å; F92-C96 PolarHBondContact O-N 3.44Å; F92-C96 VanDerWaalsContact O-N 3.09Å; F92-C96 PolarHBondContact O-SG 3Å
93	A	92.3	Very high	87.3	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-67.7	-37.5	175.8	0	0	0	0	0	112.4	I61 L80 L83 D89 R90 D95 C96 I97	I61-A93 HydrophobicContact CG1-CB 4.31Å; I61-A93 HydrophobicContact CG2-CB 4.34Å; L80-A93 HydrophobicContact CD2-CB 4.03Å; L83-A93 HydrophobicContact CD1-CB 3.11Å; D89-A93 WeakPolarHBondContact O-CB 3.46Å; D89-A93 PolarHBondContact O-N 3.49Å; R90-A93 PolarHBondContact O-N 3.44Å; A93-D95 VanDerWaalsContact C-N 3.29Å; A93-D95 PolarHBondContact O-N 2.86Å; A93-C96 WeakPolarHBondContact O-CB 3.31Å; A93-C96 PolarHBondContact O-N 3.44Å; A93-C96 VanDerWaalsContact O-N 3.11Å; A93-I97 WeakPolarHBondContact O-CG1 3.43Å; A93-I97 PolarHBondContact O-N 2.96Å
94	L	92.9	Very high	87.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.4	-45.7	171.8	-176.5	62.8	0	0	0	110.3	L80 R90 L91 C96 I97 K98 L101 I113 F117 A126 I129 L130	L80-L94 HydrophobicContact CD1-CD1 4.49Å; L80-L94 HydrophobicContact CD2-CB 4.34Å; R90-L94 WeakPolarHBondContact O-CB 3.39Å; R90-L94 PolarHBondContact O-N 2.86Å; L91-L94 WeakPolarHBondContact O-CB 3.4Å; L91-L94 PolarHBondContact O-N 3.45Å; L94-C96 VanDerWaalsContact C-N 3.25Å; L94-C96 PolarHBondContact O-N 3.31Å; L94-I97 HydrophobicContact CD1-CG1 4.38Å; L94-I97 PolarHBondContact O-N 3.32Å; L94-K98 VanDerWaalsContact O-CB 3.31Å; L94-K98 WeakPolarHBondContact O-CB 3.26Å; L94-K98 PolarHBondContact O-N 3.18Å; L94-L101 HydrophobicContact CD1-CD1 4.34Å; L94-I113 HydrophobicContact CD1-CD1 4.33Å; L94-I113 HydrophobicContact CD1-CG2 4.02Å; L94-I113 HydrophobicContact CD2-CG2 4.05Å; L94-F117 HydrophobicContact CD2-CE2 4.28Å; L94-F117 HydrophobicContact CD2-CZ 4.31Å; L94-A126 HydrophobicContact CD2-CB 3.64Å; L94-I129 HydrophobicContact CD2-CB 4.31Å; L94-I129 HydrophobicContact CD2-CD1 4.44Å; L94-I129 HydrophobicContact CD2-CG2 4.3Å; L94-I129 HydrophobicContact CG-CG2 4.1Å; L94-L130 HydrophobicContact CD1-CD2 4.16Å
95	D	91.1	Very high	87.8	Confident	63 Å²	63	46.8 Å²	46.8	34%	0.337	23%	0.232	S	C	.	.	H	α-helix	trans	-61.4	-32.7	176.5	-167	58.9	0	0	0	113	L91 F92 A93 K98 I129	L91-D95 PolarHBondContact O-N 2.99Å; F92-D95 PolarHBondContact O-N 3.28Å; A93-D95 VanDerWaalsContact C-N 3.29Å; A93-D95 PolarHBondContact O-N 2.86Å; D95-K98 WeakPolarHBondContact O-CG 3.5Å; D95-K98 WeakPolarHBondContact OD1-CD 3.39Å; D95-K98 VanDerWaalsContact OD1-CE 3.28Å; D95-K98 WeakPolarHBondContact OD1-CE 3.41Å; D95-K98 IonicContact OD1-NZ 3.47Å; D95-K98 PolarHBondContact OD1-NZ 3.3Å; D95-I129 HydrophobicContact CB-CG2 4.42Å
96	C	90.1	Very high	88.6	Confident	6 Å²	6	46.3 Å²	46.3	4%	0.041	23%	0.226	C	C	.	.	H	α-helix	trans	-70.2	-41.8	174.7	-67.4	0	0	0	0	112.6	I61 Q65 F92 A93 L94	I61-C96 HydrophobicContact CG1-CB 4.17Å; Q65-C96 WeakPolarHBondContact CG-O 3.42Å; Q65-C96 PolarHBondContact NE2-O 3.11Å; F92-C96 PolarHBondContact O-N 3.44Å; F92-C96 VanDerWaalsContact O-N 3.09Å; F92-C96 PolarHBondContact O-SG 3Å; A93-C96 WeakPolarHBondContact O-CB 3.31Å; A93-C96 PolarHBondContact O-N 3.44Å; A93-C96 VanDerWaalsContact O-N 3.11Å; L94-C96 VanDerWaalsContact C-N 3.25Å; L94-C96 PolarHBondContact O-N 3.31Å
97	I	91.8	Very high	88.9	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-91	-11.8	-174.1	70.7	-171.8	0	0	0	113.5	I61 L68 A76 I79 L80 A93 L94 H99 T100	I61-I97 HydrophobicContact CD1-CG2 3.88Å; I61-I97 HydrophobicContact CG1-CG2 4.33Å; L68-I97 HydrophobicContact CD1-CB 4.37Å; L68-I97 HydrophobicContact CD1-CG2 3.59Å; A76-I97 HydrophobicContact CB-CD1 3.79Å; I79-I97 HydrophobicContact CD1-CG2 4.5Å; L80-I97 HydrophobicContact CD2-CD1 4.29Å; L80-I97 HydrophobicContact CG-CD1 4.39Å; A93-I97 WeakPolarHBondContact O-CG1 3.43Å; A93-I97 PolarHBondContact O-N 2.96Å; L94-I97 HydrophobicContact CD1-CG1 4.38Å; L94-I97 PolarHBondContact O-N 3.32Å; I97-H99 VanDerWaalsContact C-N 3.26Å; I97-H99 PolarHBondContact O-N 2.95Å; I97-T100 WeakPolarHBondContact O-CB 3.43Å; I97-T100 PolarHBondContact O-N 3.26Å; I97-T100 PolarHBondContact O-OG1 3.34Å
98	K	89.3	Confident	89.2	Confident	29 Å²	29	51.3 Å²	51.3	13%	0.126	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-49.4	-42.2	-171.5	76.4	-178.3	176.1	-176.2	0	114	L94 D95 T100 L101 I129 T132 V133	L94-K98 VanDerWaalsContact O-CB 3.31Å; L94-K98 WeakPolarHBondContact O-CB 3.26Å; L94-K98 PolarHBondContact O-N 3.18Å; D95-K98 WeakPolarHBondContact O-CG 3.5Å; D95-K98 WeakPolarHBondContact OD1-CD 3.39Å; D95-K98 VanDerWaalsContact OD1-CE 3.28Å; D95-K98 WeakPolarHBondContact OD1-CE 3.41Å; D95-K98 IonicContact OD1-NZ 3.47Å; D95-K98 PolarHBondContact OD1-NZ 3.3Å; K98-T100 PolarHBondContact O-N 3.47Å; K98-L101 PolarHBondContact O-N 2.9Å; K98-I129 HydrophobicContact CB-CG2 4.3Å; K98-I129 HydrophobicContact CD-CG2 3.86Å; K98-T132 PolarHBondContact NZ-OG1 2.79Å; K98-V133 HydrophobicContact CB-CG2 3.4Å; K98-V133 HydrophobicContact CD-CG2 3.7Å; K98-V133 HydrophobicContact CG-CG2 3.45Å; K98-V133 VanDerWaalsContact CG-CG2 3.45Å
99	H	86.5	Confident	89.3	Confident	126 Å²	126	43.1 Å²	43.1	58%	0.583	22%	0.222	S	C	*	.	G	3₁₀ helix	trans	-73.3	-5.9	-179.3	-62.3	-59.7	0	0	0	114.8	I97	I97-H99 VanDerWaalsContact C-N 3.26Å; I97-H99 PolarHBondContact O-N 2.95Å
100	T	88	Confident	89.3	Confident	12 Å²	12	44.2 Å²	44.2	7%	0.074	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-99.9	-10.6	178.2	62.4	0	0	0	0	113.5	L68 C69 R70 M71 I97 K98	L68-T100 HydrophobicContact CB-CG2 3.84Å; C69-T100 WeakPolarHBondContact O-CB 3.28Å; R70-T100 CarbonylContact C-O 3.57Å; R70-T100 VanDerWaalsContact CA-O 3.29Å; R70-T100 WeakPolarHBondContact CA-O 3.48Å; M71-T100 PolarHBondContact N-O 3.01Å; I97-T100 WeakPolarHBondContact O-CB 3.43Å; I97-T100 PolarHBondContact O-N 3.26Å; I97-T100 PolarHBondContact O-OG1 3.34Å; K98-T100 PolarHBondContact O-N 3.47Å
101	L	89.6	Confident	89.4	Confident	10 Å²	10	47.2 Å²	47.2	5%	0.052	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-76.7	128.5	-176.8	-56.2	180	0	0	0	111.6	M71 A76 L94 K98 H104 I113 L130	M71-L101 HydrophobicContact CG-CD2 4.07Å; M71-L101 WeakPolarHBondContact O-CA 3.36Å; A76-L101 HydrophobicContact CB-CD2 3.42Å; A76-L101 VanDerWaalsContact CB-CD2 3.42Å; L94-L101 HydrophobicContact CD1-CD1 4.34Å; K98-L101 PolarHBondContact O-N 2.9Å; L101-H104 HydrophobicContact CB-CB 3.91Å; L101-H104 HydrophobicContact CD1-CB 4.18Å; L101-H104 PolarHBondContact O-ND1 2.71Å; L101-I113 HydrophobicContact CD1-CD1 4.49Å; L101-L130 HydrophobicContact CD1-CD2 3.68Å
102	I	88.4	Confident	89.4	Confident	109 Å²	109	50.8 Å²	50.8	56%	0.559	26%	0.255	S	S	*	.	S	Bend	trans	-91.2	-36.3	-177.1	-54.4	167.9	0	0	0	111.8	R70 M71	R70-I102 HydrophobicContact CB-CD1 3.77Å; R70-I102 HydrophobicContact CB-CG1 3.84Å; M71-I102 WeakPolarHBondContact O-CG1 3.47Å; M71-I102 PolarHBondContact O-N 3.23Å
103	D	87.7	Confident	89.5	Confident	35 Å²	35	48 Å²	48	19%	0.187	24%	0.243	C	C	.	.	S	Bend	trans	-112.6	21.6	-169.4	59.6	-23.8	0	0	0	112.5	T72 C73 E105 T106	T72-D103 WeakPolarHBondContact CA-OD1 3.38Å; C73-D103 WeakPolarHBondContact CB-OD1 3.47Å; C73-D103 PolarHBondContact N-OD1 3.46Å; C73-D103 PolarHBondContact N-OD2 2.82Å; C73-D103 PolarHBondContact SG-OD1 3.49Å; D103-E105 PolarHBondContact O-N 3.36Å; D103-E105 VanDerWaalsContact O-N 3.1Å; D103-T106 HydrophobicContact CB-CG2 4.22Å; D103-T106 PolarHBondContact O-N 2.75Å; D103-T106 VanDerWaalsContact O-N 3.09Å; D103-T106 PolarHBondContact O-OG1 3.06Å
104	H	84.2	Confident	89.5	Confident	23 Å²	23	49.8 Å²	49.8	11%	0.106	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-13.7	-178.3	66.3	-80.7	0	0	0	114.9	L101 I110 L130	L101-H104 HydrophobicContact CB-CB 3.91Å; L101-H104 HydrophobicContact CD1-CB 4.18Å; L101-H104 PolarHBondContact O-ND1 2.71Å; H104-I110 VanDerWaalsContact O-CG1 3.22Å; H104-I110 WeakPolarHBondContact O-CG1 3.36Å; H104-L130 HydrophobicContact CB-CD2 4.11Å
105	E	81.1	Confident	89.4	Confident	93 Å²	93	57.7 Å²	57.7	44%	0.435	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-14.5	176.9	-60.4	-176.6	169.9	0	0	112.8	D103 Y136	D103-E105 PolarHBondContact O-N 3.36Å; D103-E105 VanDerWaalsContact O-N 3.1Å; E105-Y136 WeakPolarHBondContact OE1-CD2 3.44Å; E105-Y136 VanDerWaalsContact OE2-CE2 3.26Å; E105-Y136 WeakPolarHBondContact OE2-CE2 3.44Å
106	T	87.6	Confident	89.3	Confident	64 Å²	64	54.8 Å²	54.8	39%	0.393	27%	0.267	S	S	.	.	S	Bend	trans	-74.5	146	177.5	68.7	0	0	0	0	109.4	D103 D108 G109 I110	D103-T106 HydrophobicContact CB-CG2 4.22Å; D103-T106 PolarHBondContact O-N 2.75Å; D103-T106 VanDerWaalsContact O-N 3.09Å; D103-T106 PolarHBondContact O-OG1 3.06Å; T106-D108 PolarHBondContact O-N 3.01Å; T106-G109 PolarHBondContact O-N 2.89Å; T106-G109 VanDerWaalsContact O-N 3.15Å; T106-G109 PolarHBondContact OG1-N 2.91Å; T106-I110 WeakPolarHBondContact O-CG1 3.15Å; T106-I110 PolarHBondContact O-N 3.14Å
107	T	89	Confident	89.4	Confident	102 Å²	102	54.8 Å²	54.8	63%	0.626	27%	0.266	S	S	*	.	H	α-helix	trans	-54.3	-42.7	175.3	48.6	0	0	0	0	110.8	I110 E111	T107-I110 PolarHBondContact O-N 2.8Å; T107-E111 WeakPolarHBondContact O-CG 3.45Å; T107-E111 PolarHBondContact O-N 2.83Å
108	D	90.6	Very high	89.3	Confident	101 Å²	101	59.8 Å²	59.8	54%	0.54	30%	0.297	S	S	.	.	H	α-helix	trans	-63.2	-45.9	179.1	-60.3	-4.5	0	0	0	111.3	T106 E111 Y112	T106-D108 PolarHBondContact O-N 3.01Å; D108-E111 PolarHBondContact O-N 3.01Å; D108-Y112 WeakPolarHBondContact O-CD2 3.34Å; D108-Y112 PolarHBondContact O-N 3.45Å
109	G	90.2	Very high	89.4	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-64.4	-42.5	179.8	0	0	0	0	0	112.5	C73 T106 Y112 I113	C73-G109 VanDerWaalsContact CB-O 3.3Å; C73-G109 WeakPolarHBondContact CB-O 3.48Å; T106-G109 PolarHBondContact O-N 2.89Å; T106-G109 VanDerWaalsContact O-N 3.15Å; T106-G109 PolarHBondContact OG1-N 2.91Å; G109-Y112 PolarHBondContact O-N 3.12Å; G109-I113 PolarHBondContact O-N 2.74Å; G109-I113 VanDerWaalsContact O-N 3.15Å
110	I	91.3	Very high	89.6	Confident	49 Å²	49	65.2 Å²	65.2	25%	0.251	32%	0.318	S	S	.	.	H	α-helix	trans	-60.1	-48.3	173.7	-66.3	168.8	0	0	0	109.9	H104 T106 T107 Y112 I113 L114 L127	H104-I110 VanDerWaalsContact O-CG1 3.22Å; H104-I110 WeakPolarHBondContact O-CG1 3.36Å; T106-I110 WeakPolarHBondContact O-CG1 3.15Å; T106-I110 PolarHBondContact O-N 3.14Å; T107-I110 PolarHBondContact O-N 2.8Å; I110-Y112 VanDerWaalsContact C-N 3.32Å; I110-Y112 PolarHBondContact O-N 2.98Å; I110-I113 PolarHBondContact O-N 3.11Å; I110-L114 HydrophobicContact CG2-CD1 3.74Å; I110-L114 HydrophobicContact CG2-CG 4.05Å; I110-L114 WeakPolarHBondContact O-CB 3.44Å; I110-L114 VanDerWaalsContact O-CG 3.26Å; I110-L114 WeakPolarHBondContact O-CG 3.46Å; I110-L114 PolarHBondContact O-N 2.94Å; I110-L127 HydrophobicContact CG2-CD2 3.62Å
111	E	92.5	Very high	89.8	Confident	94 Å²	94	70.3 Å²	70.3	44%	0.439	34%	0.344	S	S	.	.	H	α-helix	trans	-57.9	-42.3	177.4	-78.8	-171.4	-163.7	0	0	112.7	T107 D108 I113 L114 R115	T107-E111 WeakPolarHBondContact O-CG 3.45Å; T107-E111 PolarHBondContact O-N 2.83Å; D108-E111 PolarHBondContact O-N 3.01Å; E111-I113 PolarHBondContact O-N 3.25Å; E111-L114 PolarHBondContact O-N 3.36Å; E111-R115 VanDerWaalsContact O-CG 3.26Å; E111-R115 WeakPolarHBondContact O-CG 3.26Å; E111-R115 PolarHBondContact O-N 3.48Å; E111-R115 IonicContact OE2-NH2 3.8Å; E111-R115 PolarHBondContact OE2-NH2 3.07Å
112	Y	93.3	Very high	89.8	Confident	91 Å²	91	70.9 Å²	70.9	36%	0.357	35%	0.346	S	S	.	.	H	α-helix	trans	-56.8	-51.1	175.7	-81.2	-65.4	0	0	0	111.1	A74 T77 D108 G109 I110 L114 R115	A74-Y112 HydrophobicContact CB-CD1 4.29Å; A74-Y112 HydrophobicContact CB-CD2 4.32Å; A74-Y112 HydrophobicContact CB-CE1 4.35Å; A74-Y112 HydrophobicContact CB-CE2 4.39Å; A74-Y112 HydrophobicContact CB-CG 4.3Å; T77-Y112 WeakPolarHBondContact CG2-O 3.26Å; D108-Y112 WeakPolarHBondContact O-CD2 3.34Å; D108-Y112 PolarHBondContact O-N 3.45Å; G109-Y112 PolarHBondContact O-N 3.12Å; I110-Y112 VanDerWaalsContact C-N 3.32Å; I110-Y112 PolarHBondContact O-N 2.98Å; Y112-L114 VanDerWaalsContact C-N 3.34Å; Y112-L114 PolarHBondContact O-N 3.29Å; Y112-R115 PolarHBondContact O-N 2.89Å
113	I	92.6	Very high	90.1	Very high	0 Å²	0	68 Å²	68	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-62.3	-42.7	178.7	-61.4	-59.6	0	0	0	111.3	C73 A76 L80 L94 L101 G109 I110 E111 R115 A116 F117 L130	C73-I113 HydrophobicContact CB-CD1 4.09Å; C73-I113 HydrophobicContact CB-CG1 3.98Å; A76-I113 HydrophobicContact CB-CD1 3.95Å; L80-I113 HydrophobicContact CD1-CD1 4.21Å; L94-I113 HydrophobicContact CD1-CD1 4.33Å; L94-I113 HydrophobicContact CD1-CG2 4.02Å; L94-I113 HydrophobicContact CD2-CG2 4.05Å; L101-I113 HydrophobicContact CD1-CD1 4.49Å; G109-I113 PolarHBondContact O-N 2.74Å; G109-I113 VanDerWaalsContact O-N 3.15Å; I110-I113 PolarHBondContact O-N 3.11Å; E111-I113 PolarHBondContact O-N 3.25Å; I113-R115 VanDerWaalsContact C-N 3.29Å; I113-R115 PolarHBondContact O-N 3.29Å; I113-A116 WeakPolarHBondContact O-CB 3.48Å; I113-A116 PolarHBondContact O-N 3.48Å; I113-A116 VanDerWaalsContact O-N 3.07Å; I113-F117 HydrophobicContact CG2-CE2 4.07Å; I113-F117 WeakPolarHBondContact O-CD2 3.37Å; I113-L130 HydrophobicContact CB-CD1 4.28Å; I113-L130 HydrophobicContact CG1-CD1 4.42Å; I113-L130 HydrophobicContact CG2-CD1 4.12Å
114	L	91.7	Very high	90.3	Very high	38 Å²	38	71.4 Å²	71.4	20%	0.199	35%	0.347	C	S	.	.	H	α-helix	trans	-64.7	-31.2	-179.8	-68.8	-177.3	0	0	0	113.1	I110 E111 Y112 A116 F117 K123 L127	I110-L114 HydrophobicContact CG2-CD1 3.74Å; I110-L114 HydrophobicContact CG2-CG 4.05Å; I110-L114 WeakPolarHBondContact O-CB 3.44Å; I110-L114 VanDerWaalsContact O-CG 3.26Å; I110-L114 WeakPolarHBondContact O-CG 3.46Å; I110-L114 PolarHBondContact O-N 2.94Å; E111-L114 PolarHBondContact O-N 3.36Å; Y112-L114 VanDerWaalsContact C-N 3.34Å; Y112-L114 PolarHBondContact O-N 3.29Å; L114-A116 PolarHBondContact O-N 2.95Å; L114-F117 PolarHBondContact O-N 3.23Å; L114-F117 VanDerWaalsContact O-N 3.11Å; L114-K123 HydrophobicContact CD2-CB 3.76Å; L114-K123 HydrophobicContact CD2-CD 4.48Å; L114-K123 HydrophobicContact CD2-CG 3.95Å; L114-L127 HydrophobicContact CD1-CD2 4.4Å; L114-L127 HydrophobicContact CD2-CD2 4.19Å; L114-L127 HydrophobicContact CD2-CG 4.09Å
115	R	91.6	Very high	90.7	Very high	167 Å²	167	74.9 Å²	74.9	63%	0.63	36%	0.362	S	S	*	.	H	α-helix	trans	-62.8	-22.5	173.9	-73.6	170.5	-166.7	177.8	8.5	112.9	E111 Y112 I113 F117	E111-R115 VanDerWaalsContact O-CG 3.26Å; E111-R115 WeakPolarHBondContact O-CG 3.26Å; E111-R115 PolarHBondContact O-N 3.48Å; E111-R115 IonicContact OE2-NH2 3.8Å; E111-R115 PolarHBondContact OE2-NH2 3.07Å; Y112-R115 PolarHBondContact O-N 2.89Å; I113-R115 VanDerWaalsContact C-N 3.29Å; I113-R115 PolarHBondContact O-N 3.29Å; R115-F117 VanDerWaalsContact C-N 3.27Å; R115-F117 PolarHBondContact O-N 3.43Å
116	A	89.6	Confident	91.2	Very high	2 Å²	2	70.4 Å²	70.4	2%	0.017	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-11	176.3	0	0	0	0	0	113.5	L80 R90 I113 L114	L80-A116 HydrophobicContact CB-CB 4.02Å; L80-A116 HydrophobicContact CD1-CB 3.93Å; R90-A116 PolarHBondContact NH1-O 3.16Å; I113-A116 WeakPolarHBondContact O-CB 3.48Å; I113-A116 PolarHBondContact O-N 3.48Å; I113-A116 VanDerWaalsContact O-N 3.07Å; L114-A116 PolarHBondContact O-N 2.95Å
117	F	91.3	Very high	91.3	Very high	5 Å²	5	70.5 Å²	70.5	2%	0.022	34%	0.339	C	S	.	.			trans	-115.6	129.7	-178.6	-63	-82.2	0	0	0	111.4	L80 R90 L91 L94 I113 L114 R115 D122 K123 A126	L80-F117 HydrophobicContact CD1-CE2 4.46Å; R90-F117 HydrophobicContact CB-CD1 4.45Å; R90-F117 HydrophobicContact CB-CE1 3.59Å; R90-F117 HydrophobicContact CB-CZ 4.04Å; L91-F117 HydrophobicContact CD2-CD1 4.44Å; L91-F117 HydrophobicContact CD2-CE1 3.66Å; L91-F117 HydrophobicContact CD2-CZ 3.83Å; L91-F117 HydrophobicContact CG-CE1 3.82Å; L91-F117 HydrophobicContact CG-CZ 4.36Å; L94-F117 HydrophobicContact CD2-CE2 4.28Å; L94-F117 HydrophobicContact CD2-CZ 4.31Å; I113-F117 HydrophobicContact CG2-CE2 4.07Å; I113-F117 WeakPolarHBondContact O-CD2 3.37Å; L114-F117 PolarHBondContact O-N 3.23Å; L114-F117 VanDerWaalsContact O-N 3.11Å; R115-F117 VanDerWaalsContact C-N 3.27Å; R115-F117 PolarHBondContact O-N 3.43Å; F117-D122 HydrophobicContact CB-CB 4.44Å; F117-D122 HydrophobicContact CD1-CB 3.93Å; F117-D122 HydrophobicContact CG-CB 4.47Å; F117-K123 HydrophobicContact CB-CG 3.85Å; F117-K123 WeakPolarHBondContact O-CE 2.97Å; F117-A126 HydrophobicContact CD2-CB 3.96Å; F117-A126 HydrophobicContact CE2-CB 3.62Å; F117-A126 HydrophobicContact CZ-CB 4.12Å
118	V	89	Confident	91.3	Very high	106 Å²	106	71.6 Å²	71.6	64%	0.642	34%	0.337	S	S	*	.			trans	-82.3	-41.9	-178.6	-177.7	0	0	0	0	111.4
119	Y	91	Very high	91.2	Very high	146 Å²	146	68.2 Å²	68.2	57%	0.573	32%	0.319	S	S	*	.	S	Bend	trans	-91.6	138.9	-174.6	-57.6	-66.1	0	0	0	112.5	N87 I121 D122 K123	N87-Y119 WeakPolarHBondContact ND2-CD2 3.4Å; N87-Y119 WeakPolarHBondContact ND2-CE2 3.44Å; Y119-I121 VanDerWaalsContact C-N 3.28Å; Y119-I121 PolarHBondContact O-N 3.15Å; Y119-D122 PolarHBondContact O-N 3.2Å; Y119-D122 VanDerWaalsContact O-N 3.13Å; Y119-K123 PolarHBondContact O-N 3.35Å
120	E	90.6	Very high	91.1	Very high	122 Å²	122	68.6 Å²	68.6	57%	0.57	32%	0.321	S	S	*	.	H	α-helix	trans	-60.2	-34.9	178.3	-66.3	-56.4	137.1	0	0	113.1	D122 K123 L124	E120-D122 VanDerWaalsContact C-N 3.3Å; E120-D122 PolarHBondContact O-N 3.47Å; E120-K123 WeakPolarHBondContact O-CB 3.35Å; E120-K123 PolarHBondContact O-N 3.33Å; E120-K123 IonicContact OE1-NZ 3.06Å; E120-K123 PolarHBondContact OE1-NZ 2.62Å; E120-L124 WeakPolarHBondContact O-CG 3.37Å; E120-L124 PolarHBondContact O-N 3.13Å
121	I	92.6	Very high	90.7	Very high	120 Å²	120	69.8 Å²	69.8	62%	0.615	33%	0.333	S	S	*	.	H	α-helix	trans	-62	-40.4	177.2	-60.3	170.1	0	0	0	111	Y119 L124 K125	Y119-I121 VanDerWaalsContact C-N 3.28Å; Y119-I121 PolarHBondContact O-N 3.15Å; I121-L124 PolarHBondContact O-N 3.22Å; I121-K125 WeakPolarHBondContact O-CG 3.41Å; I121-K125 PolarHBondContact O-N 3.43Å
122	D	90.8	Very high	90.1	Very high	21 Å²	21	68.9 Å²	68.9	11%	0.112	33%	0.334	C	S	.	.	H	α-helix	trans	-76.4	-33	-179.9	-64.5	-31.5	0	0	0	111.3	N87 L91 F117 Y119 E120 K125 A126	N87-D122 WeakPolarHBondContact CB-OD2 3.31Å; N87-D122 PolarHBondContact ND2-OD2 3.46Å; L91-D122 HydrophobicContact CD1-CB 4.44Å; F117-D122 HydrophobicContact CB-CB 4.44Å; F117-D122 HydrophobicContact CD1-CB 3.93Å; F117-D122 HydrophobicContact CG-CB 4.47Å; Y119-D122 PolarHBondContact O-N 3.2Å; Y119-D122 VanDerWaalsContact O-N 3.13Å; E120-D122 VanDerWaalsContact C-N 3.3Å; E120-D122 PolarHBondContact O-N 3.47Å; D122-K125 PolarHBondContact O-N 3.26Å; D122-A126 WeakPolarHBondContact O-CB 3.43Å; D122-A126 PolarHBondContact O-N 2.99Å
123	K	93.5	Very high	89.1	Confident	49 Å²	49	65.4 Å²	65.4	21%	0.213	32%	0.322	C	S	.	.	H	α-helix	trans	-58.3	-45.5	169.7	-72.4	-178.6	-170.5	170.8	0	111.8	L114 F117 Y119 E120 K125 A126 L127	L114-K123 HydrophobicContact CD2-CB 3.76Å; L114-K123 HydrophobicContact CD2-CD 4.48Å; L114-K123 HydrophobicContact CD2-CG 3.95Å; F117-K123 HydrophobicContact CB-CG 3.85Å; F117-K123 WeakPolarHBondContact O-CE 2.97Å; Y119-K123 PolarHBondContact O-N 3.35Å; E120-K123 WeakPolarHBondContact O-CB 3.35Å; E120-K123 PolarHBondContact O-N 3.33Å; E120-K123 IonicContact OE1-NZ 3.06Å; E120-K123 PolarHBondContact OE1-NZ 2.62Å; K123-K125 PolarHBondContact O-N 2.96Å; K123-A126 WeakPolarHBondContact O-CB 3.43Å; K123-A126 PolarHBondContact O-N 2.89Å; K123-L127 WeakPolarHBondContact O-CG 3.47Å; K123-L127 PolarHBondContact O-N 3.18Å
124	L	92.7	Very high	87.6	Confident	106 Å²	106	68.4 Å²	68.4	56%	0.555	34%	0.343	S	S	*	.	H	α-helix	trans	-62.1	-42.1	176.2	-70.4	174.5	0	0	0	112.1	E120 I121 A126 L127 Q128	E120-L124 WeakPolarHBondContact O-CG 3.37Å; E120-L124 PolarHBondContact O-N 3.13Å; I121-L124 PolarHBondContact O-N 3.22Å; L124-A126 VanDerWaalsContact C-N 3.35Å; L124-L127 PolarHBondContact O-N 2.96Å; L124-Q128 WeakPolarHBondContact O-CG 3.41Å; L124-Q128 PolarHBondContact O-N 3.24Å
125	K	92.1	Very high	85.5	Confident	96 Å²	96	74.2 Å²	74.2	42%	0.417	37%	0.372	S	S	.	.	H	α-helix	trans	-64.1	-39.6	174.4	-70.7	175.4	-176.6	171.2	0	112.1	L91 I121 D122 K123 L127 Q128 I129	L91-K125 HydrophobicContact CD1-CB 4.12Å; L91-K125 HydrophobicContact CD1-CD 3.8Å; L91-K125 HydrophobicContact CD2-CB 3.95Å; I121-K125 WeakPolarHBondContact O-CG 3.41Å; I121-K125 PolarHBondContact O-N 3.43Å; D122-K125 PolarHBondContact O-N 3.26Å; K123-K125 PolarHBondContact O-N 2.96Å; K125-L127 VanDerWaalsContact C-N 3.35Å; K125-Q128 WeakPolarHBondContact O-CB 3.43Å; K125-Q128 PolarHBondContact O-N 2.67Å; K125-I129 WeakPolarHBondContact O-CG1 3.1Å; K125-I129 PolarHBondContact O-N 3.38Å
126	A	91.7	Very high	83.3	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-61.7	-43.7	175.5	0	0	0	0	0	111.2	L91 L94 F117 D122 K123 L124 Q128 I129 L130	L91-A126 HydrophobicContact CD2-CB 4.16Å; L94-A126 HydrophobicContact CD2-CB 3.64Å; F117-A126 HydrophobicContact CD2-CB 3.96Å; F117-A126 HydrophobicContact CE2-CB 3.62Å; F117-A126 HydrophobicContact CZ-CB 4.12Å; D122-A126 WeakPolarHBondContact O-CB 3.43Å; D122-A126 PolarHBondContact O-N 2.99Å; K123-A126 WeakPolarHBondContact O-CB 3.43Å; K123-A126 PolarHBondContact O-N 2.89Å; L124-A126 VanDerWaalsContact C-N 3.35Å; A126-Q128 VanDerWaalsContact C-N 3.34Å; A126-Q128 PolarHBondContact O-N 3.28Å; A126-I129 PolarHBondContact O-N 2.95Å; A126-L130 WeakPolarHBondContact O-CG 3.48Å; A126-L130 PolarHBondContact O-N 3.22Å
127	L	90	Very high	81.2	Confident	65 Å²	65	79 Å²	79	34%	0.34	40%	0.402	S	S	.	.	H	α-helix	trans	-60.8	-41.8	173.9	-69.7	175.5	0	0	0	112.2	I110 L114 K123 L124 K125 I129 L130 S131	I110-L127 HydrophobicContact CG2-CD2 3.62Å; L114-L127 HydrophobicContact CD1-CD2 4.4Å; L114-L127 HydrophobicContact CD2-CD2 4.19Å; L114-L127 HydrophobicContact CD2-CG 4.09Å; K123-L127 WeakPolarHBondContact O-CG 3.47Å; K123-L127 PolarHBondContact O-N 3.18Å; L124-L127 PolarHBondContact O-N 2.96Å; K125-L127 VanDerWaalsContact C-N 3.35Å; L127-I129 VanDerWaalsContact C-N 3.33Å; L127-I129 PolarHBondContact O-N 3.15Å; L127-L130 PolarHBondContact O-N 3.26Å; L127-S131 WeakPolarHBondContact O-CB 3.48Å; L127-S131 PolarHBondContact O-N 3.39Å
128	Q	89.1	Confident	78.9	Confident	126 Å²	126	85 Å²	85	59%	0.589	43%	0.428	S	S	*	.	H	α-helix	trans	-58.7	-45.8	173.9	-72	174.1	-10	0	0	111	L124 K125 A126 L130 S131 T132	L124-Q128 WeakPolarHBondContact O-CG 3.41Å; L124-Q128 PolarHBondContact O-N 3.24Å; K125-Q128 WeakPolarHBondContact O-CB 3.43Å; K125-Q128 PolarHBondContact O-N 2.67Å; A126-Q128 VanDerWaalsContact C-N 3.34Å; A126-Q128 PolarHBondContact O-N 3.28Å; Q128-L130 PolarHBondContact O-N 3.5Å; Q128-S131 PolarHBondContact O-N 3.09Å; Q128-S131 PolarHBondContact O-OG 3.43Å; Q128-T132 VanDerWaalsContact O-CG2 3.31Å; Q128-T132 WeakPolarHBondContact O-CG2 3.16Å; Q128-T132 PolarHBondContact O-N 2.64Å
129	I	89.1	Confident	76.9	Confident	30 Å²	30	84.7 Å²	84.7	15%	0.154	42%	0.418	C	S	.	.	H	α-helix	trans	-61.8	-45.3	177	-65.7	165.8	0	0	0	111.1	L91 L94 D95 K98 K125 A126 L127 S131 T132	L91-I129 HydrophobicContact CB-CD1 4.44Å; L91-I129 HydrophobicContact CD2-CD1 4.13Å; L94-I129 HydrophobicContact CD2-CB 4.31Å; L94-I129 HydrophobicContact CD2-CD1 4.44Å; L94-I129 HydrophobicContact CD2-CG2 4.3Å; L94-I129 HydrophobicContact CG-CG2 4.1Å; D95-I129 HydrophobicContact CB-CG2 4.42Å; K98-I129 HydrophobicContact CB-CG2 4.3Å; K98-I129 HydrophobicContact CD-CG2 3.86Å; K125-I129 WeakPolarHBondContact O-CG1 3.1Å; K125-I129 PolarHBondContact O-N 3.38Å; A126-I129 PolarHBondContact O-N 2.95Å; L127-I129 VanDerWaalsContact C-N 3.33Å; L127-I129 PolarHBondContact O-N 3.15Å; I129-S131 VanDerWaalsContact C-N 3.31Å; I129-S131 PolarHBondContact O-N 2.83Å; I129-T132 WeakPolarHBondContact O-CB 3.3Å; I129-T132 PolarHBondContact O-N 3.07Å; I129-T132 VanDerWaalsContact O-N 3.09Å; I129-T132 PolarHBondContact O-OG1 2.63Å
130	L	86.3	Confident	75	Confident	7 Å²	7	81 Å²	81	4%	0.037	41%	0.406	C	S	.	.	H	α-helix	trans	-62.2	-39.5	177.6	-67.5	177.2	0	0	0	111.7	L94 L101 H104 I113 A126 L127 Q128 T132 V133	L94-L130 HydrophobicContact CD1-CD2 4.16Å; L101-L130 HydrophobicContact CD1-CD2 3.68Å; H104-L130 HydrophobicContact CB-CD2 4.11Å; I113-L130 HydrophobicContact CB-CD1 4.28Å; I113-L130 HydrophobicContact CG1-CD1 4.42Å; I113-L130 HydrophobicContact CG2-CD1 4.12Å; A126-L130 WeakPolarHBondContact O-CG 3.48Å; A126-L130 PolarHBondContact O-N 3.22Å; L127-L130 PolarHBondContact O-N 3.26Å; Q128-L130 PolarHBondContact O-N 3.5Å; L130-T132 PolarHBondContact O-N 2.89Å; L130-V133 PolarHBondContact O-N 2.93Å
131	S	83	Confident	73.1	Confident	74 Å²	74	76.5 Å²	76.5	52%	0.517	39%	0.385	S	S	.	.	H	α-helix	trans	-63.7	-21.5	175.9	76.8	0	0	0	0	113.3	L127 Q128 I129 V133 S134	L127-S131 WeakPolarHBondContact O-CB 3.48Å; L127-S131 PolarHBondContact O-N 3.39Å; Q128-S131 PolarHBondContact O-N 3.09Å; Q128-S131 PolarHBondContact O-OG 3.43Å; I129-S131 VanDerWaalsContact C-N 3.31Å; I129-S131 PolarHBondContact O-N 2.83Å; S131-V133 VanDerWaalsContact C-N 3.26Å; S131-V133 PolarHBondContact O-N 3.17Å; S131-S134 PolarHBondContact O-OG 3.18Å
132	T	80.6	Confident	71.1	Confident	75 Å²	75	74 Å²	74	46%	0.46	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-17.8	173.5	73.1	0	0	0	0	113.7	K98 Q128 I129 L130	K98-T132 PolarHBondContact NZ-OG1 2.79Å; Q128-T132 VanDerWaalsContact O-CG2 3.31Å; Q128-T132 WeakPolarHBondContact O-CG2 3.16Å; Q128-T132 PolarHBondContact O-N 2.64Å; I129-T132 WeakPolarHBondContact O-CB 3.3Å; I129-T132 PolarHBondContact O-N 3.07Å; I129-T132 VanDerWaalsContact O-N 3.09Å; I129-T132 PolarHBondContact O-OG1 2.63Å; L130-T132 PolarHBondContact O-N 2.89Å
133	V	71.3	Confident	69.1	Low	18 Å²	18	73.2 Å²	73.2	11%	0.109	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-20.1	-178.2	-174.7	0	0	0	0	112.4	K98 L130 S131 M135	K98-V133 HydrophobicContact CB-CG2 3.4Å; K98-V133 HydrophobicContact CD-CG2 3.7Å; K98-V133 HydrophobicContact CG-CG2 3.45Å; K98-V133 VanDerWaalsContact CG-CG2 3.45Å; L130-V133 PolarHBondContact O-N 2.93Å; S131-V133 VanDerWaalsContact C-N 3.26Å; S131-V133 PolarHBondContact O-N 3.17Å; V133-M135 PolarHBondContact O-N 2.84Å
134	S	61.2	Low	66.9	Low	63 Å²	63	72.7 Å²	72.7	44%	0.441	39%	0.388	S	S	.	.			trans	-63.6	79.5	-178.7	68.4	0	0	0	0	110.1	S131 Y136	S131-S134 PolarHBondContact O-OG 3.18Å; S134-Y136 VanDerWaalsContact C-N 3.34Å
135	M	47.5	Very low	64.7	Low	161 Å²	161	69.6 Å²	69.6	79%	0.793	38%	0.381	S	S	*	.			trans	-106.1	45.8	171.1	-64.6	-149.7	85.5	0	0	107.8	V133 V137	V133-M135 PolarHBondContact O-N 2.84Å; M135-V137 PolarHBondContact O-N 3.18Å
136	Y	46.6	Very low	62.2	Low	167 Å²	167	73.5 Å²	73.5	66%	0.655	40%	0.4	S	S	*	.			trans	-55.2	108.4	133.4	-80.1	-75.3	0	0	0	104.2	E105 S134 K138	E105-Y136 WeakPolarHBondContact OE1-CD2 3.44Å; E105-Y136 VanDerWaalsContact OE2-CE2 3.26Å; E105-Y136 WeakPolarHBondContact OE2-CE2 3.44Å; S134-Y136 VanDerWaalsContact C-N 3.34Å; Y136-K138 PolarHBondContact O-N 3.05Å
137	V	44.2	Very low	59.9	Low	103 Å²	103	81.3 Å²	81.3	62%	0.624	44%	0.437	S	S	*	.			trans	-41.7	90.5	132.5	176.4	0	0	0	0	102.3	M135 K139	M135-V137 PolarHBondContact O-N 3.18Å; V137-K139 VanDerWaalsContact C-N 3.28Å; V137-K139 PolarHBondContact O-N 2.59Å
138	K	44.1	Very low	57.6	Low	129 Å²	129	83.6 Å²	83.6	56%	0.561	45%	0.453	S	S	*	.			trans	-50.4	115.3	168.5	-89.5	-176.4	156.6	-142.5	0	100.4	Y136 E140	Y136-K138 PolarHBondContact O-N 3.05Å; K138-E140 HydrophobicContact CB-CB 4.01Å; K138-E140 HydrophobicContact CB-CG 4.25Å; K138-E140 WeakPolarHBondContact CD-OE2 3.01Å; K138-E140 WeakPolarHBondContact CE-OE2 3.44Å; K138-E140 IonicContact NZ-OE2 2.71Å; K138-E140 PolarHBondContact NZ-OE2 3.06Å; K138-E140 CarbonylContact O-C 3.44Å; K138-E140 PolarHBondContact O-N 2.59Å
139	K	48	Very low	55.4	Low	100 Å²	100	87.8 Å²	87.8	44%	0.435	47%	0.465	S	S	.	.	S	Bend	trans	-56.9	-19.2	176.8	-67	-178.6	-171.8	174.3	0	108.7	V137 L141 T188 A189 I191	V137-K139 VanDerWaalsContact C-N 3.28Å; V137-K139 PolarHBondContact O-N 2.59Å; K139-L141 PolarHBondContact O-N 3.29Å; K139-L141 VanDerWaalsContact O-N 3.14Å; K139-T188 HydrophobicContact CB-CG2 4.38Å; K139-T188 CarbonylContact O-C 3.35Å; K139-T188 WeakPolarHBondContact O-CA 3.22Å; K139-A189 PolarHBondContact O-N 2.95Å; K139-I191 HydrophobicContact CD-CD1 4.18Å; K139-I191 HydrophobicContact CD-CG1 4.16Å
140	E	50.8	Low	53.1	Low	68 Å²	68	88.5 Å²	88.5	32%	0.318	48%	0.476	S	S	.	.	B	Isolated β-bridge	trans	-53.6	108.6	162.3	-43.2	-171.9	126.8	0	0	111	K138 A142 S171	K138-E140 HydrophobicContact CB-CB 4.01Å; K138-E140 HydrophobicContact CB-CG 4.25Å; K138-E140 WeakPolarHBondContact CD-OE2 3.01Å; K138-E140 WeakPolarHBondContact CE-OE2 3.44Å; K138-E140 IonicContact NZ-OE2 2.71Å; K138-E140 PolarHBondContact NZ-OE2 3.06Å; K138-E140 CarbonylContact O-C 3.44Å; K138-E140 PolarHBondContact O-N 2.59Å; E140-A142 PolarHBondContact O-N 3.36Å; E140-S171 PolarHBondContact OE1-OG 2.63Å
141	L	51	Low	51.2	Low	28 Å²	28	93.4 Å²	93.4	15%	0.147	51%	0.508	C	S	.	.			trans	-60.1	133.2	165.7	-79.1	93.9	0	0	0	108.9	K139 S143 S159 I170 V187 A189	K139-L141 PolarHBondContact O-N 3.29Å; K139-L141 VanDerWaalsContact O-N 3.14Å; L141-S143 PolarHBondContact O-N 2.96Å; L141-S159 WeakPolarHBondContact CB-OG 3.47Å; L141-I170 HydrophobicContact CB-CD1 3.61Å; L141-I170 WeakPolarHBondContact O-CG1 3.5Å; L141-V187 WeakPolarHBondContact CD1-O 3.46Å; L141-V187 PolarHBondContact N-O 3.04Å; L141-A189 HydrophobicContact CD1-CB 4.07Å; L141-A189 VanDerWaalsContact CD1-N 3.28Å
142	A	48.7	Very low	49.3	Very low	68 Å²	68	99 Å²	99	56%	0.562	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70	112.9	169	0	0	0	0	0	108.7	E140 G144 S159	E140-A142 PolarHBondContact O-N 3.36Å; A142-G144 PolarHBondContact O-N 3.44Å; A142-S159 PolarHBondContact O-OG 3.3Å
143	S	50.6	Low	47.2	Very low	5 Å²	5	98.1 Å²	98.1	4%	0.035	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	134.8	171.4	15.1	0	0	0	0	110.4	L141 S159 G168 I170 Q173	L141-S143 PolarHBondContact O-N 2.96Å; S143-S159 WeakPolarHBondContact CA-OG 3.34Å; S143-S159 PolarHBondContact N-OG 2.95Å; S143-G168 PolarHBondContact OG-O 2.61Å; S143-I170 PolarHBondContact OG-N 3.44Å; S143-Q173 VanDerWaalsContact CB-NE2 3.26Å; S143-Q173 PolarHBondContact OG-NE2 2.67Å; S143-Q173 PolarHBondContact OG-OE1 2.88Å
144	G	46.2	Very low	45.5	Very low	38 Å²	38	99.4 Å²	99.4	39%	0.392	55%	0.546	S	S	.	.	S	Bend	trans	82.1	71.2	-179.2	0	0	0	0	0	113	A142 S159	A142-G144 PolarHBondContact O-N 3.44Å; G144-S159 PolarHBondContact N-O 2.87Å
145	G	46.1	Very low	44.5	Very low	40 Å²	40	103.7 Å²	103.7	41%	0.412	56%	0.563	S	S	.	*			trans	-99.8	130.3	170	0	0	0	0	0	111.5
146	H	41.2	Very low	44.2	Very low	178 Å²	178	105.2 Å²	105.2	82%	0.824	56%	0.561	S	S	*	*			trans	-66.3	131.8	162.2	-119.2	70.1	0	0	0	108.6	V148	H146-V148 VanDerWaalsContact C-N 3.34Å; H146-V148 PolarHBondContact O-N 3.46Å
147	Q	42.7	Very low	44	Very low	165 Å²	165	100.2 Å²	100.2	77%	0.771	55%	0.549	S	S	*	.			trans	-73.2	88.9	177.5	-165	176.3	15.9	0	0	109.1	Y149	Q147-Y149 PolarHBondContact O-N 3.3Å
148	V	40.9	Very low	44.1	Very low	113 Å²	113	99.2 Å²	99.2	69%	0.685	54%	0.537	S	S	*	.			trans	-82.3	115.6	172.7	-169.4	0	0	0	0	107.9	H146 A150	H146-V148 VanDerWaalsContact C-N 3.34Å; H146-V148 PolarHBondContact O-N 3.46Å; V148-A150 VanDerWaalsContact C-N 3.32Å; V148-A150 PolarHBondContact O-N 3.11Å
149	Y	42.7	Very low	44.1	Very low	213 Å²	213	93.3 Å²	93.3	84%	0.835	51%	0.512	S	S	*	.			trans	-65.8	93.1	168.5	-172.7	-92.4	0	0	0	108.5	Q147	Q147-Y149 PolarHBondContact O-N 3.3Å
150	A	41.9	Very low	44.2	Very low	46 Å²	46	95.8 Å²	95.8	38%	0.38	52%	0.523	S	S	.	.			trans	-94.4	121.9	169.2	0	0	0	0	0	108.3	V148 F152	V148-A150 VanDerWaalsContact C-N 3.32Å; V148-A150 PolarHBondContact O-N 3.11Å; A150-F152 PolarHBondContact O-N 2.68Å
151	P	46.2	Very low	44.2	Very low	109 Å²	109	94.2 Å²	94.2	71%	0.708	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-8.2	-179.9	22.2	-30.8	0	0	0	114
152	F	43.1	Very low	44.3	Very low	192 Å²	192	93.8 Å²	93.8	84%	0.842	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	37.2	-178.9	-76.7	-76.9	0	0	0	114.5	A150	A150-F152 PolarHBondContact O-N 2.68Å
153	G	36.4	Very low	44.5	Very low	57 Å²	57	93.5 Å²	93.5	59%	0.588	51%	0.514	S	S	*	.			trans	85.3	110.1	-176.1	0	0	0	0	0	109.6	L155	G153-L155 PolarHBondContact O-N 3.35Å; G153-L155 VanDerWaalsContact O-N 3.13Å
154	G	35.5	Very low	44.9	Very low	45 Å²	45	101.6 Å²	101.6	46%	0.464	55%	0.552	S	S	.	*			trans	-54.8	122.7	174.8	0	0	0	0	0	109.2	Y156	G154-Y156 PolarHBondContact O-N 3.29Å
155	L	39.5	Very low	45.5	Very low	153 Å²	153	103.8 Å²	103.8	80%	0.801	57%	0.566	S	S	*	*			trans	-58.5	112.8	159.7	-81.5	156.3	0	0	0	105.3	G153 T157	G153-L155 PolarHBondContact O-N 3.35Å; G153-L155 VanDerWaalsContact O-N 3.13Å; L155-T157 HydrophobicContact CB-CG2 3.8Å; L155-T157 PolarHBondContact O-N 3.2Å
156	Y	41	Very low	46	Very low	192 Å²	192	104 Å²	104	75%	0.753	56%	0.558	S	S	*	*			trans	-67.4	67.7	166.4	-78.1	-91	0	0	0	108.3	G154 Q158	G154-Y156 PolarHBondContact O-N 3.29Å; Y156-Q158 PolarHBondContact O-N 3.03Å
157	T	43.2	Very low	46.7	Very low	63 Å²	63	105 Å²	105	39%	0.387	56%	0.556	S	S	.	*			trans	-84.5	42.3	162.2	76.5	0	0	0	0	108.5	L155 S159	L155-T157 HydrophobicContact CB-CG2 3.8Å; L155-T157 PolarHBondContact O-N 3.2Å; T157-S159 PolarHBondContact O-N 3.43Å; T157-S159 VanDerWaalsContact O-N 3.17Å
158	Q	46.4	Very low	47.4	Very low	81 Å²	81	98.7 Å²	98.7	38%	0.379	54%	0.535	S	S	.	.			trans	-89.3	60.6	-179.6	-68.8	-171.4	5.8	0	0	109.8	Y156 L185	Y156-Q158 PolarHBondContact O-N 3.03Å; Q158-L185 WeakPolarHBondContact O-CD1 3.35Å
159	S	44.9	Very low	48.3	Very low	6 Å²	6	94.4 Å²	94.4	4%	0.042	51%	0.509	C	S	.	.			trans	-89.7	101.9	155	34.3	0	0	0	0	107.5	L141 A142 S143 G144 T157 P161	L141-S159 WeakPolarHBondContact CB-OG 3.47Å; A142-S159 PolarHBondContact O-OG 3.3Å; S143-S159 WeakPolarHBondContact CA-OG 3.34Å; S143-S159 PolarHBondContact N-OG 2.95Å; G144-S159 PolarHBondContact N-O 2.87Å; T157-S159 PolarHBondContact O-N 3.43Å; T157-S159 VanDerWaalsContact O-N 3.17Å; S159-P161 VanDerWaalsContact O-N 3.16Å
160	F	49.7	Very low	49.2	Very low	152 Å²	152	84.9 Å²	84.9	67%	0.667	47%	0.472	S	S	*	.			trans	-49.4	122.9	161.3	-64.8	-79.1	0	0	0	106.7	G162	F160-G162 PolarHBondContact O-N 3Å
161	P	50.4	Low	50.3	Low	34 Å²	34	85 Å²	85	22%	0.221	47%	0.471	C	S	.	.			trans	-58.6	140.1	175	28	-32.6	0	0	0	107.4	S159 C163	S159-P161 VanDerWaalsContact O-N 3.16Å; P161-C163 WeakPolarHBondContact CB-O 3.45Å; P161-C163 PolarHBondContact O-N 3.22Å; P161-C163 VanDerWaalsContact O-N 3.15Å
162	G	52.4	Low	51.3	Low	20 Å²	20	85.8 Å²	85.8	21%	0.206	47%	0.465	C	S	.	.	S	Bend	trans	-58.8	-27.6	176.8	0	0	0	0	0	111.3	F160 Q173	F160-G162 PolarHBondContact O-N 3Å; G162-Q173 VanDerWaalsContact N-OE1 3.11Å
163	C	54.2	Low	52.3	Low	61 Å²	61	76.9 Å²	76.9	41%	0.412	43%	0.426	S	S	.	.	S	Bend	trans	-145.1	131.2	169.2	-178	0	0	0	0	109.4	P161 A165 L166	P161-C163 WeakPolarHBondContact CB-O 3.45Å; P161-C163 PolarHBondContact O-N 3.22Å; P161-C163 VanDerWaalsContact O-N 3.15Å; C163-A165 PolarHBondContact O-N 3.34Å; C163-A165 VanDerWaalsContact O-N 3.09Å; C163-L166 HydrophobicContact CB-CD1 3.76Å; C163-L166 HydrophobicContact CB-CG 3.93Å; C163-L166 WeakPolarHBondContact O-CB 3.48Å; C163-L166 PolarHBondContact O-N 3.06Å
164	E	58.2	Low	53.6	Low	176 Å²	176	78.6 Å²	78.6	82%	0.822	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-25.8	-176.9	-64.6	168	175.1	0	0	113.8	L166	E164-L166 VanDerWaalsContact C-N 3.33Å
165	A	59.7	Low	55	Low	84 Å²	84	80.2 Å²	80.2	69%	0.694	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-10.3	178.3	0	0	0	0	0	113.8	C163	C163-A165 PolarHBondContact O-N 3.34Å; C163-A165 VanDerWaalsContact O-N 3.09Å
166	L	56	Low	56.2	Low	45 Å²	45	77.3 Å²	77.3	24%	0.236	41%	0.413	C	S	.	.			trans	-95.8	131.4	-178.5	-62.6	176.4	0	0	0	110.6	C163 E164 Q173 L176 H179	C163-L166 HydrophobicContact CB-CD1 3.76Å; C163-L166 HydrophobicContact CB-CG 3.93Å; C163-L166 WeakPolarHBondContact O-CB 3.48Å; C163-L166 PolarHBondContact O-N 3.06Å; E164-L166 VanDerWaalsContact C-N 3.33Å; L166-Q173 HydrophobicContact CB-CG 4.02Å; L166-Q173 HydrophobicContact CD1-CB 4.4Å; L166-Q173 HydrophobicContact CD1-CG 4.47Å; L166-Q173 PolarHBondContact O-NE2 2.9Å; L166-L176 HydrophobicContact CD1-CD1 3.59Å; L166-L176 HydrophobicContact CD2-CD1 3.5Å; L166-L176 HydrophobicContact CG-CD1 4.19Å; L166-H179 VanDerWaalsContact CD1-CE1 3.5Å; L166-H179 WeakPolarHBondContact CD1-CE1 3.35Å
167	Y	55.8	Low	56.9	Low	199 Å²	199	77.8 Å²	77.8	78%	0.78	42%	0.419	S	S	*	.			trans	-114.1	151.5	170.5	-71.7	-84.7	0	0	0	109.4
168	G	56.8	Low	57.6	Low	32 Å²	32	81.9 Å²	81.9	33%	0.33	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	122.5	-174.8	-179.5	0	0	0	0	0	112.8	S143	S143-G168 PolarHBondContact OG-O 2.61Å
169	P	59.5	Low	57.8	Low	22 Å²	22	80.1 Å²	80.1	14%	0.143	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	148.5	177.1	29.5	-33.5	0	0	0	111.6	S171 E172 Q173	P169-S171 PolarHBondContact O-N 3.49Å; P169-S171 VanDerWaalsContact O-N 3.12Å; P169-E172 WeakPolarHBondContact CD-OE2 3.29Å; P169-E172 HydrophobicContact CG-CB 3.93Å; P169-E172 VanDerWaalsContact CG-CD 3.48Å; P169-E172 HydrophobicContact CG-CG 3.71Å; P169-E172 PolarHBondContact O-N 3Å; P169-Q173 PolarHBondContact O-N 3.28Å
170	I	61.8	Low	58.3	Low	13 Å²	13	88.3 Å²	88.3	7%	0.067	47%	0.473	C	S	.	.	H	α-helix	trans	-55.4	-33.9	-179.4	-71.2	166.4	0	0	0	112.3	L141 S143 Q173 M174 V187	L141-I170 HydrophobicContact CB-CD1 3.61Å; L141-I170 WeakPolarHBondContact O-CG1 3.5Å; S143-I170 PolarHBondContact OG-N 3.44Å; I170-Q173 PolarHBondContact O-N 3.1Å; I170-M174 HydrophobicContact CG2-CG 3.99Å; I170-M174 HydrophobicContact CG2-SD 4.1Å; I170-M174 WeakPolarHBondContact O-CB 3.26Å; I170-M174 VanDerWaalsContact O-CG 3.3Å; I170-M174 WeakPolarHBondContact O-CG 3.39Å; I170-M174 PolarHBondContact O-N 2.92Å; I170-V187 HydrophobicContact CB-CG1 4.15Å; I170-V187 HydrophobicContact CG2-CB 4.37Å; I170-V187 HydrophobicContact CG2-CG1 3.95Å; I170-V187 HydrophobicContact CG2-CG2 3.9Å
171	S	65.1	Low	58.3	Low	50 Å²	50	85.1 Å²	85.1	35%	0.35	47%	0.466	S	S	.	.	H	α-helix	trans	-59.9	-45.9	177.1	44.2	0	0	0	0	112.3	E140 P169 A175	E140-S171 PolarHBondContact OE1-OG 2.63Å; P169-S171 PolarHBondContact O-N 3.49Å; P169-S171 VanDerWaalsContact O-N 3.12Å; S171-A175 PolarHBondContact O-N 3.42Å; S171-A175 VanDerWaalsContact O-N 3.14Å
172	E	67.2	Low	58.4	Low	124 Å²	124	92.5 Å²	92.5	58%	0.579	49%	0.494	S	S	*	.	H	α-helix	trans	-69.8	-36.5	175.4	-75	175.8	-163.3	0	0	112	P169 A175	P169-E172 WeakPolarHBondContact CD-OE2 3.29Å; P169-E172 HydrophobicContact CG-CB 3.93Å; P169-E172 VanDerWaalsContact CG-CD 3.48Å; P169-E172 HydrophobicContact CG-CG 3.71Å; P169-E172 PolarHBondContact O-N 3Å; E172-A175 PolarHBondContact O-N 3.15Å
173	Q	64.3	Low	58.3	Low	6 Å²	6	93.7 Å²	93.7	3%	0.028	50%	0.499	C	S	.	.	H	α-helix	trans	-58.7	-64	171.6	-62.2	-161.8	-3.2	0	0	108.2	S143 G162 L166 P169 I170 A175 L176 H179	S143-Q173 VanDerWaalsContact CB-NE2 3.26Å; S143-Q173 PolarHBondContact OG-NE2 2.67Å; S143-Q173 PolarHBondContact OG-OE1 2.88Å; G162-Q173 VanDerWaalsContact N-OE1 3.11Å; L166-Q173 HydrophobicContact CB-CG 4.02Å; L166-Q173 HydrophobicContact CD1-CB 4.4Å; L166-Q173 HydrophobicContact CD1-CG 4.47Å; L166-Q173 PolarHBondContact O-NE2 2.9Å; P169-Q173 PolarHBondContact O-N 3.28Å; I170-Q173 PolarHBondContact O-N 3.1Å; Q173-A175 PolarHBondContact O-N 2.94Å; Q173-L176 VanDerWaalsContact O-CB 3.29Å; Q173-L176 WeakPolarHBondContact O-CB 3.47Å; Q173-L176 PolarHBondContact O-N 3.13Å; Q173-H179 PolarHBondContact O-CE1 3.09Å; Q173-H179 PolarHBondContact O-NE2 2.8Å
174	M	62.9	Low	58.3	Low	93 Å²	93	96.4 Å²	96.4	46%	0.458	52%	0.518	S	S	.	.	H	α-helix	trans	-51.8	-26.3	-178	-71.6	-163	77.2	0	0	115.3	I170 L176 H179 P183 V187	I170-M174 HydrophobicContact CG2-CG 3.99Å; I170-M174 HydrophobicContact CG2-SD 4.1Å; I170-M174 WeakPolarHBondContact O-CB 3.26Å; I170-M174 VanDerWaalsContact O-CG 3.3Å; I170-M174 WeakPolarHBondContact O-CG 3.39Å; I170-M174 PolarHBondContact O-N 2.92Å; M174-L176 VanDerWaalsContact C-N 3.33Å; M174-H179 WeakPolarHBondContact CA-NE2 3.38Å; M174-P183 HydrophobicContact CE-CG 4.08Å; M174-P183 HydrophobicContact CG-CG 4.3Å; M174-P183 HydrophobicContact SD-CG 3.7Å; M174-V187 HydrophobicContact SD-CG2 4.1Å
175	A	65.9	Low	58	Low	78 Å²	78	91.8 Å²	91.8	65%	0.645	50%	0.499	S	S	*	.	H	α-helix	trans	-68.9	-27.9	175.1	0	0	0	0	0	113.5	S171 E172 Q173 K177	S171-A175 PolarHBondContact O-N 3.42Å; S171-A175 VanDerWaalsContact O-N 3.14Å; E172-A175 PolarHBondContact O-N 3.15Å; Q173-A175 PolarHBondContact O-N 2.94Å; A175-K177 PolarHBondContact O-N 2.92Å
176	L	64	Low	57.6	Low	92 Å²	92	91.9 Å²	91.9	48%	0.482	49%	0.492	S	S	.	.	S	Bend	trans	-65.9	118.6	168.4	-67.7	156.4	0	0	0	107.7	L166 Q173 M174 D178 H179	L166-L176 HydrophobicContact CD1-CD1 3.59Å; L166-L176 HydrophobicContact CD2-CD1 3.5Å; L166-L176 HydrophobicContact CG-CD1 4.19Å; Q173-L176 VanDerWaalsContact O-CB 3.29Å; Q173-L176 WeakPolarHBondContact O-CB 3.47Å; Q173-L176 PolarHBondContact O-N 3.13Å; M174-L176 VanDerWaalsContact C-N 3.33Å; L176-D178 PolarHBondContact O-N 3.01Å; L176-H179 PolarHBondContact O-CD2 2.81Å; L176-H179 PolarHBondContact O-NE2 2.63Å
177	K	56.3	Low	57.3	Low	203 Å²	203	92.1 Å²	92.1	88%	0.883	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-10.2	-166.9	-94.1	177.7	170.4	178.4	0	115.9	A175	A175-K177 PolarHBondContact O-N 2.92Å
178	D	57.3	Low	57	Low	149 Å²	149	86.6 Å²	86.6	80%	0.797	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.4	19.1	-162.2	-63.1	-22.2	0	0	0	115.1	L176 L180	L176-D178 PolarHBondContact O-N 3.01Å; D178-L180 PolarHBondContact O-N 3.4Å; D178-L180 VanDerWaalsContact O-N 3.12Å
179	H	51.7	Low	56.6	Low	44 Å²	44	86.7 Å²	86.7	20%	0.204	48%	0.48	C	S	.	.			trans	-71.6	113.5	175.9	-50.1	-61.7	0	0	0	111.2	L166 Q173 M174 L176 V181	L166-H179 VanDerWaalsContact CD1-CE1 3.5Å; L166-H179 WeakPolarHBondContact CD1-CE1 3.35Å; Q173-H179 PolarHBondContact O-CE1 3.09Å; Q173-H179 PolarHBondContact O-NE2 2.8Å; M174-H179 WeakPolarHBondContact CA-NE2 3.38Å; L176-H179 PolarHBondContact O-CD2 2.81Å; L176-H179 PolarHBondContact O-NE2 2.63Å; H179-V181 PolarHBondContact O-N 2.85Å
180	L	54.2	Low	56	Low	177 Å²	177	91.7 Å²	91.7	93%	0.927	51%	0.506	S	S	*	.	S	Bend	trans	-68.1	-20.6	165.5	-70	166.9	0	0	0	111.9	D178	D178-L180 PolarHBondContact O-N 3.4Å; D178-L180 VanDerWaalsContact O-N 3.12Å
181	V	50.2	Low	55.4	Low	85 Å²	85	96 Å²	96	52%	0.515	53%	0.528	S	S	.	.			trans	-107.8	110.5	-175.8	-172.5	0	0	0	0	109.4	H179 P183	H179-V181 PolarHBondContact O-N 2.85Å; V181-P183 WeakPolarHBondContact O-CD 3.48Å
182	K	53.9	Low	54.5	Low	189 Å²	189	100 Å²	100	82%	0.822	54%	0.541	S	S	*	.			trans	-69.7	120.4	162.4	-76.4	-178.2	179.9	177.2	0	107.5	S184	K182-S184 PolarHBondContact O-N 2.97Å; K182-S184 VanDerWaalsContact O-N 3.14Å
183	P	50.3	Low	53.6	Low	46 Å²	46	99.8 Å²	99.8	30%	0.299	55%	0.55	S	S	.	*			trans	-59.6	123	172.6	21.1	-28	0	0	0	108.6	M174 V181 L185	M174-P183 HydrophobicContact CE-CG 4.08Å; M174-P183 HydrophobicContact CG-CG 4.3Å; M174-P183 HydrophobicContact SD-CG 3.7Å; V181-P183 WeakPolarHBondContact O-CD 3.48Å; P183-L185 PolarHBondContact O-N 2.81Å
184	S	54.1	Low	52.8	Low	118 Å²	118	104.7 Å²	104.7	83%	0.825	59%	0.585	S	S	*	*	S	Bend	trans	-74.9	-8.1	175.7	54.5	0	0	0	0	112.6	K182	K182-S184 PolarHBondContact O-N 2.97Å; K182-S184 VanDerWaalsContact O-N 3.14Å
185	L	50.1	Low	51.9	Low	78 Å²	78	107.7 Å²	107.7	41%	0.408	60%	0.602	S	S	.	*	S	Bend	trans	-101.7	142.7	-177.9	-66.7	166.8	0	0	0	110.4	Q158 P183 V187	Q158-L185 WeakPolarHBondContact O-CD1 3.35Å; P183-L185 PolarHBondContact O-N 2.81Å; L185-V187 PolarHBondContact O-N 3.5Å
186	P	51.4	Low	50.9	Low	87 Å²	87	106.8 Å²	106.8	57%	0.565	59%	0.591	S	S	*	*			trans	-58.9	136.3	173.5	25.4	-32.8	0	0	0	109.8	T188	P186-T188 PolarHBondContact O-N 2.69Å; P186-T188 VanDerWaalsContact O-N 3.08Å
187	V	51.4	Low	50	Low	50 Å²	50	110.4 Å²	110.4	30%	0.303	61%	0.609	S	S	.	*	S	Bend	trans	-57.7	-24.4	177	-178.5	0	0	0	0	111.6	L141 I170 M174 L185	L141-V187 WeakPolarHBondContact CD1-O 3.46Å; L141-V187 PolarHBondContact N-O 3.04Å; I170-V187 HydrophobicContact CB-CG1 4.15Å; I170-V187 HydrophobicContact CG2-CB 4.37Å; I170-V187 HydrophobicContact CG2-CG1 3.95Å; I170-V187 HydrophobicContact CG2-CG2 3.9Å; M174-V187 HydrophobicContact SD-CG2 4.1Å; L185-V187 PolarHBondContact O-N 3.5Å
188	T	48.1	Very low	49.4	Very low	82 Å²	82	109.1 Å²	109.1	50%	0.503	60%	0.604	S	S	.	*	B	Isolated β-bridge	trans	-100.9	127.3	179.7	57.1	0	0	0	0	111.9	K139 P186 N190	K139-T188 HydrophobicContact CB-CG2 4.38Å; K139-T188 CarbonylContact O-C 3.35Å; K139-T188 WeakPolarHBondContact O-CA 3.22Å; P186-T188 PolarHBondContact O-N 2.69Å; P186-T188 VanDerWaalsContact O-N 3.08Å; T188-N190 PolarHBondContact O-N 2.74Å
189	A	49.7	Very low	48.7	Very low	35 Å²	35	108.9 Å²	108.9	29%	0.289	60%	0.598	S	S	.	*			trans	-58.8	131.1	167.6	0	0	0	0	0	109.5	K139 L141 I191	K139-A189 PolarHBondContact O-N 2.95Å; L141-A189 HydrophobicContact CD1-CB 4.07Å; L141-A189 VanDerWaalsContact CD1-N 3.28Å; A189-I191 PolarHBondContact O-N 2.66Å
190	N	46.7	Very low	48.1	Very low	127 Å²	127	111.3 Å²	111.3	68%	0.679	62%	0.619	S	S	*	*			trans	-68.1	110	170.9	-164	-9.9	0	0	0	108	T188 H192	T188-N190 PolarHBondContact O-N 2.74Å; N190-H192 PolarHBondContact O-N 3.01Å; N190-H192 WeakPolarHBondContact OD1-CB 3.19Å; N190-H192 PolarHBondContact OD1-CD2 3.2Å; N190-H192 PolarHBondContact OD1-N 2.79Å
191	I	47.7	Very low	47.4	Very low	104 Å²	104	106.6 Å²	106.6	53%	0.533	60%	0.602	S	S	.	*			trans	-70.9	-18.7	-179.8	-1.5	156.7	0	0	0	111.8	K139 A189 P193	K139-I191 HydrophobicContact CD-CD1 4.18Å; K139-I191 HydrophobicContact CD-CG1 4.16Å; A189-I191 PolarHBondContact O-N 2.66Å; I191-P193 WeakPolarHBondContact O-CD 3.46Å
192	H	47.6	Very low	47	Very low	134 Å²	134	107.9 Å²	107.9	62%	0.62	61%	0.611	S	S	*	*	S	Bend	trans	-76.1	121.6	174.7	-60.9	-65.4	0	0	0	107.7	N190 S194	N190-H192 PolarHBondContact O-N 3.01Å; N190-H192 WeakPolarHBondContact OD1-CB 3.19Å; N190-H192 PolarHBondContact OD1-CD2 3.2Å; N190-H192 PolarHBondContact OD1-N 2.79Å; H192-S194 PolarHBondContact O-N 3.11Å
193	P	49	Very low	46.6	Very low	119 Å²	119	103 Å²	103	77%	0.773	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-55.5	119.4	171.4	23	-30.4	0	0	0	106.8	I191 L195	I191-P193 WeakPolarHBondContact O-CD 3.46Å; P193-L195 PolarHBondContact O-N 3.19Å
194	S	45.9	Very low	45.9	Very low	108 Å²	108	110 Å²	110	76%	0.755	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-52	133.1	165.8	29.8	0	0	0	0	106.8	H192 S196	H192-S194 PolarHBondContact O-N 3.11Å; S194-S196 PolarHBondContact O-N 3.5Å
195	L	45	Very low	45.1	Very low	156 Å²	156	112.6 Å²	112.6	82%	0.817	62%	0.62	S	S	*	*			trans	-57.3	94	172.8	-86.1	147.4	0	0	0	107	P193 I197	P193-L195 PolarHBondContact O-N 3.19Å; L195-I197 PolarHBondContact O-N 3.12Å
196	S	43.5	Very low	44.3	Very low	59 Å²	59	119.8 Å²	119.8	41%	0.413	64%	0.643	S	S	.	*			trans	-64.2	126.5	175.6	176	0	0	0	0	107.1	S194 F198 H199	S194-S196 PolarHBondContact O-N 3.5Å; S196-F198 WeakPolarHBondContact CB-O 3.49Å; S196-F198 CarbonylContact O-C 3.46Å; S196-F198 PolarHBondContact O-N 3.17Å; S196-F198 VanDerWaalsContact OG-C 3.22Å; S196-F198 WeakPolarHBondContact OG-CA 3.49Å; S196-F198 WeakPolarHBondContact OG-CB 3.5Å; S196-F198 PolarHBondContact OG-N 3.31Å; S196-F198 PolarHBondContact OG-O 3.05Å; S196-H199 PolarHBondContact O-N 2.93Å; S196-H199 PolarHBondContact O-ND1 3.04Å
197	I	46	Very low	43.7	Very low	169 Å²	169	121 Å²	121	87%	0.867	64%	0.643	S	S	*	*	S	Bend	trans	-56.9	-33.5	170.8	-36.6	170.5	0	0	0	109	L195 H199	L195-I197 PolarHBondContact O-N 3.12Å; I197-H199 VanDerWaalsContact C-N 3.29Å; I197-H199 PolarHBondContact O-N 3.09Å; I197-H199 VanDerWaalsContact O-N 3.11Å
198	F	43.2	Very low	43.1	Very low	175 Å²	175	121.7 Å²	121.7	77%	0.768	66%	0.661	S	S	*	*	S	Bend	trans	-80.4	81.6	162.1	-52.5	-78.3	0	0	0	107.8	S196 S200	S196-F198 WeakPolarHBondContact CB-O 3.49Å; S196-F198 CarbonylContact O-C 3.46Å; S196-F198 PolarHBondContact O-N 3.17Å; S196-F198 VanDerWaalsContact OG-C 3.22Å; S196-F198 WeakPolarHBondContact OG-CA 3.49Å; S196-F198 WeakPolarHBondContact OG-CB 3.5Å; S196-F198 PolarHBondContact OG-N 3.31Å; S196-F198 PolarHBondContact OG-O 3.05Å; F198-S200 PolarHBondContact O-N 3.32Å
199	H	42.5	Very low	42.7	Very low	145 Å²	145	122 Å²	122	67%	0.671	66%	0.659	S	S	*	*			trans	-55.9	98.4	153.8	-97.6	31.1	0	0	0	105.6	S196 I197 S201	S196-H199 PolarHBondContact O-N 2.93Å; S196-H199 PolarHBondContact O-ND1 3.04Å; I197-H199 VanDerWaalsContact C-N 3.29Å; I197-H199 PolarHBondContact O-N 3.09Å; I197-H199 VanDerWaalsContact O-N 3.11Å; H199-S201 PolarHBondContact O-N 2.98Å
200	S	39.8	Very low	42.6	Very low	94 Å²	94	127.2 Å²	127.2	66%	0.657	68%	0.682	S	S	*	*			trans	-61.7	100.8	162.9	60.3	0	0	0	0	103.9	F198	F198-S200 PolarHBondContact O-N 3.32Å
201	S	39.1	Very low	42.5	Very low	79 Å²	79	125.9 Å²	125.9	55%	0.552	68%	0.675	S	S	*	*			trans	-41.6	134.8	167	-67.9	0	0	0	0	106.9	H199 S203	H199-S201 PolarHBondContact O-N 2.98Å; S201-S203 PolarHBondContact O-N 3.26Å; S201-S203 PolarHBondContact O-OG 3.49Å
202	P	42.8	Very low	42.5	Very low	111 Å²	111	127.7 Å²	127.7	72%	0.721	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-56.3	9.3	-169.3	-28.7	34.5	0	0	0	117.8
203	S	44	Very low	42.5	Very low	88 Å²	88	125.1 Å²	125.1	62%	0.615	67%	0.672	S	S	*	*	G	3₁₀ helix	trans	-81.1	-6.8	-175.5	53.4	0	0	0	0	116.6	S201	S201-S203 PolarHBondContact O-N 3.26Å; S201-S203 PolarHBondContact O-OG 3.49Å
204	Y	36.5	Very low	42.3	Very low	191 Å²	191	129.6 Å²	129.6	75%	0.749	67%	0.674	S	S	*	*	G	3₁₀ helix	trans	-97	-9.1	173.5	-71.8	-71.5	0	0	0	115	Y206	Y204-Y206 PolarHBondContact O-N 3.24Å
205	K	36.9	Very low	42.3	Very low	174 Å²	174	130 Å²	130	76%	0.757	66%	0.659	S	S	*	*	S	Bend	trans	-68.2	120.9	159.8	-144.1	166.2	-169.9	166.7	0	103.5	I207	K205-I207 PolarHBondContact O-N 3.33Å
206	Y	33.9	Very low	42.6	Very low	229 Å²	229	129.5 Å²	129.5	90%	0.898	67%	0.665	S	S	*	*			trans	-55.7	85	157	-79.6	-91.9	0	0	0	105.4	Y204 G208	Y204-Y206 PolarHBondContact O-N 3.24Å; Y206-G208 PolarHBondContact O-N 2.78Å
207	I	38.2	Very low	42.9	Very low	111 Å²	111	130.1 Å²	130.1	57%	0.569	68%	0.681	S	S	*	*			trans	-48.4	118.8	151.1	-59.9	171.4	0	0	0	99.7	K205 D209	K205-I207 PolarHBondContact O-N 3.33Å; I207-D209 HydrophobicContact CB-CB 4.27Å; I207-D209 HydrophobicContact CG2-CB 4Å; I207-D209 PolarHBondContact O-N 3.14Å
208	G	39	Very low	42.6	Very low	65 Å²	65	125 Å²	125	67%	0.67	67%	0.67	S	S	*	*			trans	-64.5	66.2	169.6	0	0	0	0	0	106.6	Y206 L210	Y206-G208 PolarHBondContact O-N 2.78Å; G208-L210 PolarHBondContact O-N 3.4Å
209	D	40.8	Very low	42.5	Very low	88 Å²	88	118.1 Å²	118.1	47%	0.471	65%	0.648	S	S	.	*			trans	-73.6	93.3	-168.2	-165	9.7	0	0	0	102.7	I207 N211	I207-D209 HydrophobicContact CB-CB 4.27Å; I207-D209 HydrophobicContact CG2-CB 4Å; I207-D209 PolarHBondContact O-N 3.14Å; D209-N211 PolarHBondContact O-N 3.07Å; D209-N211 WeakPolarHBondContact OD1-CB 3.45Å; D209-N211 PolarHBondContact OD1-N 3.39Å
210	L	47.3	Very low	42.5	Very low	145 Å²	145	119.5 Å²	119.5	76%	0.759	65%	0.648	S	S	*	*			trans	-63.6	2.5	174	-78.9	131.9	0	0	0	111	G208 R212	G208-L210 PolarHBondContact O-N 3.4Å; L210-R212 WeakPolarHBondContact O-CG 3.21Å; L210-R212 PolarHBondContact O-N 3.17Å; L210-R212 VanDerWaalsContact O-N 3.12Å
211	N	43.8	Very low	42.9	Very low	100 Å²	100	118.9 Å²	118.9	54%	0.535	64%	0.641	S	S	.	*			trans	-72.6	97.9	173.3	-146.3	-1.9	0	0	0	109.6	D209 S213	D209-N211 PolarHBondContact O-N 3.07Å; D209-N211 WeakPolarHBondContact OD1-CB 3.45Å; D209-N211 PolarHBondContact OD1-N 3.39Å; N211-S213 PolarHBondContact O-N 3.39Å
212	R	47.8	Very low	43.5	Very low	142 Å²	142	120 Å²	120	54%	0.536	65%	0.647	S	S	.	*	G	3₁₀ helix	trans	-71.8	6.1	-170.5	-65.6	166	-163	-145.2	0.2	114.2	L210 W214	L210-R212 WeakPolarHBondContact O-CG 3.21Å; L210-R212 PolarHBondContact O-N 3.17Å; L210-R212 VanDerWaalsContact O-N 3.12Å; R212-W214 VanDerWaalsContact C-N 3.3Å; R212-W214 PolarHBondContact O-N 3.22Å
213	S	48.1	Very low	43.7	Very low	80 Å²	80	121.8 Å²	121.8	56%	0.559	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-75	-16.2	-174.2	48.3	0	0	0	0	113.9	N211 Y215	N211-S213 PolarHBondContact O-N 3.39Å; S213-Y215 PolarHBondContact O-N 3.2Å
214	W	44.2	Very low	44.1	Very low	213 Å²	213	122.9 Å²	122.9	81%	0.807	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-74	-10.2	176.8	-66.1	99.5	0	0	0	114.1	R212 P216	R212-W214 VanDerWaalsContact C-N 3.3Å; R212-W214 PolarHBondContact O-N 3.22Å; W214-P216 WeakPolarHBondContact O-CD 3.48Å
215	Y	45	Very low	44.6	Very low	116 Å²	116	117.1 Å²	117.1	46%	0.455	64%	0.64	S	S	.	*	S	Bend	trans	-85.4	120	167.7	-83.6	-91.3	0	0	0	108.7	S213 G217 G218	S213-Y215 PolarHBondContact O-N 3.2Å; Y215-G217 PolarHBondContact O-N 3Å; Y215-G218 PolarHBondContact O-N 3.27Å
216	P	52.3	Low	44.9	Very low	145 Å²	145	112.3 Å²	112.3	94%	0.942	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	-9.1	177.7	-23.4	32.5	0	0	0	114.7	W214	W214-P216 WeakPolarHBondContact O-CD 3.48Å
217	G	49.4	Very low	45.8	Very low	73 Å²	73	108.3 Å²	108.3	75%	0.753	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.7	11.6	175.2	0	0	0	0	0	115.9	Y215 G219	Y215-G217 PolarHBondContact O-N 3Å; G217-G219 PolarHBondContact O-N 2.71Å
218	G	40.2	Very low	46.4	Very low	60 Å²	60	106.9 Å²	106.9	62%	0.619	63%	0.626	S	S	*	*			trans	58.1	19.4	176.4	0	0	0	0	0	115.6	Y215	Y215-G218 PolarHBondContact O-N 3.27Å
219	G	39.9	Very low	46.8	Very low	31 Å²	31	109 Å²	109	32%	0.32	62%	0.622	S	S	.	*	P	Polyproline II helix	trans	-85.2	160	-172.4	0	0	0	0	0	114.1	G217	G217-G219 PolarHBondContact O-N 2.71Å
220	R	43.3	Very low	46.9	Very low	175 Å²	175	112 Å²	112	66%	0.66	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-58.6	144.1	164.1	-64.5	178.6	-177.6	-165	-1	108.1	Y34	Y34-R220 PolarHBondContact OH-NH1 2.9Å
221	P	48.8	Very low	46.7	Very low	80 Å²	80	109.3 Å²	109.3	52%	0.519	62%	0.617	S	S	.	*	P	Polyproline II helix	trans	-52.7	138.2	168.2	24	-32.5	0	0	0	107.9	L223	P221-L223 PolarHBondContact O-N 3.27Å
222	P	50.6	Low	46.7	Very low	103 Å²	103	114.1 Å²	114.1	67%	0.669	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-52.4	131	172.2	22.8	-31.1	0	0	0	107.1
223	L	48.2	Very low	46.5	Very low	149 Å²	149	114 Å²	114	78%	0.78	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-49.4	144.5	168.9	-77.9	162.1	0	0	0	107.4	P221	P221-L223 PolarHBondContact O-N 3.27Å
224	P	51.4	Low	46.2	Very low	110 Å²	110	112.4 Å²	112.4	71%	0.714	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-49.1	125.9	173.3	22.5	-32.5	0	0	0	106.8	S226	P224-S226 PolarHBondContact O-N 3.29Å
225	P	46.4	Very low	46.2	Very low	70 Å²	70	107.9 Å²	107.9	46%	0.455	64%	0.642	S	S	.	*	P	Polyproline II helix	trans	-59.7	145.5	-173.9	27.1	-37.9	0	0	0	109	Y230	P225-Y230 HydrophobicContact CB-CE2 3.34Å; P225-Y230 WeakPolarHBondContact CB-OH 3.41Å; P225-Y230 HydrophobicContact CG-CD2 4.14Å; P225-Y230 HydrophobicContact CG-CE2 3.07Å; P225-Y230 WeakPolarHBondContact CG-OH 3.48Å
226	S	44.6	Very low	46.3	Very low	73 Å²	73	108.2 Å²	108.2	51%	0.51	66%	0.658	S	S	.	*	P	Polyproline II helix	trans	-57.2	146.1	-172.6	84.5	0	0	0	0	109.7	P224 A228 D229	P224-S226 PolarHBondContact O-N 3.29Å; S226-A228 PolarHBondContact O-N 3.27Å; S226-D229 PolarHBondContact O-N 2.69Å
227	I	51.7	Low	46.2	Very low	146 Å²	146	108.4 Å²	108.4	75%	0.749	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-53.1	-19.7	-178.6	-69.6	167.7	0	0	0	111.9	D229 V231	I227-D229 VanDerWaalsContact C-N 3.27Å; I227-D229 PolarHBondContact O-N 3.28Å; I227-V231 HydrophobicContact CG2-CG2 3.77Å; I227-V231 WeakPolarHBondContact O-CG2 2.93Å
228	A	51.3	Low	46.2	Very low	80 Å²	80	112.5 Å²	112.5	66%	0.661	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-59.8	-30.6	176.9	0	0	0	0	0	114.2	S226	S226-A228 PolarHBondContact O-N 3.27Å
229	D	46.7	Very low	46.6	Very low	109 Å²	109	118.9 Å²	118.9	58%	0.583	66%	0.663	S	S	*	*	G	3₁₀ helix	trans	-92.9	-9.7	-163.5	-64.2	-28.5	0	0	0	115.5	S226 I227	S226-D229 PolarHBondContact O-N 2.69Å; I227-D229 VanDerWaalsContact C-N 3.27Å; I227-D229 PolarHBondContact O-N 3.28Å
230	Y	44	Very low	47.3	Very low	152 Å²	152	121.7 Å²	121.7	60%	0.596	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.4	3.2	-179.4	-34.3	-84.6	0	0	0	115.5	P225 K232	P225-Y230 HydrophobicContact CB-CE2 3.34Å; P225-Y230 WeakPolarHBondContact CB-OH 3.41Å; P225-Y230 HydrophobicContact CG-CD2 4.14Å; P225-Y230 HydrophobicContact CG-CE2 3.07Å; P225-Y230 WeakPolarHBondContact CG-OH 3.48Å; Y230-K232 PolarHBondContact O-N 2.53Å
231	V	43	Very low	47.5	Very low	88 Å²	88	118.9 Å²	118.9	53%	0.533	68%	0.678	S	S	.	*			trans	-74.2	83.1	161.7	-167.5	0	0	0	0	105.8	I227 V233	I227-V231 HydrophobicContact CG2-CG2 3.77Å; I227-V231 WeakPolarHBondContact O-CG2 2.93Å; V231-V233 HydrophobicContact CB-CG2 4.17Å; V231-V233 HydrophobicContact CG1-CB 4.42Å; V231-V233 HydrophobicContact CG1-CG2 3.47Å; V231-V233 VanDerWaalsContact CG1-CG2 3.47Å; V231-V233 PolarHBondContact O-N 2.97Å
232	K	43.9	Very low	47.3	Very low	202 Å²	202	121.6 Å²	121.6	88%	0.878	69%	0.693	S	S	*	*			trans	-58.5	90	150.4	-77.7	-175.2	176.7	179.2	0	104.5	Y230 G234	Y230-K232 PolarHBondContact O-N 2.53Å; K232-G234 PolarHBondContact O-N 2.97Å
233	V	43.4	Very low	47.2	Very low	139 Å²	139	124.3 Å²	124.3	84%	0.842	70%	0.697	S	S	*	*			trans	-69.9	64.4	166.5	-167.5	0	0	0	0	105.7	V231	V231-V233 HydrophobicContact CB-CG2 4.17Å; V231-V233 HydrophobicContact CG1-CB 4.42Å; V231-V233 HydrophobicContact CG1-CG2 3.47Å; V231-V233 VanDerWaalsContact CG1-CG2 3.47Å; V231-V233 PolarHBondContact O-N 2.97Å
234	G	41.7	Very low	46.9	Very low	47 Å²	47	121.1 Å²	121.1	49%	0.485	69%	0.685	S	S	.	*			trans	-106.7	144	172.4	0	0	0	0	0	107.8	K232	K232-G234 PolarHBondContact O-N 2.97Å
235	P	44	Very low	46.3	Very low	118 Å²	118	123.2 Å²	123.2	77%	0.766	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-54.5	150.8	170.7	23.1	-31.1	0	0	0	110.4	K237	P235-K237 PolarHBondContact O-N 2.83Å
236	P	47.4	Very low	46	Very low	122 Å²	122	127.8 Å²	127.8	79%	0.792	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-55.1	125.9	-179.3	21.9	-32.1	0	0	0	110.1	Q238	P236-Q238 PolarHBondContact O-N 3.1Å
237	K	49.5	Very low	45.6	Very low	150 Å²	150	131.9 Å²	131.9	65%	0.652	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-58.3	132.9	175.7	-75.1	-169.9	163.5	-165	0	109.9	P235 E241	P235-K237 PolarHBondContact O-N 2.83Å; K237-E241 WeakPolarHBondContact CD-OE2 3.29Å; K237-E241 WeakPolarHBondContact CE-OE2 3.39Å; K237-E241 WeakPolarHBondContact CG-OE2 3.43Å; K237-E241 IonicContact NZ-OE2 2.74Å
238	Q	49.8	Very low	44.8	Very low	159 Å²	159	134.4 Å²	134.4	74%	0.743	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-75	146.3	173.7	-66.6	-176.8	-1.9	0	0	109.7	P236 A240 E241	P236-Q238 PolarHBondContact O-N 3.1Å; Q238-A240 PolarHBondContact O-N 2.94Å; Q238-E241 PolarHBondContact O-N 3.49Å; Q238-E241 VanDerWaalsContact O-N 3.16Å
239	L	49.2	Very low	44	Very low	193 Å²	193	136.5 Å²	136.5	100%	1.01	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.2	-2.3	-169.6	-135.4	90.1	0	0	0	115.8
240	A	53.4	Low	43.4	Very low	91 Å²	91	136.3 Å²	136.3	75%	0.752	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.1	2.4	-175.7	0	0	0	0	0	114.1	Q238 T242	Q238-A240 PolarHBondContact O-N 2.94Å; A240-T242 PolarHBondContact O-N 3.14Å
241	E	48.1	Very low	43	Very low	116 Å²	116	133.6 Å²	133.6	54%	0.542	74%	0.737	S	S	.	*			trans	-73.8	112.2	175.7	-75.3	-175.7	-171.3	0	0	111	K237 Q238 E243	K237-E241 WeakPolarHBondContact CD-OE2 3.29Å; K237-E241 WeakPolarHBondContact CE-OE2 3.39Å; K237-E241 WeakPolarHBondContact CG-OE2 3.43Å; K237-E241 IonicContact NZ-OE2 2.74Å; Q238-E241 PolarHBondContact O-N 3.49Å; Q238-E241 VanDerWaalsContact O-N 3.16Å; E241-E243 PolarHBondContact O-N 2.79Å
242	T	45.4	Very low	42.5	Very low	136 Å²	136	136.3 Å²	136.3	83%	0.834	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-63.8	124.4	175.2	-17.4	0	0	0	0	109.3	A240	A240-T242 PolarHBondContact O-N 3.14Å
243	E	48.4	Very low	41.8	Very low	160 Å²	160	135.1 Å²	135.1	75%	0.748	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-60.9	135.2	175.7	-101.1	-166.4	151.4	0	0	110.5	E241 D245	E241-E243 PolarHBondContact O-N 2.79Å; E243-D245 PolarHBondContact O-N 3.15Å
244	P	41.6	Very low	41.2	Very low	83 Å²	83	136.1 Å²	136.1	54%	0.539	74%	0.737	S	S	.	*	P	Polyproline II helix	trans	-69.2	129.5	171.6	27	-30.9	0	0	0	110.2	F246	P244-F246 HydrophobicContact CG-CE2 4.16Å; P244-F246 WeakPolarHBondContact O-CD2 3.3Å; P244-F246 PolarHBondContact O-N 3.4Å
245	D	38	Very low	40.7	Very low	153 Å²	153	141 Å²	141	82%	0.818	75%	0.752	S	S	*	*			trans	-53.6	102.5	177.7	-86.1	-38.2	0	0	0	112.2	E243 L247	E243-D245 PolarHBondContact O-N 3.15Å; D245-L247 PolarHBondContact O-N 3.08Å
246	F	40.7	Very low	40	Very low	167 Å²	167	142.6 Å²	142.6	73%	0.732	75%	0.754	S	S	*	*	G	3₁₀ helix	trans	-76.1	1.9	178.7	-86.3	-84.1	0	0	0	114.5	P244 K248	P244-F246 HydrophobicContact CG-CE2 4.16Å; P244-F246 WeakPolarHBondContact O-CD2 3.3Å; P244-F246 PolarHBondContact O-N 3.4Å; F246-K248 VanDerWaalsContact C-N 3.25Å; F246-K248 PolarHBondContact O-N 3.39Å; F246-K248 VanDerWaalsContact O-N 3.16Å
247	L	36.4	Very low	39.1	Very low	159 Å²	159	144.5 Å²	144.5	83%	0.832	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-76.1	3.4	-173.6	-76.3	174	0	0	0	115.8	D245	D245-L247 PolarHBondContact O-N 3.08Å
248	K	35.2	Very low	38.1	Very low	198 Å²	198	141.4 Å²	141.4	86%	0.861	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-96.1	6.3	-179	-83.7	-173.4	178.4	177.5	0	116.7	F246	F246-K248 VanDerWaalsContact C-N 3.25Å; F246-K248 PolarHBondContact O-N 3.39Å; F246-K248 VanDerWaalsContact O-N 3.16Å
249	T	34.1	Very low	37.3	Very low	125 Å²	125	141.6 Å²	141.6	77%	0.767	77%	0.766	S	S	*	*			trans	-137.4	63.8	-179	-7	0	0	0	0	112.3	P251	T249-P251 WeakPolarHBondContact O-CD 3.5Å
250	S	34.7	Very low	36.1	Very low	105 Å²	105	139.5 Å²	139.5	73%	0.734	76%	0.756	S	S	*	*			trans	-86	115.7	159	40.1	0	0	0	0	109
251	P	36.2	Very low	35	Very low	94 Å²	94	140.6 Å²	140.6	61%	0.61	75%	0.754	S	S	*	*			trans	-73.6	135.8	169.4	26.8	-25.1	0	0	0	109.4	T249 F253	T249-P251 WeakPolarHBondContact O-CD 3.5Å; P251-F253 HydrophobicContact CG-CE2 4.02Å; P251-F253 WeakPolarHBondContact O-CD2 3.36Å; P251-F253 PolarHBondContact O-N 3.42Å; P251-F253 VanDerWaalsContact O-N 3.07Å
252	I	31.5	Very low	34.3	Very low	145 Å²	145	142.3 Å²	142.3	74%	0.744	77%	0.767	S	S	*	*			trans	-63.2	102.4	178.6	-59.3	161.4	0	0	0	108.1
253	F	29.8	Very low	33.4	Very low	178 Å²	178	143.8 Å²	143.8	78%	0.781	77%	0.769	S	S	*	*			trans	-87.8	113.8	166.6	-81.5	-83.7	0	0	0	108	P251 D255	P251-F253 HydrophobicContact CG-CE2 4.02Å; P251-F253 WeakPolarHBondContact O-CD2 3.36Å; P251-F253 PolarHBondContact O-N 3.42Å; P251-F253 VanDerWaalsContact O-N 3.07Å; F253-D255 PolarHBondContact O-N 3.12Å
254	H	30.2	Very low	32.6	Very low	160 Å²	160	140.6 Å²	140.6	74%	0.741	77%	0.77	S	S	*	*			trans	-72.3	112.4	172.9	-84.8	-70.8	0	0	0	109.6	N256	H254-N256 PolarHBondContact O-N 3.42Å
255	D	31	Very low	31.9	Very low	149 Å²	149	142.5 Å²	142.5	80%	0.797	78%	0.784	S	S	*	*			trans	-68.6	101	169.7	-78.7	-35.7	0	0	0	110.3	F253	F253-D255 PolarHBondContact O-N 3.12Å
256	N	29	Very low	31.6	Very low	152 Å²	152	143.3 Å²	143.3	81%	0.813	79%	0.788	S	S	*	*			trans	-103.4	74.3	164	-72.4	-16.9	0	0	0	108.6	H254	H254-N256 PolarHBondContact O-N 3.42Å
257	N	30.2	Very low	31.2	Very low	162 Å²	162	141.5 Å²	141.5	87%	0.866	79%	0.79	S	S	*	*			trans	-116.8	84	169.8	-100.5	-11.1	0	0	0	109.1
258	A	28.2	Very low	30.8	Very low	84 Å²	84	140.2 Å²	140.2	69%	0.694	79%	0.789	S	S	*	*			trans	-91.4	150.9	154.9	0	0	0	0	0	107.8
259	D	32	Very low	30.6	Very low	164 Å²	164	137.6 Å²	137.6	88%	0.877	78%	0.784	S	S	*	*			trans	95.4	59.4	177.5	-50.2	-20.5	0	0	0	115.5
260	N	24.8	Very low	30.7	Very low	149 Å²	149	141 Å²	141	80%	0.797	79%	0.792	S	S	*	*			trans	-98.8	95.6	161.5	-172	12.9	0	0	0	108.9
261	T	29.6	Very low	30.6	Very low	114 Å²	114	141.8 Å²	141.8	70%	0.699	79%	0.791	S	S	*	*			trans	-144.3	142.3	163.1	50.9	0	0	0	0	110.2
262	N	32.7	Very low	30.3	Very low	152 Å²	152	146.3 Å²	146.3	81%	0.813	80%	0.804	S	S	*	*			trans	102.1	52.9	169.6	-46.4	-28.1	0	0	0	117.1
263	N	27.2	Very low	30.3	Very low	166 Å²	166	149 Å²	149	89%	0.888	81%	0.811	S	S	*	*			trans	-98.1	90.4	148.9	-81.5	-20.4	0	0	0	108.6
264	A	32.4	Very low	30.1	Very low	94 Å²	94	145.4 Å²	145.4	78%	0.777	81%	0.808	S	S	*	*			trans	-110	106.1	169.7	0	0	0	0	0	109
265	C	27.1	Very low	30	Very low	122 Å²	122	150.7 Å²	150.7	82%	0.824	83%	0.833	S	S	*	*			trans	-63.1	122.5	176.8	-169.7	0	0	0	0	110.2	T267	C265-T267 PolarHBondContact O-N 3.14Å
266	L	31.6	Very low	30	Very low	171 Å²	171	150.8 Å²	150.8	90%	0.895	84%	0.835	S	S	*	*			trans	-86.9	107.7	171.5	-80.4	164.3	0	0	0	109
267	T	31	Very low	30	Very low	128 Å²	128	150.7 Å²	150.7	79%	0.785	84%	0.836	S	S	*	*			trans	-69	138.9	174.5	22.2	0	0	0	0	112.4	C265	C265-T267 PolarHBondContact O-N 3.14Å
268	V	28.3	Very low	30	Very low	133 Å²	133	150.1 Å²	150.1	81%	0.806	83%	0.834	S	S	*	*			trans	-75.1	125.4	174	174.9	0	0	0	0	109.4
269	D	31.9	Very low	30.1	Very low	143 Å²	143	154 Å²	154	77%	0.765	84%	0.843	S	S	*	*			trans	-167.3	91	161.7	-92.9	-32	0	0	0	110.2
270	Q	34.9	Very low	30	Very low	196 Å²	196	153.4 Å²	153.4	92%	0.916	84%	0.84	S	S	*	*			trans	-142.8	90.9	149.1	-75.2	-157.5	-19.5	0	0	108.4	E272	Q270-E272 PolarHBondContact O-N 3.48Å
271	V	32.9	Very low	30.3	Very low	121 Å²	121	153.7 Å²	153.7	73%	0.733	84%	0.843	S	S	*	*			trans	-71.7	116.2	171.2	170.1	0	0	0	0	108.4	K273	V271-K273 PolarHBondContact O-N 3.34Å
272	E	29.4	Very low	30.4	Very low	189 Å²	189	156.5 Å²	156.5	88%	0.883	85%	0.854	S	S	*	*			trans	-59.9	119.1	164	-69.6	176.1	151.5	0	0	108.9	Q270	Q270-E272 PolarHBondContact O-N 3.48Å
273	K	31.3	Very low	30.2	Very low	201 Å²	201	156.8 Å²	156.8	87%	0.874	86%	0.857	S	S	*	*			trans	-100.9	113.6	166.5	-106.9	-179.3	177.7	179.3	0	108.8	V271	V271-K273 PolarHBondContact O-N 3.34Å
274	S	26.8	Very low	30.5	Very low	103 Å²	103	156.1 Å²	156.1	72%	0.72	85%	0.854	S	S	*	*			trans	-61.1	147.9	163.7	46.4	0	0	0	0	113.2
275	E	28.1	Very low	30.3	Very low	272 Å²	272	161.7 Å²	161.7	100%	1.271	86%	0.861	S	S	*	*			trans	67.4	0	161.8	-69.9	-179.7	157.3	0	0	119.5

Retrieved 275 of 275 residues in 48.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).