A0A061I9M9_CRIGR Loading...

TBC1 domain family member 23

AlphaFold DB , UniProt , Accession A0A061I9M9, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Tbc1d23, Length 699 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35	Very low	33.7	Very low	251 Å²	251	159.5 Å²	159.5	100%	1.236	89%	0.892	S	S	*	*				0	93.3	0	-74.4	174	177.6	0	0	106.5
2	A	34.9	Very low	34.2	Very low	106 Å²	106	158.2 Å²	158.2	88%	0.876	89%	0.892	S	S	*	*			trans	-135.8	96.6	173.5	0	0	0	0	0	104.3
3	E	34.9	Very low	34.8	Very low	201 Å²	201	154.2 Å²	154.2	94%	0.939	88%	0.88	S	S	*	*			trans	-102.3	128.1	167.8	-67.8	173.9	162.7	0	0	104
4	G	31.4	Very low	35.2	Very low	76 Å²	76	147.5 Å²	147.5	78%	0.784	86%	0.862	S	S	*	*			cis	114.9	66	32.1	0	0	0	0	0	107.3	E6	G4-E6 PolarHBondContact O-N 3.4Å
5	E	34.4	Very low	36	Very low	198 Å²	198	140.5 Å²	140.5	93%	0.925	83%	0.834	S	S	*	*			trans	-75.6	112.4	172.9	-88	-178.7	154.6	0	0	109.2
6	E	31.8	Very low	37.3	Very low	192 Å²	192	138.3 Å²	138.3	90%	0.897	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-71.6	120.8	174.6	-108.2	175.8	163.9	0	0	110.8	G4	G4-E6 PolarHBondContact O-N 3.4Å
7	L	34.6	Very low	39.8	Very low	173 Å²	173	134.8 Å²	134.8	91%	0.906	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-65.4	121.5	166.6	-78	149.1	0	0	0	110.2
8	L	31.3	Very low	42.7	Very low	163 Å²	163	128.7 Å²	128.7	85%	0.853	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-78.3	134.5	161.8	-74.6	166.8	0	0	0	109.3
9	P	35.5	Very low	45.3	Very low	120 Å²	120	125.5 Å²	125.5	78%	0.779	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-73.1	133.4	-176.6	23.1	-22.9	0	0	0	111.3	S11	P9-S11 PolarHBondContact O-N 3.31Å
10	L	32.3	Very low	47.5	Very low	168 Å²	168	124.5 Å²	124.5	88%	0.88	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-56.7	124	166	-87.7	116.7	0	0	0	109.4	T12	L10-T12 PolarHBondContact O-N 2.86Å; L10-T12 VanDerWaalsContact O-N 3.12Å
11	S	34.2	Very low	49.6	Very low	106 Å²	106	122.1 Å²	122.1	74%	0.741	71%	0.709	S	S	*	*			trans	-63.1	106.5	173.9	53.4	0	0	0	0	111	P9 S13	P9-S11 PolarHBondContact O-N 3.31Å; S11-S13 PolarHBondContact O-N 3.21Å
12	T	39.6	Very low	52.4	Low	144 Å²	144	110.2 Å²	110.2	88%	0.883	65%	0.65	S	S	*	*			trans	-76.4	96	159.2	49.2	0	0	0	0	108.4	L10	L10-T12 PolarHBondContact O-N 2.86Å; L10-T12 VanDerWaalsContact O-N 3.12Å
13	S	41.8	Very low	55.1	Low	106 Å²	106	109.4 Å²	109.4	74%	0.741	63%	0.629	S	S	*	*			trans	-145.9	43.3	176.5	75	0	0	0	0	114.1	S11	S11-S13 PolarHBondContact O-N 3.21Å
14	G	40.7	Very low	57.8	Low	61 Å²	61	105.9 Å²	105.9	63%	0.629	61%	0.612	S	S	*	*	S	Bend	trans	-117.2	-17.1	172.6	0	0	0	0	0	115.4
15	G	46.9	Very low	60.7	Low	43 Å²	43	103 Å²	103	44%	0.443	58%	0.581	S	S	.	*	S	Bend	trans	-75.8	-41.6	-176.3	0	0	0	0	0	114.2	S17 W18	G15-S17 PolarHBondContact O-N 3.31Å; G15-W18 VanDerWaalsContact O-CD1 3.27Å; G15-W18 PolarHBondContact O-NE1 3.44Å
16	D	56.8	Low	63.3	Low	105 Å²	105	94.3 Å²	94.3	56%	0.561	54%	0.541	S	S	*	.	H	α-helix	trans	-79.2	-15.5	-169	-77.5	12.2	0	0	0	115.8	K20	D16-K20 WeakPolarHBondContact O-CB 3.45Å; D16-K20 WeakPolarHBondContact O-CD 3.44Å; D16-K20 VanDerWaalsContact O-CG 3.25Å; D16-K20 WeakPolarHBondContact O-CG 3.43Å; D16-K20 PolarHBondContact O-N 3.36Å; D16-K20 IonicContact OD2-NZ 4Å
17	S	80.8	Confident	66.1	Low	78 Å²	78	93.2 Å²	93.2	55%	0.545	54%	0.536	S	S	.	.	H	α-helix	trans	-72.9	-48.7	-169.3	-168	0	0	0	0	112	G15 K20 D21	G15-S17 PolarHBondContact O-N 3.31Å; S17-K20 PolarHBondContact O-N 3.02Å; S17-D21 PolarHBondContact O-N 3.45Å
18	W	90.9	Very high	68.4	Low	25 Å²	25	90.5 Å²	90.5	10%	0.095	53%	0.526	C	S	.	.	H	α-helix	trans	-77.3	-28.7	-174.2	74.2	-83.5	0	0	0	112.7	G15 D21 L22 I39 I40 R43 P44 P46	G15-W18 VanDerWaalsContact O-CD1 3.27Å; G15-W18 PolarHBondContact O-NE1 3.44Å; W18-D21 PolarHBondContact O-N 3.48Å; W18-L22 HydrophobicContact CZ3-CD2 4.1Å; W18-L22 WeakPolarHBondContact O-CB 3.45Å; W18-L22 PolarHBondContact O-N 2.72Å; W18-I39 WeakPolarHBondContact O-CG2 3.38Å; W18-I40 HydrophobicContact CZ3-CG1 4.48Å; W18-R43 VanDerWaalsContact CB-NH1 3.34Å; W18-R43 HydrophobicContact CH2-CB 4.05Å; W18-R43 HydrophobicContact CZ2-CB 4.03Å; W18-P44 WeakPolarHBondContact CH2-O 3.34Å; W18-P46 HydrophobicContact CH2-CG 4.48Å
19	E	91.9	Very high	70.4	Confident	69 Å²	69	84.9 Å²	84.9	32%	0.322	51%	0.508	S	S	.	.	H	α-helix	trans	-66.3	-41.8	173.6	-66.6	-176.7	-170.4	0	0	110.2	L22 E23 P46	E19-L22 WeakPolarHBondContact O-CB 3.25Å; E19-L22 PolarHBondContact O-N 2.98Å; E19-E23 WeakPolarHBondContact O-CG 3.45Å; E19-E23 PolarHBondContact O-N 3.5Å; E19-P46 HydrophobicContact CG-CG 4.16Å
20	K	90.9	Very high	72.1	Confident	104 Å²	104	83.4 Å²	83.4	45%	0.452	51%	0.514	S	S	.	.	H	α-helix	trans	-64.3	-43.1	172.2	-73.2	175.3	-175.3	170.5	0	112.3	D16 S17 L22 E23 E24	D16-K20 WeakPolarHBondContact O-CB 3.45Å; D16-K20 WeakPolarHBondContact O-CD 3.44Å; D16-K20 VanDerWaalsContact O-CG 3.25Å; D16-K20 WeakPolarHBondContact O-CG 3.43Å; D16-K20 PolarHBondContact O-N 3.36Å; D16-K20 IonicContact OD2-NZ 4Å; S17-K20 PolarHBondContact O-N 3.02Å; K20-L22 PolarHBondContact O-N 3.12Å; K20-E23 PolarHBondContact O-N 3.31Å; K20-E24 WeakPolarHBondContact O-CB 3.24Å; K20-E24 WeakPolarHBondContact O-CG 3.46Å; K20-E24 PolarHBondContact O-N 3.25Å
21	D	91.4	Very high	74.4	Confident	76 Å²	76	76.6 Å²	76.6	41%	0.406	48%	0.481	S	S	.	.	H	α-helix	trans	-59.1	-37.3	175.1	-61.5	-28.5	0	0	0	111	S17 W18 A25 I39	S17-D21 PolarHBondContact O-N 3.45Å; W18-D21 PolarHBondContact O-N 3.48Å; D21-A25 VanDerWaalsContact O-CB 3.24Å; D21-A25 WeakPolarHBondContact O-CB 3.25Å; D21-A25 PolarHBondContact O-N 3.2Å; D21-I39 HydrophobicContact CB-CG2 4.13Å
22	L	92.9	Very high	76.9	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	47%	0.467	C	S	.	.	H	α-helix	trans	-69.4	-44.9	175.5	-179.9	62	0	0	0	112	W18 E19 K20 A25 L26 L36 I39 I40 L45 L49 V53	W18-L22 HydrophobicContact CZ3-CD2 4.1Å; W18-L22 WeakPolarHBondContact O-CB 3.45Å; W18-L22 PolarHBondContact O-N 2.72Å; E19-L22 WeakPolarHBondContact O-CB 3.25Å; E19-L22 PolarHBondContact O-N 2.98Å; K20-L22 PolarHBondContact O-N 3.12Å; L22-A25 PolarHBondContact O-N 3Å; L22-L26 HydrophobicContact CD1-CD1 4.13Å; L22-L26 HydrophobicContact CD1-CG 4.28Å; L22-L26 HydrophobicContact CG-CD1 4.08Å; L22-L26 WeakPolarHBondContact O-CB 3.46Å; L22-L26 VanDerWaalsContact O-CG 3.25Å; L22-L26 WeakPolarHBondContact O-CG 3.48Å; L22-L26 PolarHBondContact O-N 2.91Å; L22-L36 HydrophobicContact CD1-CD2 3.53Å; L22-I39 HydrophobicContact CB-CG2 3.95Å; L22-I40 HydrophobicContact CD1-CD1 4.42Å; L22-I40 HydrophobicContact CD1-CG1 4.26Å; L22-I40 HydrophobicContact CD2-CG1 4.18Å; L22-L45 HydrophobicContact CD2-CD2 4.19Å; L22-L49 HydrophobicContact CD2-CD1 3.87Å; L22-L49 HydrophobicContact CG-CD1 4.05Å; L22-V53 HydrophobicContact CD1-CG2 4.33Å
23	E	93	Very high	79.3	Confident	90 Å²	90	70.4 Å²	70.4	42%	0.421	43%	0.434	S	S	.	.	H	α-helix	trans	-57.8	-50.1	174.8	-73.8	175.9	174.1	0	0	111.1	E19 K20 A25 L26 E27 L49	E19-E23 WeakPolarHBondContact O-CG 3.45Å; E19-E23 PolarHBondContact O-N 3.5Å; K20-E23 PolarHBondContact O-N 3.31Å; E23-A25 VanDerWaalsContact C-N 3.35Å; E23-A25 PolarHBondContact O-N 3.43Å; E23-L26 PolarHBondContact O-N 2.92Å; E23-E27 WeakPolarHBondContact O-CG 3.36Å; E23-E27 PolarHBondContact O-N 3.02Å; E23-L49 HydrophobicContact CG-CD1 3.68Å; E23-L49 HydrophobicContact CG-CD2 4.06Å; E23-L49 HydrophobicContact CG-CG 4.46Å
24	E	91.5	Very high	81.6	Confident	126 Å²	126	70.8 Å²	70.8	59%	0.589	42%	0.424	S	S	*	.	H	α-helix	trans	-62	-40.7	179	-72	-177.5	-171.6	0	0	112	K20 L26 E27 T28	K20-E24 WeakPolarHBondContact O-CB 3.24Å; K20-E24 WeakPolarHBondContact O-CG 3.46Å; K20-E24 PolarHBondContact O-N 3.25Å; E24-L26 VanDerWaalsContact C-N 3.34Å; E24-L26 PolarHBondContact O-N 3.23Å; E24-E27 PolarHBondContact O-N 3.22Å; E24-T28 WeakPolarHBondContact O-CB 3.36Å; E24-T28 WeakPolarHBondContact O-CG2 3.41Å; E24-T28 PolarHBondContact O-N 3.42Å; E24-T28 PolarHBondContact O-OG1 3.38Å
25	A	90.8	Very high	83.9	Confident	15 Å²	15	71 Å²	71	12%	0.124	41%	0.413	C	S	.	.	H	α-helix	trans	-65.6	-36.5	177.3	0	0	0	0	0	112.7	D21 L22 E23 T28 I39	D21-A25 VanDerWaalsContact O-CB 3.24Å; D21-A25 WeakPolarHBondContact O-CB 3.25Å; D21-A25 PolarHBondContact O-N 3.2Å; L22-A25 PolarHBondContact O-N 3Å; E23-A25 VanDerWaalsContact C-N 3.35Å; E23-A25 PolarHBondContact O-N 3.43Å; A25-T28 PolarHBondContact O-OG1 2.86Å; A25-I39 HydrophobicContact CB-CD1 3.8Å
26	L	90.8	Very high	86	Confident	16 Å²	16	69 Å²	69	8%	0.084	39%	0.392	C	S	.	.	H	α-helix	trans	-73.8	-38.3	176.7	-70.2	171.7	0	0	0	111.9	L22 E23 E24 G29 L36 L49 Q52 V53 I56	L22-L26 HydrophobicContact CD1-CD1 4.13Å; L22-L26 HydrophobicContact CD1-CG 4.28Å; L22-L26 HydrophobicContact CG-CD1 4.08Å; L22-L26 WeakPolarHBondContact O-CB 3.46Å; L22-L26 VanDerWaalsContact O-CG 3.25Å; L22-L26 WeakPolarHBondContact O-CG 3.48Å; L22-L26 PolarHBondContact O-N 2.91Å; E23-L26 PolarHBondContact O-N 2.92Å; E24-L26 VanDerWaalsContact C-N 3.34Å; E24-L26 PolarHBondContact O-N 3.23Å; L26-G29 PolarHBondContact O-N 3.43Å; L26-L36 HydrophobicContact CD2-CD1 4.38Å; L26-L36 HydrophobicContact CD2-CD2 4.01Å; L26-L36 HydrophobicContact CG-CD2 4.4Å; L26-L49 HydrophobicContact CD1-CB 4.12Å; L26-L49 HydrophobicContact CD1-CD2 4.13Å; L26-L49 HydrophobicContact CD1-CG 4.48Å; L26-Q52 HydrophobicContact CD1-CB 4.16Å; L26-Q52 HydrophobicContact CD2-CB 4.07Å; L26-V53 HydrophobicContact CD1-CG2 4.17Å; L26-I56 HydrophobicContact CD2-CD1 3.44Å; L26-I56 VanDerWaalsContact CD2-CD1 3.44Å
27	E	88.9	Confident	87.6	Confident	169 Å²	169	69 Å²	69	79%	0.79	38%	0.384	S	S	*	.	H	α-helix	trans	-70.1	-40.1	178.7	-76.9	-171.1	172.2	0	0	113.4	E23 E24 G29	E23-E27 WeakPolarHBondContact O-CG 3.36Å; E23-E27 PolarHBondContact O-N 3.02Å; E24-E27 PolarHBondContact O-N 3.22Å; E27-G29 PolarHBondContact O-N 3.35Å
28	T	83.1	Confident	88.1	Confident	116 Å²	116	69.8 Å²	69.8	71%	0.712	38%	0.382	S	S	*	.	H	α-helix	trans	-64.1	-24.1	178.6	41.2	0	0	0	0	112.6	E24 A25	E24-T28 WeakPolarHBondContact O-CB 3.36Å; E24-T28 WeakPolarHBondContact O-CG2 3.41Å; E24-T28 PolarHBondContact O-N 3.42Å; E24-T28 PolarHBondContact O-OG1 3.38Å; A25-T28 PolarHBondContact O-OG1 2.86Å
29	G	73.6	Confident	88.1	Confident	46 Å²	46	70.2 Å²	70.2	47%	0.474	39%	0.386	S	S	.	.			trans	74.3	160.8	175.5	0	0	0	0	0	113.7	L26 E27 C31	L26-G29 PolarHBondContact O-N 3.43Å; E27-G29 PolarHBondContact O-N 3.35Å; G29-C31 VanDerWaalsContact C-N 3.26Å; G29-C31 PolarHBondContact O-N 3.23Å
30	G	70.6	Confident	88.2	Confident	88 Å²	88	66.9 Å²	66.9	91%	0.907	37%	0.371	S	S	*	.			trans	71.6	13.2	178.3	0	0	0	0	0	115.4
31	C	81.4	Confident	88.1	Confident	26 Å²	26	68.1 Å²	68.1	18%	0.176	38%	0.378	C	S	.	.			trans	-71.5	140.2	172.8	86.2	0	0	0	0	110.9	G29 L36	G29-C31 VanDerWaalsContact C-N 3.26Å; G29-C31 PolarHBondContact O-N 3.23Å; C31-L36 WeakPolarHBondContact SG-CD2 3.45Å; C31-L36 WeakPolarHBondContact SG-CG 3.2Å
32	D	86.2	Confident	87.8	Confident	85 Å²	85	68 Å²	68	46%	0.455	39%	0.394	S	S	.	.			trans	-88.8	165.7	173.8	63.1	15.4	0	0	0	111.8	E34 T35 L36	D32-E34 PolarHBondContact O-N 3.21Å; D32-T35 PolarHBondContact O-N 3.43Å; D32-T35 WeakPolarHBondContact OD1-CB 3.5Å; D32-T35 PolarHBondContact OD1-N 3.19Å; D32-T35 PolarHBondContact OD1-OG1 3.22Å; D32-L36 PolarHBondContact O-N 2.61Å
33	L	89.6	Confident	87.6	Confident	35 Å²	35	72.6 Å²	72.6	18%	0.183	41%	0.411	C	S	.	.	H	α-helix	trans	-60.7	-31.7	-179.9	-176.7	60	0	0	0	112.5	L36 R37 A57 A225	L33-L36 PolarHBondContact O-N 3.48Å; L33-R37 WeakPolarHBondContact O-CB 3.48Å; L33-R37 PolarHBondContact O-N 3.09Å; L33-A57 HydrophobicContact CD1-CB 3.68Å; L33-A57 HydrophobicContact CD2-CB 4.37Å; L33-A225 HydrophobicContact CD2-CB 3.69Å
34	E	90	Very high	87.5	Confident	113 Å²	113	73.6 Å²	73.6	53%	0.528	43%	0.426	S	S	.	.	H	α-helix	trans	-69	-42.2	-178.6	-176.4	154.4	-145	0	0	111.7	D32 R37 N38	D32-E34 PolarHBondContact O-N 3.21Å; E34-R37 PolarHBondContact O-N 2.94Å; E34-R37 IonicContact OE1-NH2 3.94Å; E34-R37 PolarHBondContact OE1-NH2 3.3Å; E34-N38 PolarHBondContact O-N 3.48Å; E34-N38 PolarHBondContact O-ND2 3.17Å
35	T	89.4	Confident	87.6	Confident	66 Å²	66	68 Å²	68	41%	0.405	40%	0.4	S	S	.	.	H	α-helix	trans	-60.9	-47.1	173.2	-55.7	0	0	0	0	110.9	D32 R37 N38 I39	D32-T35 PolarHBondContact O-N 3.43Å; D32-T35 WeakPolarHBondContact OD1-CB 3.5Å; D32-T35 PolarHBondContact OD1-N 3.19Å; D32-T35 PolarHBondContact OD1-OG1 3.22Å; T35-R37 PolarHBondContact O-N 3.07Å; T35-N38 WeakPolarHBondContact O-CB 3.28Å; T35-N38 PolarHBondContact O-N 3.02Å; T35-I39 HydrophobicContact CG2-CD1 4.32Å; T35-I39 WeakPolarHBondContact O-CG1 3.09Å; T35-I39 PolarHBondContact O-N 3.39Å
36	L	90.5	Very high	87.7	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	40%	0.403	C	S	.	.	H	α-helix	trans	-58.9	-46.3	177	-68.7	-179.6	0	0	0	112	L22 L26 C31 D32 L33 N38 I39 I40 I56	L22-L36 HydrophobicContact CD1-CD2 3.53Å; L26-L36 HydrophobicContact CD2-CD1 4.38Å; L26-L36 HydrophobicContact CD2-CD2 4.01Å; L26-L36 HydrophobicContact CG-CD2 4.4Å; C31-L36 WeakPolarHBondContact SG-CD2 3.45Å; C31-L36 WeakPolarHBondContact SG-CG 3.2Å; D32-L36 PolarHBondContact O-N 2.61Å; L33-L36 PolarHBondContact O-N 3.48Å; L36-N38 PolarHBondContact O-N 3.12Å; L36-I39 PolarHBondContact O-N 3.3Å; L36-I39 VanDerWaalsContact O-N 3.09Å; L36-I40 HydrophobicContact CB-CD1 4.23Å; L36-I40 WeakPolarHBondContact O-CD1 3.37Å; L36-I40 VanDerWaalsContact O-CG1 3.28Å; L36-I40 WeakPolarHBondContact O-CG1 3.45Å; L36-I40 PolarHBondContact O-N 3.08Å; L36-I56 HydrophobicContact CD1-CB 3.9Å; L36-I56 HydrophobicContact CD1-CD1 3.76Å; L36-I56 HydrophobicContact CD1-CG1 4.44Å; L36-I56 HydrophobicContact CD1-CG2 3.61Å
37	R	91.1	Very high	87.8	Confident	105 Å²	105	71.1 Å²	71.1	40%	0.396	43%	0.426	S	S	.	.	H	α-helix	trans	-58.8	-38.3	178.5	-172.5	-178.9	67	-168.6	-2.9	111.8	L33 E34 T35 I39 Q41	L33-R37 WeakPolarHBondContact O-CB 3.48Å; L33-R37 PolarHBondContact O-N 3.09Å; E34-R37 PolarHBondContact O-N 2.94Å; E34-R37 IonicContact OE1-NH2 3.94Å; E34-R37 PolarHBondContact OE1-NH2 3.3Å; T35-R37 PolarHBondContact O-N 3.07Å; R37-I39 VanDerWaalsContact C-N 3.31Å; R37-I39 PolarHBondContact O-N 3.1Å; R37-Q41 PolarHBondContact O-N 3.17Å
38	N	91.2	Very high	87.9	Confident	95 Å²	95	71 Å²	71	51%	0.508	43%	0.425	S	S	.	.	H	α-helix	trans	-68.8	-28.3	178.6	-68.5	-25.6	0	0	0	113.4	E34 T35 L36 Q41	E34-N38 PolarHBondContact O-N 3.48Å; E34-N38 PolarHBondContact O-ND2 3.17Å; T35-N38 WeakPolarHBondContact O-CB 3.28Å; T35-N38 PolarHBondContact O-N 3.02Å; L36-N38 PolarHBondContact O-N 3.12Å; N38-Q41 WeakPolarHBondContact O-CG 3.4Å; N38-Q41 PolarHBondContact O-NE2 3.28Å; N38-Q41 VanDerWaalsContact O-NE2 3.12Å
39	I	91.8	Very high	88.4	Confident	34 Å²	34	66.2 Å²	66.2	17%	0.174	40%	0.395	C	S	.	.	H	α-helix	trans	-78.5	-48.1	175	-61.9	166.3	0	0	0	110.2	W18 D21 L22 A25 T35 L36 R37	W18-I39 WeakPolarHBondContact O-CG2 3.38Å; D21-I39 HydrophobicContact CB-CG2 4.13Å; L22-I39 HydrophobicContact CB-CG2 3.95Å; A25-I39 HydrophobicContact CB-CD1 3.8Å; T35-I39 HydrophobicContact CG2-CD1 4.32Å; T35-I39 WeakPolarHBondContact O-CG1 3.09Å; T35-I39 PolarHBondContact O-N 3.39Å; L36-I39 PolarHBondContact O-N 3.3Å; L36-I39 VanDerWaalsContact O-N 3.09Å; R37-I39 VanDerWaalsContact C-N 3.31Å; R37-I39 PolarHBondContact O-N 3.1Å
40	I	92.9	Very high	89.5	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-70.4	-41.2	-174.5	-61.2	156.3	0	0	0	111.4	W18 L22 L36 G42 R43 L45 V53 Q223	W18-I40 HydrophobicContact CZ3-CG1 4.48Å; L22-I40 HydrophobicContact CD1-CD1 4.42Å; L22-I40 HydrophobicContact CD1-CG1 4.26Å; L22-I40 HydrophobicContact CD2-CG1 4.18Å; L36-I40 HydrophobicContact CB-CD1 4.23Å; L36-I40 WeakPolarHBondContact O-CD1 3.37Å; L36-I40 VanDerWaalsContact O-CG1 3.28Å; L36-I40 WeakPolarHBondContact O-CG1 3.45Å; L36-I40 PolarHBondContact O-N 3.08Å; I40-G42 PolarHBondContact O-N 3.19Å; I40-G42 VanDerWaalsContact O-N 3.16Å; I40-R43 WeakPolarHBondContact CG2-O 3.39Å; I40-R43 WeakPolarHBondContact O-CB 3.48Å; I40-R43 VanDerWaalsContact O-CG 3.23Å; I40-R43 WeakPolarHBondContact O-CG 3.47Å; I40-R43 PolarHBondContact O-N 3.2Å; I40-L45 HydrophobicContact CD1-CD2 3.69Å; I40-L45 HydrophobicContact CG1-CD2 3.87Å; I40-L45 HydrophobicContact CG2-CD2 4.03Å; I40-V53 HydrophobicContact CD1-CG1 4.08Å; I40-Q223 HydrophobicContact CD1-CG 4.5Å; I40-Q223 VanDerWaalsContact CD1-OE1 3.31Å
41	Q	89.1	Confident	90.7	Very high	130 Å²	130	61.8 Å²	61.8	61%	0.607	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	37.4	178.7	-56.2	-174.4	-16	0	0	114.2	R37 N38 R43	R37-Q41 PolarHBondContact O-N 3.17Å; N38-Q41 WeakPolarHBondContact O-CG 3.4Å; N38-Q41 PolarHBondContact O-NE2 3.28Å; N38-Q41 VanDerWaalsContact O-NE2 3.12Å; Q41-R43 VanDerWaalsContact C-N 3.25Å; Q41-R43 PolarHBondContact O-N 3.31Å
42	G	84.8	Confident	91.2	Very high	72 Å²	72	64.8 Å²	64.8	74%	0.742	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	6.9	-179.7	0	0	0	0	0	115.2	I40	I40-G42 PolarHBondContact O-N 3.19Å; I40-G42 VanDerWaalsContact O-N 3.16Å
43	R	89.9	Confident	91.7	Very high	97 Å²	97	60.8 Å²	60.8	37%	0.366	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-70.8	154.4	174.2	-63.3	172.9	-164.7	158.2	11.8	111.2	W18 I40 Q41 L45	W18-R43 VanDerWaalsContact CB-NH1 3.34Å; W18-R43 HydrophobicContact CH2-CB 4.05Å; W18-R43 HydrophobicContact CZ2-CB 4.03Å; I40-R43 WeakPolarHBondContact CG2-O 3.39Å; I40-R43 WeakPolarHBondContact O-CB 3.48Å; I40-R43 VanDerWaalsContact O-CG 3.23Å; I40-R43 WeakPolarHBondContact O-CG 3.47Å; I40-R43 PolarHBondContact O-N 3.2Å; Q41-R43 VanDerWaalsContact C-N 3.25Å; Q41-R43 PolarHBondContact O-N 3.31Å; R43-L45 PolarHBondContact O-N 3.27Å
44	P	90.6	Very high	92	Very high	111 Å²	111	59.3 Å²	59.3	72%	0.721	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-62.6	133.8	178.7	25.7	-34.9	0	0	0	111.3	W18	W18-P44 WeakPolarHBondContact CH2-O 3.34Å
45	L	93.5	Very high	92.2	Very high	10 Å²	10	55.9 Å²	55.9	5%	0.052	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-75.7	136	-178.5	-76.2	177.3	0	0	0	112.2	L22 I40 R43 R50 V53 D219	L22-L45 HydrophobicContact CD2-CD2 4.19Å; I40-L45 HydrophobicContact CD1-CD2 3.69Å; I40-L45 HydrophobicContact CG1-CD2 3.87Å; I40-L45 HydrophobicContact CG2-CD2 4.03Å; R43-L45 PolarHBondContact O-N 3.27Å; L45-R50 PolarHBondContact O-NH2 3.04Å; L45-V53 HydrophobicContact CD1-CB 4.19Å; L45-V53 HydrophobicContact CD1-CG1 3.83Å; L45-V53 HydrophobicContact CD2-CG1 4.43Å; L45-V53 HydrophobicContact CD2-CG2 4.25Å; L45-D219 HydrophobicContact CD1-CB 4.01Å; L45-D219 HydrophobicContact CG-CB 4.47Å
46	P	93.3	Very high	92.4	Very high	29 Å²	29	54.3 Å²	54.3	19%	0.188	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-60	139.2	168.4	-23.7	35	0	0	0	111.3	W18 E19 E48 L49 R50	W18-P46 HydrophobicContact CH2-CG 4.48Å; E19-P46 HydrophobicContact CG-CG 4.16Å; P46-E48 VanDerWaalsContact C-N 3.3Å; P46-E48 PolarHBondContact O-N 3.3Å; P46-L49 HydrophobicContact CB-CB 4.46Å; P46-L49 HydrophobicContact CB-CD1 4.25Å; P46-L49 HydrophobicContact CB-CG 4.28Å; P46-L49 HydrophobicContact CG-CD1 4.13Å; P46-L49 PolarHBondContact O-N 2.84Å; P46-R50 PolarHBondContact O-N 3.22Å; P46-R50 VanDerWaalsContact O-N 3.08Å
47	A	91.4	Very high	92.6	Very high	67 Å²	67	54.4 Å²	54.4	55%	0.554	30%	0.295	S	S	*	.	H	α-helix	trans	-59.2	-40.1	-175.2	0	0	0	0	0	113.4	L49 R50	A47-L49 VanDerWaalsContact C-N 3.29Å; A47-L49 PolarHBondContact O-N 3.34Å; A47-R50 PolarHBondContact O-N 3.41Å
48	E	92.5	Very high	92.8	Very high	166 Å²	166	49.9 Å²	49.9	78%	0.776	28%	0.279	S	S	*	.	H	α-helix	trans	-68	-28.3	-178.6	-54	-55.6	149.8	0	0	112.9	P46	P46-E48 VanDerWaalsContact C-N 3.3Å; P46-E48 PolarHBondContact O-N 3.3Å
49	L	93.9	Very high	92.9	Very high	15 Å²	15	52.3 Å²	52.3	8%	0.079	29%	0.292	C	S	.	.	H	α-helix	trans	-95.5	-18.5	-177.1	-55.4	180	0	0	0	112.8	L22 E23 L26 P46 A47 A51 Q52 V53	L22-L49 HydrophobicContact CD2-CD1 3.87Å; L22-L49 HydrophobicContact CG-CD1 4.05Å; E23-L49 HydrophobicContact CG-CD1 3.68Å; E23-L49 HydrophobicContact CG-CD2 4.06Å; E23-L49 HydrophobicContact CG-CG 4.46Å; L26-L49 HydrophobicContact CD1-CB 4.12Å; L26-L49 HydrophobicContact CD1-CD2 4.13Å; L26-L49 HydrophobicContact CD1-CG 4.48Å; P46-L49 HydrophobicContact CB-CB 4.46Å; P46-L49 HydrophobicContact CB-CD1 4.25Å; P46-L49 HydrophobicContact CB-CG 4.28Å; P46-L49 HydrophobicContact CG-CD1 4.13Å; P46-L49 PolarHBondContact O-N 2.84Å; A47-L49 VanDerWaalsContact C-N 3.29Å; A47-L49 PolarHBondContact O-N 3.34Å; L49-A51 VanDerWaalsContact C-N 3.29Å; L49-A51 PolarHBondContact O-N 3.27Å; L49-Q52 PolarHBondContact O-N 2.92Å; L49-V53 PolarHBondContact O-N 3.45Å; L49-V53 VanDerWaalsContact O-N 3.07Å
50	R	95.6	Very high	92.9	Very high	24 Å²	24	51 Å²	51	9%	0.091	29%	0.285	C	S	.	.	H	α-helix	trans	-52.6	-44.8	-176.3	-176.5	174.9	-75.2	98.6	9.4	112.6	L45 P46 A47 Q52 V53 W54 L138 D219	L45-R50 PolarHBondContact O-NH2 3.04Å; P46-R50 PolarHBondContact O-N 3.22Å; P46-R50 VanDerWaalsContact O-N 3.08Å; A47-R50 PolarHBondContact O-N 3.41Å; R50-Q52 VanDerWaalsContact C-N 3.31Å; R50-Q52 PolarHBondContact O-N 3.23Å; R50-V53 PolarHBondContact O-N 3.17Å; R50-W54 HydrophobicContact CG-CD2 4.23Å; R50-W54 HydrophobicContact CG-CG 4.25Å; R50-W54 HydrophobicContact CG-CZ2 4.25Å; R50-W54 WeakPolarHBondContact O-CB 3.42Å; R50-W54 PolarHBondContact O-N 2.92Å; R50-L138 HydrophobicContact CB-CD2 4.02Å; R50-L138 HydrophobicContact CG-CD2 3.76Å; R50-D219 WeakPolarHBondContact CD-OD1 3.4Å; R50-D219 IonicContact CZ-OD1 3.93Å; R50-D219 IonicContact CZ-OD2 3.67Å; R50-D219 IonicContact NE-OD1 3.64Å; R50-D219 PolarHBondContact NE-OD1 2.94Å; R50-D219 IonicContact NE-OD2 2.78Å; R50-D219 PolarHBondContact NE-OD2 2.97Å; R50-D219 IonicContact NH2-OD2 3.98Å; R50-D219 PolarHBondContact NH2-OD2 3.42Å
51	A	95.3	Very high	92.6	Very high	18 Å²	18	53.9 Å²	53.9	15%	0.149	31%	0.31	C	S	.	.	H	α-helix	trans	-59	-40.8	179.5	0	0	0	0	0	112.6	L49 K55 L138 L140	L49-A51 VanDerWaalsContact C-N 3.29Å; L49-A51 PolarHBondContact O-N 3.27Å; A51-K55 VanDerWaalsContact O-CG 3.22Å; A51-K55 WeakPolarHBondContact O-CG 3.35Å; A51-K55 PolarHBondContact O-N 3.06Å; A51-K55 VanDerWaalsContact O-N 3.12Å; A51-L138 HydrophobicContact CB-CD2 4.44Å; A51-L140 HydrophobicContact CB-CD2 3.9Å
52	Q	93.9	Very high	92.2	Very high	89 Å²	89	52 Å²	52	42%	0.416	33%	0.325	S	S	.	.	H	α-helix	trans	-72.3	-45.5	-179.8	-58.5	-172.2	41.8	0	0	111.1	L26 L49 R50 W54 K55 I56	L26-Q52 HydrophobicContact CD1-CB 4.16Å; L26-Q52 HydrophobicContact CD2-CB 4.07Å; L49-Q52 PolarHBondContact O-N 2.92Å; R50-Q52 VanDerWaalsContact C-N 3.31Å; R50-Q52 PolarHBondContact O-N 3.23Å; Q52-W54 VanDerWaalsContact C-N 3.35Å; Q52-W54 PolarHBondContact O-N 2.93Å; Q52-K55 PolarHBondContact O-N 3.17Å; Q52-I56 WeakPolarHBondContact O-CG1 3.37Å; Q52-I56 PolarHBondContact O-N 3.48Å
53	V	95	Very high	92.3	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.006	31%	0.308	C	S	.	.	H	α-helix	trans	-59.8	-45.1	177.2	176.7	0	0	0	0	111	L22 L26 I40 L45 L49 R50 K55 I56 A57	L22-V53 HydrophobicContact CD1-CG2 4.33Å; L26-V53 HydrophobicContact CD1-CG2 4.17Å; I40-V53 HydrophobicContact CD1-CG1 4.08Å; L45-V53 HydrophobicContact CD1-CB 4.19Å; L45-V53 HydrophobicContact CD1-CG1 3.83Å; L45-V53 HydrophobicContact CD2-CG1 4.43Å; L45-V53 HydrophobicContact CD2-CG2 4.25Å; L49-V53 PolarHBondContact O-N 3.45Å; L49-V53 VanDerWaalsContact O-N 3.07Å; R50-V53 PolarHBondContact O-N 3.17Å; V53-K55 PolarHBondContact O-N 2.61Å; V53-I56 PolarHBondContact O-N 3.24Å; V53-A57 WeakPolarHBondContact O-CB 3.33Å; V53-A57 PolarHBondContact O-N 3.37Å
54	W	96.5	Very high	92.1	Very high	4 Å²	4	50.7 Å²	50.7	2%	0.015	32%	0.317	C	S	.	.	H	α-helix	trans	-64.1	-40.3	177.8	-77.9	27.5	0	0	0	112.2	R50 Q52 I56 A57 L58 P134 L135 L138 Q215 W218 D219 L222	R50-W54 HydrophobicContact CG-CD2 4.23Å; R50-W54 HydrophobicContact CG-CG 4.25Å; R50-W54 HydrophobicContact CG-CZ2 4.25Å; R50-W54 WeakPolarHBondContact O-CB 3.42Å; R50-W54 PolarHBondContact O-N 2.92Å; Q52-W54 VanDerWaalsContact C-N 3.35Å; Q52-W54 PolarHBondContact O-N 2.93Å; W54-I56 VanDerWaalsContact C-N 3.3Å; W54-I56 PolarHBondContact O-N 3.12Å; W54-A57 PolarHBondContact O-N 3.35Å; W54-L58 VanDerWaalsContact O-CB 3.28Å; W54-L58 WeakPolarHBondContact O-CB 3.34Å; W54-L58 VanDerWaalsContact O-CG 3.26Å; W54-L58 WeakPolarHBondContact O-CG 3.21Å; W54-L58 PolarHBondContact O-N 3.23Å; W54-P134 HydrophobicContact CH2-CB 3.94Å; W54-P134 HydrophobicContact CZ3-CB 4.09Å; W54-L135 HydrophobicContact CE3-CD2 3.9Å; W54-L135 HydrophobicContact CZ3-CD2 3.92Å; W54-L138 HydrophobicContact CD2-CD1 4.04Å; W54-L138 HydrophobicContact CE3-CD1 3.47Å; W54-L138 VanDerWaalsContact CE3-CD1 3.47Å; W54-L138 HydrophobicContact CZ3-CD1 3.81Å; W54-Q215 HydrophobicContact CH2-CG 4.47Å; W54-W218 HydrophobicContact CE3-CE3 4.2Å; W54-W218 HydrophobicContact CH2-CB 3.49Å; W54-W218 VanDerWaalsContact CH2-CB 3.49Å; W54-W218 HydrophobicContact CH2-CD2 4.07Å; W54-W218 AromaticContact CH2-CE3 3.58Å; W54-W218 HydrophobicContact CH2-CE3 3.58Å; W54-W218 HydrophobicContact CH2-CG 4.09Å; W54-W218 HydrophobicContact CZ2-CB 3.38Å; W54-W218 HydrophobicContact CZ2-CE3 4.48Å; W54-W218 HydrophobicContact CZ2-CG 4.44Å; W54-W218 HydrophobicContact CZ3-CB 4.4Å; W54-W218 HydrophobicContact CZ3-CD2 4.35Å; W54-W218 AromaticContact CZ3-CE3 3.42Å; W54-W218 HydrophobicContact CZ3-CE3 3.42Å; W54-W218 VanDerWaalsContact CZ3-CE3 3.42Å; W54-W218 HydrophobicContact CZ3-CZ3 4.03Å; W54-D219 WeakPolarHBondContact CZ2-OD1 3.21Å; W54-D219 PolarHBondContact NE1-OD1 3.33Å; W54-L222 HydrophobicContact CB-CD1 4.27Å; W54-L222 HydrophobicContact CD2-CD1 3.56Å; W54-L222 HydrophobicContact CE3-CD1 3.91Å; W54-L222 HydrophobicContact CG-CD1 3.73Å
55	K	94.9	Very high	92	Very high	41 Å²	41	48.7 Å²	48.7	18%	0.178	30%	0.3	C	S	.	.	H	α-helix	trans	-61.5	-38.5	175.2	-75	174.8	-168.5	-177.1	0	112.1	A51 Q52 V53 N59 V60 A61 D144	A51-K55 VanDerWaalsContact O-CG 3.22Å; A51-K55 WeakPolarHBondContact O-CG 3.35Å; A51-K55 PolarHBondContact O-N 3.06Å; A51-K55 VanDerWaalsContact O-N 3.12Å; Q52-K55 PolarHBondContact O-N 3.17Å; V53-K55 PolarHBondContact O-N 2.61Å; K55-N59 PolarHBondContact O-N 3.07Å; K55-V60 HydrophobicContact CB-CG2 4.03Å; K55-V60 HydrophobicContact CG-CG2 4.11Å; K55-V60 WeakPolarHBondContact O-CG2 3.22Å; K55-V60 PolarHBondContact O-N 2.92Å; K55-A61 PolarHBondContact O-N 2.98Å; K55-D144 WeakPolarHBondContact CE-OD2 3.38Å; K55-D144 IonicContact NZ-OD2 3.3Å; K55-D144 PolarHBondContact NZ-OD2 3.37Å
56	I	94	Very high	91.5	Very high	33 Å²	33	50 Å²	50	17%	0.169	31%	0.309	C	S	.	.	H	α-helix	trans	-70.4	-45.2	176.6	-65.9	166.1	0	0	0	110.3	L26 L36 Q52 V53 W54 L58 N59 A61	L26-I56 HydrophobicContact CD2-CD1 3.44Å; L26-I56 VanDerWaalsContact CD2-CD1 3.44Å; L36-I56 HydrophobicContact CD1-CB 3.9Å; L36-I56 HydrophobicContact CD1-CD1 3.76Å; L36-I56 HydrophobicContact CD1-CG1 4.44Å; L36-I56 HydrophobicContact CD1-CG2 3.61Å; Q52-I56 WeakPolarHBondContact O-CG1 3.37Å; Q52-I56 PolarHBondContact O-N 3.48Å; V53-I56 PolarHBondContact O-N 3.24Å; W54-I56 VanDerWaalsContact C-N 3.3Å; W54-I56 PolarHBondContact O-N 3.12Å; I56-L58 VanDerWaalsContact C-N 3.27Å; I56-L58 PolarHBondContact O-N 3.44Å; I56-N59 PolarHBondContact O-N 2.88Å; I56-A61 HydrophobicContact CG1-CB 3.96Å
57	A	94.4	Very high	91	Very high	2 Å²	2	49 Å²	49	2%	0.017	30%	0.302	C	S	.	.	H	α-helix	trans	-61	-34.4	177.5	0	0	0	0	0	113.6	L33 V53 W54 N59 L222	L33-A57 HydrophobicContact CD1-CB 3.68Å; L33-A57 HydrophobicContact CD2-CB 4.37Å; V53-A57 WeakPolarHBondContact O-CB 3.33Å; V53-A57 PolarHBondContact O-N 3.37Å; W54-A57 PolarHBondContact O-N 3.35Å; A57-N59 VanDerWaalsContact C-N 3.31Å; A57-L222 HydrophobicContact CB-CB 3.93Å
58	L	94.3	Very high	90.7	Very high	9 Å²	9	49.4 Å²	49.4	5%	0.047	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-3.8	174.8	-67.9	176.7	0	0	0	113.7	W54 I56 V60 C148 A151 I152 Y156 L222	W54-L58 VanDerWaalsContact O-CB 3.28Å; W54-L58 WeakPolarHBondContact O-CB 3.34Å; W54-L58 VanDerWaalsContact O-CG 3.26Å; W54-L58 WeakPolarHBondContact O-CG 3.21Å; W54-L58 PolarHBondContact O-N 3.23Å; I56-L58 VanDerWaalsContact C-N 3.27Å; I56-L58 PolarHBondContact O-N 3.44Å; L58-V60 VanDerWaalsContact C-N 3.33Å; L58-V60 HydrophobicContact CB-CG1 4.38Å; L58-V60 HydrophobicContact CB-CG2 3.92Å; L58-V60 PolarHBondContact O-N 3.16Å; L58-C148 HydrophobicContact CD1-CB 3.79Å; L58-A151 HydrophobicContact CB-CB 3.98Å; L58-A151 HydrophobicContact CD2-CB 4.15Å; L58-A151 HydrophobicContact CG-CB 4.5Å; L58-I152 HydrophobicContact CD1-CD1 4.02Å; L58-I152 HydrophobicContact CD1-CG1 4.03Å; L58-I152 HydrophobicContact CD2-CG1 3.68Å; L58-Y156 HydrophobicContact CD2-CD2 4.27Å; L58-Y156 HydrophobicContact CD2-CE2 3.68Å; L58-L222 HydrophobicContact CD2-CD2 3.67Å; L58-L222 HydrophobicContact CG-CD1 4.49Å; L58-L222 HydrophobicContact CG-CD2 4.34Å
59	N	93.1	Very high	90.2	Very high	146 Å²	146	46.9 Å²	46.9	78%	0.781	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	46.2	-176	-167.5	34.1	0	0	0	112.7	K55 I56 A57	K55-N59 PolarHBondContact O-N 3.07Å; I56-N59 PolarHBondContact O-N 2.88Å; A57-N59 VanDerWaalsContact C-N 3.31Å
60	V	92.5	Very high	90	Very high	6 Å²	6	48.1 Å²	48.1	4%	0.036	31%	0.311	C	S	.	.			trans	-124.4	5.4	179.1	-62.2	0	0	0	0	113.1	K55 L58 G62 K63 N147 A151	K55-V60 HydrophobicContact CB-CG2 4.03Å; K55-V60 HydrophobicContact CG-CG2 4.11Å; K55-V60 WeakPolarHBondContact O-CG2 3.22Å; K55-V60 PolarHBondContact O-N 2.92Å; L58-V60 VanDerWaalsContact C-N 3.33Å; L58-V60 HydrophobicContact CB-CG1 4.38Å; L58-V60 HydrophobicContact CB-CG2 3.92Å; L58-V60 PolarHBondContact O-N 3.16Å; V60-G62 PolarHBondContact O-N 3.39Å; V60-K63 HydrophobicContact CG1-CD 4.36Å; V60-K63 WeakPolarHBondContact O-CB 3.23Å; V60-K63 PolarHBondContact O-N 2.97Å; V60-N147 HydrophobicContact CB-CB 4.14Å; V60-N147 HydrophobicContact CG1-CB 4.17Å; V60-A151 HydrophobicContact CG1-CB 3.9Å
61	A	86.4	Confident	89.5	Confident	62 Å²	62	52.5 Å²	52.5	51%	0.512	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	124.3	172.9	0	0	0	0	0	110.6	K55 I56 K63	K55-A61 PolarHBondContact O-N 2.98Å; I56-A61 HydrophobicContact CG1-CB 3.96Å; A61-K63 VanDerWaalsContact C-N 3.25Å; A61-K63 PolarHBondContact O-N 2.87Å
62	G	80.9	Confident	89.1	Confident	90 Å²	90	53.7 Å²	53.7	93%	0.928	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	11.3	179.6	0	0	0	0	0	115.4	V60	V60-G62 PolarHBondContact O-N 3.39Å
63	K	86.7	Confident	89	Confident	89 Å²	89	52.5 Å²	52.5	39%	0.387	35%	0.348	S	S	.	.			trans	-72.9	135.2	176.5	-163.3	178.5	-179.4	-163.9	0	110.3	V60 A61 N147	V60-K63 HydrophobicContact CG1-CD 4.36Å; V60-K63 WeakPolarHBondContact O-CB 3.23Å; V60-K63 PolarHBondContact O-N 2.97Å; A61-K63 VanDerWaalsContact C-N 3.25Å; A61-K63 PolarHBondContact O-N 2.87Å; K63-N147 HydrophobicContact CD-CB 4.49Å
64	G	86.5	Confident	88.9	Confident	53 Å²	53	55.2 Å²	55.2	55%	0.546	36%	0.362	S	S	.	.			trans	-63.2	166.2	179.6	0	0	0	0	0	113.8	S66 N147	G64-S66 PolarHBondContact O-N 3.34Å; G64-S66 VanDerWaalsContact O-N 3.14Å; G64-N147 PolarHBondContact O-ND2 2.89Å
65	D	87.2	Confident	88.8	Confident	69 Å²	69	59.7 Å²	59.7	37%	0.369	39%	0.387	S	S	.	.			trans	-72	105.4	176.9	-178.2	13.9	0	0	0	111	L67 A68 S143	D65-L67 PolarHBondContact O-N 3.23Å; D65-L67 WeakPolarHBondContact OD1-CB 3.39Å; D65-L67 PolarHBondContact OD1-N 2.8Å; D65-A68 HydrophobicContact CB-CB 4.02Å; D65-A68 WeakPolarHBondContact O-CB 3.42Å; D65-A68 PolarHBondContact O-N 3.17Å; D65-A68 PolarHBondContact OD2-N 2.82Å; D65-S143 WeakPolarHBondContact OD1-CB 3.31Å
66	S	82.6	Confident	88.8	Confident	36 Å²	36	59.2 Å²	59.2	25%	0.252	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-20.7	177.5	-58.4	0	0	0	0	112.4	G64 F113 N147	G64-S66 PolarHBondContact O-N 3.34Å; G64-S66 VanDerWaalsContact O-N 3.14Å; S66-F113 VanDerWaalsContact O-CZ 3.28Å; S66-F113 WeakPolarHBondContact O-CZ 3.44Å; S66-N147 PolarHBondContact OG-OD1 3.46Å
67	L	84.2	Confident	88.8	Confident	8 Å²	8	63.4 Å²	63.4	4%	0.042	42%	0.415	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-14.5	178.9	-70.3	84.9	0	0	0	112.2	D65 S69 W70 F113 R142 Y146	D65-L67 PolarHBondContact O-N 3.23Å; D65-L67 WeakPolarHBondContact OD1-CB 3.39Å; D65-L67 PolarHBondContact OD1-N 2.8Å; L67-S69 PolarHBondContact O-N 2.94Å; L67-S69 VanDerWaalsContact O-N 3.14Å; L67-W70 HydrophobicContact CD2-CE3 4.09Å; L67-W70 HydrophobicContact CD2-CZ3 4.16Å; L67-W70 HydrophobicContact CG-CE3 4.43Å; L67-W70 WeakPolarHBondContact O-CB 3.47Å; L67-W70 PolarHBondContact O-N 3.07Å; L67-F113 HydrophobicContact CD1-CD1 4.13Å; L67-F113 HydrophobicContact CD1-CE1 4.37Å; L67-F113 HydrophobicContact CD2-CD1 4.47Å; L67-F113 HydrophobicContact CG-CD1 3.78Å; L67-F113 HydrophobicContact CG-CE1 4.15Å; L67-F113 HydrophobicContact CG-CG 4.25Å; L67-R142 HydrophobicContact CD2-CG 4.02Å; L67-Y146 VanDerWaalsContact CD1-CB 3.4Å; L67-Y146 HydrophobicContact CD1-CD1 3.8Å; L67-Y146 HydrophobicContact CD1-CD2 4.2Å; L67-Y146 HydrophobicContact CD1-CG 3.52Å
68	A	83.9	Confident	88.8	Confident	77 Å²	77	65 Å²	65	64%	0.636	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-29.6	-176.4	0	0	0	0	0	113.3	D65	D65-A68 HydrophobicContact CB-CB 4.02Å; D65-A68 WeakPolarHBondContact O-CB 3.42Å; D65-A68 PolarHBondContact O-N 3.17Å; D65-A68 PolarHBondContact OD2-N 2.82Å
69	S	82.3	Confident	88.9	Confident	113 Å²	113	65.4 Å²	65.4	79%	0.79	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-6	176.7	55.9	0	0	0	0	114.3	L67	L67-S69 PolarHBondContact O-N 2.94Å; L67-S69 VanDerWaalsContact O-N 3.14Å
70	W	89.6	Confident	88.9	Confident	41 Å²	41	65.1 Å²	65.1	16%	0.155	42%	0.422	C	S	.	.	S	Bend	trans	-92.5	142.5	-178.4	179.1	40.2	0	0	0	110.9	L67 G72 V73 L74 S109 T112 F113 K116	L67-W70 HydrophobicContact CD2-CE3 4.09Å; L67-W70 HydrophobicContact CD2-CZ3 4.16Å; L67-W70 HydrophobicContact CG-CE3 4.43Å; L67-W70 WeakPolarHBondContact O-CB 3.47Å; L67-W70 PolarHBondContact O-N 3.07Å; W70-G72 PolarHBondContact O-N 3.31Å; W70-V73 VanDerWaalsContact CZ2-O 3.31Å; W70-V73 WeakPolarHBondContact CZ2-O 3.31Å; W70-L74 HydrophobicContact CH2-CD2 3.85Å; W70-L74 HydrophobicContact CZ2-CD2 4.41Å; W70-S109 WeakPolarHBondContact CZ3-O 3.34Å; W70-T112 HydrophobicContact CH2-CG2 4.18Å; W70-T112 HydrophobicContact CZ2-CG2 4.06Å; W70-F113 HydrophobicContact CB-CD2 3.85Å; W70-F113 HydrophobicContact CB-CE2 3.7Å; W70-F113 HydrophobicContact CD2-CB 4.17Å; W70-F113 AromaticContact CD2-CD2 3.52Å; W70-F113 HydrophobicContact CD2-CD2 3.52Å; W70-F113 HydrophobicContact CD2-CE2 4.31Å; W70-F113 HydrophobicContact CD2-CG 4.13Å; W70-F113 HydrophobicContact CE3-CB 3.69Å; W70-F113 AromaticContact CE3-CD2 3.73Å; W70-F113 HydrophobicContact CE3-CD2 3.73Å; W70-F113 AromaticContact CE3-CG 3.86Å; W70-F113 HydrophobicContact CE3-CG 3.86Å; W70-F113 AromaticContact CG-CD2 3.56Å; W70-F113 HydrophobicContact CG-CD2 3.56Å; W70-F113 AromaticContact CG-CE2 3.88Å; W70-F113 HydrophobicContact CG-CE2 3.88Å; W70-F113 HydrophobicContact CH2-CB 4.01Å; W70-F113 HydrophobicContact CZ2-CB 4.48Å; W70-F113 HydrophobicContact CZ3-CB 3.61Å; W70-F113 HydrophobicContact CZ3-CD2 4.49Å; W70-F113 HydrophobicContact CZ3-CG 4.3Å; W70-K116 HydrophobicContact CZ2-CD 4.29Å
71	D	85.6	Confident	89.1	Confident	116 Å²	116	67.4 Å²	67.4	62%	0.62	44%	0.437	S	S	*	.			trans	-71.2	-7.7	-179.5	60.1	9.9	0	0	0	114.3	V73	D71-V73 HydrophobicContact CB-CG2 4.12Å; D71-V73 PolarHBondContact O-N 3.04Å; D71-V73 PolarHBondContact OD1-N 2.85Å; D71-V73 VanDerWaalsContact OD1-N 3.11Å
72	G	86.9	Confident	89.5	Confident	42 Å²	42	64.5 Å²	64.5	43%	0.433	41%	0.412	S	S	.	.			trans	71.6	11	179	0	0	0	0	0	114.3	W70 L74	W70-G72 PolarHBondContact O-N 3.31Å; G72-L74 PolarHBondContact O-N 3.32Å
73	V	90.5	Very high	90.2	Very high	64 Å²	64	63.6 Å²	63.6	39%	0.388	38%	0.384	S	S	.	.			trans	-78.6	122.3	-176.2	-178.6	0	0	0	0	110.6	W70 D71 D75 K116	W70-V73 VanDerWaalsContact CZ2-O 3.31Å; W70-V73 WeakPolarHBondContact CZ2-O 3.31Å; D71-V73 HydrophobicContact CB-CG2 4.12Å; D71-V73 PolarHBondContact O-N 3.04Å; D71-V73 PolarHBondContact OD1-N 2.85Å; D71-V73 VanDerWaalsContact OD1-N 3.11Å; V73-D75 HydrophobicContact CG1-CB 3.78Å; V73-D75 PolarHBondContact O-N 3.43Å; V73-K116 PolarHBondContact O-NZ 3.32Å
74	L	94.4	Very high	90.6	Very high	59 Å²	59	65.2 Å²	65.2	31%	0.309	39%	0.391	S	S	.	.			trans	-91.8	80.3	177.5	-55.5	179	0	0	0	111	W70 G72 Q79 E108 T112	W70-L74 HydrophobicContact CH2-CD2 3.85Å; W70-L74 HydrophobicContact CZ2-CD2 4.41Å; G72-L74 PolarHBondContact O-N 3.32Å; L74-Q79 HydrophobicContact CB-CG 4.27Å; L74-E108 HydrophobicContact CD1-CG 4.07Å; L74-T112 HydrophobicContact CD2-CG2 3.9Å
75	D	93.8	Very high	90.9	Very high	98 Å²	98	63.8 Å²	63.8	52%	0.524	37%	0.37	S	S	.	.			trans	-131.4	27.8	-169.2	65.9	-13.2	0	0	0	114.6	V73 K116	V73-D75 HydrophobicContact CG1-CB 3.78Å; V73-D75 PolarHBondContact O-N 3.43Å; D75-K116 WeakPolarHBondContact OD1-CE 3.35Å; D75-K116 IonicContact OD1-NZ 3.37Å; D75-K116 PolarHBondContact OD1-NZ 3.43Å; D75-K116 IonicContact OD2-NZ 3.13Å
76	L	94	Very high	91.1	Very high	30 Å²	30	60.5 Å²	60.5	16%	0.157	35%	0.353	C	S	.	.			trans	-68.2	150	174.4	-70.7	173	0	0	0	111.7	E78 Q79 I82 T112 C115 K116	L76-E78 PolarHBondContact O-N 3.27Å; L76-Q79 HydrophobicContact CB-CB 4.45Å; L76-Q79 VanDerWaalsContact O-CB 3.22Å; L76-Q79 WeakPolarHBondContact O-CB 3.39Å; L76-Q79 PolarHBondContact O-N 3.43Å; L76-I82 HydrophobicContact CD1-CD1 3.88Å; L76-T112 HydrophobicContact CD1-CG2 3.75Å; L76-T112 HydrophobicContact CG-CG2 3.97Å; L76-C115 HydrophobicContact CD1-CB 3.45Å; L76-C115 VanDerWaalsContact CD1-CB 3.45Å; L76-K116 HydrophobicContact CD2-CG 3.98Å
77	P	94.8	Very high	91.6	Very high	121 Å²	121	61.9 Å²	61.9	79%	0.786	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-36.1	174.2	-23.3	32.5	0	0	0	112.9
78	E	94.6	Very high	91.9	Very high	35 Å²	35	65.6 Å²	65.6	16%	0.164	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	16.9	178.5	61.5	-89.7	-150.4	0	0	114.4	L76 N80 T81 I82 K121 Y122	L76-E78 PolarHBondContact O-N 3.27Å; E78-N80 VanDerWaalsContact C-N 3.3Å; E78-N80 PolarHBondContact O-N 3.45Å; E78-T81 WeakPolarHBondContact O-CB 3.41Å; E78-T81 PolarHBondContact O-N 3.09Å; E78-I82 PolarHBondContact O-N 3.24Å; E78-K121 WeakPolarHBondContact OE1-CA 3.18Å; E78-K121 WeakPolarHBondContact OE1-CB 3.43Å; E78-Y122 PolarHBondContact OE1-N 3.35Å
79	Q	95.7	Very high	92.1	Very high	19 Å²	19	62.1 Å²	62.1	9%	0.089	35%	0.345	C	S	.	.	H	α-helix	trans	-57	-39.6	-177.2	-165.8	67.8	41.6	0	0	113.3	L74 L76 T81 I82 H83 E108 T112	L74-Q79 HydrophobicContact CB-CG 4.27Å; L76-Q79 HydrophobicContact CB-CB 4.45Å; L76-Q79 VanDerWaalsContact O-CB 3.22Å; L76-Q79 WeakPolarHBondContact O-CB 3.39Å; L76-Q79 PolarHBondContact O-N 3.43Å; Q79-T81 PolarHBondContact O-N 3.22Å; Q79-I82 WeakPolarHBondContact O-CB 3.41Å; Q79-I82 PolarHBondContact O-N 3.14Å; Q79-H83 WeakPolarHBondContact O-CB 3.28Å; Q79-H83 PolarHBondContact O-N 3.39Å; Q79-E108 PolarHBondContact NE2-OE1 3Å; Q79-T112 PolarHBondContact NE2-OG1 2.85Å; Q79-T112 PolarHBondContact OE1-OG1 3.37Å
80	N	94.8	Very high	92.3	Very high	139 Å²	139	57.6 Å²	57.6	74%	0.743	31%	0.312	S	S	*	.	H	α-helix	trans	-60.8	-33.5	178.4	-66.9	-33.5	0	0	0	112.3	E78 K84	E78-N80 VanDerWaalsContact C-N 3.3Å; E78-N80 PolarHBondContact O-N 3.45Å; N80-K84 WeakPolarHBondContact O-CB 3.41Å; N80-K84 PolarHBondContact O-N 3.23Å; N80-K84 VanDerWaalsContact O-N 3.15Å
81	T	95.1	Very high	92.2	Very high	55 Å²	55	62.8 Å²	62.8	34%	0.337	34%	0.338	S	S	.	.	H	α-helix	trans	-71.3	-45.3	176.9	-54.7	0	0	0	0	110.4	E78 Q79 H83 K84 D85 Y122 T124	E78-T81 WeakPolarHBondContact O-CB 3.41Å; E78-T81 PolarHBondContact O-N 3.09Å; Q79-T81 PolarHBondContact O-N 3.22Å; T81-H83 VanDerWaalsContact C-N 3.33Å; T81-H83 PolarHBondContact O-N 2.91Å; T81-K84 PolarHBondContact O-N 3.16Å; T81-D85 PolarHBondContact O-N 3.11Å; T81-D85 VanDerWaalsContact O-N 3.09Å; T81-Y122 HydrophobicContact CG2-CD1 4.37Å; T81-Y122 HydrophobicContact CG2-CE1 4.18Å; T81-T124 HydrophobicContact CG2-CG2 3.27Å
82	I	95.3	Very high	92.2	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-56.6	-49.6	174.5	-61.5	169.4	0	0	0	110.1	L76 E78 Q79 K84 D85 C86 E108 I111 Y122	L76-I82 HydrophobicContact CD1-CD1 3.88Å; E78-I82 PolarHBondContact O-N 3.24Å; Q79-I82 WeakPolarHBondContact O-CB 3.41Å; Q79-I82 PolarHBondContact O-N 3.14Å; I82-K84 VanDerWaalsContact C-N 3.33Å; I82-K84 PolarHBondContact O-N 3.36Å; I82-D85 PolarHBondContact O-N 3.31Å; I82-C86 WeakPolarHBondContact O-CB 3.26Å; I82-C86 PolarHBondContact O-N 3.14Å; I82-C86 PolarHBondContact O-SG 3.32Å; I82-E108 HydrophobicContact CG2-CG 4.05Å; I82-I111 HydrophobicContact CD1-CG2 4.09Å; I82-I111 HydrophobicContact CG1-CG2 4.22Å; I82-I111 HydrophobicContact CG2-CB 4.17Å; I82-I111 HydrophobicContact CG2-CD1 4.41Å; I82-I111 HydrophobicContact CG2-CG2 3.85Å; I82-Y122 HydrophobicContact CD1-CD1 4.46Å; I82-Y122 HydrophobicContact CD1-CG 4.1Å; I82-Y122 HydrophobicContact CG1-CD1 3.46Å; I82-Y122 VanDerWaalsContact CG1-CD1 3.46Å; I82-Y122 HydrophobicContact CG1-CD2 4.03Å; I82-Y122 HydrophobicContact CG1-CE1 3.95Å; I82-Y122 HydrophobicContact CG1-CE2 4.44Å; I82-Y122 HydrophobicContact CG1-CG 3.52Å
83	H	95.4	Very high	91.8	Very high	71 Å²	71	62 Å²	62	33%	0.329	32%	0.319	S	S	.	.	H	α-helix	trans	-57.6	-45.8	-178.9	-172.9	70.6	0	0	0	112.1	Q79 T81 C86 L87 E108	Q79-H83 WeakPolarHBondContact O-CB 3.28Å; Q79-H83 PolarHBondContact O-N 3.39Å; T81-H83 VanDerWaalsContact C-N 3.33Å; T81-H83 PolarHBondContact O-N 2.91Å; H83-C86 PolarHBondContact O-N 3.22Å; H83-L87 WeakPolarHBondContact NE2-CD1 3.35Å; H83-L87 WeakPolarHBondContact O-CG 3.33Å; H83-L87 PolarHBondContact O-N 2.94Å; H83-E108 IonicContact CE1-OE2 3.47Å; H83-E108 IonicContact CG-OE1 2.8Å; H83-E108 IonicContact CG-OE2 3.05Å; H83-E108 IonicContact ND1-OE1 2.71Å; H83-E108 IonicContact ND1-OE2 2.64Å; H83-E108 PolarHBondContact ND1-OE2 3.04Å
84	K	94.6	Very high	91.2	Very high	124 Å²	124	64 Å²	64	54%	0.539	34%	0.337	S	S	.	.	H	α-helix	trans	-60.9	-48.4	178.3	-175	-175.2	168.2	-166.6	0	112	N80 T81 I82 C86 L87 E88	N80-K84 WeakPolarHBondContact O-CB 3.41Å; N80-K84 PolarHBondContact O-N 3.23Å; N80-K84 VanDerWaalsContact O-N 3.15Å; T81-K84 PolarHBondContact O-N 3.16Å; I82-K84 VanDerWaalsContact C-N 3.33Å; I82-K84 PolarHBondContact O-N 3.36Å; K84-C86 VanDerWaalsContact C-N 3.3Å; K84-C86 PolarHBondContact O-N 3.24Å; K84-L87 WeakPolarHBondContact O-CB 3.25Å; K84-L87 PolarHBondContact O-N 3.3Å; K84-E88 WeakPolarHBondContact CE-OE1 3.17Å; K84-E88 IonicContact NZ-OE1 2.69Å; K84-E88 PolarHBondContact O-N 3.48Å
85	D	93	Very high	90.5	Very high	22 Å²	22	63 Å²	63	12%	0.118	33%	0.333	C	S	.	.	H	α-helix	trans	-65.7	-35.4	-179.1	-66	0.3	0	0	0	111.5	T81 I82 F89 Y122 T129	T81-D85 PolarHBondContact O-N 3.11Å; T81-D85 VanDerWaalsContact O-N 3.09Å; I82-D85 PolarHBondContact O-N 3.31Å; D85-F89 VanDerWaalsContact O-CB 3.24Å; D85-F89 WeakPolarHBondContact O-CB 3.23Å; D85-F89 PolarHBondContact O-N 2.86Å; D85-Y122 WeakPolarHBondContact CB-OH 3.41Å; D85-Y122 VanDerWaalsContact OD2-CE1 3.31Å; D85-Y122 WeakPolarHBondContact OD2-CE1 3.1Å; D85-Y122 PolarHBondContact OD2-OH 3.45Å; D85-T129 HydrophobicContact CB-CG2 4.22Å
86	C	92.9	Very high	90	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-68.3	-37.3	175.8	-63.4	0	0	0	0	112.2	I82 H83 K84 F89 I90 L104 I107	I82-C86 WeakPolarHBondContact O-CB 3.26Å; I82-C86 PolarHBondContact O-N 3.14Å; I82-C86 PolarHBondContact O-SG 3.32Å; H83-C86 PolarHBondContact O-N 3.22Å; K84-C86 VanDerWaalsContact C-N 3.3Å; K84-C86 PolarHBondContact O-N 3.24Å; C86-F89 PolarHBondContact O-N 2.9Å; C86-I90 WeakPolarHBondContact O-CG1 3.4Å; C86-I90 PolarHBondContact O-N 2.86Å; C86-L104 HydrophobicContact CB-CD1 3.59Å; C86-I107 HydrophobicContact CB-CG2 4.29Å
87	L	91.9	Very high	89.3	Confident	66 Å²	66	69.7 Å²	69.7	35%	0.346	37%	0.368	S	S	.	.	H	α-helix	trans	-63.4	-51.5	173.8	-75.9	172	0	0	0	111.4	H83 K84 F89 I90 E91 L104	H83-L87 WeakPolarHBondContact NE2-CD1 3.35Å; H83-L87 WeakPolarHBondContact O-CG 3.33Å; H83-L87 PolarHBondContact O-N 2.94Å; K84-L87 WeakPolarHBondContact O-CB 3.25Å; K84-L87 PolarHBondContact O-N 3.3Å; L87-F89 PolarHBondContact O-N 3.3Å; L87-I90 PolarHBondContact O-N 2.84Å; L87-I90 VanDerWaalsContact O-N 3.12Å; L87-E91 WeakPolarHBondContact O-CG 3.36Å; L87-E91 PolarHBondContact O-N 3.47Å; L87-L104 HydrophobicContact CD2-CD1 4.07Å; L87-L104 HydrophobicContact CD2-CD2 3.57Å; L87-L104 HydrophobicContact CD2-CG 4.5Å; L87-L104 HydrophobicContact CG-CD1 4.23Å; L87-L104 HydrophobicContact CG-CD2 4.39Å
88	E	90.3	Very high	88.8	Confident	85 Å²	85	72.9 Å²	72.9	40%	0.397	37%	0.372	S	S	.	.	H	α-helix	trans	-57.3	-39.1	177.8	-71.8	-179.1	-176.3	0	0	111.1	K84 Q92	K84-E88 WeakPolarHBondContact CE-OE1 3.17Å; K84-E88 IonicContact NZ-OE1 2.69Å; K84-E88 PolarHBondContact O-N 3.48Å; E88-Q92 WeakPolarHBondContact O-CG 3.39Å; E88-Q92 PolarHBondContact O-N 2.87Å; E88-Q92 VanDerWaalsContact O-N 3.12Å
89	F	87.8	Confident	88.2	Confident	5 Å²	5	76.3 Å²	76.3	2%	0.022	39%	0.386	C	S	.	.	H	α-helix	trans	-64.5	-42.1	176.9	172.2	-115.8	0	0	0	113.4	D85 C86 L87 Q92 L93 I107 K133	D85-F89 VanDerWaalsContact O-CB 3.24Å; D85-F89 WeakPolarHBondContact O-CB 3.23Å; D85-F89 PolarHBondContact O-N 2.86Å; C86-F89 PolarHBondContact O-N 2.9Å; L87-F89 PolarHBondContact O-N 3.3Å; F89-Q92 PolarHBondContact O-N 3.42Å; F89-L93 HydrophobicContact CD1-CD1 4.32Å; F89-L93 HydrophobicContact CE1-CD1 3.64Å; F89-L93 HydrophobicContact CE1-CG 4.46Å; F89-L93 HydrophobicContact CE2-CD1 3.99Å; F89-L93 HydrophobicContact CE2-CD2 4.29Å; F89-L93 HydrophobicContact CE2-CG 3.99Å; F89-L93 HydrophobicContact CZ-CD1 3.44Å; F89-L93 VanDerWaalsContact CZ-CD1 3.44Å; F89-L93 HydrophobicContact CZ-CD2 4.35Å; F89-L93 HydrophobicContact CZ-CG 3.97Å; F89-L93 WeakPolarHBondContact O-CG 3.47Å; F89-L93 PolarHBondContact O-N 2.99Å; F89-L93 VanDerWaalsContact O-N 3.14Å; F89-I107 HydrophobicContact CD1-CD1 3.9Å; F89-I107 HydrophobicContact CE1-CD1 3.62Å; F89-K133 HydrophobicContact CE2-CB 3.67Å; F89-K133 HydrophobicContact CE2-CD 4.42Å; F89-K133 HydrophobicContact CE2-CG 3.89Å; F89-K133 HydrophobicContact CZ-CB 3.86Å; F89-K133 HydrophobicContact CZ-CG 4.26Å
90	I	88.2	Confident	87.8	Confident	18 Å²	18	76.4 Å²	76.4	9%	0.092	39%	0.39	C	S	.	.	H	α-helix	trans	-69.8	-37.2	178.7	-74.1	177.5	0	0	0	111.9	C86 L87 Q92 L93 S94 V95 A100 L103 L104 I107	C86-I90 WeakPolarHBondContact O-CG1 3.4Å; C86-I90 PolarHBondContact O-N 2.86Å; L87-I90 PolarHBondContact O-N 2.84Å; L87-I90 VanDerWaalsContact O-N 3.12Å; I90-Q92 VanDerWaalsContact C-N 3.3Å; I90-Q92 PolarHBondContact O-N 3.26Å; I90-L93 PolarHBondContact O-N 3.4Å; I90-S94 PolarHBondContact O-N 3Å; I90-V95 HydrophobicContact CG2-CG2 3.67Å; I90-A100 HydrophobicContact CG2-CB 4.04Å; I90-L103 HydrophobicContact CD1-CB 4.44Å; I90-L104 HydrophobicContact CD1-CB 3.38Å; I90-L104 HydrophobicContact CD1-CD1 3.71Å; I90-L104 HydrophobicContact CD1-CG 4.11Å; I90-L104 VanDerWaalsContact CD1-N 3.35Å; I90-I107 HydrophobicContact CD1-CD1 4.18Å; I90-I107 HydrophobicContact CG1-CD1 4.22Å
91	E	87.2	Confident	87.5	Confident	149 Å²	149	72.8 Å²	72.8	70%	0.696	38%	0.38	S	S	*	.	H	α-helix	trans	-59.4	-42.6	172.7	-71.7	179.8	-178.5	0	0	111.1	L87 L93 S94	L87-E91 WeakPolarHBondContact O-CG 3.36Å; L87-E91 PolarHBondContact O-N 3.47Å; E91-L93 VanDerWaalsContact C-N 3.31Å; E91-L93 PolarHBondContact O-N 3.48Å; E91-S94 PolarHBondContact O-N 3.4Å
92	Q	84.8	Confident	87.3	Confident	128 Å²	128	76.3 Å²	76.3	60%	0.598	39%	0.393	S	S	*	.	H	α-helix	trans	-64.6	-33	176	-72.3	176	8.6	0	0	113.3	E88 F89 I90 S94	E88-Q92 WeakPolarHBondContact O-CG 3.39Å; E88-Q92 PolarHBondContact O-N 2.87Å; E88-Q92 VanDerWaalsContact O-N 3.12Å; F89-Q92 PolarHBondContact O-N 3.42Å; I90-Q92 VanDerWaalsContact C-N 3.3Å; I90-Q92 PolarHBondContact O-N 3.26Å; Q92-S94 VanDerWaalsContact C-N 3.28Å; Q92-S94 PolarHBondContact O-N 3.42Å
93	L	79.6	Confident	87.1	Confident	13 Å²	13	78.2 Å²	78.2	7%	0.068	40%	0.402	C	S	.	.	H	α-helix	trans	-72.9	-17.6	179.5	-76	-179.6	0	0	0	113.9	F89 I90 E91 V95 K133 V136 Y137	F89-L93 HydrophobicContact CD1-CD1 4.32Å; F89-L93 HydrophobicContact CE1-CD1 3.64Å; F89-L93 HydrophobicContact CE1-CG 4.46Å; F89-L93 HydrophobicContact CE2-CD1 3.99Å; F89-L93 HydrophobicContact CE2-CD2 4.29Å; F89-L93 HydrophobicContact CE2-CG 3.99Å; F89-L93 HydrophobicContact CZ-CD1 3.44Å; F89-L93 VanDerWaalsContact CZ-CD1 3.44Å; F89-L93 HydrophobicContact CZ-CD2 4.35Å; F89-L93 HydrophobicContact CZ-CG 3.97Å; F89-L93 WeakPolarHBondContact O-CG 3.47Å; F89-L93 PolarHBondContact O-N 2.99Å; F89-L93 VanDerWaalsContact O-N 3.14Å; I90-L93 PolarHBondContact O-N 3.4Å; E91-L93 VanDerWaalsContact C-N 3.31Å; E91-L93 PolarHBondContact O-N 3.48Å; L93-V95 HydrophobicContact CB-CG1 3.95Å; L93-V95 PolarHBondContact O-N 2.92Å; L93-K133 HydrophobicContact CD2-CG 4.05Å; L93-V136 HydrophobicContact CD1-CG1 4.12Å; L93-Y137 HydrophobicContact CD2-CD2 4.08Å; L93-Y137 HydrophobicContact CD2-CE2 3.26Å
94	S	77.9	Confident	86.9	Confident	108 Å²	108	76 Å²	76	76%	0.755	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	52	39.1	-177.5	-59.5	0	0	0	0	113.4	I90 E91 Q92	I90-S94 PolarHBondContact O-N 3Å; E91-S94 PolarHBondContact O-N 3.4Å; Q92-S94 VanDerWaalsContact C-N 3.28Å; Q92-S94 PolarHBondContact O-N 3.42Å
95	V	78.9	Confident	86.8	Confident	38 Å²	38	74.8 Å²	74.8	23%	0.23	39%	0.392	C	S	.	.			trans	-70.1	152.6	178.1	-69.3	0	0	0	0	111.7	I90 L93 E97 A100 L103	I90-V95 HydrophobicContact CG2-CG2 3.67Å; L93-V95 HydrophobicContact CB-CG1 3.95Å; L93-V95 PolarHBondContact O-N 2.92Å; V95-E97 PolarHBondContact O-N 3.35Å; V95-A100 HydrophobicContact CG2-CB 3.86Å; V95-L103 HydrophobicContact CB-CD1 4.37Å; V95-L103 HydrophobicContact CG1-CD1 3.99Å; V95-L103 HydrophobicContact CG2-CD1 4.44Å
96	P	83.1	Confident	86.8	Confident	88 Å²	88	75 Å²	75	57%	0.571	39%	0.393	S	S	*	.			trans	-56.8	132.8	173.6	-22.6	32.8	0	0	0	111.4	E98 K99 A100	P96-E98 PolarHBondContact O-N 3.37Å; P96-K99 PolarHBondContact O-N 3Å; P96-A100 PolarHBondContact O-N 3.49Å; P96-A100 VanDerWaalsContact O-N 3.08Å
97	E	80.2	Confident	86.8	Confident	180 Å²	180	75 Å²	75	84%	0.841	39%	0.393	S	S	*	.	H	α-helix	trans	-53.1	-33.3	-176.4	-69.8	-174.5	173.7	0	0	113	V95 K99 A100	V95-E97 PolarHBondContact O-N 3.35Å; E97-K99 VanDerWaalsContact C-N 3.27Å; E97-K99 PolarHBondContact O-N 3.28Å; E97-A100 PolarHBondContact O-N 3.37Å
98	E	82.6	Confident	87	Confident	187 Å²	187	72.3 Å²	72.3	87%	0.874	38%	0.379	S	S	*	.	H	α-helix	trans	-60.5	-33.4	178.5	-62.2	-178.1	176.2	0	0	113.3	P96	P96-E98 PolarHBondContact O-N 3.37Å
99	K	83.9	Confident	87.2	Confident	107 Å²	107	68.7 Å²	68.7	47%	0.465	36%	0.363	S	S	.	.	H	α-helix	trans	-101.4	-14.3	180	-66	-171.5	177.3	-173.5	0	113.1	P96 E97 A101 E102 L103	P96-K99 PolarHBondContact O-N 3Å; E97-K99 VanDerWaalsContact C-N 3.27Å; E97-K99 PolarHBondContact O-N 3.28Å; K99-A101 VanDerWaalsContact C-N 3.31Å; K99-A101 PolarHBondContact O-N 3.39Å; K99-E102 PolarHBondContact O-N 3.24Å; K99-L103 WeakPolarHBondContact O-CG 3.34Å; K99-L103 PolarHBondContact O-N 2.76Å
100	A	86.9	Confident	87.5	Confident	21 Å²	21	68.4 Å²	68.4	17%	0.174	36%	0.362	C	S	.	.	H	α-helix	trans	-58.4	-42.7	-176.6	0	0	0	0	0	112.2	I90 V95 P96 E97 L104	I90-A100 HydrophobicContact CG2-CB 4.04Å; V95-A100 HydrophobicContact CG2-CB 3.86Å; P96-A100 PolarHBondContact O-N 3.49Å; P96-A100 VanDerWaalsContact O-N 3.08Å; E97-A100 PolarHBondContact O-N 3.37Å; A100-L104 WeakPolarHBondContact O-CB 3.41Å; A100-L104 PolarHBondContact O-N 3.3Å
101	A	88.7	Confident	87.9	Confident	64 Å²	64	67.6 Å²	67.6	53%	0.529	36%	0.357	S	S	.	.	H	α-helix	trans	-67.1	-39	-179.3	0	0	0	0	0	113	K99 L105	K99-A101 VanDerWaalsContact C-N 3.31Å; K99-A101 PolarHBondContact O-N 3.39Å; A101-L105 WeakPolarHBondContact O-CG 3.35Å; A101-L105 PolarHBondContact O-N 3.48Å
102	E	90.1	Very high	88.3	Confident	128 Å²	128	60.5 Å²	60.5	60%	0.598	32%	0.324	S	S	*	.	H	α-helix	trans	-67.1	-47.1	177.2	-174.2	176	-172.8	0	0	110.7	K99 L104 L105 D106	K99-E102 PolarHBondContact O-N 3.24Å; E102-L104 VanDerWaalsContact C-N 3.32Å; E102-L104 PolarHBondContact O-N 3.46Å; E102-L105 PolarHBondContact O-N 2.77Å; E102-D106 PolarHBondContact O-N 3.43Å
103	L	90.4	Very high	88.8	Confident	40 Å²	40	55.5 Å²	55.5	21%	0.209	30%	0.301	C	S	.	.	H	α-helix	trans	-61.4	-39.5	176.9	-70.4	174.8	0	0	0	112.3	I90 V95 K99 D106 I107 V136	I90-L103 HydrophobicContact CD1-CB 4.44Å; V95-L103 HydrophobicContact CB-CD1 4.37Å; V95-L103 HydrophobicContact CG1-CD1 3.99Å; V95-L103 HydrophobicContact CG2-CD1 4.44Å; K99-L103 WeakPolarHBondContact O-CG 3.34Å; K99-L103 PolarHBondContact O-N 2.76Å; L103-D106 PolarHBondContact O-N 2.91Å; L103-I107 HydrophobicContact CB-CD1 4.48Å; L103-I107 WeakPolarHBondContact O-CB 3.28Å; L103-I107 VanDerWaalsContact O-CD1 3.3Å; L103-I107 WeakPolarHBondContact O-CD1 3.42Å; L103-I107 WeakPolarHBondContact O-CG1 3.37Å; L103-I107 PolarHBondContact O-N 3.35Å; L103-V136 HydrophobicContact CD1-CG1 4.31Å; L103-V136 HydrophobicContact CD2-CG1 4.09Å
104	L	92.6	Very high	89.5	Confident	26 Å²	26	55.6 Å²	55.6	14%	0.136	30%	0.3	C	S	.	.	H	α-helix	trans	-57.7	-50.2	176.2	-178	63.2	0	0	0	111.5	C86 L87 I90 A100 E102 D106 I107 E108	C86-L104 HydrophobicContact CB-CD1 3.59Å; L87-L104 HydrophobicContact CD2-CD1 4.07Å; L87-L104 HydrophobicContact CD2-CD2 3.57Å; L87-L104 HydrophobicContact CD2-CG 4.5Å; L87-L104 HydrophobicContact CG-CD1 4.23Å; L87-L104 HydrophobicContact CG-CD2 4.39Å; I90-L104 HydrophobicContact CD1-CB 3.38Å; I90-L104 HydrophobicContact CD1-CD1 3.71Å; I90-L104 HydrophobicContact CD1-CG 4.11Å; I90-L104 VanDerWaalsContact CD1-N 3.35Å; A100-L104 WeakPolarHBondContact O-CB 3.41Å; A100-L104 PolarHBondContact O-N 3.3Å; E102-L104 VanDerWaalsContact C-N 3.32Å; E102-L104 PolarHBondContact O-N 3.46Å; L104-D106 VanDerWaalsContact C-N 3.33Å; L104-D106 PolarHBondContact O-N 3.26Å; L104-I107 PolarHBondContact O-N 3.37Å; L104-E108 VanDerWaalsContact O-CB 3.22Å; L104-E108 WeakPolarHBondContact O-CB 3.5Å; L104-E108 PolarHBondContact O-N 2.83Å
105	L	92.3	Very high	90.2	Very high	98 Å²	98	50.6 Å²	50.6	51%	0.513	27%	0.265	S	S	.	.	H	α-helix	trans	-63.4	-41.1	179.3	-69.5	172.4	0	0	0	111.4	A101 E102 S109	A101-L105 WeakPolarHBondContact O-CG 3.35Å; A101-L105 PolarHBondContact O-N 3.48Å; E102-L105 PolarHBondContact O-N 2.77Å; L105-S109 WeakPolarHBondContact O-CB 3.47Å; L105-S109 PolarHBondContact O-N 2.94Å; L105-S109 PolarHBondContact O-OG 3.29Å
106	D	92.1	Very high	90.8	Very high	25 Å²	25	52 Å²	52	13%	0.134	27%	0.268	C	S	.	.	H	α-helix	trans	-64.7	-48.2	178.4	-79.9	-5.7	0	0	0	111.8	E102 L103 L104 S109 V110 R142	E102-D106 PolarHBondContact O-N 3.43Å; L103-D106 PolarHBondContact O-N 2.91Å; L104-D106 VanDerWaalsContact C-N 3.33Å; L104-D106 PolarHBondContact O-N 3.26Å; D106-S109 PolarHBondContact O-N 3.07Å; D106-S109 PolarHBondContact O-OG 3.5Å; D106-V110 WeakPolarHBondContact O-CB 2.98Å; D106-V110 WeakPolarHBondContact O-CG2 3.11Å; D106-V110 PolarHBondContact O-N 3.35Å; D106-R142 HydrophobicContact CB-CB 4.49Å; D106-R142 HydrophobicContact CB-CG 4.39Å; D106-R142 WeakPolarHBondContact OD1-CD 3.48Å; D106-R142 IonicContact OD1-NH1 2.61Å
107	I	93.4	Very high	91.2	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.4	-49.4	177.9	-68.5	159.4	0	0	0	110.9	C86 F89 I90 L103 L104 S109 V110 I111 L132 V136	C86-I107 HydrophobicContact CB-CG2 4.29Å; F89-I107 HydrophobicContact CD1-CD1 3.9Å; F89-I107 HydrophobicContact CE1-CD1 3.62Å; I90-I107 HydrophobicContact CD1-CD1 4.18Å; I90-I107 HydrophobicContact CG1-CD1 4.22Å; L103-I107 HydrophobicContact CB-CD1 4.48Å; L103-I107 WeakPolarHBondContact O-CB 3.28Å; L103-I107 VanDerWaalsContact O-CD1 3.3Å; L103-I107 WeakPolarHBondContact O-CD1 3.42Å; L103-I107 WeakPolarHBondContact O-CG1 3.37Å; L103-I107 PolarHBondContact O-N 3.35Å; L104-I107 PolarHBondContact O-N 3.37Å; I107-S109 VanDerWaalsContact C-N 3.32Å; I107-S109 PolarHBondContact O-N 3.08Å; I107-V110 PolarHBondContact O-N 3.27Å; I107-I111 HydrophobicContact CG2-CD1 4.17Å; I107-I111 WeakPolarHBondContact O-CG1 3.37Å; I107-I111 PolarHBondContact O-N 2.97Å; I107-I111 VanDerWaalsContact O-N 3.08Å; I107-L132 HydrophobicContact CG2-CD1 3.85Å; I107-V136 HydrophobicContact CD1-CG2 3.99Å; I107-V136 HydrophobicContact CG1-CG2 3.98Å
108	E	95.3	Very high	91.6	Very high	11 Å²	11	46.5 Å²	46.5	5%	0.051	24%	0.236	C	C	.	.	H	α-helix	trans	-63	-40.8	-178.6	-175.6	169	-177.1	0	0	111.1	L74 Q79 I82 H83 L104 T112	L74-E108 HydrophobicContact CD1-CG 4.07Å; Q79-E108 PolarHBondContact NE2-OE1 3Å; I82-E108 HydrophobicContact CG2-CG 4.05Å; H83-E108 IonicContact CE1-OE2 3.47Å; H83-E108 IonicContact CG-OE1 2.8Å; H83-E108 IonicContact CG-OE2 3.05Å; H83-E108 IonicContact ND1-OE1 2.71Å; H83-E108 IonicContact ND1-OE2 2.64Å; H83-E108 PolarHBondContact ND1-OE2 3.04Å; L104-E108 VanDerWaalsContact O-CB 3.22Å; L104-E108 WeakPolarHBondContact O-CB 3.5Å; L104-E108 PolarHBondContact O-N 2.83Å; E108-T112 VanDerWaalsContact O-CB 3.26Å; E108-T112 WeakPolarHBondContact O-CB 3.28Å; E108-T112 PolarHBondContact O-N 3.48Å; E108-T112 PolarHBondContact O-OG1 3.38Å
109	S	94.7	Very high	91.9	Very high	8 Å²	8	44.9 Å²	44.9	6%	0.056	23%	0.233	C	C	.	.	H	α-helix	trans	-67.1	-39	177.1	72.5	0	0	0	0	112.8	W70 L105 D106 I107 T112 F113 R142	W70-S109 WeakPolarHBondContact CZ3-O 3.34Å; L105-S109 WeakPolarHBondContact O-CB 3.47Å; L105-S109 PolarHBondContact O-N 2.94Å; L105-S109 PolarHBondContact O-OG 3.29Å; D106-S109 PolarHBondContact O-N 3.07Å; D106-S109 PolarHBondContact O-OG 3.5Å; I107-S109 VanDerWaalsContact C-N 3.32Å; I107-S109 PolarHBondContact O-N 3.08Å; S109-T112 PolarHBondContact O-N 3.33Å; S109-F113 VanDerWaalsContact O-CB 3.23Å; S109-F113 WeakPolarHBondContact O-CB 3.19Å; S109-F113 PolarHBondContact O-N 3.44Å; S109-R142 VanDerWaalsContact OG-CD 3.25Å; S109-R142 WeakPolarHBondContact OG-CD 3.41Å
110	V	95.7	Very high	92.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-61	-48.9	175.6	165	0	0	0	0	111.1	D106 I107 Y114 L132 R142 L145 Y146 F149	D106-V110 WeakPolarHBondContact O-CB 2.98Å; D106-V110 WeakPolarHBondContact O-CG2 3.11Å; D106-V110 PolarHBondContact O-N 3.35Å; I107-V110 PolarHBondContact O-N 3.27Å; V110-Y114 WeakPolarHBondContact O-CB 3.23Å; V110-Y114 PolarHBondContact O-N 3.47Å; V110-L132 HydrophobicContact CG1-CD1 4.45Å; V110-L132 HydrophobicContact CG1-CD2 4.07Å; V110-R142 HydrophobicContact CG2-CG 4.21Å; V110-L145 HydrophobicContact CG2-CD2 4.17Å; V110-L145 HydrophobicContact CG2-CG 4.25Å; V110-Y146 HydrophobicContact CG1-CD2 4.18Å; V110-F149 HydrophobicContact CG1-CB 4.39Å; V110-F149 HydrophobicContact CG1-CD1 4.02Å; V110-F149 HydrophobicContact CG1-CG 4.26Å
111	I	95.5	Very high	92.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.6	-48.3	178.9	-67.2	173.1	0	0	0	110.3	I82 I107 F113 Y114 C115 Y122 W128 T129 L132	I82-I111 HydrophobicContact CD1-CG2 4.09Å; I82-I111 HydrophobicContact CG1-CG2 4.22Å; I82-I111 HydrophobicContact CG2-CB 4.17Å; I82-I111 HydrophobicContact CG2-CD1 4.41Å; I82-I111 HydrophobicContact CG2-CG2 3.85Å; I107-I111 HydrophobicContact CG2-CD1 4.17Å; I107-I111 WeakPolarHBondContact O-CG1 3.37Å; I107-I111 PolarHBondContact O-N 2.97Å; I107-I111 VanDerWaalsContact O-N 3.08Å; I111-F113 PolarHBondContact O-N 3.46Å; I111-Y114 WeakPolarHBondContact O-CB 3.38Å; I111-Y114 PolarHBondContact O-N 3.46Å; I111-C115 PolarHBondContact O-N 3.18Å; I111-Y122 HydrophobicContact CD1-CE2 4.46Å; I111-Y122 HydrophobicContact CG2-CD2 3.58Å; I111-Y122 HydrophobicContact CG2-CE2 3.81Å; I111-Y122 HydrophobicContact CG2-CG 4.46Å; I111-W128 HydrophobicContact CG2-CE3 4.15Å; I111-W128 HydrophobicContact CG2-CZ3 4.42Å; I111-T129 HydrophobicContact CD1-CG2 4.11Å; I111-L132 HydrophobicContact CD1-CD1 4.05Å; I111-L132 HydrophobicContact CG1-CD1 3.92Å
112	T	95.2	Very high	92.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-60.8	-46.2	-178.3	-56.1	0	0	0	0	111.4	W70 L74 L76 Q79 E108 S109 Y114 C115 K116	W70-T112 HydrophobicContact CH2-CG2 4.18Å; W70-T112 HydrophobicContact CZ2-CG2 4.06Å; L74-T112 HydrophobicContact CD2-CG2 3.9Å; L76-T112 HydrophobicContact CD1-CG2 3.75Å; L76-T112 HydrophobicContact CG-CG2 3.97Å; Q79-T112 PolarHBondContact NE2-OG1 2.85Å; Q79-T112 PolarHBondContact OE1-OG1 3.37Å; E108-T112 VanDerWaalsContact O-CB 3.26Å; E108-T112 WeakPolarHBondContact O-CB 3.28Å; E108-T112 PolarHBondContact O-N 3.48Å; E108-T112 PolarHBondContact O-OG1 3.38Å; S109-T112 PolarHBondContact O-N 3.33Å; T112-Y114 VanDerWaalsContact C-N 3.34Å; T112-Y114 PolarHBondContact O-N 3.24Å; T112-C115 WeakPolarHBondContact O-CB 3.13Å; T112-C115 PolarHBondContact O-N 3.44Å; T112-K116 WeakPolarHBondContact O-CG 3.4Å; T112-K116 PolarHBondContact O-N 3.36Å
113	F	95.5	Very high	92.3	Very high	24 Å²	24	43.8 Å²	43.8	11%	0.105	22%	0.222	C	C	.	.	H	α-helix	trans	-64.8	-38.4	177.5	-177.4	-120.5	0	0	0	112.3	S66 L67 W70 S109 I111 K116 S117 Y146	S66-F113 VanDerWaalsContact O-CZ 3.28Å; S66-F113 WeakPolarHBondContact O-CZ 3.44Å; L67-F113 HydrophobicContact CD1-CD1 4.13Å; L67-F113 HydrophobicContact CD1-CE1 4.37Å; L67-F113 HydrophobicContact CD2-CD1 4.47Å; L67-F113 HydrophobicContact CG-CD1 3.78Å; L67-F113 HydrophobicContact CG-CE1 4.15Å; L67-F113 HydrophobicContact CG-CG 4.25Å; W70-F113 HydrophobicContact CB-CD2 3.85Å; W70-F113 HydrophobicContact CB-CE2 3.7Å; W70-F113 HydrophobicContact CD2-CB 4.17Å; W70-F113 AromaticContact CD2-CD2 3.52Å; W70-F113 HydrophobicContact CD2-CD2 3.52Å; W70-F113 HydrophobicContact CD2-CE2 4.31Å; W70-F113 HydrophobicContact CD2-CG 4.13Å; W70-F113 HydrophobicContact CE3-CB 3.69Å; W70-F113 AromaticContact CE3-CD2 3.73Å; W70-F113 HydrophobicContact CE3-CD2 3.73Å; W70-F113 AromaticContact CE3-CG 3.86Å; W70-F113 HydrophobicContact CE3-CG 3.86Å; W70-F113 AromaticContact CG-CD2 3.56Å; W70-F113 HydrophobicContact CG-CD2 3.56Å; W70-F113 AromaticContact CG-CE2 3.88Å; W70-F113 HydrophobicContact CG-CE2 3.88Å; W70-F113 HydrophobicContact CH2-CB 4.01Å; W70-F113 HydrophobicContact CZ2-CB 4.48Å; W70-F113 HydrophobicContact CZ3-CB 3.61Å; W70-F113 HydrophobicContact CZ3-CD2 4.49Å; W70-F113 HydrophobicContact CZ3-CG 4.3Å; S109-F113 VanDerWaalsContact O-CB 3.23Å; S109-F113 WeakPolarHBondContact O-CB 3.19Å; S109-F113 PolarHBondContact O-N 3.44Å; I111-F113 PolarHBondContact O-N 3.46Å; F113-K116 PolarHBondContact O-N 2.67Å; F113-S117 VanDerWaalsContact O-CB 3.27Å; F113-S117 WeakPolarHBondContact O-CB 3.32Å; F113-S117 PolarHBondContact O-N 3.26Å; F113-S117 PolarHBondContact O-OG 2.99Å; F113-Y146 HydrophobicContact CD1-CD1 4.4Å; F113-Y146 AromaticContact CD1-CD2 3.77Å; F113-Y146 HydrophobicContact CD1-CD2 3.77Å; F113-Y146 AromaticContact CD1-CE1 3.99Å; F113-Y146 HydrophobicContact CD1-CE1 3.99Å; F113-Y146 AromaticContact CD1-CE2 3.3Å; F113-Y146 HydrophobicContact CD1-CE2 3.3Å; F113-Y146 HydrophobicContact CD1-CG 4.3Å; F113-Y146 AromaticContact CD1-CZ 3.41Å; F113-Y146 VanDerWaalsContact CD1-CZ 3.41Å; F113-Y146 HydrophobicContact CE1-CD1 4.3Å; F113-Y146 HydrophobicContact CE1-CD2 4.42Å; F113-Y146 AromaticContact CE1-CE1 3.66Å; F113-Y146 HydrophobicContact CE1-CE1 3.66Å; F113-Y146 AromaticContact CE1-CE2 3.81Å; F113-Y146 HydrophobicContact CE1-CE2 3.81Å; F113-Y146 AromaticContact CE1-CZ 3.37Å; F113-Y146 WeakPolarHBondContact CE1-OH 3.41Å; F113-Y146 HydrophobicContact CG-CE2 4.34Å
114	Y	94	Very high	92.1	Very high	15 Å²	15	46.3 Å²	46.3	6%	0.059	24%	0.239	C	C	.	.	H	α-helix	trans	-61.3	-47.7	174.5	-174.3	-96.8	0	0	0	111.6	V110 I111 T112 K116 S117 R118 V120 W128 Y146 F149 Y150 M153	V110-Y114 WeakPolarHBondContact O-CB 3.23Å; V110-Y114 PolarHBondContact O-N 3.47Å; I111-Y114 WeakPolarHBondContact O-CB 3.38Å; I111-Y114 PolarHBondContact O-N 3.46Å; T112-Y114 VanDerWaalsContact C-N 3.34Å; T112-Y114 PolarHBondContact O-N 3.24Å; Y114-K116 PolarHBondContact O-N 3.32Å; Y114-S117 PolarHBondContact O-N 2.98Å; Y114-S117 PolarHBondContact O-OG 3.24Å; Y114-S117 VanDerWaalsContact O-OG 3.12Å; Y114-R118 HydrophobicContact CD1-CG 4.47Å; Y114-R118 HydrophobicContact CD2-CG 4.05Å; Y114-R118 HydrophobicContact CE1-CG 4.23Å; Y114-R118 HydrophobicContact CE2-CG 3.76Å; Y114-R118 HydrophobicContact CG-CG 4.39Å; Y114-R118 WeakPolarHBondContact O-CB 3.5Å; Y114-R118 WeakPolarHBondContact O-CG 3.19Å; Y114-R118 PolarHBondContact O-N 3.41Å; Y114-V120 HydrophobicContact CD1-CG2 4.16Å; Y114-V120 HydrophobicContact CE1-CG2 4.05Å; Y114-W128 HydrophobicContact CD1-CE3 4.32Å; Y114-W128 AromaticContact CD1-CH2 3.59Å; Y114-W128 HydrophobicContact CD1-CH2 3.59Å; Y114-W128 HydrophobicContact CD1-CZ2 4.2Å; Y114-W128 AromaticContact CD1-CZ3 3.64Å; Y114-W128 HydrophobicContact CD1-CZ3 3.64Å; Y114-W128 AromaticContact CE1-CH2 3.62Å; Y114-W128 HydrophobicContact CE1-CH2 3.62Å; Y114-W128 AromaticContact CE1-CZ2 3.82Å; Y114-W128 HydrophobicContact CE1-CZ2 3.82Å; Y114-W128 HydrophobicContact CE1-CZ3 4.12Å; Y114-Y146 HydrophobicContact CD2-CE2 4.32Å; Y114-F149 HydrophobicContact CD1-CE1 4.09Å; Y114-F149 HydrophobicContact CD2-CD1 4.25Å; Y114-F149 AromaticContact CD2-CE1 3.81Å; Y114-F149 HydrophobicContact CD2-CE1 3.81Å; Y114-F149 HydrophobicContact CE2-CE1 4.32Å; Y114-F149 HydrophobicContact CG-CD1 4.46Å; Y114-F149 AromaticContact CG-CE1 3.68Å; Y114-F149 HydrophobicContact CG-CE1 3.68Å; Y114-Y150 HydrophobicContact CD2-CD2 4.17Å; Y114-Y150 AromaticContact CE2-CD2 3.96Å; Y114-Y150 HydrophobicContact CE2-CD2 3.96Å; Y114-M153 HydrophobicContact CE1-CE 4Å; Y114-M153 HydrophobicContact CE2-CB 4.21Å; Y114-M153 HydrophobicContact CE2-CG 4.43Å
115	C	93.2	Very high	91.6	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.014	26%	0.257	C	S	.	.	H	α-helix	trans	-55.3	-48.9	174.4	-81.5	0	0	0	0	112.7	L76 I111 T112 N119 V120	L76-C115 HydrophobicContact CD1-CB 3.45Å; L76-C115 VanDerWaalsContact CD1-CB 3.45Å; I111-C115 PolarHBondContact O-N 3.18Å; T112-C115 WeakPolarHBondContact O-CB 3.13Å; T112-C115 PolarHBondContact O-N 3.44Å; C115-N119 WeakPolarHBondContact O-CA 3.4Å; C115-N119 PolarHBondContact O-N 3.11Å; C115-V120 WeakPolarHBondContact CA-O 3.39Å; C115-V120 WeakPolarHBondContact CB-O 3.27Å; C115-V120 PolarHBondContact O-N 3Å; C115-V120 VanDerWaalsContact O-N 3.14Å; C115-V120 PolarHBondContact SG-O 3.32Å; C115-V120 VanDerWaalsContact SG-O 3.34Å
116	K	92.5	Very high	91	Very high	67 Å²	67	46.1 Å²	46.1	29%	0.291	24%	0.244	S	C	.	.	H	α-helix	trans	-62.5	-50.3	177.9	-75.1	-176.3	170.1	-174.5	0	112.6	W70 V73 D75 L76 T112 F113 Y114 R118 N119	W70-K116 HydrophobicContact CZ2-CD 4.29Å; V73-K116 PolarHBondContact O-NZ 3.32Å; D75-K116 WeakPolarHBondContact OD1-CE 3.35Å; D75-K116 IonicContact OD1-NZ 3.37Å; D75-K116 PolarHBondContact OD1-NZ 3.43Å; D75-K116 IonicContact OD2-NZ 3.13Å; L76-K116 HydrophobicContact CD2-CG 3.98Å; T112-K116 WeakPolarHBondContact O-CG 3.4Å; T112-K116 PolarHBondContact O-N 3.36Å; F113-K116 PolarHBondContact O-N 2.67Å; Y114-K116 PolarHBondContact O-N 3.32Å; K116-R118 VanDerWaalsContact C-N 3.32Å; K116-R118 PolarHBondContact O-N 3.14Å; K116-N119 PolarHBondContact O-N 3.24Å
117	S	90.6	Very high	90.6	Very high	53 Å²	53	45.3 Å²	45.3	37%	0.371	24%	0.24	S	C	.	.	H	α-helix	trans	-69	-28.9	-174.7	59.5	0	0	0	0	113.5	F113 Y114 Y146	F113-S117 VanDerWaalsContact O-CB 3.27Å; F113-S117 WeakPolarHBondContact O-CB 3.32Å; F113-S117 PolarHBondContact O-N 3.26Å; F113-S117 PolarHBondContact O-OG 2.99Å; Y114-S117 PolarHBondContact O-N 2.98Å; Y114-S117 PolarHBondContact O-OG 3.24Å; Y114-S117 VanDerWaalsContact O-OG 3.12Å; S117-Y146 PolarHBondContact OG-OH 3.45Å
118	R	88	Confident	90.5	Very high	100 Å²	100	46.3 Å²	46.3	38%	0.377	24%	0.244	S	C	.	.	H	α-helix	trans	-101.2	-6.3	-179.4	-57	-58.8	-68	135.9	0.3	113.8	Y114 K116 V120	Y114-R118 HydrophobicContact CD1-CG 4.47Å; Y114-R118 HydrophobicContact CD2-CG 4.05Å; Y114-R118 HydrophobicContact CE1-CG 4.23Å; Y114-R118 HydrophobicContact CE2-CG 3.76Å; Y114-R118 HydrophobicContact CG-CG 4.39Å; Y114-R118 WeakPolarHBondContact O-CB 3.5Å; Y114-R118 WeakPolarHBondContact O-CG 3.19Å; Y114-R118 PolarHBondContact O-N 3.41Å; K116-R118 VanDerWaalsContact C-N 3.32Å; K116-R118 PolarHBondContact O-N 3.14Å; R118-V120 VanDerWaalsContact C-N 3.29Å; R118-V120 HydrophobicContact CB-CG1 4.11Å; R118-V120 HydrophobicContact CB-CG2 3.97Å; R118-V120 PolarHBondContact O-N 3.18Å
119	N	88.5	Confident	90.2	Very high	153 Å²	153	46.2 Å²	46.2	82%	0.818	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	47.1	-174	-167.6	41.5	0	0	0	112	C115 K116	C115-N119 WeakPolarHBondContact O-CA 3.4Å; C115-N119 PolarHBondContact O-N 3.11Å; K116-N119 PolarHBondContact O-N 3.24Å
120	V	88.8	Confident	90.1	Very high	57 Å²	57	47.2 Å²	47.2	35%	0.345	25%	0.248	S	C	.	.			trans	-116.5	141.2	178.1	-64.9	0	0	0	0	109.6	Y114 C115 R118 W128	Y114-V120 HydrophobicContact CD1-CG2 4.16Å; Y114-V120 HydrophobicContact CE1-CG2 4.05Å; C115-V120 WeakPolarHBondContact CA-O 3.39Å; C115-V120 WeakPolarHBondContact CB-O 3.27Å; C115-V120 PolarHBondContact O-N 3Å; C115-V120 VanDerWaalsContact O-N 3.14Å; C115-V120 PolarHBondContact SG-O 3.32Å; C115-V120 VanDerWaalsContact SG-O 3.34Å; R118-V120 VanDerWaalsContact C-N 3.29Å; R118-V120 HydrophobicContact CB-CG1 4.11Å; R118-V120 HydrophobicContact CB-CG2 3.97Å; R118-V120 PolarHBondContact O-N 3.18Å; V120-W128 HydrophobicContact CG2-CH2 3.73Å
121	K	90.4	Very high	90	Very high	175 Å²	175	47.2 Å²	47.2	76%	0.761	25%	0.248	S	C	*	.			trans	-86.8	139.2	178.7	-65.4	-175.2	178.8	-178.3	0	110.6	E78	E78-K121 WeakPolarHBondContact OE1-CA 3.18Å; E78-K121 WeakPolarHBondContact OE1-CB 3.43Å
122	Y	92.1	Very high	89.9	Confident	13 Å²	13	47.2 Å²	47.2	5%	0.051	25%	0.248	C	C	.	.			trans	-78.2	147.1	174.4	-176.4	-90.6	0	0	0	110.8	E78 T81 I82 D85 I111 L126 W128	E78-Y122 PolarHBondContact OE1-N 3.35Å; T81-Y122 HydrophobicContact CG2-CD1 4.37Å; T81-Y122 HydrophobicContact CG2-CE1 4.18Å; I82-Y122 HydrophobicContact CD1-CD1 4.46Å; I82-Y122 HydrophobicContact CD1-CG 4.1Å; I82-Y122 HydrophobicContact CG1-CD1 3.46Å; I82-Y122 VanDerWaalsContact CG1-CD1 3.46Å; I82-Y122 HydrophobicContact CG1-CD2 4.03Å; I82-Y122 HydrophobicContact CG1-CE1 3.95Å; I82-Y122 HydrophobicContact CG1-CE2 4.44Å; I82-Y122 HydrophobicContact CG1-CG 3.52Å; D85-Y122 WeakPolarHBondContact CB-OH 3.41Å; D85-Y122 VanDerWaalsContact OD2-CE1 3.31Å; D85-Y122 WeakPolarHBondContact OD2-CE1 3.1Å; D85-Y122 PolarHBondContact OD2-OH 3.45Å; I111-Y122 HydrophobicContact CD1-CE2 4.46Å; I111-Y122 HydrophobicContact CG2-CD2 3.58Å; I111-Y122 HydrophobicContact CG2-CE2 3.81Å; I111-Y122 HydrophobicContact CG2-CG 4.46Å; Y122-L126 HydrophobicContact CD2-CD1 4.28Å; Y122-W128 AromaticContact CD2-CE3 3.89Å; Y122-W128 HydrophobicContact CD2-CE3 3.89Å; Y122-W128 HydrophobicContact CD2-CZ3 4.08Å; Y122-W128 HydrophobicContact CE2-CE3 4.21Å
123	S	88.6	Confident	89.7	Confident	53 Å²	53	49.1 Å²	49.1	37%	0.371	26%	0.256	S	S	.	.			trans	-146.2	147.6	173	-172.8	0	0	0	0	109.1	S125 L126	S123-S125 PolarHBondContact O-N 3.31Å; S123-S125 PolarHBondContact OG-OG 2.95Å; S123-L126 VanDerWaalsContact N-CD1 3.34Å; S123-L126 VanDerWaalsContact O-CB 3.23Å; S123-L126 WeakPolarHBondContact O-CB 3.21Å; S123-L126 VanDerWaalsContact O-CG 3.26Å; S123-L126 WeakPolarHBondContact O-CG 3.2Å; S123-L126 PolarHBondContact O-N 2.93Å
124	T	85.9	Confident	89.6	Confident	92 Å²	92	48 Å²	48	56%	0.564	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-19.2	179.7	57.6	0	0	0	0	113.1	T81 L126	T81-T124 HydrophobicContact CG2-CG2 3.27Å; T124-L126 PolarHBondContact O-N 3.39Å
125	S	80.8	Confident	89.6	Confident	74 Å²	74	47.2 Å²	47.2	52%	0.517	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-8.7	174.1	58.6	0	0	0	0	113.2	S123	S123-S125 PolarHBondContact O-N 3.31Å; S123-S125 PolarHBondContact OG-OG 2.95Å
126	L	81.2	Confident	89.6	Confident	46 Å²	46	47.7 Å²	47.7	24%	0.241	25%	0.251	C	S	.	.			trans	-80	127.5	177.3	-58.7	174.6	0	0	0	109.7	Y122 S123 T124 W128	Y122-L126 HydrophobicContact CD2-CD1 4.28Å; S123-L126 VanDerWaalsContact N-CD1 3.34Å; S123-L126 VanDerWaalsContact O-CB 3.23Å; S123-L126 WeakPolarHBondContact O-CB 3.21Å; S123-L126 VanDerWaalsContact O-CG 3.26Å; S123-L126 WeakPolarHBondContact O-CG 3.2Å; S123-L126 PolarHBondContact O-N 2.93Å; T124-L126 PolarHBondContact O-N 3.39Å; L126-W128 HydrophobicContact CB-CD2 4.26Å; L126-W128 HydrophobicContact CB-CG 4.1Å; L126-W128 HydrophobicContact CD1-CD2 4.17Å; L126-W128 HydrophobicContact CD1-CE3 4.42Å; L126-W128 HydrophobicContact CD1-CH2 3.98Å; L126-W128 HydrophobicContact CD1-CZ2 3.74Å; L126-W128 HydrophobicContact CD1-CZ3 4.33Å; L126-W128 PolarHBondContact O-N 3.18Å
127	S	83.1	Confident	89.4	Confident	8 Å²	8	49.3 Å²	49.3	6%	0.056	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	26.3	-178	-26.4	0	0	0	0	113.9	H130 L131 N199	S127-H130 WeakPolarHBondContact O-CB 3.49Å; S127-H130 PolarHBondContact O-N 2.91Å; S127-L131 PolarHBondContact O-N 2.95Å; S127-L131 VanDerWaalsContact O-N 3.15Å; S127-N199 PolarHBondContact OG-OD1 3.44Å
128	W	90.4	Very high	89.5	Confident	21 Å²	21	48.1 Å²	48.1	8%	0.08	25%	0.245	C	C	.	.	H	α-helix	trans	-71.1	-36.6	-169.4	-66.2	1.1	0	0	0	113.7	I111 Y114 V120 Y122 L126 H130 L131 L132 F149 M153	I111-W128 HydrophobicContact CG2-CE3 4.15Å; I111-W128 HydrophobicContact CG2-CZ3 4.42Å; Y114-W128 HydrophobicContact CD1-CE3 4.32Å; Y114-W128 AromaticContact CD1-CH2 3.59Å; Y114-W128 HydrophobicContact CD1-CH2 3.59Å; Y114-W128 HydrophobicContact CD1-CZ2 4.2Å; Y114-W128 AromaticContact CD1-CZ3 3.64Å; Y114-W128 HydrophobicContact CD1-CZ3 3.64Å; Y114-W128 AromaticContact CE1-CH2 3.62Å; Y114-W128 HydrophobicContact CE1-CH2 3.62Å; Y114-W128 AromaticContact CE1-CZ2 3.82Å; Y114-W128 HydrophobicContact CE1-CZ2 3.82Å; Y114-W128 HydrophobicContact CE1-CZ3 4.12Å; V120-W128 HydrophobicContact CG2-CH2 3.73Å; Y122-W128 AromaticContact CD2-CE3 3.89Å; Y122-W128 HydrophobicContact CD2-CE3 3.89Å; Y122-W128 HydrophobicContact CD2-CZ3 4.08Å; Y122-W128 HydrophobicContact CE2-CE3 4.21Å; L126-W128 HydrophobicContact CB-CD2 4.26Å; L126-W128 HydrophobicContact CB-CG 4.1Å; L126-W128 HydrophobicContact CD1-CD2 4.17Å; L126-W128 HydrophobicContact CD1-CE3 4.42Å; L126-W128 HydrophobicContact CD1-CH2 3.98Å; L126-W128 HydrophobicContact CD1-CZ2 3.74Å; L126-W128 HydrophobicContact CD1-CZ3 4.33Å; L126-W128 PolarHBondContact O-N 3.18Å; W128-H130 VanDerWaalsContact C-N 3.25Å; W128-H130 PolarHBondContact O-N 2.97Å; W128-L131 PolarHBondContact O-N 3.41Å; W128-L132 PolarHBondContact O-N 2.79Å; W128-F149 HydrophobicContact CB-CE2 4.16Å; W128-F149 HydrophobicContact CB-CZ 4.12Å; W128-F149 HydrophobicContact CD2-CZ 4.11Å; W128-F149 HydrophobicContact CE3-CZ 4.26Å; W128-F149 HydrophobicContact CG-CE2 4.41Å; W128-F149 HydrophobicContact CG-CZ 4.05Å; W128-M153 HydrophobicContact CZ2-CE 3.9Å; W128-M153 VanDerWaalsContact NE1-CE 3.32Å
129	T	90.3	Very high	89.5	Confident	9 Å²	9	50.6 Å²	50.6	6%	0.055	26%	0.261	C	S	.	.	H	α-helix	trans	-59.5	-40.2	172.9	49.6	0	0	0	0	110.8	D85 I111 L131 L132 K133	D85-T129 HydrophobicContact CB-CG2 4.22Å; I111-T129 HydrophobicContact CD1-CG2 4.11Å; T129-L131 PolarHBondContact O-N 3.28Å; T129-L132 PolarHBondContact O-N 3.48Å; T129-K133 PolarHBondContact O-N 3.41Å
130	H	91.4	Very high	89.7	Confident	30 Å²	30	44.3 Å²	44.3	14%	0.139	23%	0.228	C	C	.	.	H	α-helix	trans	-68	-34.2	176.8	-56.7	-68.1	0	0	0	113.1	S127 W128 L132 K133 P134 A206 H207	S127-H130 WeakPolarHBondContact O-CB 3.49Å; S127-H130 PolarHBondContact O-N 2.91Å; W128-H130 VanDerWaalsContact C-N 3.25Å; W128-H130 PolarHBondContact O-N 2.97Å; H130-L132 VanDerWaalsContact C-N 3.28Å; H130-L132 PolarHBondContact O-N 2.82Å; H130-K133 WeakPolarHBondContact O-CB 3.4Å; H130-K133 PolarHBondContact O-N 2.96Å; H130-P134 WeakPolarHBondContact O-CD 3.16Å; H130-A206 VanDerWaalsContact O-CB 3.24Å; H130-A206 WeakPolarHBondContact O-CB 3.22Å; H130-H207 HydrophobicContact CB-CB 4.11Å; H130-H207 AromaticContact CD2-ND1 3.14Å; H130-H207 PolarHBondContact CD2-ND1 3.32Å; H130-H207 AromaticContact CE1-CE1 3.64Å; H130-H207 AromaticContact CE1-ND1 3.05Å; H130-H207 PolarHBondContact CE1-ND1 3.26Å; H130-H207 AromaticContact CG-ND1 3.45Å; H130-H207 AromaticContact ND1-ND1 3.39Å; H130-H207 PolarHBondContact ND1-ND1 2.94Å; H130-H207 AromaticContact NE2-CE1 3.44Å; H130-H207 PolarHBondContact NE2-CE1 3.47Å; H130-H207 AromaticContact NE2-ND1 2.85Å; H130-H207 PolarHBondContact NE2-ND1 3.07Å
131	L	93.3	Very high	89.9	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-65.2	-32	172.1	-71.9	174.7	0	0	0	112.7	S127 W128 T129 K133 P134 F149 I152 M153 I157 G202 S203 L204 W218	S127-L131 PolarHBondContact O-N 2.95Å; S127-L131 VanDerWaalsContact O-N 3.15Å; W128-L131 PolarHBondContact O-N 3.41Å; T129-L131 PolarHBondContact O-N 3.28Å; L131-K133 VanDerWaalsContact C-N 3.31Å; L131-P134 WeakPolarHBondContact O-CD 3.36Å; L131-F149 HydrophobicContact CB-CD2 4.43Å; L131-F149 HydrophobicContact CB-CE2 4.28Å; L131-F149 HydrophobicContact CD1-CE2 4.36Å; L131-I152 HydrophobicContact CD2-CG2 4.26Å; L131-M153 HydrophobicContact CD1-SD 3.61Å; L131-I157 HydrophobicContact CD1-CD1 4.03Å; L131-I157 HydrophobicContact CD1-CG1 3.95Å; L131-I157 HydrophobicContact CD2-CD1 3.98Å; L131-G202 WeakPolarHBondContact CD1-O 3.3Å; L131-S203 WeakPolarHBondContact CD2-O 3.26Å; L131-L204 HydrophobicContact CD2-CD1 4.39Å; L131-L204 HydrophobicContact CD2-CG 4.23Å; L131-W218 HydrophobicContact CD2-CH2 4.03Å; L131-W218 HydrophobicContact CD2-CZ2 3.9Å; L131-W218 WeakPolarHBondContact O-CH2 3.39Å
132	L	93.8	Very high	90	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-74	-23.5	177.2	-68.7	169.6	0	0	0	112.2	I107 V110 I111 W128 T129 H130 L135 V136 L145 F149	I107-L132 HydrophobicContact CG2-CD1 3.85Å; V110-L132 HydrophobicContact CG1-CD1 4.45Å; V110-L132 HydrophobicContact CG1-CD2 4.07Å; I111-L132 HydrophobicContact CD1-CD1 4.05Å; I111-L132 HydrophobicContact CG1-CD1 3.92Å; W128-L132 PolarHBondContact O-N 2.79Å; T129-L132 PolarHBondContact O-N 3.48Å; H130-L132 VanDerWaalsContact C-N 3.28Å; H130-L132 PolarHBondContact O-N 2.82Å; L132-L135 HydrophobicContact CD2-CD1 4.4Å; L132-L135 PolarHBondContact O-N 2.91Å; L132-L135 VanDerWaalsContact O-N 3.07Å; L132-V136 HydrophobicContact CB-CG2 4.41Å; L132-V136 VanDerWaalsContact O-CG2 3.31Å; L132-V136 WeakPolarHBondContact O-CG2 3.39Å; L132-V136 PolarHBondContact O-N 3.19Å; L132-L145 HydrophobicContact CD2-CD1 3.91Å; L132-L145 HydrophobicContact CD2-CG 4.2Å; L132-F149 HydrophobicContact CD2-CB 3.87Å; L132-F149 HydrophobicContact CD2-CD2 3.62Å; L132-F149 HydrophobicContact CD2-CE2 4.41Å; L132-F149 HydrophobicContact CD2-CG 3.88Å; L132-F149 HydrophobicContact CG-CD2 3.95Å; L132-F149 HydrophobicContact CG-CE2 4.3Å
133	K	91.1	Very high	90	Very high	39 Å²	39	42.2 Å²	42.2	17%	0.17	22%	0.222	C	C	.	.	H	α-helix	trans	-46.1	-63	178.5	-168.7	-177.4	178.6	-173.4	0	114.4	F89 L93 T129 H130 L131 L135 V136 Y137	F89-K133 HydrophobicContact CE2-CB 3.67Å; F89-K133 HydrophobicContact CE2-CD 4.42Å; F89-K133 HydrophobicContact CE2-CG 3.89Å; F89-K133 HydrophobicContact CZ-CB 3.86Å; F89-K133 HydrophobicContact CZ-CG 4.26Å; L93-K133 HydrophobicContact CD2-CG 4.05Å; T129-K133 PolarHBondContact O-N 3.41Å; H130-K133 WeakPolarHBondContact O-CB 3.4Å; H130-K133 PolarHBondContact O-N 2.96Å; L131-K133 VanDerWaalsContact C-N 3.31Å; K133-L135 PolarHBondContact O-N 3.42Å; K133-V136 PolarHBondContact O-N 3.07Å; K133-Y137 WeakPolarHBondContact O-CD2 3.43Å; K133-Y137 PolarHBondContact O-N 2.91Å
134	P	93.5	Very high	90.3	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-63.5	-28.5	-180	25.2	-35.1	0	0	0	113.7	W54 H130 L131 I211 T214 W218	W54-P134 HydrophobicContact CH2-CB 3.94Å; W54-P134 HydrophobicContact CZ3-CB 4.09Å; H130-P134 WeakPolarHBondContact O-CD 3.16Å; L131-P134 WeakPolarHBondContact O-CD 3.36Å; P134-I211 HydrophobicContact CB-CD1 4.27Å; P134-T214 HydrophobicContact CB-CG2 4.11Å; P134-T214 HydrophobicContact CG-CG2 4.1Å; P134-W218 HydrophobicContact CB-CD2 4.44Å; P134-W218 HydrophobicContact CB-CE3 4.22Å; P134-W218 HydrophobicContact CB-CZ3 4.28Å; P134-W218 HydrophobicContact CG-CD2 4Å; P134-W218 HydrophobicContact CG-CE3 3.78Å; P134-W218 HydrophobicContact CG-CH2 3.39Å; P134-W218 HydrophobicContact CG-CZ2 3.65Å; P134-W218 HydrophobicContact CG-CZ3 3.45Å; P134-W218 VanDerWaalsContact CG-CZ3 3.45Å
135	L	94.7	Very high	90.8	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-76	-37.4	-179.9	-59.9	175.3	0	0	0	112.8	W54 L132 K133 Y137 L138 L145 C148 F149 I152 W218	W54-L135 HydrophobicContact CE3-CD2 3.9Å; W54-L135 HydrophobicContact CZ3-CD2 3.92Å; L132-L135 HydrophobicContact CD2-CD1 4.4Å; L132-L135 PolarHBondContact O-N 2.91Å; L132-L135 VanDerWaalsContact O-N 3.07Å; K133-L135 PolarHBondContact O-N 3.42Å; L135-Y137 VanDerWaalsContact C-N 3.31Å; L135-Y137 PolarHBondContact O-N 3.49Å; L135-L138 HydrophobicContact CD2-CD1 4.5Å; L135-L138 WeakPolarHBondContact O-CB 3.45Å; L135-L138 PolarHBondContact O-N 3.45Å; L135-L138 VanDerWaalsContact O-N 3.17Å; L135-L145 HydrophobicContact CB-CD1 3.49Å; L135-L145 VanDerWaalsContact CB-CD1 3.49Å; L135-L145 HydrophobicContact CD1-CD1 4.27Å; L135-C148 HydrophobicContact CD1-CB 4.02Å; L135-C148 HydrophobicContact CD2-CB 3.89Å; L135-F149 HydrophobicContact CD1-CB 4.25Å; L135-I152 HydrophobicContact CD1-CD1 3.98Å; L135-I152 HydrophobicContact CD2-CD1 4.14Å; L135-I152 HydrophobicContact CG-CD1 4.42Å; L135-W218 HydrophobicContact CD2-CZ3 4.23Å; L135-W218 HydrophobicContact CG-CZ3 4.26Å
136	V	91.9	Very high	91.5	Very high	11 Å²	11	33.9 Å²	33.9	7%	0.067	16%	0.163	C	C	.	.	H	α-helix	trans	-65.4	-37	176.8	168.3	0	0	0	0	110.6	L93 L103 I107 L132 K133 L138 Q139 L145	L93-V136 HydrophobicContact CD1-CG1 4.12Å; L103-V136 HydrophobicContact CD1-CG1 4.31Å; L103-V136 HydrophobicContact CD2-CG1 4.09Å; I107-V136 HydrophobicContact CD1-CG2 3.99Å; I107-V136 HydrophobicContact CG1-CG2 3.98Å; L132-V136 HydrophobicContact CB-CG2 4.41Å; L132-V136 VanDerWaalsContact O-CG2 3.31Å; L132-V136 WeakPolarHBondContact O-CG2 3.39Å; L132-V136 PolarHBondContact O-N 3.19Å; K133-V136 PolarHBondContact O-N 3.07Å; V136-L138 PolarHBondContact O-N 2.89Å; V136-Q139 PolarHBondContact O-N 2.92Å; V136-L145 HydrophobicContact CG2-CD1 4.34Å; V136-L145 HydrophobicContact CG2-CD2 4.39Å
137	Y	90.1	Very high	92.2	Very high	102 Å²	102	31.7 Å²	31.7	40%	0.4	15%	0.152	S	C	.	.	H	α-helix	trans	-62.1	-23.9	174.1	-92.3	-84.7	0	0	0	113.9	L93 K133 L135 Q139 I211	L93-Y137 HydrophobicContact CD2-CD2 4.08Å; L93-Y137 HydrophobicContact CD2-CE2 3.26Å; K133-Y137 WeakPolarHBondContact O-CD2 3.43Å; K133-Y137 PolarHBondContact O-N 2.91Å; L135-Y137 VanDerWaalsContact C-N 3.31Å; L135-Y137 PolarHBondContact O-N 3.49Å; Y137-Q139 PolarHBondContact O-N 3.47Å; Y137-I211 HydrophobicContact CD1-CG1 4.07Å; Y137-I211 HydrophobicContact CD2-CB 4.43Å; Y137-I211 HydrophobicContact CD2-CD1 3.35Å; Y137-I211 HydrophobicContact CD2-CG1 3.51Å; Y137-I211 HydrophobicContact CE1-CG1 4.22Å; Y137-I211 HydrophobicContact CE1-CG2 4.47Å; Y137-I211 HydrophobicContact CE2-CB 4.08Å; Y137-I211 HydrophobicContact CE2-CD1 3.82Å; Y137-I211 HydrophobicContact CE2-CG1 3.64Å; Y137-I211 HydrophobicContact CE2-CG2 4.48Å; Y137-I211 HydrophobicContact CG-CD1 3.81Å; Y137-I211 HydrophobicContact CG-CG1 3.73Å
138	L	91	Very high	92.8	Very high	27 Å²	27	31.4 Å²	31.4	14%	0.141	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-4.4	173.9	-64.7	173.3	0	0	0	113.3	R50 A51 W54 L135 V136 L140	R50-L138 HydrophobicContact CB-CD2 4.02Å; R50-L138 HydrophobicContact CG-CD2 3.76Å; A51-L138 HydrophobicContact CB-CD2 4.44Å; W54-L138 HydrophobicContact CD2-CD1 4.04Å; W54-L138 HydrophobicContact CE3-CD1 3.47Å; W54-L138 VanDerWaalsContact CE3-CD1 3.47Å; W54-L138 HydrophobicContact CZ3-CD1 3.81Å; L135-L138 HydrophobicContact CD2-CD1 4.5Å; L135-L138 WeakPolarHBondContact O-CB 3.45Å; L135-L138 PolarHBondContact O-N 3.45Å; L135-L138 VanDerWaalsContact O-N 3.17Å; V136-L138 PolarHBondContact O-N 2.89Å; L138-L140 HydrophobicContact CB-CD1 4.32Å; L138-L140 HydrophobicContact CB-CD2 4.2Å; L138-L140 HydrophobicContact CB-CG 3.83Å; L138-L140 HydrophobicContact CD1-CD1 4.34Å; L138-L140 PolarHBondContact O-N 3.32Å
139	Q	89.8	Confident	93.1	Very high	153 Å²	153	30.4 Å²	30.4	72%	0.715	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	41.7	180	-56.8	-175.7	27.9	0	0	112.9	V136 Y137	V136-Q139 PolarHBondContact O-N 2.92Å; Y137-Q139 PolarHBondContact O-N 3.47Å
140	L	91.7	Very high	93.3	Very high	20 Å²	20	33.4 Å²	33.4	11%	0.105	16%	0.157	C	C	.	.			trans	-70.6	147.4	178.7	-61.9	176.7	0	0	0	111	A51 L138 D144 L145	A51-L140 HydrophobicContact CB-CD2 3.9Å; L138-L140 HydrophobicContact CB-CD1 4.32Å; L138-L140 HydrophobicContact CB-CD2 4.2Å; L138-L140 HydrophobicContact CB-CG 3.83Å; L138-L140 HydrophobicContact CD1-CD1 4.34Å; L138-L140 PolarHBondContact O-N 3.32Å; L140-D144 HydrophobicContact CB-CB 4.22Å; L140-L145 HydrophobicContact CB-CB 4.49Å
141	P	92.8	Very high	93.4	Very high	70 Å²	70	32.6 Å²	32.6	46%	0.455	16%	0.155	S	C	.	.			trans	-62.9	151.7	167.6	29.2	-34.6	0	0	0	109.9	S143 D144 L145	P141-S143 PolarHBondContact O-N 2.85Å; P141-D144 HydrophobicContact CG-CB 3.94Å; P141-D144 WeakPolarHBondContact CG-OD2 3.39Å; P141-D144 PolarHBondContact O-N 3.1Å; P141-L145 PolarHBondContact O-N 2.89Å
142	R	92.8	Very high	93.6	Very high	105 Å²	105	32.7 Å²	32.7	40%	0.396	16%	0.156	S	C	.	.	H	α-helix	trans	-48.3	-40	-177.4	-176.4	176.8	59.6	-157.4	8.1	114.6	L67 D106 S109 V110 D144 L145 Y146	L67-R142 HydrophobicContact CD2-CG 4.02Å; D106-R142 HydrophobicContact CB-CB 4.49Å; D106-R142 HydrophobicContact CB-CG 4.39Å; D106-R142 WeakPolarHBondContact OD1-CD 3.48Å; D106-R142 IonicContact OD1-NH1 2.61Å; S109-R142 VanDerWaalsContact OG-CD 3.25Å; S109-R142 WeakPolarHBondContact OG-CD 3.41Å; V110-R142 HydrophobicContact CG2-CG 4.21Å; R142-D144 VanDerWaalsContact C-N 3.35Å; R142-D144 PolarHBondContact O-N 3.24Å; R142-L145 PolarHBondContact O-N 3.27Å; R142-Y146 PolarHBondContact O-N 3.26Å
143	S	92.8	Very high	93.5	Very high	27 Å²	27	33.6 Å²	33.6	19%	0.189	16%	0.16	C	C	.	.	H	α-helix	trans	-59.6	-45.6	178.2	58.3	0	0	0	0	112	D65 P141 N147	D65-S143 WeakPolarHBondContact OD1-CB 3.31Å; P141-S143 PolarHBondContact O-N 2.85Å; S143-N147 WeakPolarHBondContact O-CB 3.33Å; S143-N147 PolarHBondContact O-N 3.33Å; S143-N147 PolarHBondContact O-ND2 3.38Å
144	D	94.4	Very high	93.5	Very high	30 Å²	30	33.4 Å²	33.4	16%	0.16	16%	0.161	C	C	.	.	H	α-helix	trans	-75.7	-35.9	-179.2	-68.2	-14.3	0	0	0	111	K55 L140 P141 R142 Y146 N147 C148	K55-D144 WeakPolarHBondContact CE-OD2 3.38Å; K55-D144 IonicContact NZ-OD2 3.3Å; K55-D144 PolarHBondContact NZ-OD2 3.37Å; L140-D144 HydrophobicContact CB-CB 4.22Å; P141-D144 HydrophobicContact CG-CB 3.94Å; P141-D144 WeakPolarHBondContact CG-OD2 3.39Å; P141-D144 PolarHBondContact O-N 3.1Å; R142-D144 VanDerWaalsContact C-N 3.35Å; R142-D144 PolarHBondContact O-N 3.24Å; D144-Y146 VanDerWaalsContact C-N 3.35Å; D144-Y146 PolarHBondContact O-N 3.18Å; D144-N147 PolarHBondContact O-N 2.96Å; D144-C148 WeakPolarHBondContact O-CB 3.33Å; D144-C148 PolarHBondContact O-N 3.03Å; D144-C148 PolarHBondContact O-SG 3.37Å
145	L	95.8	Very high	93.5	Very high	6 Å²	6	36.8 Å²	36.8	3%	0.031	18%	0.176	C	C	.	.	H	α-helix	trans	-56.4	-49.3	172.7	-178.5	60.6	0	0	0	110.8	V110 L132 L135 V136 L140 P141 R142 F149	V110-L145 HydrophobicContact CG2-CD2 4.17Å; V110-L145 HydrophobicContact CG2-CG 4.25Å; L132-L145 HydrophobicContact CD2-CD1 3.91Å; L132-L145 HydrophobicContact CD2-CG 4.2Å; L135-L145 HydrophobicContact CB-CD1 3.49Å; L135-L145 VanDerWaalsContact CB-CD1 3.49Å; L135-L145 HydrophobicContact CD1-CD1 4.27Å; V136-L145 HydrophobicContact CG2-CD1 4.34Å; V136-L145 HydrophobicContact CG2-CD2 4.39Å; L140-L145 HydrophobicContact CB-CB 4.49Å; P141-L145 PolarHBondContact O-N 2.89Å; R142-L145 PolarHBondContact O-N 3.27Å; L145-F149 VanDerWaalsContact O-CB 3.27Å; L145-F149 WeakPolarHBondContact O-CB 3.45Å; L145-F149 PolarHBondContact O-N 3.4Å
146	Y	95.6	Very high	93.5	Very high	8 Å²	8	36.8 Å²	36.8	3%	0.031	18%	0.176	C	C	.	.	H	α-helix	trans	-63.3	-45.8	174.8	176.9	-98.4	0	0	0	112.5	L67 V110 F113 Y114 S117 R142 D144 C148 F149 Y150	L67-Y146 VanDerWaalsContact CD1-CB 3.4Å; L67-Y146 HydrophobicContact CD1-CD1 3.8Å; L67-Y146 HydrophobicContact CD1-CD2 4.2Å; L67-Y146 HydrophobicContact CD1-CG 3.52Å; V110-Y146 HydrophobicContact CG1-CD2 4.18Å; F113-Y146 HydrophobicContact CD1-CD1 4.4Å; F113-Y146 AromaticContact CD1-CD2 3.77Å; F113-Y146 HydrophobicContact CD1-CD2 3.77Å; F113-Y146 AromaticContact CD1-CE1 3.99Å; F113-Y146 HydrophobicContact CD1-CE1 3.99Å; F113-Y146 AromaticContact CD1-CE2 3.3Å; F113-Y146 HydrophobicContact CD1-CE2 3.3Å; F113-Y146 HydrophobicContact CD1-CG 4.3Å; F113-Y146 AromaticContact CD1-CZ 3.41Å; F113-Y146 VanDerWaalsContact CD1-CZ 3.41Å; F113-Y146 HydrophobicContact CE1-CD1 4.3Å; F113-Y146 HydrophobicContact CE1-CD2 4.42Å; F113-Y146 AromaticContact CE1-CE1 3.66Å; F113-Y146 HydrophobicContact CE1-CE1 3.66Å; F113-Y146 AromaticContact CE1-CE2 3.81Å; F113-Y146 HydrophobicContact CE1-CE2 3.81Å; F113-Y146 AromaticContact CE1-CZ 3.37Å; F113-Y146 WeakPolarHBondContact CE1-OH 3.41Å; F113-Y146 HydrophobicContact CG-CE2 4.34Å; Y114-Y146 HydrophobicContact CD2-CE2 4.32Å; S117-Y146 PolarHBondContact OG-OH 3.45Å; R142-Y146 PolarHBondContact O-N 3.26Å; D144-Y146 VanDerWaalsContact C-N 3.35Å; D144-Y146 PolarHBondContact O-N 3.18Å; Y146-C148 VanDerWaalsContact C-N 3.33Å; Y146-C148 PolarHBondContact O-N 3.39Å; Y146-F149 PolarHBondContact O-N 2.92Å; Y146-Y150 HydrophobicContact CE1-CD2 4.4Å; Y146-Y150 WeakPolarHBondContact O-CB 3.49Å; Y146-Y150 PolarHBondContact O-N 2.69Å
147	N	95.3	Very high	93.6	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-60.6	-44	-178.4	-76.8	-28	0	0	0	111.3	V60 K63 G64 S66 S143 D144 A151	V60-N147 HydrophobicContact CB-CB 4.14Å; V60-N147 HydrophobicContact CG1-CB 4.17Å; K63-N147 HydrophobicContact CD-CB 4.49Å; G64-N147 PolarHBondContact O-ND2 2.89Å; S66-N147 PolarHBondContact OG-OD1 3.46Å; S143-N147 WeakPolarHBondContact O-CB 3.33Å; S143-N147 PolarHBondContact O-N 3.33Å; S143-N147 PolarHBondContact O-ND2 3.38Å; D144-N147 PolarHBondContact O-N 2.96Å; N147-A151 WeakPolarHBondContact O-CB 3.28Å; N147-A151 PolarHBondContact O-N 3.41Å
148	C	96.6	Very high	93.7	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.007	16%	0.158	C	C	.	.	H	α-helix	trans	-63.5	-50.2	174.6	-71.4	0	0	0	0	111.7	L58 L135 D144 Y146 Y150 A151 I152	L58-C148 HydrophobicContact CD1-CB 3.79Å; L135-C148 HydrophobicContact CD1-CB 4.02Å; L135-C148 HydrophobicContact CD2-CB 3.89Å; D144-C148 WeakPolarHBondContact O-CB 3.33Å; D144-C148 PolarHBondContact O-N 3.03Å; D144-C148 PolarHBondContact O-SG 3.37Å; Y146-C148 VanDerWaalsContact C-N 3.33Å; Y146-C148 PolarHBondContact O-N 3.39Å; C148-Y150 VanDerWaalsContact C-N 3.34Å; C148-Y150 PolarHBondContact O-N 3.14Å; C148-A151 PolarHBondContact O-N 3.19Å; C148-I152 WeakPolarHBondContact O-CG1 3.29Å; C148-I152 PolarHBondContact O-N 3.46Å
149	F	96.3	Very high	93.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-56.3	-48	177.6	174	-103.5	0	0	0	111.7	V110 Y114 W128 L131 L132 L135 L145 Y146 A151 I152 M153	V110-F149 HydrophobicContact CG1-CB 4.39Å; V110-F149 HydrophobicContact CG1-CD1 4.02Å; V110-F149 HydrophobicContact CG1-CG 4.26Å; Y114-F149 HydrophobicContact CD1-CE1 4.09Å; Y114-F149 HydrophobicContact CD2-CD1 4.25Å; Y114-F149 AromaticContact CD2-CE1 3.81Å; Y114-F149 HydrophobicContact CD2-CE1 3.81Å; Y114-F149 HydrophobicContact CE2-CE1 4.32Å; Y114-F149 HydrophobicContact CG-CD1 4.46Å; Y114-F149 AromaticContact CG-CE1 3.68Å; Y114-F149 HydrophobicContact CG-CE1 3.68Å; W128-F149 HydrophobicContact CB-CE2 4.16Å; W128-F149 HydrophobicContact CB-CZ 4.12Å; W128-F149 HydrophobicContact CD2-CZ 4.11Å; W128-F149 HydrophobicContact CE3-CZ 4.26Å; W128-F149 HydrophobicContact CG-CE2 4.41Å; W128-F149 HydrophobicContact CG-CZ 4.05Å; L131-F149 HydrophobicContact CB-CD2 4.43Å; L131-F149 HydrophobicContact CB-CE2 4.28Å; L131-F149 HydrophobicContact CD1-CE2 4.36Å; L132-F149 HydrophobicContact CD2-CB 3.87Å; L132-F149 HydrophobicContact CD2-CD2 3.62Å; L132-F149 HydrophobicContact CD2-CE2 4.41Å; L132-F149 HydrophobicContact CD2-CG 3.88Å; L132-F149 HydrophobicContact CG-CD2 3.95Å; L132-F149 HydrophobicContact CG-CE2 4.3Å; L135-F149 HydrophobicContact CD1-CB 4.25Å; L145-F149 VanDerWaalsContact O-CB 3.27Å; L145-F149 WeakPolarHBondContact O-CB 3.45Å; L145-F149 PolarHBondContact O-N 3.4Å; Y146-F149 PolarHBondContact O-N 2.92Å; F149-A151 PolarHBondContact O-N 3.33Å; F149-I152 PolarHBondContact O-N 3.12Å; F149-M153 HydrophobicContact CD1-CG 4.3Å; F149-M153 HydrophobicContact CD2-CG 4.25Å; F149-M153 HydrophobicContact CE1-CG 3.88Å; F149-M153 HydrophobicContact CE2-CG 3.83Å; F149-M153 HydrophobicContact CE2-SD 4.21Å; F149-M153 HydrophobicContact CG-CG 4.47Å; F149-M153 HydrophobicContact CZ-CG 3.62Å; F149-M153 HydrophobicContact CZ-SD 4.09Å; F149-M153 WeakPolarHBondContact O-CB 3.48Å; F149-M153 WeakPolarHBondContact O-CG 3.49Å; F149-M153 PolarHBondContact O-N 2.9Å
150	Y	94.1	Very high	93.1	Very high	72 Å²	72	32 Å²	32	28%	0.282	15%	0.154	S	C	.	.	H	α-helix	trans	-60.2	-43.4	177	179.2	-86	0	0	0	112.1	Y114 Y146 C148 N154	Y114-Y150 HydrophobicContact CD2-CD2 4.17Å; Y114-Y150 AromaticContact CE2-CD2 3.96Å; Y114-Y150 HydrophobicContact CE2-CD2 3.96Å; Y146-Y150 HydrophobicContact CE1-CD2 4.4Å; Y146-Y150 WeakPolarHBondContact O-CB 3.49Å; Y146-Y150 PolarHBondContact O-N 2.69Å; C148-Y150 VanDerWaalsContact C-N 3.34Å; C148-Y150 PolarHBondContact O-N 3.14Å; Y150-N154 WeakPolarHBondContact CD1-ND2 3.26Å; Y150-N154 WeakPolarHBondContact CE1-ND2 3.31Å; Y150-N154 WeakPolarHBondContact CE2-ND2 3.44Å; Y150-N154 PolarHBondContact O-N 3.4Å; Y150-N154 VanDerWaalsContact O-N 3.16Å; Y150-N154 PolarHBondContact O-ND2 3.46Å
151	A	94.6	Very high	92.9	Very high	14 Å²	14	32.3 Å²	32.3	12%	0.116	16%	0.157	C	C	.	.	H	α-helix	trans	-63.1	-44.5	178.4	0	0	0	0	0	111.3	L58 V60 N147 C148 F149 N154 K155	L58-A151 HydrophobicContact CB-CB 3.98Å; L58-A151 HydrophobicContact CD2-CB 4.15Å; L58-A151 HydrophobicContact CG-CB 4.5Å; V60-A151 HydrophobicContact CG1-CB 3.9Å; N147-A151 WeakPolarHBondContact O-CB 3.28Å; N147-A151 PolarHBondContact O-N 3.41Å; C148-A151 PolarHBondContact O-N 3.19Å; F149-A151 PolarHBondContact O-N 3.33Å; A151-N154 PolarHBondContact O-N 3.02Å; A151-K155 WeakPolarHBondContact O-CB 3.5Å; A151-K155 PolarHBondContact O-N 3.37Å
152	I	96	Very high	92.6	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-62.2	-49.2	177.3	-69.2	158.6	0	0	0	110.9	L58 L131 L135 C148 F149 N154 K155 Y156 I157 L204 W218	L58-I152 HydrophobicContact CD1-CD1 4.02Å; L58-I152 HydrophobicContact CD1-CG1 4.03Å; L58-I152 HydrophobicContact CD2-CG1 3.68Å; L131-I152 HydrophobicContact CD2-CG2 4.26Å; L135-I152 HydrophobicContact CD1-CD1 3.98Å; L135-I152 HydrophobicContact CD2-CD1 4.14Å; L135-I152 HydrophobicContact CG-CD1 4.42Å; C148-I152 WeakPolarHBondContact O-CG1 3.29Å; C148-I152 PolarHBondContact O-N 3.46Å; F149-I152 PolarHBondContact O-N 3.12Å; I152-N154 VanDerWaalsContact C-N 3.25Å; I152-N154 PolarHBondContact O-N 3.41Å; I152-K155 PolarHBondContact O-N 3.47Å; I152-Y156 HydrophobicContact CG1-CD2 4.4Å; I152-Y156 PolarHBondContact O-N 3.34Å; I152-I157 HydrophobicContact CG2-CD1 4.43Å; I152-I157 HydrophobicContact CG2-CG1 4.18Å; I152-I157 PolarHBondContact O-N 3.02Å; I152-L204 HydrophobicContact CG2-CD1 3.98Å; I152-W218 HydrophobicContact CD1-CE3 4.29Å; I152-W218 HydrophobicContact CD1-CH2 3.9Å; I152-W218 HydrophobicContact CD1-CZ3 3.41Å; I152-W218 VanDerWaalsContact CD1-CZ3 3.41Å
153	M	92.9	Very high	92.3	Very high	20 Å²	20	32.1 Å²	32.1	10%	0.099	16%	0.164	C	C	.	.	H	α-helix	trans	-57.3	-34.9	179.7	-79	-63.2	-64.9	0	0	113.4	Y114 W128 L131 F149 I157	Y114-M153 HydrophobicContact CE1-CE 4Å; Y114-M153 HydrophobicContact CE2-CB 4.21Å; Y114-M153 HydrophobicContact CE2-CG 4.43Å; W128-M153 HydrophobicContact CZ2-CE 3.9Å; W128-M153 VanDerWaalsContact NE1-CE 3.32Å; L131-M153 HydrophobicContact CD1-SD 3.61Å; F149-M153 HydrophobicContact CD1-CG 4.3Å; F149-M153 HydrophobicContact CD2-CG 4.25Å; F149-M153 HydrophobicContact CE1-CG 3.88Å; F149-M153 HydrophobicContact CE2-CG 3.83Å; F149-M153 HydrophobicContact CE2-SD 4.21Å; F149-M153 HydrophobicContact CG-CG 4.47Å; F149-M153 HydrophobicContact CZ-CG 3.62Å; F149-M153 HydrophobicContact CZ-SD 4.09Å; F149-M153 WeakPolarHBondContact O-CB 3.48Å; F149-M153 WeakPolarHBondContact O-CG 3.49Å; F149-M153 PolarHBondContact O-N 2.9Å; M153-I157 HydrophobicContact SD-CB 4.32Å; M153-I157 HydrophobicContact SD-CG1 4.01Å; M153-I157 HydrophobicContact SD-CG2 4.42Å
154	N	90.3	Very high	91.9	Very high	35 Å²	35	38.5 Å²	38.5	19%	0.187	19%	0.188	C	C	.	.	H	α-helix	trans	-91.3	-30	-178.9	-69.1	-66	0	0	0	113.8	Y150 A151 I152 G299	Y150-N154 WeakPolarHBondContact CD1-ND2 3.26Å; Y150-N154 WeakPolarHBondContact CE1-ND2 3.31Å; Y150-N154 WeakPolarHBondContact CE2-ND2 3.44Å; Y150-N154 PolarHBondContact O-N 3.4Å; Y150-N154 VanDerWaalsContact O-N 3.16Å; Y150-N154 PolarHBondContact O-ND2 3.46Å; A151-N154 PolarHBondContact O-N 3.02Å; I152-N154 VanDerWaalsContact C-N 3.25Å; I152-N154 PolarHBondContact O-N 3.41Å; N154-G299 PolarHBondContact O-N 2.89Å
155	K	93.3	Very high	91.7	Very high	71 Å²	71	37.1 Å²	37.1	31%	0.309	18%	0.181	S	C	.	.	H	α-helix	trans	-94	-39.9	-174.3	-168.9	175.7	177.9	-166.5	0	112.7	A151 I152 P227	A151-K155 WeakPolarHBondContact O-CB 3.5Å; A151-K155 PolarHBondContact O-N 3.37Å; I152-K155 PolarHBondContact O-N 3.47Å; K155-P227 HydrophobicContact CG-CG 4.37Å; K155-P227 VanDerWaalsContact O-CB 3.26Å; K155-P227 WeakPolarHBondContact O-CB 3.47Å; K155-P227 WeakPolarHBondContact O-CG 3.47Å
156	Y	95.7	Very high	91.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.3	-14.1	-167.9	-60.5	-63.5	0	0	0	114.5	L58 I152 Y221 L222 A225 P227 F298	L58-Y156 HydrophobicContact CD2-CD2 4.27Å; L58-Y156 HydrophobicContact CD2-CE2 3.68Å; I152-Y156 HydrophobicContact CG1-CD2 4.4Å; I152-Y156 PolarHBondContact O-N 3.34Å; Y156-Y221 HydrophobicContact CD1-CD1 4.26Å; Y156-Y221 AromaticContact CD1-CE1 3.42Å; Y156-Y221 HydrophobicContact CD1-CE1 3.42Å; Y156-Y221 VanDerWaalsContact CD1-CE1 3.42Å; Y156-Y221 HydrophobicContact CE1-CE1 4.02Å; Y156-Y221 AromaticContact CG-CE1 3.79Å; Y156-Y221 HydrophobicContact CG-CE1 3.79Å; Y156-L222 HydrophobicContact CD2-CD2 3.91Å; Y156-L222 HydrophobicContact CE2-CD2 3.33Å; Y156-A225 WeakPolarHBondContact OH-CA 3.43Å; Y156-P227 HydrophobicContact CD1-CB 4.37Å; Y156-P227 HydrophobicContact CD1-CG 4.27Å; Y156-P227 HydrophobicContact CE1-CG 4.4Å; Y156-F298 WeakPolarHBondContact O-CE1 3.33Å
157	I	94.5	Very high	91.5	Very high	12 Å²	12	41 Å²	41	6%	0.062	20%	0.195	C	C	.	.	S	Bend	trans	-100.3	124	174.8	-52.1	-58.2	0	0	0	109.3	L131 I152 M153 C161 L204	L131-I157 HydrophobicContact CD1-CD1 4.03Å; L131-I157 HydrophobicContact CD1-CG1 3.95Å; L131-I157 HydrophobicContact CD2-CD1 3.98Å; I152-I157 HydrophobicContact CG2-CD1 4.43Å; I152-I157 HydrophobicContact CG2-CG1 4.18Å; I152-I157 PolarHBondContact O-N 3.02Å; M153-I157 HydrophobicContact SD-CB 4.32Å; M153-I157 HydrophobicContact SD-CG1 4.01Å; M153-I157 HydrophobicContact SD-CG2 4.42Å; I157-C161 HydrophobicContact CG2-CB 4.49Å; I157-L204 HydrophobicContact CD1-CD1 4.09Å; I157-L204 HydrophobicContact CD1-CD2 3.96Å; I157-L204 HydrophobicContact CD1-CG 3.75Å
158	P	92.3	Very high	91.5	Very high	4 Å²	4	41.2 Å²	41.2	3%	0.026	20%	0.196	C	C	.	.			trans	-64.9	146.7	174.8	-16.9	28.1	0	0	0	111.7	D160 C161 P167 L201 L297 F298	P158-D160 PolarHBondContact O-N 3.44Å; P158-C161 HydrophobicContact CB-CB 4.44Å; P158-C161 WeakPolarHBondContact O-CB 3.48Å; P158-C161 PolarHBondContact O-N 3.3Å; P158-P167 HydrophobicContact CB-CB 3.9Å; P158-P167 HydrophobicContact CB-CG 3.38Å; P158-P167 HydrophobicContact CG-CB 4.02Å; P158-P167 HydrophobicContact CG-CG 4.07Å; P158-L201 HydrophobicContact CG-CD1 4Å; P158-L201 HydrophobicContact CG-CD2 3.82Å; P158-L201 HydrophobicContact CG-CG 3.92Å; P158-L297 WeakPolarHBondContact CA-O 3.32Å; P158-F298 HydrophobicContact CB-CE1 4.18Å; P158-F298 HydrophobicContact CG-CD1 4.34Å; P158-F298 HydrophobicContact CG-CE1 3.54Å; P158-F298 HydrophobicContact CG-CZ 3.8Å
159	R	84.1	Confident	91.5	Very high	109 Å²	109	43.2 Å²	43.2	41%	0.411	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-39.1	-176.5	-68	168.5	155.5	-109.5	-17.2	114.2	C161 L297 G299 T301	R159-C161 VanDerWaalsContact C-N 3.32Å; R159-L297 PolarHBondContact N-O 3.32Å; R159-G299 PolarHBondContact NE-O 3.07Å; R159-G299 PolarHBondContact NH2-O 3.01Å; R159-T301 PolarHBondContact NH1-OG1 3.15Å
160	D	82.4	Confident	91.6	Very high	66 Å²	66	43.2 Å²	43.2	35%	0.353	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	41.8	-179.6	-172	27.5	0	0	0	110.3	P158 S162 G165 R166 P167	P158-D160 PolarHBondContact O-N 3.44Å; D160-S162 PolarHBondContact O-N 3.13Å; D160-S162 PolarHBondContact OD1-OG 3.34Å; D160-G165 WeakPolarHBondContact O-CA 3.21Å; D160-G165 VanDerWaalsContact OD2-CA 3.28Å; D160-G165 WeakPolarHBondContact OD2-CA 3.3Å; D160-R166 PolarHBondContact OD2-N 2.79Å; D160-P167 WeakPolarHBondContact O-CD 3.32Å; D160-P167 WeakPolarHBondContact O-CG 3.35Å
161	C	88.3	Confident	91.8	Very high	27 Å²	27	39.8 Å²	39.8	18%	0.182	19%	0.192	C	C	.	.			trans	-75.4	65.3	173.2	-169.1	0	0	0	0	109.7	I157 P158 R159	I157-C161 HydrophobicContact CG2-CB 4.49Å; P158-C161 HydrophobicContact CB-CB 4.44Å; P158-C161 WeakPolarHBondContact O-CB 3.48Å; P158-C161 PolarHBondContact O-N 3.3Å; R159-C161 VanDerWaalsContact C-N 3.32Å
162	S	85.9	Confident	91.9	Very high	53 Å²	53	40.8 Å²	40.8	37%	0.371	19%	0.193	S	C	.	.	S	Bend	trans	-130.4	169.9	-179.3	75.6	0	0	0	0	110.2	D160 K164 G165 F168	D160-S162 PolarHBondContact O-N 3.13Å; D160-S162 PolarHBondContact OD1-OG 3.34Å; S162-K164 PolarHBondContact O-N 3.41Å; S162-G165 PolarHBondContact O-N 3.37Å; S162-F168 WeakPolarHBondContact O-CD2 3.49Å; S162-F168 VanDerWaalsContact O-CE2 3.23Å; S162-F168 WeakPolarHBondContact O-CE2 3.41Å
163	L	86.9	Confident	92	Very high	119 Å²	119	40.8 Å²	40.8	62%	0.623	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.1	130.3	177.2	-67.8	173	0	0	0	110.2	G165 L198	L163-G165 PolarHBondContact O-N 3.13Å; L163-L198 HydrophobicContact CD2-CD2 4.08Å
164	K	85.3	Confident	92.3	Very high	161 Å²	161	39.9 Å²	39.9	70%	0.7	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	56	23.9	-173.8	-51.2	176.6	-178.9	176.6	0	114.5	S162 H169 D194	S162-K164 PolarHBondContact O-N 3.41Å; K164-H169 PolarHBondContact O-CE1 2.99Å; K164-D194 PolarHBondContact N-OD2 3.03Å
165	G	89.3	Confident	92.7	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.01	18%	0.18	C	C	.	.			trans	-66.7	159.2	175.9	0	0	0	0	0	112.9	D160 S162 L163 P167 F168 H169	D160-G165 WeakPolarHBondContact O-CA 3.21Å; D160-G165 VanDerWaalsContact OD2-CA 3.28Å; D160-G165 WeakPolarHBondContact OD2-CA 3.3Å; S162-G165 PolarHBondContact O-N 3.37Å; L163-G165 PolarHBondContact O-N 3.13Å; G165-P167 VanDerWaalsContact C-N 3.33Å; G165-F168 PolarHBondContact O-N 3.44Å; G165-H169 PolarHBondContact O-ND1 3.24Å
166	R	92	Very high	92.9	Very high	96 Å²	96	35.9 Å²	35.9	36%	0.362	17%	0.169	S	C	.	.	H	α-helix	trans	-52.3	-38.8	174.8	-69.6	-175.2	178.2	-176.1	0.7	114.9	D160 F168 H169 L170 L297 L312	D160-R166 PolarHBondContact OD2-N 2.79Å; R166-F168 PolarHBondContact O-N 3.27Å; R166-H169 PolarHBondContact O-N 2.89Å; R166-H169 VanDerWaalsContact O-N 3.15Å; R166-L170 PolarHBondContact O-N 3.01Å; R166-L297 HydrophobicContact CB-CD2 3.79Å; R166-L312 HydrophobicContact CB-CD1 4.27Å
167	P	95.2	Very high	93	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-56	-35.9	178.3	-27.9	37.3	0	0	0	114.1	P158 D160 G165 L170 F171 L201 Y231	P158-P167 HydrophobicContact CB-CB 3.9Å; P158-P167 HydrophobicContact CB-CG 3.38Å; P158-P167 HydrophobicContact CG-CB 4.02Å; P158-P167 HydrophobicContact CG-CG 4.07Å; D160-P167 WeakPolarHBondContact O-CD 3.32Å; D160-P167 WeakPolarHBondContact O-CG 3.35Å; G165-P167 VanDerWaalsContact C-N 3.33Å; P167-L170 PolarHBondContact O-N 3.37Å; P167-F171 PolarHBondContact O-N 2.99Å; P167-F171 VanDerWaalsContact O-N 3.1Å; P167-L201 HydrophobicContact CB-CD2 3.81Å; P167-Y231 WeakPolarHBondContact CA-OH 3.27Å; P167-Y231 WeakPolarHBondContact CB-OH 3.41Å; P167-Y231 VanDerWaalsContact O-CE1 3.31Å; P167-Y231 WeakPolarHBondContact O-CE1 3.45Å; P167-Y231 PolarHBondContact O-OH 3.42Å
168	F	96.4	Very high	93.2	Very high	3 Å²	3	35.6 Å²	35.6	1%	0.013	17%	0.168	C	C	.	.	H	α-helix	trans	-79	-28.6	-178.9	-60.9	-70.8	0	0	0	112.5	S162 G165 R166 F171 R172 P193 D194 L198 L201	S162-F168 WeakPolarHBondContact O-CD2 3.49Å; S162-F168 VanDerWaalsContact O-CE2 3.23Å; S162-F168 WeakPolarHBondContact O-CE2 3.41Å; G165-F168 PolarHBondContact O-N 3.44Å; R166-F168 PolarHBondContact O-N 3.27Å; F168-F171 PolarHBondContact O-N 3.44Å; F168-R172 PolarHBondContact O-N 2.85Å; F168-P193 HydrophobicContact CB-CB 4.31Å; F168-P193 HydrophobicContact CD1-CB 4.37Å; F168-D194 HydrophobicContact CB-CB 4.02Å; F168-D194 HydrophobicContact CD1-CB 4.12Å; F168-D194 HydrophobicContact CD2-CB 3.67Å; F168-D194 HydrophobicContact CE2-CB 4.2Å; F168-D194 HydrophobicContact CG-CB 3.64Å; F168-L198 HydrophobicContact CE2-CD1 3.81Å; F168-L198 HydrophobicContact CZ-CB 4.37Å; F168-L198 HydrophobicContact CZ-CD1 3.65Å; F168-L201 HydrophobicContact CE1-CB 4.25Å; F168-L201 HydrophobicContact CE1-CD2 3.94Å; F168-L201 HydrophobicContact CZ-CB 4.42Å; F168-L201 HydrophobicContact CZ-CD2 4.07Å
169	H	96	Very high	93.4	Very high	43 Å²	43	36.3 Å²	36.3	20%	0.199	17%	0.171	C	C	.	.	H	α-helix	trans	-66.6	-42.1	169.3	-64.5	100.1	0	0	0	111.1	K164 G165 R166 F171 R172 L173 L312	K164-H169 PolarHBondContact O-CE1 2.99Å; G165-H169 PolarHBondContact O-ND1 3.24Å; R166-H169 PolarHBondContact O-N 2.89Å; R166-H169 VanDerWaalsContact O-N 3.15Å; H169-F171 VanDerWaalsContact C-N 3.29Å; H169-F171 PolarHBondContact O-N 2.86Å; H169-R172 WeakPolarHBondContact O-CB 3.48Å; H169-R172 PolarHBondContact O-N 3.45Å; H169-L173 WeakPolarHBondContact O-CG 3.28Å; H169-L173 PolarHBondContact O-N 3.27Å; H169-L312 HydrophobicContact CB-CB 4Å
170	L	97.4	Very high	94	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-59	-42.4	172.9	-176.2	61.5	0	0	0	111.5	R166 P167 L173 L174 F228 Y231 F290 N294 L297 L312 L318	R166-L170 PolarHBondContact O-N 3.01Å; P167-L170 PolarHBondContact O-N 3.37Å; L170-L173 PolarHBondContact O-N 3.36Å; L170-L174 PolarHBondContact O-N 3.39Å; L170-F228 HydrophobicContact CD2-CD1 4.3Å; L170-F228 HydrophobicContact CD2-CE1 3.94Å; L170-Y231 HydrophobicContact CD2-CE2 4.04Å; L170-F290 HydrophobicContact CD1-CD2 3.78Å; L170-F290 HydrophobicContact CD1-CE2 3.41Å; L170-F290 VanDerWaalsContact CD1-CE2 3.41Å; L170-F290 HydrophobicContact CD1-CZ 4.17Å; L170-F290 HydrophobicContact CD2-CE2 4.02Å; L170-F290 HydrophobicContact CD2-CZ 3.93Å; L170-F290 HydrophobicContact CG-CD2 4.34Å; L170-F290 HydrophobicContact CG-CE2 3.51Å; L170-F290 HydrophobicContact CG-CZ 3.81Å; L170-N294 HydrophobicContact CD2-CB 3.91Å; L170-L297 HydrophobicContact CB-CD1 4.33Å; L170-L297 HydrophobicContact CD2-CD1 3.5Å; L170-L297 VanDerWaalsContact CD2-CD1 3.5Å; L170-L312 HydrophobicContact CB-CD1 4.15Å; L170-L318 HydrophobicContact CD1-CD1 4.23Å
171	F	98.4	Very high	94.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-64.8	-41.9	176.6	-172.6	-140.8	0	0	0	112.3	P167 F168 H169 L173 L174 I175 P193 Y196 A197 Y231 M234 L235 L238	P167-F171 PolarHBondContact O-N 2.99Å; P167-F171 VanDerWaalsContact O-N 3.1Å; F168-F171 PolarHBondContact O-N 3.44Å; H169-F171 VanDerWaalsContact C-N 3.29Å; H169-F171 PolarHBondContact O-N 2.86Å; F171-L173 VanDerWaalsContact C-N 3.31Å; F171-L173 PolarHBondContact O-N 3.36Å; F171-L174 HydrophobicContact CD2-CD2 4.46Å; F171-L174 WeakPolarHBondContact O-CB 3.34Å; F171-L174 PolarHBondContact O-N 3.17Å; F171-L174 VanDerWaalsContact O-N 3.1Å; F171-I175 HydrophobicContact CD1-CD1 4.06Å; F171-I175 HydrophobicContact CD2-CD1 4.35Å; F171-I175 HydrophobicContact CD2-CG1 4.22Å; F171-I175 HydrophobicContact CE1-CD1 3.83Å; F171-I175 HydrophobicContact CE1-CG1 4.49Å; F171-I175 HydrophobicContact CE2-CD1 4.15Å; F171-I175 HydrophobicContact CE2-CG1 3.93Å; F171-I175 HydrophobicContact CG-CD1 4.28Å; F171-I175 HydrophobicContact CZ-CD1 3.86Å; F171-I175 HydrophobicContact CZ-CG1 4.05Å; F171-I175 WeakPolarHBondContact O-CG1 3.5Å; F171-I175 PolarHBondContact O-N 2.86Å; F171-P193 HydrophobicContact CD1-CB 3.65Å; F171-P193 HydrophobicContact CD1-CG 4.32Å; F171-P193 HydrophobicContact CE1-CB 4.31Å; F171-Y196 HydrophobicContact CE1-CE2 4.35Å; F171-A197 HydrophobicContact CE1-CB 4.33Å; F171-Y231 HydrophobicContact CB-CD1 3.78Å; F171-Y231 HydrophobicContact CB-CE1 3.94Å; F171-Y231 HydrophobicContact CD2-CD1 4.02Å; F171-Y231 WeakPolarHBondContact CE2-O 3.34Å; F171-Y231 HydrophobicContact CG-CD1 4.13Å; F171-M234 HydrophobicContact CD1-CE 3.5Å; F171-M234 VanDerWaalsContact CD1-CE 3.5Å; F171-M234 HydrophobicContact CE1-CB 4.03Å; F171-M234 HydrophobicContact CE1-CE 3.6Å; F171-M234 HydrophobicContact CE2-CB 3.78Å; F171-M234 HydrophobicContact CG-CE 4.07Å; F171-M234 HydrophobicContact CZ-CB 3.49Å; F171-M234 VanDerWaalsContact CZ-CB 3.49Å; F171-M234 HydrophobicContact CZ-CE 4.21Å; F171-L235 HydrophobicContact CE2-CB 4.14Å; F171-L238 HydrophobicContact CZ-CD2 4.33Å
172	R	97.9	Very high	94.9	Very high	35 Å²	35	32.3 Å²	32.3	13%	0.132	15%	0.153	C	C	.	.	H	α-helix	trans	-54.8	-46.6	172.8	-172	-170.7	60.3	71.2	2.6	111.5	F168 H169 L174 I175 Q176 P193 A315	F168-R172 PolarHBondContact O-N 2.85Å; H169-R172 WeakPolarHBondContact O-CB 3.48Å; H169-R172 PolarHBondContact O-N 3.45Å; R172-L174 VanDerWaalsContact C-N 3.29Å; R172-L174 PolarHBondContact O-N 2.81Å; R172-I175 PolarHBondContact O-N 3.41Å; R172-Q176 WeakPolarHBondContact O-CB 3.49Å; R172-Q176 PolarHBondContact O-N 2.98Å; R172-P193 HydrophobicContact CB-CG 3.93Å; R172-A315 PolarHBondContact NH2-O 2.52Å
173	L	98.1	Very high	95.4	Very high	2 Å²	2	30 Å²	30	1%	0.01	14%	0.137	C	C	.	.	H	α-helix	trans	-62.5	-36.6	178.1	-65.2	176.6	0	0	0	112.3	H169 L170 F171 Q176 Y177 L312 A315 L318	H169-L173 WeakPolarHBondContact O-CG 3.28Å; H169-L173 PolarHBondContact O-N 3.27Å; L170-L173 PolarHBondContact O-N 3.36Å; F171-L173 VanDerWaalsContact C-N 3.31Å; F171-L173 PolarHBondContact O-N 3.36Å; L173-Q176 PolarHBondContact O-N 2.76Å; L173-Y177 WeakPolarHBondContact O-CB 3.27Å; L173-Y177 PolarHBondContact O-N 3.18Å; L173-L312 HydrophobicContact CD1-CD2 4.04Å; L173-A315 HydrophobicContact CD1-CB 3.87Å; L173-A315 HydrophobicContact CD2-CB 4.23Å; L173-L318 HydrophobicContact CB-CD1 3.98Å; L173-L318 HydrophobicContact CD1-CD1 4.35Å
174	L	98.6	Very high	95.7	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-66.5	-43.5	175.1	-174.6	66.6	0	0	0	111.8	L170 F171 R172 Q176 Y177 H178 F232 L235 T286 F290	L170-L174 PolarHBondContact O-N 3.39Å; F171-L174 HydrophobicContact CD2-CD2 4.46Å; F171-L174 WeakPolarHBondContact O-CB 3.34Å; F171-L174 PolarHBondContact O-N 3.17Å; F171-L174 VanDerWaalsContact O-N 3.1Å; R172-L174 VanDerWaalsContact C-N 3.29Å; R172-L174 PolarHBondContact O-N 2.81Å; L174-Q176 VanDerWaalsContact C-N 3.33Å; L174-Y177 WeakPolarHBondContact O-CB 3.25Å; L174-Y177 PolarHBondContact O-N 2.87Å; L174-H178 PolarHBondContact O-CD2 2.79Å; L174-H178 PolarHBondContact O-N 3.25Å; L174-F232 HydrophobicContact CD1-CD1 4.47Å; L174-F232 HydrophobicContact CD1-CE1 3.78Å; L174-F232 HydrophobicContact CD1-CZ 4.46Å; L174-F232 HydrophobicContact CD2-CD1 3.96Å; L174-F232 HydrophobicContact CD2-CE1 3.92Å; L174-F232 HydrophobicContact CG-CE1 4.48Å; L174-L235 HydrophobicContact CD2-CD2 4.34Å; L174-L235 HydrophobicContact CG-CD2 4.25Å; L174-T286 HydrophobicContact CD1-CG2 3.93Å; L174-F290 HydrophobicContact CB-CE2 3.93Å; L174-F290 HydrophobicContact CB-CZ 4.32Å; L174-F290 HydrophobicContact CD1-CD2 4.34Å; L174-F290 HydrophobicContact CD1-CE2 4.07Å; L174-F290 HydrophobicContact CD1-CZ 4.36Å; L174-F290 HydrophobicContact CD2-CE2 4.36Å; L174-F290 HydrophobicContact CD2-CZ 3.99Å; L174-F290 HydrophobicContact CG-CE2 4.34Å; L174-F290 HydrophobicContact CG-CZ 4.46Å
175	I	98.3	Very high	96.1	Very high	2 Å²	2	20.7 Å²	20.7	1%	0.01	10%	0.098	C	C	.	.	H	α-helix	trans	-60.9	-45.9	174.9	-58.7	160.6	0	0	0	109.4	F171 R172 Y177 H178 E179 C183 P193 L235 L238	F171-I175 HydrophobicContact CD1-CD1 4.06Å; F171-I175 HydrophobicContact CD2-CD1 4.35Å; F171-I175 HydrophobicContact CD2-CG1 4.22Å; F171-I175 HydrophobicContact CE1-CD1 3.83Å; F171-I175 HydrophobicContact CE1-CG1 4.49Å; F171-I175 HydrophobicContact CE2-CD1 4.15Å; F171-I175 HydrophobicContact CE2-CG1 3.93Å; F171-I175 HydrophobicContact CG-CD1 4.28Å; F171-I175 HydrophobicContact CZ-CD1 3.86Å; F171-I175 HydrophobicContact CZ-CG1 4.05Å; F171-I175 WeakPolarHBondContact O-CG1 3.5Å; F171-I175 PolarHBondContact O-N 2.86Å; R172-I175 PolarHBondContact O-N 3.41Å; I175-Y177 VanDerWaalsContact C-N 3.26Å; I175-Y177 PolarHBondContact O-N 2.82Å; I175-H178 PolarHBondContact O-N 3.12Å; I175-E179 HydrophobicContact CG2-CB 4.4Å; I175-E179 CarbonylContact O-C 3.51Å; I175-E179 VanDerWaalsContact O-CA 3.3Å; I175-E179 WeakPolarHBondContact O-CA 3.12Å; I175-E179 PolarHBondContact O-N 3.44Å; I175-C183 HydrophobicContact CG2-CB 3.92Å; I175-P193 HydrophobicContact CD1-CG 4.28Å; I175-L235 HydrophobicContact CG1-CD1 4.09Å; I175-L238 HydrophobicContact CD1-CD2 3.4Å; I175-L238 VanDerWaalsContact CD1-CD2 3.4Å; I175-L238 HydrophobicContact CG1-CD2 3.78Å; I175-L238 HydrophobicContact CG2-CD2 4.15Å
176	Q	97.8	Very high	96.4	Very high	20 Å²	20	20.9 Å²	20.9	9%	0.093	10%	0.098	C	C	.	.	H	α-helix	trans	-60.7	-35.3	177.4	-169.7	178.5	0.7	0	0	113.2	R172 L173 L174 C183 L316 L420	R172-Q176 WeakPolarHBondContact O-CB 3.49Å; R172-Q176 PolarHBondContact O-N 2.98Å; L173-Q176 PolarHBondContact O-N 2.76Å; L174-Q176 VanDerWaalsContact C-N 3.33Å; Q176-C183 HydrophobicContact CB-CB 4.09Å; Q176-L316 PolarHBondContact NE2-O 2.94Å; Q176-L316 PolarHBondContact OE1-O 2.88Å; Q176-L420 HydrophobicContact CG-CD2 3.92Å
177	Y	98.5	Very high	96.5	Very high	4 Å²	4	19.4 Å²	19.4	2%	0.016	10%	0.098	C	C	.	.	H	α-helix	trans	-68.3	-38.4	-179.2	-164.2	-102.5	0	0	0	112.5	L173 L174 I175 P287 L318 H397 Y426 V427	L173-Y177 WeakPolarHBondContact O-CB 3.27Å; L173-Y177 PolarHBondContact O-N 3.18Å; L174-Y177 WeakPolarHBondContact O-CB 3.25Å; L174-Y177 PolarHBondContact O-N 2.87Å; I175-Y177 VanDerWaalsContact C-N 3.26Å; I175-Y177 PolarHBondContact O-N 2.82Å; Y177-P287 HydrophobicContact CE1-CG 4.29Å; Y177-P287 HydrophobicContact CE2-CG 4.47Å; Y177-P287 WeakPolarHBondContact OH-CD 3.4Å; Y177-P287 VanDerWaalsContact OH-CG 3.27Å; Y177-P287 WeakPolarHBondContact OH-CG 3.49Å; Y177-L318 HydrophobicContact CD2-CB 4.08Å; Y177-L318 HydrophobicContact CD2-CD2 4.35Å; Y177-H397 AromaticContact CE1-ND1 3.71Å; Y177-H397 AromaticContact CZ-ND1 3.56Å; Y177-H397 PolarHBondContact OH-ND1 3.21Å; Y177-Y426 AromaticContact CD1-CD1 3.71Å; Y177-Y426 HydrophobicContact CD1-CD1 3.71Å; Y177-Y426 HydrophobicContact CD1-CE1 4.39Å; Y177-Y426 AromaticContact CE1-CD1 3.46Å; Y177-Y426 HydrophobicContact CE1-CD1 3.46Å; Y177-Y426 VanDerWaalsContact CE1-CD1 3.46Å; Y177-Y426 HydrophobicContact CE1-CE1 4.29Å; Y177-Y426 HydrophobicContact CE1-CG 4.16Å; Y177-Y426 VanDerWaalsContact CE2-C 3.45Å; Y177-Y426 WeakPolarHBondContact O-CD1 3.28Å; Y177-Y426 PolarHBondContact O-N 3.11Å; Y177-V427 WeakPolarHBondContact CD2-O 3.47Å
178	H	98.2	Very high	96.4	Very high	2 Å²	2	24.7 Å²	24.7	1%	0.009	13%	0.13	C	C	.	.	H	α-helix	trans	-104	-36	-174.1	-73.2	-74.7	0	0	0	114.1	L174 I175 L235 Y282 T286 Y426	L174-H178 PolarHBondContact O-CD2 2.79Å; L174-H178 PolarHBondContact O-N 3.25Å; I175-H178 PolarHBondContact O-N 3.12Å; H178-L235 HydrophobicContact CB-CD2 4.17Å; H178-Y282 HydrophobicContact CB-CD1 3.95Å; H178-Y282 HydrophobicContact CB-CE1 3.86Å; H178-Y282 AromaticContact CE1-CD1 3.9Å; H178-Y282 PolarHBondContact CE1-O 3.48Å; H178-Y282 AromaticContact CG-CD1 3.6Å; H178-Y282 AromaticContact ND1-CD1 3.42Å; H178-Y282 WeakPolarHBondContact ND1-CD1 3.45Å; H178-Y282 AromaticContact ND1-CE1 3.92Å; H178-T286 PolarHBondContact CE1-OG1 3.35Å; H178-T286 PolarHBondContact NE2-OG1 3.47Å; H178-Y426 AromaticContact CE1-CE1 3.9Å; H178-Y426 AromaticContact ND1-CE1 3.48Å; H178-Y426 WeakPolarHBondContact ND1-CE1 3.37Å
179	E	97.1	Very high	96.2	Very high	20 Å²	20	26.7 Å²	26.7	9%	0.093	14%	0.139	C	C	.	.			trans	-130.7	66.2	-176	-65.4	-65.1	156.8	0	0	110.4	I175 E181 L182 C183 V239 K242 Y282	I175-E179 HydrophobicContact CG2-CB 4.4Å; I175-E179 CarbonylContact O-C 3.51Å; I175-E179 VanDerWaalsContact O-CA 3.3Å; I175-E179 WeakPolarHBondContact O-CA 3.12Å; I175-E179 PolarHBondContact O-N 3.44Å; E179-E181 VanDerWaalsContact C-N 3.28Å; E179-E181 PolarHBondContact O-N 3.48Å; E179-L182 HydrophobicContact CB-CB 3.92Å; E179-L182 HydrophobicContact CB-CD2 4.41Å; E179-L182 PolarHBondContact O-N 3.41Å; E179-L182 VanDerWaalsContact O-N 3.15Å; E179-C183 PolarHBondContact O-N 3.44Å; E179-V239 HydrophobicContact CG-CG2 3.65Å; E179-K242 IonicContact OE2-NZ 3.39Å; E179-K242 PolarHBondContact OE2-NZ 3.21Å; E179-Y282 PolarHBondContact OE1-OH 2.59Å
180	P	96.2	Very high	96.1	Very high	9 Å²	9	30.7 Å²	30.7	6%	0.058	16%	0.156	C	C	.	.	H	α-helix	trans	-62.2	-33.9	-173.2	25.2	-35.8	0	0	0	113.1	C183 S184 N423 E425	P180-C183 PolarHBondContact O-N 2.88Å; P180-S184 VanDerWaalsContact O-CB 3.24Å; P180-S184 WeakPolarHBondContact O-CB 3.4Å; P180-S184 PolarHBondContact O-N 2.75Å; P180-N423 HydrophobicContact CB-CB 4.39Å; P180-N423 VanDerWaalsContact CG-C 3.45Å; P180-N423 HydrophobicContact CG-CB 4.16Å; P180-N423 VanDerWaalsContact CG-O 3.24Å; P180-N423 WeakPolarHBondContact CG-O 3.39Å; P180-E425 HydrophobicContact CG-CG 3.87Å
181	E	94.3	Very high	96	Very high	107 Å²	107	30.7 Å²	30.7	50%	0.5	16%	0.156	S	C	.	.	H	α-helix	trans	-64.7	-44.6	175.9	-177	177	-151.2	0	0	111.7	E179 S184 F185 N423	E179-E181 VanDerWaalsContact C-N 3.28Å; E179-E181 PolarHBondContact O-N 3.48Å; E181-S184 PolarHBondContact O-N 2.61Å; E181-F185 PolarHBondContact O-N 3Å; E181-N423 HydrophobicContact CB-CB 4.41Å
182	L	94.9	Very high	95.8	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-65.7	-43.9	177	-177.6	57.4	0	0	0	111.1	E179 S184 F185 L186 L238 K242	E179-L182 HydrophobicContact CB-CB 3.92Å; E179-L182 HydrophobicContact CB-CD2 4.41Å; E179-L182 PolarHBondContact O-N 3.41Å; E179-L182 VanDerWaalsContact O-N 3.15Å; L182-S184 VanDerWaalsContact C-N 3.35Å; L182-S184 PolarHBondContact O-N 3.4Å; L182-F185 PolarHBondContact O-N 3.13Å; L182-L186 HydrophobicContact CD1-CD1 4.43Å; L182-L186 HydrophobicContact CD1-CG 4.43Å; L182-L186 HydrophobicContact CG-CD1 4.24Å; L182-L186 WeakPolarHBondContact O-CG 3.36Å; L182-L186 PolarHBondContact O-N 3.22Å; L182-L238 HydrophobicContact CD2-CD2 4.27Å; L182-L238 HydrophobicContact CD2-CG 3.93Å; L182-K242 HydrophobicContact CD2-CB 4.39Å
183	C	96	Very high	95.8	Very high	4 Å²	4	31.9 Å²	31.9	3%	0.027	17%	0.167	C	C	.	.	H	α-helix	trans	-58.5	-48	175.5	-165.6	0	0	0	0	111.1	I175 Q176 E179 P180 F185 L186 D187	I175-C183 HydrophobicContact CG2-CB 3.92Å; Q176-C183 HydrophobicContact CB-CB 4.09Å; E179-C183 PolarHBondContact O-N 3.44Å; P180-C183 PolarHBondContact O-N 2.88Å; C183-F185 VanDerWaalsContact C-N 3.33Å; C183-F185 PolarHBondContact O-N 2.99Å; C183-L186 PolarHBondContact O-N 3.33Å; C183-D187 WeakPolarHBondContact O-CB 3.48Å; C183-D187 VanDerWaalsContact O-CG 3.3Å; C183-D187 PolarHBondContact O-N 3.08Å; C183-D187 PolarHBondContact SG-OD2 3.37Å; C183-D187 VanDerWaalsContact SG-OD2 3.39Å
184	S	94.5	Very high	95.6	Very high	52 Å²	52	32.3 Å²	32.3	36%	0.364	17%	0.169	S	C	.	.	H	α-helix	trans	-60.1	-41.3	179.2	-176.1	0	0	0	0	112.2	P180 E181 L182 T188	P180-S184 VanDerWaalsContact O-CB 3.24Å; P180-S184 WeakPolarHBondContact O-CB 3.4Å; P180-S184 PolarHBondContact O-N 2.75Å; E181-S184 PolarHBondContact O-N 2.61Å; L182-S184 VanDerWaalsContact C-N 3.35Å; L182-S184 PolarHBondContact O-N 3.4Å; S184-T188 VanDerWaalsContact O-CB 3.27Å; S184-T188 WeakPolarHBondContact O-CB 3.5Å; S184-T188 PolarHBondContact O-N 2.8Å; S184-T188 PolarHBondContact O-OG1 2.64Å
185	F	93.6	Very high	95.5	Very high	33 Å²	33	34.3 Å²	34.3	15%	0.145	18%	0.183	C	C	.	.	H	α-helix	trans	-61	-49.7	174	174.2	-88.8	0	0	0	112.1	E181 L182 C183 T188 K189 I245 E249 I256	E181-F185 PolarHBondContact O-N 3Å; L182-F185 PolarHBondContact O-N 3.13Å; C183-F185 VanDerWaalsContact C-N 3.33Å; C183-F185 PolarHBondContact O-N 2.99Å; F185-T188 PolarHBondContact O-N 2.86Å; F185-K189 HydrophobicContact CE1-CD 3.93Å; F185-K189 HydrophobicContact CE1-CG 4.5Å; F185-K189 HydrophobicContact CE2-CD 4.24Å; F185-K189 HydrophobicContact CZ-CD 3.64Å; F185-K189 VanDerWaalsContact CZ-CE 3.46Å; F185-K189 HydrophobicContact CZ-CG 4.38Å; F185-K189 PolarHBondContact O-N 3.35Å; F185-I245 HydrophobicContact CD1-CG2 3.79Å; F185-I245 HydrophobicContact CE1-CG2 3.16Å; F185-I245 HydrophobicContact CZ-CG2 3.75Å; F185-E249 HydrophobicContact CE2-CG 4.17Å; F185-I256 HydrophobicContact CE1-CD1 4.43Å; F185-I256 HydrophobicContact CZ-CD1 4.25Å
186	L	94.8	Very high	95.3	Very high	4 Å²	4	34.3 Å²	34.3	2%	0.021	18%	0.183	C	C	.	.	H	α-helix	trans	-62.7	-45	-179.9	-68.7	173.1	0	0	0	111.4	L182 C183 T188 K189 K190 I191 L238 L260	L182-L186 HydrophobicContact CD1-CD1 4.43Å; L182-L186 HydrophobicContact CD1-CG 4.43Å; L182-L186 HydrophobicContact CG-CD1 4.24Å; L182-L186 WeakPolarHBondContact O-CG 3.36Å; L182-L186 PolarHBondContact O-N 3.22Å; C183-L186 PolarHBondContact O-N 3.33Å; L186-T188 PolarHBondContact O-N 3.16Å; L186-K189 CarbonylContact O-C 3.57Å; L186-K189 PolarHBondContact O-N 3.21Å; L186-K190 PolarHBondContact O-N 2.97Å; L186-I191 HydrophobicContact CD2-CB 4.04Å; L186-I191 HydrophobicContact CD2-CD1 4.36Å; L186-I191 HydrophobicContact CD2-CG2 3.96Å; L186-I191 PolarHBondContact O-N 3.03Å; L186-L238 HydrophobicContact CD1-CD1 4.48Å; L186-L238 HydrophobicContact CD1-CD2 4.23Å; L186-L260 HydrophobicContact CD2-CD1 4.12Å
187	D	93.4	Very high	95.3	Very high	65 Å²	65	33.4 Å²	33.4	35%	0.348	18%	0.179	S	C	.	.	H	α-helix	trans	-62.4	-42.3	177.5	-73.6	-25.7	0	0	0	111.3	C183 K189 K190	C183-D187 WeakPolarHBondContact O-CB 3.48Å; C183-D187 VanDerWaalsContact O-CG 3.3Å; C183-D187 PolarHBondContact O-N 3.08Å; C183-D187 PolarHBondContact SG-OD2 3.37Å; C183-D187 VanDerWaalsContact SG-OD2 3.39Å; D187-K189 VanDerWaalsContact C-N 3.33Å; D187-K189 PolarHBondContact O-N 2.65Å; D187-K190 WeakPolarHBondContact O-CA 2.98Å; D187-K190 PolarHBondContact O-N 3.03Å
188	T	93	Very high	95.1	Very high	111 Å²	111	34.7 Å²	34.7	68%	0.681	19%	0.186	S	C	*	.	H	α-helix	trans	-61.6	-40.6	176.5	-62	0	0	0	0	111.7	S184 F185 L186 K190	S184-T188 VanDerWaalsContact O-CB 3.27Å; S184-T188 WeakPolarHBondContact O-CB 3.5Å; S184-T188 PolarHBondContact O-N 2.8Å; S184-T188 PolarHBondContact O-OG1 2.64Å; F185-T188 PolarHBondContact O-N 2.86Å; L186-T188 PolarHBondContact O-N 3.16Å; T188-K190 PolarHBondContact O-N 2.95Å
189	K	92.6	Very high	95	Very high	46 Å²	46	36 Å²	36	20%	0.2	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-0.4	174.2	-71.5	-158.3	172.3	-166.1	0	113.9	F185 L186 D187 I191 E249 N251 I256	F185-K189 HydrophobicContact CE1-CD 3.93Å; F185-K189 HydrophobicContact CE1-CG 4.5Å; F185-K189 HydrophobicContact CE2-CD 4.24Å; F185-K189 HydrophobicContact CZ-CD 3.64Å; F185-K189 VanDerWaalsContact CZ-CE 3.46Å; F185-K189 HydrophobicContact CZ-CG 4.38Å; F185-K189 PolarHBondContact O-N 3.35Å; L186-K189 CarbonylContact O-C 3.57Å; L186-K189 PolarHBondContact O-N 3.21Å; D187-K189 VanDerWaalsContact C-N 3.33Å; D187-K189 PolarHBondContact O-N 2.65Å; K189-I191 HydrophobicContact CB-CD1 3.91Å; K189-I191 HydrophobicContact CB-CG1 4.01Å; K189-I191 HydrophobicContact CD-CD1 4.38Å; K189-I191 PolarHBondContact O-N 3.18Å; K189-E249 PolarHBondContact NZ-O 2.92Å; K189-N251 PolarHBondContact NZ-O 3.29Å; K189-I256 HydrophobicContact CD-CD1 3.75Å
190	K	94.1	Very high	95	Very high	126 Å²	126	35 Å²	35	55%	0.548	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	36.1	-176.2	-53.7	-179.2	178	-178.5	0	112.6	L186 D187 T188 K253	L186-K190 PolarHBondContact O-N 2.97Å; D187-K190 WeakPolarHBondContact O-CA 2.98Å; D187-K190 PolarHBondContact O-N 3.03Å; T188-K190 PolarHBondContact O-N 2.95Å; K190-K253 WeakPolarHBondContact O-CE 3.31Å; K190-K253 PolarHBondContact O-NZ 3.07Å
191	I	95.5	Very high	95	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	19%	0.185	C	C	.	.			trans	-94.1	97.3	173.3	-61.3	172.1	0	0	0	106.7	L186 K189 Y196 K253 I256 L260	L186-I191 HydrophobicContact CD2-CB 4.04Å; L186-I191 HydrophobicContact CD2-CD1 4.36Å; L186-I191 HydrophobicContact CD2-CG2 3.96Å; L186-I191 PolarHBondContact O-N 3.03Å; K189-I191 HydrophobicContact CB-CD1 3.91Å; K189-I191 HydrophobicContact CB-CG1 4.01Å; K189-I191 HydrophobicContact CD-CD1 4.38Å; K189-I191 PolarHBondContact O-N 3.18Å; I191-Y196 HydrophobicContact CG2-CD1 3.69Å; I191-Y196 HydrophobicContact CG2-CE1 3.89Å; I191-K253 HydrophobicContact CD1-CG 4.36Å; I191-K253 HydrophobicContact CG1-CG 3.69Å; I191-I256 HydrophobicContact CD1-CB 3.82Å; I191-I256 HydrophobicContact CD1-CD1 4.42Å; I191-I256 HydrophobicContact CD1-CG2 3.59Å; I191-L260 HydrophobicContact CG2-CD1 4.27Å
192	T	95.3	Very high	95	Very high	53 Å²	53	29.8 Å²	29.8	33%	0.325	16%	0.164	S	C	.	.			trans	-87.9	151.3	-179.5	50.6	0	0	0	0	110.3	D194 S195	T192-D194 WeakPolarHBondContact CB-OD1 3.16Å; T192-D194 PolarHBondContact O-N 3.39Å; T192-D194 VanDerWaalsContact O-N 3.12Å; T192-D194 PolarHBondContact OG1-OD1 3.02Å; T192-S195 WeakPolarHBondContact O-CB 3.26Å; T192-S195 PolarHBondContact O-N 3.41Å; T192-S195 PolarHBondContact O-OG 3.21Å
193	P	97.4	Very high	95	Very high	6 Å²	6	29.7 Å²	29.7	4%	0.039	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-27.6	-173	-24.1	33.5	0	0	0	115.4	F168 F171 R172 I175 S195 Y196 A197	F168-P193 HydrophobicContact CB-CB 4.31Å; F168-P193 HydrophobicContact CD1-CB 4.37Å; F171-P193 HydrophobicContact CD1-CB 3.65Å; F171-P193 HydrophobicContact CD1-CG 4.32Å; F171-P193 HydrophobicContact CE1-CB 4.31Å; R172-P193 HydrophobicContact CB-CG 3.93Å; I175-P193 HydrophobicContact CD1-CG 4.28Å; P193-S195 PolarHBondContact O-N 3.17Å; P193-Y196 HydrophobicContact CB-CE1 4.39Å; P193-Y196 PolarHBondContact O-N 3.09Å; P193-A197 WeakPolarHBondContact O-CA 3.5Å; P193-A197 VanDerWaalsContact O-CB 3.25Å; P193-A197 WeakPolarHBondContact O-CB 3.39Å; P193-A197 PolarHBondContact O-N 2.84Å
194	D	94.8	Very high	95.1	Very high	12 Å²	12	29.7 Å²	29.7	6%	0.064	16%	0.164	C	C	.	.	H	α-helix	trans	-64.3	-21.5	173.2	62.9	-52.1	0	0	0	113.3	K164 F168 T192 L198	K164-D194 PolarHBondContact N-OD2 3.03Å; F168-D194 HydrophobicContact CB-CB 4.02Å; F168-D194 HydrophobicContact CD1-CB 4.12Å; F168-D194 HydrophobicContact CD2-CB 3.67Å; F168-D194 HydrophobicContact CE2-CB 4.2Å; F168-D194 HydrophobicContact CG-CB 3.64Å; T192-D194 WeakPolarHBondContact CB-OD1 3.16Å; T192-D194 PolarHBondContact O-N 3.39Å; T192-D194 VanDerWaalsContact O-N 3.12Å; T192-D194 PolarHBondContact OG1-OD1 3.02Å; D194-L198 WeakPolarHBondContact O-CB 3.37Å
195	S	94.6	Very high	95.2	Very high	41 Å²	41	27.2 Å²	27.2	29%	0.287	15%	0.147	S	C	.	.	H	α-helix	trans	-77.4	-20.8	-179.3	78	0	0	0	0	114.1	T192 P193	T192-S195 WeakPolarHBondContact O-CB 3.26Å; T192-S195 PolarHBondContact O-N 3.41Å; T192-S195 PolarHBondContact O-OG 3.21Å; P193-S195 PolarHBondContact O-N 3.17Å
196	Y	95.5	Very high	95.3	Very high	3 Å²	3	25.7 Å²	25.7	1%	0.012	14%	0.14	C	C	.	.	H	α-helix	trans	-126.9	-23.3	-178.4	62.5	-97.4	0	0	0	113.5	F171 I191 P193 W200 L238 L260	F171-Y196 HydrophobicContact CE1-CE2 4.35Å; I191-Y196 HydrophobicContact CG2-CD1 3.69Å; I191-Y196 HydrophobicContact CG2-CE1 3.89Å; P193-Y196 HydrophobicContact CB-CE1 4.39Å; P193-Y196 PolarHBondContact O-N 3.09Å; Y196-W200 AromaticContact CD2-CH2 3.89Å; Y196-W200 HydrophobicContact CD2-CH2 3.89Å; Y196-W200 HydrophobicContact CD2-CZ2 4.11Å; Y196-W200 HydrophobicContact CD2-CZ3 4.15Å; Y196-W200 HydrophobicContact CE2-CH2 4.09Å; Y196-W200 HydrophobicContact CE2-CZ3 4.04Å; Y196-W200 PolarHBondContact O-NE1 3.07Å; Y196-L238 HydrophobicContact CE2-CD1 4.15Å; Y196-L238 WeakPolarHBondContact OH-CD2 3.12Å; Y196-L260 HydrophobicContact CD1-CD1 3.87Å; Y196-L260 HydrophobicContact CD2-CB 4.2Å; Y196-L260 HydrophobicContact CD2-CD1 4.42Å; Y196-L260 HydrophobicContact CE1-CD1 4.15Å; Y196-L260 HydrophobicContact CG-CB 3.94Å; Y196-L260 HydrophobicContact CG-CD1 4.01Å
197	A	96.8	Very high	95.2	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-111.4	9.9	-174.7	0	0	0	0	0	113.9	F171 P193 N199 W200 L201 M234	F171-A197 HydrophobicContact CE1-CB 4.33Å; P193-A197 WeakPolarHBondContact O-CA 3.5Å; P193-A197 VanDerWaalsContact O-CB 3.25Å; P193-A197 WeakPolarHBondContact O-CB 3.39Å; P193-A197 PolarHBondContact O-N 2.84Å; A197-N199 PolarHBondContact O-N 2.68Å; A197-W200 HydrophobicContact CB-CB 4.13Å; A197-W200 HydrophobicContact CB-CD2 3.71Å; A197-W200 HydrophobicContact CB-CE3 3.54Å; A197-W200 HydrophobicContact CB-CG 4Å; A197-W200 HydrophobicContact CB-CZ3 4.21Å; A197-W200 WeakPolarHBondContact O-CB 3.26Å; A197-W200 PolarHBondContact O-N 2.86Å; A197-L201 PolarHBondContact O-N 2.93Å; A197-L201 VanDerWaalsContact O-N 3.13Å; A197-M234 HydrophobicContact CB-CE 3.53Å
198	L	95.2	Very high	95.3	Very high	31 Å²	31	26.7 Å²	26.7	16%	0.162	14%	0.141	C	C	.	.	H	α-helix	trans	-54.8	-52.3	177.6	179.5	63.4	0	0	0	111.4	L163 F168 D194 G202	L163-L198 HydrophobicContact CD2-CD2 4.08Å; F168-L198 HydrophobicContact CE2-CD1 3.81Å; F168-L198 HydrophobicContact CZ-CB 4.37Å; F168-L198 HydrophobicContact CZ-CD1 3.65Å; D194-L198 WeakPolarHBondContact O-CB 3.37Å; L198-G202 PolarHBondContact O-N 3.26Å
199	N	94.8	Very high	95.4	Very high	29 Å²	29	21.6 Å²	21.6	16%	0.155	11%	0.11	C	C	.	.	H	α-helix	trans	-78.8	-19.2	179.3	-73.5	-42.1	0	0	0	112.8	S127 A197 S203 H207 Y208	S127-N199 PolarHBondContact OG-OD1 3.44Å; A197-N199 PolarHBondContact O-N 2.68Å; N199-S203 WeakPolarHBondContact O-CB 3.33Å; N199-S203 PolarHBondContact O-N 3.13Å; N199-S203 PolarHBondContact O-OG 3.08Å; N199-H207 HydrophobicContact CB-CB 4.35Å; N199-Y208 HydrophobicContact CB-CE2 3.5Å; N199-Y208 WeakPolarHBondContact CB-OH 3.37Å; N199-Y208 PolarHBondContact ND2-OH 3.42Å
200	W	97.1	Very high	95.4	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-61.4	-50.2	171.3	-63	5.1	0	0	0	110.1	Y196 A197 L204 F205 Y208 M234 I237 L260 E261 T263 P264	Y196-W200 AromaticContact CD2-CH2 3.89Å; Y196-W200 HydrophobicContact CD2-CH2 3.89Å; Y196-W200 HydrophobicContact CD2-CZ2 4.11Å; Y196-W200 HydrophobicContact CD2-CZ3 4.15Å; Y196-W200 HydrophobicContact CE2-CH2 4.09Å; Y196-W200 HydrophobicContact CE2-CZ3 4.04Å; Y196-W200 PolarHBondContact O-NE1 3.07Å; A197-W200 HydrophobicContact CB-CB 4.13Å; A197-W200 HydrophobicContact CB-CD2 3.71Å; A197-W200 HydrophobicContact CB-CE3 3.54Å; A197-W200 HydrophobicContact CB-CG 4Å; A197-W200 HydrophobicContact CB-CZ3 4.21Å; A197-W200 WeakPolarHBondContact O-CB 3.26Å; A197-W200 PolarHBondContact O-N 2.86Å; W200-L204 CarbonylContact O-C 3.47Å; W200-L204 VanDerWaalsContact O-CA 3.23Å; W200-L204 WeakPolarHBondContact O-CA 3.5Å; W200-L204 PolarHBondContact O-N 3.15Å; W200-L204 VanDerWaalsContact O-N 3.08Å; W200-F205 HydrophobicContact CB-CD1 3.86Å; W200-F205 HydrophobicContact CB-CE1 3.63Å; W200-F205 HydrophobicContact CD2-CE1 4.12Å; W200-F205 HydrophobicContact CE3-CE1 4.23Å; W200-F205 HydrophobicContact CG-CD1 4.08Å; W200-F205 AromaticContact CG-CE1 3.89Å; W200-F205 HydrophobicContact CG-CE1 3.89Å; W200-F205 PolarHBondContact O-N 3.47Å; W200-Y208 AromaticContact CD1-CD2 3.76Å; W200-Y208 AromaticContact CD1-CE2 3.56Å; W200-Y208 AromaticContact NE1-CE2 3.97Å; W200-M234 HydrophobicContact CB-CE 4.43Å; W200-M234 HydrophobicContact CB-CG 4.31Å; W200-M234 HydrophobicContact CE3-CB 4.05Å; W200-M234 HydrophobicContact CE3-CE 4.39Å; W200-M234 HydrophobicContact CE3-CG 4.03Å; W200-M234 HydrophobicContact CZ3-CB 4.44Å; W200-I237 HydrophobicContact CH2-CG2 3.81Å; W200-I237 HydrophobicContact CZ2-CG2 4.23Å; W200-I237 HydrophobicContact CZ3-CB 4.45Å; W200-I237 HydrophobicContact CZ3-CG2 4.17Å; W200-L260 VanDerWaalsContact CZ2-O 3.25Å; W200-L260 WeakPolarHBondContact CZ2-O 3.49Å; W200-E261 PolarHBondContact NE1-O 3.37Å; W200-T263 WeakPolarHBondContact CZ2-OG1 3.31Å; W200-P264 HydrophobicContact CD2-CG 4.09Å; W200-P264 HydrophobicContact CG-CG 4.2Å; W200-P264 HydrophobicContact CZ2-CG 3.99Å; W200-P264 VanDerWaalsContact NE1-CG 3.3Å
201	L	96.4	Very high	95.4	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-76.7	-44.4	-179.9	-171.1	54.2	0	0	0	111.8	P158 P167 F168 A197 S203 L204 I230 Y231 M234	P158-L201 HydrophobicContact CG-CD1 4Å; P158-L201 HydrophobicContact CG-CD2 3.82Å; P158-L201 HydrophobicContact CG-CG 3.92Å; P167-L201 HydrophobicContact CB-CD2 3.81Å; F168-L201 HydrophobicContact CE1-CB 4.25Å; F168-L201 HydrophobicContact CE1-CD2 3.94Å; F168-L201 HydrophobicContact CZ-CB 4.42Å; F168-L201 HydrophobicContact CZ-CD2 4.07Å; A197-L201 PolarHBondContact O-N 2.93Å; A197-L201 VanDerWaalsContact O-N 3.13Å; L201-S203 VanDerWaalsContact C-N 3.33Å; L201-S203 PolarHBondContact O-N 3.06Å; L201-L204 PolarHBondContact O-N 3.5Å; L201-I230 HydrophobicContact CD1-CB 4.33Å; L201-I230 HydrophobicContact CD1-CG1 3.81Å; L201-I230 HydrophobicContact CD1-CG2 3.52Å; L201-Y231 HydrophobicContact CD2-CE1 4.32Å; L201-M234 HydrophobicContact CB-CE 4.2Å; L201-M234 HydrophobicContact CB-SD 4.16Å; L201-M234 HydrophobicContact CD1-SD 4.12Å
202	G	94.4	Very high	95.3	Very high	6 Å²	6	21.3 Å²	21.3	6%	0.062	12%	0.117	C	C	.	.	H	α-helix	trans	-68.5	-26.1	-176.7	0	0	0	0	0	114.7	L131 L198	L131-G202 WeakPolarHBondContact CD1-O 3.3Å; L198-G202 PolarHBondContact O-N 3.26Å
203	S	95.7	Very high	95.4	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-113.2	1.1	177.2	75.8	0	0	0	0	114.4	L131 N199 L201 F205 A206 H207	L131-S203 WeakPolarHBondContact CD2-O 3.26Å; N199-S203 WeakPolarHBondContact O-CB 3.33Å; N199-S203 PolarHBondContact O-N 3.13Å; N199-S203 PolarHBondContact O-OG 3.08Å; L201-S203 VanDerWaalsContact C-N 3.33Å; L201-S203 PolarHBondContact O-N 3.06Å; S203-F205 PolarHBondContact O-N 3.12Å; S203-A206 WeakPolarHBondContact O-CB 3.4Å; S203-A206 PolarHBondContact O-N 3.5Å; S203-A206 PolarHBondContact OG-N 3.04Å; S203-H207 VanDerWaalsContact OG-CB 3.31Å; S203-H207 WeakPolarHBondContact OG-CB 3.4Å; S203-H207 PolarHBondContact OG-N 3.35Å
204	L	97.1	Very high	95.4	Very high	5 Å²	5	18.7 Å²	18.7	3%	0.026	10%	0.101	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	50	-170.4	-54.3	175.5	0	0	0	111	L131 I152 I157 W200 L201 A206 W218 Y221 I230	L131-L204 HydrophobicContact CD2-CD1 4.39Å; L131-L204 HydrophobicContact CD2-CG 4.23Å; I152-L204 HydrophobicContact CG2-CD1 3.98Å; I157-L204 HydrophobicContact CD1-CD1 4.09Å; I157-L204 HydrophobicContact CD1-CD2 3.96Å; I157-L204 HydrophobicContact CD1-CG 3.75Å; W200-L204 CarbonylContact O-C 3.47Å; W200-L204 VanDerWaalsContact O-CA 3.23Å; W200-L204 WeakPolarHBondContact O-CA 3.5Å; W200-L204 PolarHBondContact O-N 3.15Å; W200-L204 VanDerWaalsContact O-N 3.08Å; L201-L204 PolarHBondContact O-N 3.5Å; L204-A206 PolarHBondContact O-N 3.26Å; L204-A206 VanDerWaalsContact O-N 3.12Å; L204-W218 HydrophobicContact CB-CZ2 3.97Å; L204-W218 HydrophobicContact CD1-CZ2 4.07Å; L204-W218 PolarHBondContact O-NE1 3.16Å; L204-W218 VanDerWaalsContact O-NE1 3.1Å; L204-Y221 HydrophobicContact CD1-CE1 4.33Å; L204-Y221 HydrophobicContact CD2-CE1 4.39Å; L204-I230 HydrophobicContact CD2-CD1 4.02Å; L204-I230 HydrophobicContact CD2-CG1 4Å
205	F	97.4	Very high	95.4	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	-5.5	-174.5	-50.1	-69	0	0	0	117.9	W200 S203 H207 Y208 C209 I217 I230 L233 M234 I237 P264	W200-F205 HydrophobicContact CB-CD1 3.86Å; W200-F205 HydrophobicContact CB-CE1 3.63Å; W200-F205 HydrophobicContact CD2-CE1 4.12Å; W200-F205 HydrophobicContact CE3-CE1 4.23Å; W200-F205 HydrophobicContact CG-CD1 4.08Å; W200-F205 AromaticContact CG-CE1 3.89Å; W200-F205 HydrophobicContact CG-CE1 3.89Å; W200-F205 PolarHBondContact O-N 3.47Å; S203-F205 PolarHBondContact O-N 3.12Å; F205-H207 PolarHBondContact O-N 2.98Å; F205-Y208 PolarHBondContact O-N 3.37Å; F205-Y208 VanDerWaalsContact O-N 3.08Å; F205-C209 PolarHBondContact O-N 3.01Å; F205-I217 HydrophobicContact CD2-CD1 4.37Å; F205-I217 HydrophobicContact CD2-CG2 4.39Å; F205-I230 HydrophobicContact CD2-CD1 3.89Å; F205-I230 HydrophobicContact CE2-CD1 3.27Å; F205-I230 HydrophobicContact CZ-CD1 3.77Å; F205-L233 HydrophobicContact CE2-CB 3.79Å; F205-L233 HydrophobicContact CE2-CD1 4.26Å; F205-L233 HydrophobicContact CZ-CB 4.04Å; F205-M234 HydrophobicContact CE1-CG 3.99Å; F205-M234 HydrophobicContact CZ-CB 4.41Å; F205-M234 HydrophobicContact CZ-CG 3.63Å; F205-I237 HydrophobicContact CD1-CD1 4Å; F205-I237 HydrophobicContact CE1-CD1 3.4Å; F205-I237 HydrophobicContact CE2-CD1 4.26Å; F205-I237 HydrophobicContact CZ-CD1 3.55Å; F205-P264 HydrophobicContact CD1-CB 4.02Å; F205-P264 HydrophobicContact CD1-CG 3.99Å; F205-P264 HydrophobicContact CE1-CG 4.38Å
206	A	95.5	Very high	95.5	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-19.5	-175.8	0	0	0	0	0	114.8	H130 S203 L204 T214 W218	H130-A206 VanDerWaalsContact O-CB 3.24Å; H130-A206 WeakPolarHBondContact O-CB 3.22Å; S203-A206 WeakPolarHBondContact O-CB 3.4Å; S203-A206 PolarHBondContact O-N 3.5Å; S203-A206 PolarHBondContact OG-N 3.04Å; L204-A206 PolarHBondContact O-N 3.26Å; L204-A206 VanDerWaalsContact O-N 3.12Å; A206-T214 HydrophobicContact CB-CG2 3.65Å; A206-W218 HydrophobicContact CB-CZ2 4.46Å
207	H	93.8	Very high	95.6	Very high	65 Å²	65	18.9 Å²	18.9	30%	0.301	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-44	173.8	-176.4	89	0	0	0	112.5	H130 N199 S203 F205	H130-H207 HydrophobicContact CB-CB 4.11Å; H130-H207 AromaticContact CD2-ND1 3.14Å; H130-H207 PolarHBondContact CD2-ND1 3.32Å; H130-H207 AromaticContact CE1-CE1 3.64Å; H130-H207 AromaticContact CE1-ND1 3.05Å; H130-H207 PolarHBondContact CE1-ND1 3.26Å; H130-H207 AromaticContact CG-ND1 3.45Å; H130-H207 AromaticContact ND1-ND1 3.39Å; H130-H207 PolarHBondContact ND1-ND1 2.94Å; H130-H207 AromaticContact NE2-CE1 3.44Å; H130-H207 PolarHBondContact NE2-CE1 3.47Å; H130-H207 AromaticContact NE2-ND1 2.85Å; H130-H207 PolarHBondContact NE2-ND1 3.07Å; N199-H207 HydrophobicContact CB-CB 4.35Å; S203-H207 VanDerWaalsContact OG-CB 3.31Å; S203-H207 WeakPolarHBondContact OG-CB 3.4Å; S203-H207 PolarHBondContact OG-N 3.35Å; F205-H207 PolarHBondContact O-N 2.98Å
208	Y	93.8	Very high	95.7	Very high	26 Å²	26	19 Å²	19	10%	0.102	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-35.4	-171.8	-58	-80.8	0	0	0	113.5	N199 W200 F205 E261 P264 S265	N199-Y208 HydrophobicContact CB-CE2 3.5Å; N199-Y208 WeakPolarHBondContact CB-OH 3.37Å; N199-Y208 PolarHBondContact ND2-OH 3.42Å; W200-Y208 AromaticContact CD1-CD2 3.76Å; W200-Y208 AromaticContact CD1-CE2 3.56Å; W200-Y208 AromaticContact NE1-CE2 3.97Å; F205-Y208 PolarHBondContact O-N 3.37Å; F205-Y208 VanDerWaalsContact O-N 3.08Å; Y208-E261 HydrophobicContact CE1-CG 3.68Å; Y208-E261 WeakPolarHBondContact CE1-O 3.48Å; Y208-E261 HydrophobicContact CE2-CG 4.5Å; Y208-E261 VanDerWaalsContact CZ-CG 3.47Å; Y208-E261 VanDerWaalsContact OH-CD 3.29Å; Y208-E261 WeakPolarHBondContact OH-CG 3.42Å; Y208-E261 PolarHBondContact OH-OE1 3.12Å; Y208-P264 HydrophobicContact CD2-CG 4.44Å; Y208-S265 WeakPolarHBondContact O-CA 3.45Å; Y208-S265 WeakPolarHBondContact O-CB 3.47Å
209	C	95.6	Very high	95.8	Very high	3 Å²	3	18 Å²	18	2%	0.02	10%	0.097	C	C	.	.	S	Bend	trans	-75.2	155.9	-176.8	-65.5	0	0	0	0	112.1	F205 V213 T214 P264	F205-C209 PolarHBondContact O-N 3.01Å; C209-V213 HydrophobicContact CB-CB 4.3Å; C209-V213 HydrophobicContact CB-CG1 4.06Å; C209-T214 WeakPolarHBondContact CB-OG1 3.19Å; C209-P264 PolarHBondContact SG-O 2.87Å
210	S	93.8	Very high	95.8	Very high	52 Å²	52	17.7 Å²	17.7	36%	0.364	10%	0.101	S	C	.	.			trans	-62.5	163.3	167.6	91.5	0	0	0	0	110.5	E212 V213 T214	S210-E212 VanDerWaalsContact C-N 3.33Å; S210-E212 VanDerWaalsContact CB-OE2 3.28Å; S210-E212 WeakPolarHBondContact CB-OE2 3.17Å; S210-E212 PolarHBondContact O-N 3.09Å; S210-E212 PolarHBondContact OG-N 2.92Å; S210-E212 PolarHBondContact OG-OE2 3.34Å; S210-V213 WeakPolarHBondContact OG-CG2 3.23Å; S210-V213 PolarHBondContact OG-N 3.35Å; S210-T214 VanDerWaalsContact O-CB 3.29Å; S210-T214 WeakPolarHBondContact O-CB 3.24Å; S210-T214 PolarHBondContact O-N 2.97Å; S210-T214 PolarHBondContact O-OG1 2.9Å
211	I	92.6	Very high	95.8	Very high	16 Å²	16	17.9 Å²	17.9	8%	0.082	10%	0.102	C	C	.	.	H	α-helix	trans	-64.8	-39.5	-179.3	-179.6	61.3	0	0	0	111.7	P134 Y137 T214 Q215	P134-I211 HydrophobicContact CB-CD1 4.27Å; Y137-I211 HydrophobicContact CD1-CG1 4.07Å; Y137-I211 HydrophobicContact CD2-CB 4.43Å; Y137-I211 HydrophobicContact CD2-CD1 3.35Å; Y137-I211 HydrophobicContact CD2-CG1 3.51Å; Y137-I211 HydrophobicContact CE1-CG1 4.22Å; Y137-I211 HydrophobicContact CE1-CG2 4.47Å; Y137-I211 HydrophobicContact CE2-CB 4.08Å; Y137-I211 HydrophobicContact CE2-CD1 3.82Å; Y137-I211 HydrophobicContact CE2-CG1 3.64Å; Y137-I211 HydrophobicContact CE2-CG2 4.48Å; Y137-I211 HydrophobicContact CG-CD1 3.81Å; Y137-I211 HydrophobicContact CG-CG1 3.73Å; I211-T214 PolarHBondContact O-N 2.96Å; I211-Q215 HydrophobicContact CD1-CG 4.13Å; I211-Q215 HydrophobicContact CG1-CG 4.41Å; I211-Q215 WeakPolarHBondContact O-CB 3.48Å; I211-Q215 WeakPolarHBondContact O-CG 3.24Å; I211-Q215 PolarHBondContact O-N 3.08Å
212	E	94.3	Very high	95.8	Very high	99 Å²	99	18 Å²	18	46%	0.463	10%	0.102	S	C	.	.	H	α-helix	trans	-64.3	-46.6	-179	-54.2	76.6	-168.1	0	0	110.5	S210 Q215 A216 L269	S210-E212 VanDerWaalsContact C-N 3.33Å; S210-E212 VanDerWaalsContact CB-OE2 3.28Å; S210-E212 WeakPolarHBondContact CB-OE2 3.17Å; S210-E212 PolarHBondContact O-N 3.09Å; S210-E212 PolarHBondContact OG-N 2.92Å; S210-E212 PolarHBondContact OG-OE2 3.34Å; E212-Q215 PolarHBondContact O-N 3.05Å; E212-A216 PolarHBondContact O-N 3.27Å; E212-L269 HydrophobicContact CB-CD1 4.13Å; E212-L269 HydrophobicContact CB-CD2 4.08Å; E212-L269 HydrophobicContact CB-CG 4.33Å; E212-L269 WeakPolarHBondContact O-CD2 3.42Å
213	V	96.4	Very high	95.8	Very high	4 Å²	4	18.3 Å²	18.3	2%	0.024	10%	0.102	C	C	.	.	H	α-helix	trans	-65.7	-43.2	177.2	176.4	0	0	0	0	110.6	C209 S210 Q215 A216 I217 L267 L269 I272	C209-V213 HydrophobicContact CB-CB 4.3Å; C209-V213 HydrophobicContact CB-CG1 4.06Å; S210-V213 WeakPolarHBondContact OG-CG2 3.23Å; S210-V213 PolarHBondContact OG-N 3.35Å; V213-Q215 VanDerWaalsContact C-N 3.34Å; V213-Q215 PolarHBondContact O-N 3.03Å; V213-A216 PolarHBondContact O-N 3.12Å; V213-I217 HydrophobicContact CG1-CD1 4.04Å; V213-I217 WeakPolarHBondContact O-CG1 3.36Å; V213-I217 PolarHBondContact O-N 3.15Å; V213-L267 HydrophobicContact CG1-CB 4Å; V213-L267 WeakPolarHBondContact CG2-O 3.16Å; V213-L269 HydrophobicContact CG2-CD2 4.27Å; V213-L269 HydrophobicContact CG2-CG 4.31Å; V213-I272 HydrophobicContact CG1-CD1 3.75Å
214	T	96.9	Very high	95.7	Very high	0 Å²	0	20.7 Å²	20.7	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-59.7	-44.8	175.8	-57.4	0	0	0	0	111.1	P134 A206 C209 S210 I211 I217 W218	P134-T214 HydrophobicContact CB-CG2 4.11Å; P134-T214 HydrophobicContact CG-CG2 4.1Å; A206-T214 HydrophobicContact CB-CG2 3.65Å; C209-T214 WeakPolarHBondContact CB-OG1 3.19Å; S210-T214 VanDerWaalsContact O-CB 3.29Å; S210-T214 WeakPolarHBondContact O-CB 3.24Å; S210-T214 PolarHBondContact O-N 2.97Å; S210-T214 PolarHBondContact O-OG1 2.9Å; I211-T214 PolarHBondContact O-N 2.96Å; T214-I217 PolarHBondContact O-N 3.07Å; T214-W218 HydrophobicContact CG2-CG 4.5Å; T214-W218 WeakPolarHBondContact O-CB 3.46Å; T214-W218 PolarHBondContact O-N 3.15Å
215	Q	96.2	Very high	95.6	Very high	32 Å²	32	22 Å²	22	15%	0.15	12%	0.124	C	C	.	.	H	α-helix	trans	-63.2	-43.8	177	-77.4	-178.8	-21.3	0	0	111.6	W54 I211 E212 V213 I217 W218 D219	W54-Q215 HydrophobicContact CH2-CG 4.47Å; I211-Q215 HydrophobicContact CD1-CG 4.13Å; I211-Q215 HydrophobicContact CG1-CG 4.41Å; I211-Q215 WeakPolarHBondContact O-CB 3.48Å; I211-Q215 WeakPolarHBondContact O-CG 3.24Å; I211-Q215 PolarHBondContact O-N 3.08Å; E212-Q215 PolarHBondContact O-N 3.05Å; V213-Q215 VanDerWaalsContact C-N 3.34Å; V213-Q215 PolarHBondContact O-N 3.03Å; Q215-I217 PolarHBondContact O-N 3.39Å; Q215-W218 PolarHBondContact O-N 3.29Å; Q215-D219 WeakPolarHBondContact O-CB 3.38Å; Q215-D219 PolarHBondContact O-N 3.31Å
216	A	96.9	Very high	95.5	Very high	26 Å²	26	23.1 Å²	23.1	22%	0.215	13%	0.13	C	C	.	.	H	α-helix	trans	-61.9	-42.8	176.7	0	0	0	0	0	112.4	E212 V213 D219 G220 L269 I272	E212-A216 PolarHBondContact O-N 3.27Å; V213-A216 PolarHBondContact O-N 3.12Å; A216-D219 PolarHBondContact O-N 3.41Å; A216-G220 PolarHBondContact O-N 2.89Å; A216-L269 HydrophobicContact CB-CD2 3.84Å; A216-I272 HydrophobicContact CB-CG1 4.16Å; A216-I272 HydrophobicContact CB-CG2 4.22Å
217	I	97.8	Very high	95.5	Very high	2 Å²	2	23.8 Å²	23.8	1%	0.01	14%	0.135	C	C	.	.	H	α-helix	trans	-61.4	-47.4	173.9	-67.3	168.8	0	0	0	110.1	F205 V213 T214 Q215 D219 G220 Y221 L233 I272 F276	F205-I217 HydrophobicContact CD2-CD1 4.37Å; F205-I217 HydrophobicContact CD2-CG2 4.39Å; V213-I217 HydrophobicContact CG1-CD1 4.04Å; V213-I217 WeakPolarHBondContact O-CG1 3.36Å; V213-I217 PolarHBondContact O-N 3.15Å; T214-I217 PolarHBondContact O-N 3.07Å; Q215-I217 PolarHBondContact O-N 3.39Å; I217-D219 PolarHBondContact O-N 2.96Å; I217-G220 PolarHBondContact O-N 3.21Å; I217-Y221 WeakPolarHBondContact O-CB 3.48Å; I217-Y221 PolarHBondContact O-N 3.41Å; I217-L233 HydrophobicContact CG2-CD1 4.32Å; I217-I272 HydrophobicContact CD1-CD1 4.03Å; I217-I272 HydrophobicContact CG1-CD1 3.66Å; I217-I272 HydrophobicContact CG1-CG2 4.43Å; I217-F276 HydrophobicContact CG2-CE2 4.36Å; I217-F276 HydrophobicContact CG2-CZ 4.42Å; I217-F276 WeakPolarHBondContact O-CZ 3.49Å
218	W	97.9	Very high	95.7	Very high	2 Å²	2	20.8 Å²	20.8	1%	0.008	12%	0.121	C	C	.	.	H	α-helix	trans	-69.5	-32.5	-177.7	-77.4	39.7	0	0	0	112.6	W54 L131 P134 L135 I152 L204 A206 T214 Q215 G220 Y221 L222	W54-W218 HydrophobicContact CE3-CE3 4.2Å; W54-W218 HydrophobicContact CH2-CB 3.49Å; W54-W218 VanDerWaalsContact CH2-CB 3.49Å; W54-W218 HydrophobicContact CH2-CD2 4.07Å; W54-W218 AromaticContact CH2-CE3 3.58Å; W54-W218 HydrophobicContact CH2-CE3 3.58Å; W54-W218 HydrophobicContact CH2-CG 4.09Å; W54-W218 HydrophobicContact CZ2-CB 3.38Å; W54-W218 HydrophobicContact CZ2-CE3 4.48Å; W54-W218 HydrophobicContact CZ2-CG 4.44Å; W54-W218 HydrophobicContact CZ3-CB 4.4Å; W54-W218 HydrophobicContact CZ3-CD2 4.35Å; W54-W218 AromaticContact CZ3-CE3 3.42Å; W54-W218 HydrophobicContact CZ3-CE3 3.42Å; W54-W218 VanDerWaalsContact CZ3-CE3 3.42Å; W54-W218 HydrophobicContact CZ3-CZ3 4.03Å; L131-W218 HydrophobicContact CD2-CH2 4.03Å; L131-W218 HydrophobicContact CD2-CZ2 3.9Å; L131-W218 WeakPolarHBondContact O-CH2 3.39Å; P134-W218 HydrophobicContact CB-CD2 4.44Å; P134-W218 HydrophobicContact CB-CE3 4.22Å; P134-W218 HydrophobicContact CB-CZ3 4.28Å; P134-W218 HydrophobicContact CG-CD2 4Å; P134-W218 HydrophobicContact CG-CE3 3.78Å; P134-W218 HydrophobicContact CG-CH2 3.39Å; P134-W218 HydrophobicContact CG-CZ2 3.65Å; P134-W218 HydrophobicContact CG-CZ3 3.45Å; P134-W218 VanDerWaalsContact CG-CZ3 3.45Å; L135-W218 HydrophobicContact CD2-CZ3 4.23Å; L135-W218 HydrophobicContact CG-CZ3 4.26Å; I152-W218 HydrophobicContact CD1-CE3 4.29Å; I152-W218 HydrophobicContact CD1-CH2 3.9Å; I152-W218 HydrophobicContact CD1-CZ3 3.41Å; I152-W218 VanDerWaalsContact CD1-CZ3 3.41Å; L204-W218 HydrophobicContact CB-CZ2 3.97Å; L204-W218 HydrophobicContact CD1-CZ2 4.07Å; L204-W218 PolarHBondContact O-NE1 3.16Å; L204-W218 VanDerWaalsContact O-NE1 3.1Å; A206-W218 HydrophobicContact CB-CZ2 4.46Å; T214-W218 HydrophobicContact CG2-CG 4.5Å; T214-W218 WeakPolarHBondContact O-CB 3.46Å; T214-W218 PolarHBondContact O-N 3.15Å; Q215-W218 PolarHBondContact O-N 3.29Å; W218-G220 PolarHBondContact O-N 2.81Å; W218-Y221 PolarHBondContact O-N 3.26Å; W218-L222 HydrophobicContact CE3-CD1 4.42Å; W218-L222 VanDerWaalsContact O-CB 3.23Å; W218-L222 WeakPolarHBondContact O-CB 3.46Å; W218-L222 WeakPolarHBondContact O-CG 3.35Å; W218-L222 PolarHBondContact O-N 3.16Å
219	D	96.6	Very high	95.9	Very high	11 Å²	11	19.6 Å²	19.6	6%	0.059	12%	0.116	C	C	.	.	H	α-helix	trans	-57.1	-49.8	173.4	-73.2	-15.6	0	0	0	110.3	L45 R50 W54 Q215 A216 I217 Q223	L45-D219 HydrophobicContact CD1-CB 4.01Å; L45-D219 HydrophobicContact CG-CB 4.47Å; R50-D219 WeakPolarHBondContact CD-OD1 3.4Å; R50-D219 IonicContact CZ-OD1 3.93Å; R50-D219 IonicContact CZ-OD2 3.67Å; R50-D219 IonicContact NE-OD1 3.64Å; R50-D219 PolarHBondContact NE-OD1 2.94Å; R50-D219 IonicContact NE-OD2 2.78Å; R50-D219 PolarHBondContact NE-OD2 2.97Å; R50-D219 IonicContact NH2-OD2 3.98Å; R50-D219 PolarHBondContact NH2-OD2 3.42Å; W54-D219 WeakPolarHBondContact CZ2-OD1 3.21Å; W54-D219 PolarHBondContact NE1-OD1 3.33Å; Q215-D219 WeakPolarHBondContact O-CB 3.38Å; Q215-D219 PolarHBondContact O-N 3.31Å; A216-D219 PolarHBondContact O-N 3.41Å; I217-D219 PolarHBondContact O-N 2.96Å; D219-Q223 WeakPolarHBondContact O-CB 3.46Å; D219-Q223 WeakPolarHBondContact O-CG 3.35Å; D219-Q223 PolarHBondContact O-N 2.74Å; D219-Q223 PolarHBondContact O-NE2 3.15Å
220	G	95.8	Very high	96	Very high	23 Å²	23	19.5 Å²	19.5	24%	0.237	12%	0.116	C	C	.	.	H	α-helix	trans	-70.6	-45.1	176.7	0	0	0	0	0	112.9	A216 I217 W218 L222 Q223 Q224	A216-G220 PolarHBondContact O-N 2.89Å; I217-G220 PolarHBondContact O-N 3.21Å; W218-G220 PolarHBondContact O-N 2.81Å; G220-L222 PolarHBondContact O-N 3.13Å; G220-Q223 PolarHBondContact O-N 2.84Å; G220-Q224 WeakPolarHBondContact O-CB 3.44Å; G220-Q224 PolarHBondContact O-N 2.84Å
221	Y	97.6	Very high	96.2	Very high	3 Å²	3	17 Å²	17	1%	0.012	10%	0.098	C	C	.	.	H	α-helix	trans	-63.8	-44.9	-174.6	-168.8	-107.3	0	0	0	112.6	Y156 L204 I217 W218 Q224 A225 D226 P227 F229 I230 L233	Y156-Y221 HydrophobicContact CD1-CD1 4.26Å; Y156-Y221 AromaticContact CD1-CE1 3.42Å; Y156-Y221 HydrophobicContact CD1-CE1 3.42Å; Y156-Y221 VanDerWaalsContact CD1-CE1 3.42Å; Y156-Y221 HydrophobicContact CE1-CE1 4.02Å; Y156-Y221 AromaticContact CG-CE1 3.79Å; Y156-Y221 HydrophobicContact CG-CE1 3.79Å; L204-Y221 HydrophobicContact CD1-CE1 4.33Å; L204-Y221 HydrophobicContact CD2-CE1 4.39Å; I217-Y221 WeakPolarHBondContact O-CB 3.48Å; I217-Y221 PolarHBondContact O-N 3.41Å; W218-Y221 PolarHBondContact O-N 3.26Å; Y221-Q224 PolarHBondContact O-N 2.65Å; Y221-A225 PolarHBondContact O-N 2.86Å; Y221-D226 PolarHBondContact OH-O 3.25Å; Y221-P227 PolarHBondContact OH-O 3.33Å; Y221-F229 HydrophobicContact CD2-CB 4.33Å; Y221-F229 AromaticContact CD2-CD1 3.98Å; Y221-F229 HydrophobicContact CD2-CD1 3.98Å; Y221-F229 HydrophobicContact CE2-CB 3.79Å; Y221-F229 HydrophobicContact CE2-CD1 4.22Å; Y221-I230 HydrophobicContact CE2-CB 4Å; Y221-I230 WeakPolarHBondContact OH-CB 3.35Å; Y221-L233 HydrophobicContact CD2-CD1 3.96Å; Y221-L233 HydrophobicContact CE2-CD1 4.39Å
222	L	96.6	Very high	96.5	Very high	2 Å²	2	16.4 Å²	16.4	1%	0.01	10%	0.095	C	C	.	.	H	α-helix	trans	-70.6	-35.6	179.1	-64.9	179.1	0	0	0	111.9	W54 A57 L58 Y156 W218 G220 A225	W54-L222 HydrophobicContact CB-CD1 4.27Å; W54-L222 HydrophobicContact CD2-CD1 3.56Å; W54-L222 HydrophobicContact CE3-CD1 3.91Å; W54-L222 HydrophobicContact CG-CD1 3.73Å; A57-L222 HydrophobicContact CB-CB 3.93Å; L58-L222 HydrophobicContact CD2-CD2 3.67Å; L58-L222 HydrophobicContact CG-CD1 4.49Å; L58-L222 HydrophobicContact CG-CD2 4.34Å; Y156-L222 HydrophobicContact CD2-CD2 3.91Å; Y156-L222 HydrophobicContact CE2-CD2 3.33Å; W218-L222 HydrophobicContact CE3-CD1 4.42Å; W218-L222 VanDerWaalsContact O-CB 3.23Å; W218-L222 WeakPolarHBondContact O-CB 3.46Å; W218-L222 WeakPolarHBondContact O-CG 3.35Å; W218-L222 PolarHBondContact O-N 3.16Å; G220-L222 PolarHBondContact O-N 3.13Å; L222-A225 PolarHBondContact O-N 2.83Å
223	Q	93.9	Very high	96.7	Very high	13 Å²	13	11.7 Å²	11.7	6%	0.061	7%	0.073	C	C	.	.	H	α-helix	trans	-66.6	-38.1	173.4	-77.1	179.7	73.5	0	0	112.7	I40 D219 G220 A225	I40-Q223 HydrophobicContact CD1-CG 4.5Å; I40-Q223 VanDerWaalsContact CD1-OE1 3.31Å; D219-Q223 WeakPolarHBondContact O-CB 3.46Å; D219-Q223 WeakPolarHBondContact O-CG 3.35Å; D219-Q223 PolarHBondContact O-N 2.74Å; D219-Q223 PolarHBondContact O-NE2 3.15Å; G220-Q223 PolarHBondContact O-N 2.84Å; Q223-A225 VanDerWaalsContact C-N 3.28Å
224	Q	93.6	Very high	96.8	Very high	51 Å²	51	11.5 Å²	11.5	24%	0.238	7%	0.072	C	C	.	.	H	α-helix	trans	-69.4	-29.7	176.3	-173.8	168.6	-22.6	0	0	112.2	G220 Y221 D226 F229	G220-Q224 WeakPolarHBondContact O-CB 3.44Å; G220-Q224 PolarHBondContact O-N 2.84Å; Y221-Q224 PolarHBondContact O-N 2.65Å; Q224-D226 HydrophobicContact CG-CB 4.24Å; Q224-D226 PolarHBondContact O-N 3.2Å; Q224-F229 VanDerWaalsContact NE2-CE2 3.34Å; Q224-F229 VanDerWaalsContact OE1-CE1 3.23Å
225	A	94.4	Very high	96.9	Very high	31 Å²	31	11.5 Å²	11.5	26%	0.256	7%	0.072	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	31.9	174.7	0	0	0	0	0	115.1	L33 Y156 Y221 L222 Q223	L33-A225 HydrophobicContact CD2-CB 3.69Å; Y156-A225 WeakPolarHBondContact OH-CA 3.43Å; Y221-A225 PolarHBondContact O-N 2.86Å; L222-A225 PolarHBondContact O-N 2.83Å; Q223-A225 VanDerWaalsContact C-N 3.28Å
226	D	95.1	Very high	97	Very high	24 Å²	24	10.1 Å²	10.1	13%	0.128	7%	0.065	C	C	.	.			trans	-112	108.5	177.4	174.4	20.4	0	0	0	111.3	Y221 Q224 F228 F229 R291	Y221-D226 PolarHBondContact OH-O 3.25Å; Q224-D226 HydrophobicContact CG-CB 4.24Å; Q224-D226 PolarHBondContact O-N 3.2Å; D226-F228 PolarHBondContact O-N 2.94Å; D226-F228 PolarHBondContact OD1-N 2.96Å; D226-F229 HydrophobicContact CB-CB 4.07Å; D226-F229 WeakPolarHBondContact O-CB 3.32Å; D226-F229 PolarHBondContact O-N 3Å; D226-F229 VanDerWaalsContact O-N 3.07Å; D226-R291 IonicContact OD1-NE 3.93Å; D226-R291 IonicContact OD2-CZ 2.8Å; D226-R291 IonicContact OD2-NE 3.58Å; D226-R291 PolarHBondContact OD2-NE 3.05Å; D226-R291 IonicContact OD2-NH2 3.07Å; D226-R291 PolarHBondContact OD2-NH2 3.31Å
227	P	95.8	Very high	97	Very high	14 Å²	14	9.2 Å²	9.2	9%	0.091	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-25.4	178.2	-26.1	36.3	0	0	0	115.6	K155 Y156 Y221 F229 I230 F298	K155-P227 HydrophobicContact CG-CG 4.37Å; K155-P227 VanDerWaalsContact O-CB 3.26Å; K155-P227 WeakPolarHBondContact O-CB 3.47Å; K155-P227 WeakPolarHBondContact O-CG 3.47Å; Y156-P227 HydrophobicContact CD1-CB 4.37Å; Y156-P227 HydrophobicContact CD1-CG 4.27Å; Y156-P227 HydrophobicContact CE1-CG 4.4Å; Y221-P227 PolarHBondContact OH-O 3.33Å; P227-F229 VanDerWaalsContact C-N 3.31Å; P227-I230 WeakPolarHBondContact O-CG2 3.45Å; P227-F298 HydrophobicContact CB-CD1 3.93Å; P227-F298 HydrophobicContact CB-CD2 3.99Å; P227-F298 HydrophobicContact CB-CE1 4Å; P227-F298 HydrophobicContact CB-CE2 4.07Å; P227-F298 HydrophobicContact CB-CG 3.91Å; P227-F298 HydrophobicContact CB-CZ 4.07Å; P227-F298 WeakPolarHBondContact O-CZ 3.25Å
228	F	97.4	Very high	97	Very high	2 Å²	2	9.1 Å²	9.1	1%	0.009	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-10.1	-179.6	-71.7	-93.2	0	0	0	112.5	L170 D226 I230 Y231 F290 R291 N294 H295 F298	L170-F228 HydrophobicContact CD2-CD1 4.3Å; L170-F228 HydrophobicContact CD2-CE1 3.94Å; D226-F228 PolarHBondContact O-N 2.94Å; D226-F228 PolarHBondContact OD1-N 2.96Å; F228-I230 PolarHBondContact O-N 3.46Å; F228-Y231 HydrophobicContact CB-CD2 4.35Å; F228-Y231 HydrophobicContact CD1-CD2 4.01Å; F228-Y231 AromaticContact CD1-CE2 3.91Å; F228-Y231 HydrophobicContact CD1-CE2 3.91Å; F228-Y231 HydrophobicContact CE1-CE2 4.4Å; F228-Y231 WeakPolarHBondContact O-CB 3.46Å; F228-Y231 WeakPolarHBondContact O-CD2 3Å; F228-Y231 PolarHBondContact O-N 3.48Å; F228-Y231 VanDerWaalsContact O-N 3.15Å; F228-F290 HydrophobicContact CB-CE1 4.22Å; F228-F290 HydrophobicContact CD1-CD1 4.15Å; F228-F290 AromaticContact CD1-CE1 3.8Å; F228-F290 HydrophobicContact CD1-CE1 3.8Å; F228-F290 HydrophobicContact CG-CE1 4.45Å; F228-R291 HydrophobicContact CB-CG 3.87Å; F228-R291 HydrophobicContact CD2-CB 4.19Å; F228-R291 HydrophobicContact CD2-CG 4.13Å; F228-R291 HydrophobicContact CG-CB 4.33Å; F228-R291 HydrophobicContact CG-CG 3.92Å; F228-N294 HydrophobicContact CE1-CB 3.73Å; F228-N294 HydrophobicContact CZ-CB 3.99Å; F228-N294 WeakPolarHBondContact CZ-O 3.41Å; F228-H295 AromaticContact CE2-ND1 3.89Å; F228-F298 HydrophobicContact CD1-CE2 4.11Å; F228-F298 HydrophobicContact CD2-CD2 4.42Å; F228-F298 HydrophobicContact CD2-CE2 4.17Å; F228-F298 HydrophobicContact CE1-CD2 4.32Å; F228-F298 AromaticContact CE1-CE2 3.83Å; F228-F298 HydrophobicContact CE1-CE2 3.83Å; F228-F298 AromaticContact CE2-CD2 3.8Å; F228-F298 HydrophobicContact CE2-CD2 3.8Å; F228-F298 AromaticContact CE2-CE2 3.89Å; F228-F298 HydrophobicContact CE2-CE2 3.89Å; F228-F298 HydrophobicContact CG-CE2 4.27Å; F228-F298 AromaticContact CZ-CD2 3.74Å; F228-F298 HydrophobicContact CZ-CD2 3.74Å; F228-F298 AromaticContact CZ-CE2 3.71Å; F228-F298 HydrophobicContact CZ-CE2 3.71Å
229	F	98.2	Very high	96.9	Very high	1 Å²	1	10.3 Å²	10.3	0%	0.004	6%	0.064	C	C	.	.	H	α-helix	trans	-65.4	-24.7	-175.5	-167.4	-112.4	0	0	0	112.6	Y221 Q224 D226 P227 Y231 F232 L233 F276 A279 Q280	Y221-F229 HydrophobicContact CD2-CB 4.33Å; Y221-F229 AromaticContact CD2-CD1 3.98Å; Y221-F229 HydrophobicContact CD2-CD1 3.98Å; Y221-F229 HydrophobicContact CE2-CB 3.79Å; Y221-F229 HydrophobicContact CE2-CD1 4.22Å; Q224-F229 VanDerWaalsContact NE2-CE2 3.34Å; Q224-F229 VanDerWaalsContact OE1-CE1 3.23Å; D226-F229 HydrophobicContact CB-CB 4.07Å; D226-F229 WeakPolarHBondContact O-CB 3.32Å; D226-F229 PolarHBondContact O-N 3Å; D226-F229 VanDerWaalsContact O-N 3.07Å; P227-F229 VanDerWaalsContact C-N 3.31Å; F229-Y231 PolarHBondContact O-N 3.41Å; F229-F232 HydrophobicContact CD2-CB 4.46Å; F229-F232 HydrophobicContact CD2-CD2 4.11Å; F229-F232 PolarHBondContact O-N 2.82Å; F229-L233 HydrophobicContact CD1-CD1 4.07Å; F229-L233 HydrophobicContact CD1-CD2 4.4Å; F229-L233 HydrophobicContact CD1-CG 4.04Å; F229-L233 HydrophobicContact CE1-CD1 4.24Å; F229-L233 HydrophobicContact CE1-CD2 3.81Å; F229-L233 HydrophobicContact CE1-CG 3.95Å; F229-L233 HydrophobicContact CZ-CD2 4.42Å; F229-L233 PolarHBondContact O-N 3.12Å; F229-L233 VanDerWaalsContact O-N 3.13Å; F229-F276 HydrophobicContact CD1-CE1 4.26Å; F229-F276 AromaticContact CE1-CD1 3.54Å; F229-F276 HydrophobicContact CE1-CD1 3.54Å; F229-F276 AromaticContact CE1-CE1 3.6Å; F229-F276 HydrophobicContact CE1-CE1 3.6Å; F229-F276 HydrophobicContact CE1-CG 4.25Å; F229-F276 HydrophobicContact CE1-CZ 4.35Å; F229-F276 HydrophobicContact CZ-CD1 4.11Å; F229-A279 HydrophobicContact CE1-CB 4.2Å; F229-A279 HydrophobicContact CE2-CB 3.79Å; F229-A279 HydrophobicContact CZ-CB 3.47Å; F229-A279 VanDerWaalsContact CZ-CB 3.47Å; F229-Q280 HydrophobicContact CE2-CG 3.9Å; F229-Q280 HydrophobicContact CZ-CG 3.89Å
230	I	98.2	Very high	96.8	Very high	2 Å²	2	14.9 Å²	14.9	1%	0.01	9%	0.088	C	C	.	.	H	α-helix	trans	-59.3	-35.1	176.6	-171.9	60.7	0	0	0	111.9	L201 L204 F205 Y221 P227 F228 F232 L233 M234	L201-I230 HydrophobicContact CD1-CB 4.33Å; L201-I230 HydrophobicContact CD1-CG1 3.81Å; L201-I230 HydrophobicContact CD1-CG2 3.52Å; L204-I230 HydrophobicContact CD2-CD1 4.02Å; L204-I230 HydrophobicContact CD2-CG1 4Å; F205-I230 HydrophobicContact CD2-CD1 3.89Å; F205-I230 HydrophobicContact CE2-CD1 3.27Å; F205-I230 HydrophobicContact CZ-CD1 3.77Å; Y221-I230 HydrophobicContact CE2-CB 4Å; Y221-I230 WeakPolarHBondContact OH-CB 3.35Å; P227-I230 WeakPolarHBondContact O-CG2 3.45Å; F228-I230 PolarHBondContact O-N 3.46Å; I230-F232 VanDerWaalsContact C-N 3.28Å; I230-F232 PolarHBondContact O-N 2.68Å; I230-L233 HydrophobicContact CD1-CD1 4.4Å; I230-L233 PolarHBondContact O-N 3.18Å; I230-M234 HydrophobicContact CD1-CG 4.48Å; I230-M234 HydrophobicContact CG1-CG 4.29Å; I230-M234 HydrophobicContact CG1-SD 3.96Å; I230-M234 WeakPolarHBondContact O-CB 3.3Å; I230-M234 WeakPolarHBondContact O-CG 2.79Å; I230-M234 PolarHBondContact O-N 3.21Å
231	Y	98.6	Very high	96.7	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-63.8	-35	177.9	-68.3	-72.2	0	0	0	112.3	P167 L170 F171 L201 F228 F229 L235 F290 F298	P167-Y231 WeakPolarHBondContact CA-OH 3.27Å; P167-Y231 WeakPolarHBondContact CB-OH 3.41Å; P167-Y231 VanDerWaalsContact O-CE1 3.31Å; P167-Y231 WeakPolarHBondContact O-CE1 3.45Å; P167-Y231 PolarHBondContact O-OH 3.42Å; L170-Y231 HydrophobicContact CD2-CE2 4.04Å; F171-Y231 HydrophobicContact CB-CD1 3.78Å; F171-Y231 HydrophobicContact CB-CE1 3.94Å; F171-Y231 HydrophobicContact CD2-CD1 4.02Å; F171-Y231 WeakPolarHBondContact CE2-O 3.34Å; F171-Y231 HydrophobicContact CG-CD1 4.13Å; L201-Y231 HydrophobicContact CD2-CE1 4.32Å; F228-Y231 HydrophobicContact CB-CD2 4.35Å; F228-Y231 HydrophobicContact CD1-CD2 4.01Å; F228-Y231 AromaticContact CD1-CE2 3.91Å; F228-Y231 HydrophobicContact CD1-CE2 3.91Å; F228-Y231 HydrophobicContact CE1-CE2 4.4Å; F228-Y231 WeakPolarHBondContact O-CB 3.46Å; F228-Y231 WeakPolarHBondContact O-CD2 3Å; F228-Y231 PolarHBondContact O-N 3.48Å; F228-Y231 VanDerWaalsContact O-N 3.15Å; F229-Y231 PolarHBondContact O-N 3.41Å; Y231-L235 WeakPolarHBondContact O-CB 3.26Å; Y231-L235 PolarHBondContact O-N 3.17Å; Y231-F290 HydrophobicContact CD2-CE1 4.09Å; Y231-F290 AromaticContact CD2-CZ 3.99Å; Y231-F290 HydrophobicContact CD2-CZ 3.99Å; Y231-F290 HydrophobicContact CG-CE1 4.38Å; Y231-F290 AromaticContact CG-CZ 3.97Å; Y231-F290 HydrophobicContact CG-CZ 3.97Å; Y231-F298 HydrophobicContact CE2-CE2 4.16Å; Y231-F298 HydrophobicContact CE2-CZ 4.01Å
232	F	98.7	Very high	96.4	Very high	2 Å²	2	16.3 Å²	16.3	1%	0.009	9%	0.089	C	C	.	.	H	α-helix	trans	-75.3	-39.2	176.5	-59.1	-71	0	0	0	111.3	L174 F229 I230 M234 L235 I236 A279 C283 T286 F290	L174-F232 HydrophobicContact CD1-CD1 4.47Å; L174-F232 HydrophobicContact CD1-CE1 3.78Å; L174-F232 HydrophobicContact CD1-CZ 4.46Å; L174-F232 HydrophobicContact CD2-CD1 3.96Å; L174-F232 HydrophobicContact CD2-CE1 3.92Å; L174-F232 HydrophobicContact CG-CE1 4.48Å; F229-F232 HydrophobicContact CD2-CB 4.46Å; F229-F232 HydrophobicContact CD2-CD2 4.11Å; F229-F232 PolarHBondContact O-N 2.82Å; I230-F232 VanDerWaalsContact C-N 3.28Å; I230-F232 PolarHBondContact O-N 2.68Å; F232-M234 VanDerWaalsContact C-N 3.34Å; F232-M234 PolarHBondContact O-N 3.34Å; F232-L235 WeakPolarHBondContact O-CB 3.41Å; F232-L235 PolarHBondContact O-N 3.37Å; F232-I236 WeakPolarHBondContact O-CG1 3.44Å; F232-I236 PolarHBondContact O-N 3.5Å; F232-A279 HydrophobicContact CB-CB 3.82Å; F232-C283 HydrophobicContact CD1-CB 4.15Å; F232-C283 HydrophobicContact CD2-CB 3.87Å; F232-C283 HydrophobicContact CE1-CB 4.14Å; F232-C283 HydrophobicContact CE2-CB 3.86Å; F232-C283 HydrophobicContact CG-CB 4.03Å; F232-C283 HydrophobicContact CZ-CB 4.01Å; F232-T286 HydrophobicContact CE1-CG2 4.12Å; F232-T286 VanDerWaalsContact CE1-OG1 3.3Å; F232-T286 WeakPolarHBondContact CE1-OG1 3.4Å; F232-T286 HydrophobicContact CZ-CG2 4.03Å; F232-F290 HydrophobicContact CE2-CD1 4.42Å; F232-F290 HydrophobicContact CE2-CE1 4.25Å; F232-F290 HydrophobicContact CZ-CD1 4.06Å; F232-F290 HydrophobicContact CZ-CE1 4.08Å
233	L	98.6	Very high	96.1	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-59.3	-46.1	172.3	-64.2	174.1	0	0	0	111.3	F205 I217 Y221 F229 I230 L235 I236 I237 L275 F276 A279	F205-L233 HydrophobicContact CE2-CB 3.79Å; F205-L233 HydrophobicContact CE2-CD1 4.26Å; F205-L233 HydrophobicContact CZ-CB 4.04Å; I217-L233 HydrophobicContact CG2-CD1 4.32Å; Y221-L233 HydrophobicContact CD2-CD1 3.96Å; Y221-L233 HydrophobicContact CE2-CD1 4.39Å; F229-L233 HydrophobicContact CD1-CD1 4.07Å; F229-L233 HydrophobicContact CD1-CD2 4.4Å; F229-L233 HydrophobicContact CD1-CG 4.04Å; F229-L233 HydrophobicContact CE1-CD1 4.24Å; F229-L233 HydrophobicContact CE1-CD2 3.81Å; F229-L233 HydrophobicContact CE1-CG 3.95Å; F229-L233 HydrophobicContact CZ-CD2 4.42Å; F229-L233 PolarHBondContact O-N 3.12Å; F229-L233 VanDerWaalsContact O-N 3.13Å; I230-L233 HydrophobicContact CD1-CD1 4.4Å; I230-L233 PolarHBondContact O-N 3.18Å; L233-L235 VanDerWaalsContact C-N 3.31Å; L233-L235 PolarHBondContact O-N 3.13Å; L233-I236 PolarHBondContact O-N 2.81Å; L233-I237 WeakPolarHBondContact O-CG1 3.31Å; L233-I237 PolarHBondContact O-N 2.69Å; L233-L275 HydrophobicContact CD2-CD1 4.23Å; L233-L275 HydrophobicContact CD2-CD2 4.12Å; L233-L275 HydrophobicContact CD2-CG 3.75Å; L233-F276 HydrophobicContact CD1-CE2 4.5Å; L233-F276 HydrophobicContact CD1-CZ 4.3Å; L233-F276 HydrophobicContact CD2-CD2 4.05Å; L233-F276 HydrophobicContact CD2-CE2 4Å; L233-F276 HydrophobicContact CD2-CG 4.47Å; L233-F276 HydrophobicContact CD2-CZ 4.36Å; L233-A279 HydrophobicContact CD2-CB 3.88Å; L233-A279 HydrophobicContact CG-CB 4.45Å
234	M	98.6	Very high	95.9	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.5	-39.3	175.1	-66.7	163.9	68.7	0	0	111.8	F171 A197 W200 L201 F205 I230 F232 I237 L238	F171-M234 HydrophobicContact CD1-CE 3.5Å; F171-M234 VanDerWaalsContact CD1-CE 3.5Å; F171-M234 HydrophobicContact CE1-CB 4.03Å; F171-M234 HydrophobicContact CE1-CE 3.6Å; F171-M234 HydrophobicContact CE2-CB 3.78Å; F171-M234 HydrophobicContact CG-CE 4.07Å; F171-M234 HydrophobicContact CZ-CB 3.49Å; F171-M234 VanDerWaalsContact CZ-CB 3.49Å; F171-M234 HydrophobicContact CZ-CE 4.21Å; A197-M234 HydrophobicContact CB-CE 3.53Å; W200-M234 HydrophobicContact CB-CE 4.43Å; W200-M234 HydrophobicContact CB-CG 4.31Å; W200-M234 HydrophobicContact CE3-CB 4.05Å; W200-M234 HydrophobicContact CE3-CE 4.39Å; W200-M234 HydrophobicContact CE3-CG 4.03Å; W200-M234 HydrophobicContact CZ3-CB 4.44Å; L201-M234 HydrophobicContact CB-CE 4.2Å; L201-M234 HydrophobicContact CB-SD 4.16Å; L201-M234 HydrophobicContact CD1-SD 4.12Å; F205-M234 HydrophobicContact CE1-CG 3.99Å; F205-M234 HydrophobicContact CZ-CB 4.41Å; F205-M234 HydrophobicContact CZ-CG 3.63Å; I230-M234 HydrophobicContact CD1-CG 4.48Å; I230-M234 HydrophobicContact CG1-CG 4.29Å; I230-M234 HydrophobicContact CG1-SD 3.96Å; I230-M234 WeakPolarHBondContact O-CB 3.3Å; I230-M234 WeakPolarHBondContact O-CG 2.79Å; I230-M234 PolarHBondContact O-N 3.21Å; F232-M234 VanDerWaalsContact C-N 3.34Å; F232-M234 PolarHBondContact O-N 3.34Å; M234-I237 PolarHBondContact O-N 3.14Å; M234-L238 WeakPolarHBondContact O-CB 3.35Å; M234-L238 PolarHBondContact O-N 2.95Å
235	L	98.6	Very high	95.7	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-60.6	-48.4	177.2	179.3	63.3	0	0	0	110.9	F171 L174 I175 H178 Y231 F232 L233 I237 L238 V239 Y282	F171-L235 HydrophobicContact CE2-CB 4.14Å; L174-L235 HydrophobicContact CD2-CD2 4.34Å; L174-L235 HydrophobicContact CG-CD2 4.25Å; I175-L235 HydrophobicContact CG1-CD1 4.09Å; H178-L235 HydrophobicContact CB-CD2 4.17Å; Y231-L235 WeakPolarHBondContact O-CB 3.26Å; Y231-L235 PolarHBondContact O-N 3.17Å; F232-L235 WeakPolarHBondContact O-CB 3.41Å; F232-L235 PolarHBondContact O-N 3.37Å; L233-L235 VanDerWaalsContact C-N 3.31Å; L233-L235 PolarHBondContact O-N 3.13Å; L235-I237 PolarHBondContact O-N 3.23Å; L235-L238 WeakPolarHBondContact O-CB 3.24Å; L235-L238 PolarHBondContact O-N 3.04Å; L235-L238 VanDerWaalsContact O-N 3.16Å; L235-V239 HydrophobicContact CD1-CG2 3.9Å; L235-V239 HydrophobicContact CG-CG2 4.05Å; L235-V239 WeakPolarHBondContact O-CG2 3.47Å; L235-V239 PolarHBondContact O-N 3.36Å; L235-Y282 HydrophobicContact CD2-CD1 3.58Å; L235-Y282 HydrophobicContact CD2-CE1 4.17Å; L235-Y282 HydrophobicContact CD2-CG 4.08Å
236	I	98.3	Very high	95.2	Very high	3 Å²	3	23.3 Å²	23.3	2%	0.015	13%	0.13	C	C	.	.	H	α-helix	trans	-62.1	-44.6	-179.2	-58.6	-45.6	0	0	0	111.4	F232 L233 L238 V239 N240 L275 L278 A279 Y282	F232-I236 WeakPolarHBondContact O-CG1 3.44Å; F232-I236 PolarHBondContact O-N 3.5Å; L233-I236 PolarHBondContact O-N 2.81Å; I236-L238 PolarHBondContact O-N 3.04Å; I236-V239 PolarHBondContact O-N 2.73Å; I236-N240 WeakPolarHBondContact O-CB 3.35Å; I236-N240 VanDerWaalsContact O-CG 3.23Å; I236-N240 PolarHBondContact O-N 2.73Å; I236-N240 PolarHBondContact O-ND2 3.21Å; I236-L275 HydrophobicContact CB-CD1 3.67Å; I236-L275 HydrophobicContact CG1-CD1 4.37Å; I236-L275 HydrophobicContact CG2-CD1 3.67Å; I236-L278 HydrophobicContact CD1-CB 3.82Å; I236-L278 HydrophobicContact CG1-CB 3.92Å; I236-L278 HydrophobicContact CG2-CB 4.2Å; I236-L278 HydrophobicContact CG2-CD1 4.02Å; I236-A279 HydrophobicContact CG1-CB 4.14Å; I236-Y282 HydrophobicContact CD1-CD2 3.37Å; I236-Y282 HydrophobicContact CD1-CE2 3.61Å; I236-Y282 HydrophobicContact CD1-CG 4.07Å
237	I	97.3	Very high	94.7	Very high	7 Å²	7	26.2 Å²	26.2	4%	0.036	16%	0.157	C	C	.	.	H	α-helix	trans	-57.7	-42.1	176.5	-66.6	169.8	0	0	0	110.4	W200 F205 L233 M234 L235 T241 T263 P264 L267 L275	W200-I237 HydrophobicContact CH2-CG2 3.81Å; W200-I237 HydrophobicContact CZ2-CG2 4.23Å; W200-I237 HydrophobicContact CZ3-CB 4.45Å; W200-I237 HydrophobicContact CZ3-CG2 4.17Å; F205-I237 HydrophobicContact CD1-CD1 4Å; F205-I237 HydrophobicContact CE1-CD1 3.4Å; F205-I237 HydrophobicContact CE2-CD1 4.26Å; F205-I237 HydrophobicContact CZ-CD1 3.55Å; L233-I237 WeakPolarHBondContact O-CG1 3.31Å; L233-I237 PolarHBondContact O-N 2.69Å; M234-I237 PolarHBondContact O-N 3.14Å; L235-I237 PolarHBondContact O-N 3.23Å; I237-T241 WeakPolarHBondContact O-CG2 3.45Å; I237-T263 WeakPolarHBondContact CG2-OG1 3.33Å; I237-P264 HydrophobicContact CD1-CB 4.29Å; I237-P264 HydrophobicContact CD1-CG 4.35Å; I237-P264 HydrophobicContact CG2-CG 4.25Å; I237-L267 HydrophobicContact CD1-CD1 3.92Å; I237-L267 HydrophobicContact CG1-CD1 4.24Å; I237-L275 HydrophobicContact CG1-CD1 4.25Å
238	L	97.6	Very high	93.9	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-68.3	-46.2	177.5	-177.6	64.4	0	0	0	112.3	F171 I175 L182 L186 Y196 M234 L235 I236 N240 T241 L260	F171-L238 HydrophobicContact CZ-CD2 4.33Å; I175-L238 HydrophobicContact CD1-CD2 3.4Å; I175-L238 VanDerWaalsContact CD1-CD2 3.4Å; I175-L238 HydrophobicContact CG1-CD2 3.78Å; I175-L238 HydrophobicContact CG2-CD2 4.15Å; L182-L238 HydrophobicContact CD2-CD2 4.27Å; L182-L238 HydrophobicContact CD2-CG 3.93Å; L186-L238 HydrophobicContact CD1-CD1 4.48Å; L186-L238 HydrophobicContact CD1-CD2 4.23Å; Y196-L238 HydrophobicContact CE2-CD1 4.15Å; Y196-L238 WeakPolarHBondContact OH-CD2 3.12Å; M234-L238 WeakPolarHBondContact O-CB 3.35Å; M234-L238 PolarHBondContact O-N 2.95Å; L235-L238 WeakPolarHBondContact O-CB 3.24Å; L235-L238 PolarHBondContact O-N 3.04Å; L235-L238 VanDerWaalsContact O-N 3.16Å; I236-L238 PolarHBondContact O-N 3.04Å; L238-N240 VanDerWaalsContact C-N 3.27Å; L238-N240 PolarHBondContact O-N 3.42Å; L238-T241 PolarHBondContact O-N 3.18Å; L238-T241 PolarHBondContact O-OG1 3.05Å; L238-L260 HydrophobicContact CD1-CD1 4.48Å; L238-L260 HydrophobicContact CD1-CD2 3.48Å; L238-L260 VanDerWaalsContact CD1-CD2 3.48Å
239	V	96.1	Very high	92.8	Very high	27 Å²	27	35 Å²	35	16%	0.164	20%	0.197	C	C	.	.	H	α-helix	trans	-59.8	-38.8	179.3	176.2	0	0	0	0	111.1	E179 L235 I236 T241 K242	E179-V239 HydrophobicContact CG-CG2 3.65Å; L235-V239 HydrophobicContact CD1-CG2 3.9Å; L235-V239 HydrophobicContact CG-CG2 4.05Å; L235-V239 WeakPolarHBondContact O-CG2 3.47Å; L235-V239 PolarHBondContact O-N 3.36Å; I236-V239 PolarHBondContact O-N 2.73Å; V239-T241 PolarHBondContact O-N 3.45Å; V239-K242 WeakPolarHBondContact O-CB 3.45Å; V239-K242 PolarHBondContact O-N 3.2Å
240	N	94.3	Very high	91.8	Very high	107 Å²	107	40.3 Å²	40.3	57%	0.572	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-18.4	176.8	-73.6	-12.3	0	0	0	113.3	I236 L238	I236-N240 WeakPolarHBondContact O-CB 3.35Å; I236-N240 VanDerWaalsContact O-CG 3.23Å; I236-N240 PolarHBondContact O-N 2.73Å; I236-N240 PolarHBondContact O-ND2 3.21Å; L238-N240 VanDerWaalsContact C-N 3.27Å; L238-N240 PolarHBondContact O-N 3.42Å
241	T	92.9	Very high	91.2	Very high	10 Å²	10	42.6 Å²	42.6	6%	0.061	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-4.8	179.2	70.1	0	0	0	0	113.7	I237 L238 V239 D243 V244 I245 F259 T263	I237-T241 WeakPolarHBondContact O-CG2 3.45Å; L238-T241 PolarHBondContact O-N 3.18Å; L238-T241 PolarHBondContact O-OG1 3.05Å; V239-T241 PolarHBondContact O-N 3.45Å; T241-D243 PolarHBondContact O-N 3.29Å; T241-V244 PolarHBondContact O-N 3.38Å; T241-V244 VanDerWaalsContact O-N 3.11Å; T241-I245 WeakPolarHBondContact O-CG1 3.27Å; T241-I245 PolarHBondContact O-N 3.02Å; T241-I245 WeakPolarHBondContact OG1-CD1 3.39Å; T241-F259 HydrophobicContact CG2-CE1 4.24Å; T241-F259 HydrophobicContact CG2-CZ 4.41Å; T241-T263 HydrophobicContact CG2-CG2 3.4Å; T241-T263 VanDerWaalsContact CG2-CG2 3.4Å
242	K	91.9	Very high	90.8	Very high	47 Å²	47	44.8 Å²	44.8	20%	0.204	26%	0.262	C	S	.	.	H	α-helix	trans	-51	-54.5	-174.3	179.8	178.9	179.2	174.6	0	112.2	E179 L182 V239 V244 I245 S246	E179-K242 IonicContact OE2-NZ 3.39Å; E179-K242 PolarHBondContact OE2-NZ 3.21Å; L182-K242 HydrophobicContact CD2-CB 4.39Å; V239-K242 WeakPolarHBondContact O-CB 3.45Å; V239-K242 PolarHBondContact O-N 3.2Å; K242-V244 VanDerWaalsContact C-N 3.28Å; K242-V244 PolarHBondContact O-N 3.04Å; K242-I245 PolarHBondContact O-N 2.84Å; K242-S246 WeakPolarHBondContact O-CB 3.41Å; K242-S246 PolarHBondContact O-N 3.19Å; K242-S246 PolarHBondContact O-OG 2.96Å
243	D	90	Very high	90.4	Very high	136 Å²	136	48.5 Å²	48.5	73%	0.727	28%	0.278	S	S	*	.	H	α-helix	trans	-62.9	-35.1	-177	-68.5	-25.5	0	0	0	112.5	T241 A247	T241-D243 PolarHBondContact O-N 3.29Å; D243-A247 WeakPolarHBondContact O-CB 3.33Å; D243-A247 PolarHBondContact O-N 2.66Å; D243-A247 VanDerWaalsContact O-N 3.11Å
244	V	89.7	Confident	90.1	Very high	60 Å²	60	54.6 Å²	54.6	36%	0.364	31%	0.306	S	S	.	.	H	α-helix	trans	-69.3	-44.3	178.6	-178.8	0	0	0	0	110.7	T241 K242 A247 Q248 F259	T241-V244 PolarHBondContact O-N 3.38Å; T241-V244 VanDerWaalsContact O-N 3.11Å; K242-V244 VanDerWaalsContact C-N 3.28Å; K242-V244 PolarHBondContact O-N 3.04Å; V244-A247 PolarHBondContact O-N 3.43Å; V244-Q248 WeakPolarHBondContact O-CB 3.22Å; V244-Q248 VanDerWaalsContact O-CG 3.3Å; V244-Q248 WeakPolarHBondContact O-CG 3.19Å; V244-Q248 PolarHBondContact O-N 3.49Å; V244-F259 HydrophobicContact CB-CE1 4.46Å; V244-F259 HydrophobicContact CB-CZ 4.31Å; V244-F259 HydrophobicContact CG1-CE1 4.06Å; V244-F259 HydrophobicContact CG1-CE2 4.46Å; V244-F259 HydrophobicContact CG1-CZ 3.78Å
245	I	89.1	Confident	89.7	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-71.3	-40.7	-177.9	-67.1	169.1	0	0	0	110.9	F185 T241 K242 A247 Q248 I256 F259 L260	F185-I245 HydrophobicContact CD1-CG2 3.79Å; F185-I245 HydrophobicContact CE1-CG2 3.16Å; F185-I245 HydrophobicContact CZ-CG2 3.75Å; T241-I245 WeakPolarHBondContact O-CG1 3.27Å; T241-I245 PolarHBondContact O-N 3.02Å; T241-I245 WeakPolarHBondContact OG1-CD1 3.39Å; K242-I245 PolarHBondContact O-N 2.84Å; I245-A247 VanDerWaalsContact C-N 3.27Å; I245-A247 PolarHBondContact O-N 2.87Å; I245-Q248 PolarHBondContact O-N 3.15Å; I245-Q248 VanDerWaalsContact O-N 3.12Å; I245-I256 HydrophobicContact CG2-CG2 4.24Å; I245-F259 HydrophobicContact CD1-CE1 4.41Å; I245-F259 HydrophobicContact CG1-CD1 4.28Å; I245-F259 HydrophobicContact CG1-CE1 4.04Å; I245-L260 HydrophobicContact CD1-CD1 4.19Å; I245-L260 HydrophobicContact CD1-CD2 3.37Å; I245-L260 HydrophobicContact CD1-CG 3.84Å
246	S	83.8	Confident	89.5	Confident	48 Å²	48	60 Å²	60	34%	0.336	33%	0.331	S	S	.	.	H	α-helix	trans	-64.2	-30.5	174.4	-67	0	0	0	0	112.5	K242 Q248 E249	K242-S246 WeakPolarHBondContact O-CB 3.41Å; K242-S246 PolarHBondContact O-N 3.19Å; K242-S246 PolarHBondContact O-OG 2.96Å; S246-Q248 VanDerWaalsContact C-N 3.32Å; S246-E249 VanDerWaalsContact O-CG 3.24Å; S246-E249 WeakPolarHBondContact O-CG 3.44Å
247	A	85.6	Confident	89.2	Confident	84 Å²	84	60.5 Å²	60.5	69%	0.694	34%	0.335	S	S	*	.	H	α-helix	trans	-76.5	-18.3	174.6	0	0	0	0	0	113.6	D243 V244 I245	D243-A247 WeakPolarHBondContact O-CB 3.33Å; D243-A247 PolarHBondContact O-N 2.66Å; D243-A247 VanDerWaalsContact O-N 3.11Å; V244-A247 PolarHBondContact O-N 3.43Å; I245-A247 VanDerWaalsContact C-N 3.27Å; I245-A247 PolarHBondContact O-N 2.87Å
248	Q	79.3	Confident	89	Confident	68 Å²	68	65.9 Å²	65.9	32%	0.318	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	36.9	-172.8	-69.9	-177.3	10.2	0	0	112.9	V244 I245 S246 S250 N251	V244-Q248 WeakPolarHBondContact O-CB 3.22Å; V244-Q248 VanDerWaalsContact O-CG 3.3Å; V244-Q248 WeakPolarHBondContact O-CG 3.19Å; V244-Q248 PolarHBondContact O-N 3.49Å; I245-Q248 PolarHBondContact O-N 3.15Å; I245-Q248 VanDerWaalsContact O-N 3.12Å; S246-Q248 VanDerWaalsContact C-N 3.32Å; Q248-S250 PolarHBondContact O-N 3.38Å; Q248-N251 HydrophobicContact CB-CB 4.46Å; Q248-N251 WeakPolarHBondContact O-CB 3.4Å; Q248-N251 PolarHBondContact O-N 2.96Å; Q248-N251 PolarHBondContact OE1-ND2 3.28Å
249	E	73.6	Confident	88.9	Confident	133 Å²	133	69.4 Å²	69.4	62%	0.621	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-24.9	-176.4	-56.2	-167.3	148.1	0	0	113.9	F185 K189 S246 N251	F185-E249 HydrophobicContact CE2-CG 4.17Å; K189-E249 PolarHBondContact NZ-O 2.92Å; S246-E249 VanDerWaalsContact O-CG 3.24Å; S246-E249 WeakPolarHBondContact O-CG 3.44Å; E249-N251 VanDerWaalsContact C-N 3.31Å; E249-N251 PolarHBondContact O-N 3.17Å
250	S	77.1	Confident	88.8	Confident	112 Å²	112	68.1 Å²	68.1	78%	0.783	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	-17.3	177.1	54.8	0	0	0	0	114.7	Q248	Q248-S250 PolarHBondContact O-N 3.38Å
251	N	85.3	Confident	88.9	Confident	51 Å²	51	65.7 Å²	65.7	27%	0.273	35%	0.353	S	S	.	.	S	Bend	trans	-72.5	149.4	-174.5	-68.8	6.3	0	0	0	111.2	K189 Q248 E249 E255 I256	K189-N251 PolarHBondContact NZ-O 3.29Å; Q248-N251 HydrophobicContact CB-CB 4.46Å; Q248-N251 WeakPolarHBondContact O-CB 3.4Å; Q248-N251 PolarHBondContact O-N 2.96Å; Q248-N251 PolarHBondContact OE1-ND2 3.28Å; E249-N251 VanDerWaalsContact C-N 3.31Å; E249-N251 PolarHBondContact O-N 3.17Å; N251-E255 HydrophobicContact CB-CB 4.46Å; N251-I256 HydrophobicContact CB-CD1 4.23Å; N251-I256 HydrophobicContact CB-CG1 3.98Å
252	S	89.7	Confident	89	Confident	46 Å²	46	67.9 Å²	67.9	32%	0.322	37%	0.365	S	S	.	.			trans	-66.4	160.5	179.3	63.4	0	0	0	0	111.6	E254 E255 I256	S252-E254 PolarHBondContact O-N 3.26Å; S252-E255 PolarHBondContact N-OE2 3.2Å; S252-E255 PolarHBondContact O-N 3.09Å; S252-E255 WeakPolarHBondContact OG-CB 3.23Å; S252-E255 WeakPolarHBondContact OG-CG 3.49Å; S252-E255 PolarHBondContact OG-N 3.01Å; S252-E255 PolarHBondContact OG-OE2 3.32Å; S252-I256 WeakPolarHBondContact O-CG1 3.48Å; S252-I256 PolarHBondContact O-N 3.25Å
253	K	90.9	Very high	89.2	Confident	80 Å²	80	66.5 Å²	66.5	35%	0.348	36%	0.36	S	S	.	.	H	α-helix	trans	-56.7	-42.5	177.6	176.6	-173.5	162.3	167.9	0	110.8	K190 I191 S257	K190-K253 WeakPolarHBondContact O-CE 3.31Å; K190-K253 PolarHBondContact O-NZ 3.07Å; I191-K253 HydrophobicContact CD1-CG 4.36Å; I191-K253 HydrophobicContact CG1-CG 3.69Å; K253-S257 WeakPolarHBondContact O-CB 3.31Å; K253-S257 PolarHBondContact O-N 3.15Å; K253-S257 PolarHBondContact O-OG 3.02Å
254	E	91.8	Very high	89.5	Confident	128 Å²	128	60 Å²	60	60%	0.598	33%	0.325	S	S	*	.	H	α-helix	trans	-68.6	-42.3	-175.4	-65.2	68.8	-151.7	0	0	111.4	S252 S257 H258	S252-E254 PolarHBondContact O-N 3.26Å; E254-S257 PolarHBondContact O-N 3.26Å; E254-H258 WeakPolarHBondContact O-CB 3.47Å; E254-H258 PolarHBondContact O-N 3.38Å
255	E	91.7	Very high	89.7	Confident	111 Å²	111	60.1 Å²	60.1	52%	0.519	33%	0.329	S	S	.	.	H	α-helix	trans	-63.3	-44.2	176.4	-73.9	162.4	162.1	0	0	111.9	N251 S252 H258 F259	N251-E255 HydrophobicContact CB-CB 4.46Å; S252-E255 PolarHBondContact N-OE2 3.2Å; S252-E255 PolarHBondContact O-N 3.09Å; S252-E255 WeakPolarHBondContact OG-CB 3.23Å; S252-E255 WeakPolarHBondContact OG-CG 3.49Å; S252-E255 PolarHBondContact OG-N 3.01Å; S252-E255 PolarHBondContact OG-OE2 3.32Å; E255-H258 PolarHBondContact O-N 3.31Å; E255-F259 WeakPolarHBondContact O-CB 3.49Å; E255-F259 PolarHBondContact O-N 2.7Å
256	I	93	Very high	90	Very high	1 Å²	1	64.3 Å²	64.3	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-66.4	-41.9	178	-63.9	171.3	0	0	0	110.4	F185 K189 I191 I245 N251 S252 F259 L260	F185-I256 HydrophobicContact CE1-CD1 4.43Å; F185-I256 HydrophobicContact CZ-CD1 4.25Å; K189-I256 HydrophobicContact CD-CD1 3.75Å; I191-I256 HydrophobicContact CD1-CB 3.82Å; I191-I256 HydrophobicContact CD1-CD1 4.42Å; I191-I256 HydrophobicContact CD1-CG2 3.59Å; I245-I256 HydrophobicContact CG2-CG2 4.24Å; N251-I256 HydrophobicContact CB-CD1 4.23Å; N251-I256 HydrophobicContact CB-CG1 3.98Å; S252-I256 WeakPolarHBondContact O-CG1 3.48Å; S252-I256 PolarHBondContact O-N 3.25Å; I256-F259 PolarHBondContact O-N 2.79Å; I256-L260 HydrophobicContact CG2-CD1 4.02Å; I256-L260 HydrophobicContact CG2-CG 4.39Å; I256-L260 WeakPolarHBondContact O-CB 3.33Å; I256-L260 WeakPolarHBondContact O-CG 3.43Å; I256-L260 PolarHBondContact O-N 3.36Å
257	S	92.9	Very high	90.5	Very high	14 Å²	14	63.1 Å²	63.1	10%	0.098	35%	0.348	C	S	.	.	H	α-helix	trans	-62.8	-44.1	178.3	-56.8	0	0	0	0	111.3	K253 E254 L260 E261	K253-S257 WeakPolarHBondContact O-CB 3.31Å; K253-S257 PolarHBondContact O-N 3.15Å; K253-S257 PolarHBondContact O-OG 3.02Å; E254-S257 PolarHBondContact O-N 3.26Å; S257-L260 PolarHBondContact O-N 3.14Å; S257-E261 VanDerWaalsContact O-CB 3.3Å; S257-E261 WeakPolarHBondContact O-CB 3.35Å; S257-E261 PolarHBondContact O-N 3.04Å
258	H	92.8	Very high	91	Very high	121 Å²	121	63.2 Å²	63.2	56%	0.56	34%	0.337	S	S	*	.	H	α-helix	trans	-67.8	-38.9	177.4	-178.6	-83.2	0	0	0	112.4	E254 E255 N262	E254-H258 WeakPolarHBondContact O-CB 3.47Å; E254-H258 PolarHBondContact O-N 3.38Å; E255-H258 PolarHBondContact O-N 3.31Å; H258-N262 PolarHBondContact CE1-ND2 3.36Å; H258-N262 VanDerWaalsContact CE1-ND2 3.27Å; H258-N262 PolarHBondContact O-N 3.26Å; H258-N262 PolarHBondContact O-ND2 3.36Å
259	F	94.5	Very high	91.7	Very high	73 Å²	73	64.9 Å²	64.9	32%	0.32	35%	0.347	S	S	.	.	H	α-helix	trans	-59.4	-53.3	172.5	166.9	-105	0	0	0	110.3	T241 V244 I245 E255 I256 E261 N262 T263	T241-F259 HydrophobicContact CG2-CE1 4.24Å; T241-F259 HydrophobicContact CG2-CZ 4.41Å; V244-F259 HydrophobicContact CB-CE1 4.46Å; V244-F259 HydrophobicContact CB-CZ 4.31Å; V244-F259 HydrophobicContact CG1-CE1 4.06Å; V244-F259 HydrophobicContact CG1-CE2 4.46Å; V244-F259 HydrophobicContact CG1-CZ 3.78Å; I245-F259 HydrophobicContact CD1-CE1 4.41Å; I245-F259 HydrophobicContact CG1-CD1 4.28Å; I245-F259 HydrophobicContact CG1-CE1 4.04Å; E255-F259 WeakPolarHBondContact O-CB 3.49Å; E255-F259 PolarHBondContact O-N 2.7Å; I256-F259 PolarHBondContact O-N 2.79Å; F259-E261 PolarHBondContact O-N 3.28Å; F259-N262 PolarHBondContact O-N 3.22Å; F259-T263 HydrophobicContact CE1-CG2 4.24Å; F259-T263 HydrophobicContact CZ-CG2 4.23Å; F259-T263 WeakPolarHBondContact O-CG2 3.45Å; F259-T263 PolarHBondContact O-N 2.95Å
260	L	95.8	Very high	92.7	Very high	0 Å²	0	66 Å²	66	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-53.7	-55.3	178.5	-82.5	172.9	0	0	0	110.7	L186 I191 Y196 W200 L238 I245 I256 S257 N262 T263	L186-L260 HydrophobicContact CD2-CD1 4.12Å; I191-L260 HydrophobicContact CG2-CD1 4.27Å; Y196-L260 HydrophobicContact CD1-CD1 3.87Å; Y196-L260 HydrophobicContact CD2-CB 4.2Å; Y196-L260 HydrophobicContact CD2-CD1 4.42Å; Y196-L260 HydrophobicContact CE1-CD1 4.15Å; Y196-L260 HydrophobicContact CG-CB 3.94Å; Y196-L260 HydrophobicContact CG-CD1 4.01Å; W200-L260 VanDerWaalsContact CZ2-O 3.25Å; W200-L260 WeakPolarHBondContact CZ2-O 3.49Å; L238-L260 HydrophobicContact CD1-CD1 4.48Å; L238-L260 HydrophobicContact CD1-CD2 3.48Å; L238-L260 VanDerWaalsContact CD1-CD2 3.48Å; I245-L260 HydrophobicContact CD1-CD1 4.19Å; I245-L260 HydrophobicContact CD1-CD2 3.37Å; I245-L260 HydrophobicContact CD1-CG 3.84Å; I256-L260 HydrophobicContact CG2-CD1 4.02Å; I256-L260 HydrophobicContact CG2-CG 4.39Å; I256-L260 WeakPolarHBondContact O-CB 3.33Å; I256-L260 WeakPolarHBondContact O-CG 3.43Å; I256-L260 PolarHBondContact O-N 3.36Å; S257-L260 PolarHBondContact O-N 3.14Å; L260-N262 PolarHBondContact O-N 3.21Å; L260-T263 WeakPolarHBondContact O-CB 3.17Å; L260-T263 VanDerWaalsContact O-CG2 3.27Å; L260-T263 WeakPolarHBondContact O-CG2 3.3Å; L260-T263 PolarHBondContact O-N 2.87Å; L260-T263 PolarHBondContact O-OG1 3.27Å
261	E	95.6	Very high	93.6	Very high	56 Å²	56	63.4 Å²	63.4	26%	0.262	33%	0.33	S	S	.	.	H	α-helix	trans	-47.2	-40.5	-176.5	-174.8	177.2	-175.4	0	0	113.3	W200 Y208 S257 F259 P264	W200-E261 PolarHBondContact NE1-O 3.37Å; Y208-E261 HydrophobicContact CE1-CG 3.68Å; Y208-E261 WeakPolarHBondContact CE1-O 3.48Å; Y208-E261 HydrophobicContact CE2-CG 4.5Å; Y208-E261 VanDerWaalsContact CZ-CG 3.47Å; Y208-E261 VanDerWaalsContact OH-CD 3.29Å; Y208-E261 WeakPolarHBondContact OH-CG 3.42Å; Y208-E261 PolarHBondContact OH-OE1 3.12Å; S257-E261 VanDerWaalsContact O-CB 3.3Å; S257-E261 WeakPolarHBondContact O-CB 3.35Å; S257-E261 PolarHBondContact O-N 3.04Å; F259-E261 PolarHBondContact O-N 3.28Å; E261-P264 WeakPolarHBondContact O-CD 3.42Å
262	N	95.3	Very high	94.1	Very high	57 Å²	57	61.7 Å²	61.7	31%	0.305	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-5.1	-177.4	-69.4	-65.8	0	0	0	115	H258 F259 L260 S265	H258-N262 PolarHBondContact CE1-ND2 3.36Å; H258-N262 VanDerWaalsContact CE1-ND2 3.27Å; H258-N262 PolarHBondContact O-N 3.26Å; H258-N262 PolarHBondContact O-ND2 3.36Å; F259-N262 PolarHBondContact O-N 3.22Å; L260-N262 PolarHBondContact O-N 3.21Å; N262-S265 WeakPolarHBondContact O-CB 3.38Å; N262-S265 PolarHBondContact O-N 2.98Å; N262-S265 VanDerWaalsContact O-N 3.07Å; N262-S265 PolarHBondContact O-OG 3.5Å
263	T	95.3	Very high	94.3	Very high	17 Å²	17	67.2 Å²	67.2	10%	0.104	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-56.4	-37.1	-176.2	52.9	0	0	0	0	115.2	W200 I237 T241 F259 L260 S265 S266	W200-T263 WeakPolarHBondContact CZ2-OG1 3.31Å; I237-T263 WeakPolarHBondContact CG2-OG1 3.33Å; T241-T263 HydrophobicContact CG2-CG2 3.4Å; T241-T263 VanDerWaalsContact CG2-CG2 3.4Å; F259-T263 HydrophobicContact CE1-CG2 4.24Å; F259-T263 HydrophobicContact CZ-CG2 4.23Å; F259-T263 WeakPolarHBondContact O-CG2 3.45Å; F259-T263 PolarHBondContact O-N 2.95Å; L260-T263 WeakPolarHBondContact O-CB 3.17Å; L260-T263 VanDerWaalsContact O-CG2 3.27Å; L260-T263 WeakPolarHBondContact O-CG2 3.3Å; L260-T263 PolarHBondContact O-N 2.87Å; L260-T263 PolarHBondContact O-OG1 3.27Å; T263-S265 PolarHBondContact O-N 2.58Å; T263-S265 VanDerWaalsContact O-N 3.15Å; T263-S266 PolarHBondContact O-N 3.02Å; T263-S266 VanDerWaalsContact O-N 3.16Å
264	P	96.6	Very high	94.6	Very high	0 Å²	0	68.2 Å²	68.2	0%	0	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-65.4	-20.3	178.8	-16.8	30	0	0	0	113.6	W200 F205 Y208 C209 I237 E261 S266 L267	W200-P264 HydrophobicContact CD2-CG 4.09Å; W200-P264 HydrophobicContact CG-CG 4.2Å; W200-P264 HydrophobicContact CZ2-CG 3.99Å; W200-P264 VanDerWaalsContact NE1-CG 3.3Å; F205-P264 HydrophobicContact CD1-CB 4.02Å; F205-P264 HydrophobicContact CD1-CG 3.99Å; F205-P264 HydrophobicContact CE1-CG 4.38Å; Y208-P264 HydrophobicContact CD2-CG 4.44Å; C209-P264 PolarHBondContact SG-O 2.87Å; I237-P264 HydrophobicContact CD1-CB 4.29Å; I237-P264 HydrophobicContact CD1-CG 4.35Å; I237-P264 HydrophobicContact CG2-CG 4.25Å; E261-P264 WeakPolarHBondContact O-CD 3.42Å; P264-S266 PolarHBondContact O-N 3.39Å; P264-L267 HydrophobicContact CB-CD1 4.45Å; P264-L267 WeakPolarHBondContact O-CB 3.41Å; P264-L267 PolarHBondContact O-N 3.13Å
265	S	94.7	Very high	94.8	Very high	62 Å²	62	62.4 Å²	62.4	43%	0.434	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-68.1	-16.5	178	70.1	0	0	0	0	113.5	Y208 N262 T263	Y208-S265 WeakPolarHBondContact O-CA 3.45Å; Y208-S265 WeakPolarHBondContact O-CB 3.47Å; N262-S265 WeakPolarHBondContact O-CB 3.38Å; N262-S265 PolarHBondContact O-N 2.98Å; N262-S265 VanDerWaalsContact O-N 3.07Å; N262-S265 PolarHBondContact O-OG 3.5Å; T263-S265 PolarHBondContact O-N 2.58Å; T263-S265 VanDerWaalsContact O-N 3.15Å
266	S	94.1	Very high	95.1	Very high	88 Å²	88	58.2 Å²	58.2	62%	0.615	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-86.5	-5.1	178.7	-57.6	0	0	0	0	113.7	T263 P264 N268	T263-S266 PolarHBondContact O-N 3.02Å; T263-S266 VanDerWaalsContact O-N 3.16Å; P264-S266 PolarHBondContact O-N 3.39Å; S266-N268 PolarHBondContact O-ND2 3.28Å
267	L	95.9	Very high	95.3	Very high	24 Å²	24	61 Å²	61	13%	0.126	32%	0.323	C	S	.	.			trans	-72.3	137	178.6	-69	171	0	0	0	111.3	V213 I237 P264 D271 L275	V213-L267 HydrophobicContact CG1-CB 4Å; V213-L267 WeakPolarHBondContact CG2-O 3.16Å; I237-L267 HydrophobicContact CD1-CD1 3.92Å; I237-L267 HydrophobicContact CG1-CD1 4.24Å; P264-L267 HydrophobicContact CB-CD1 4.45Å; P264-L267 WeakPolarHBondContact O-CB 3.41Å; P264-L267 PolarHBondContact O-N 3.13Å; L267-D271 HydrophobicContact CD2-CB 4.2Å; L267-L275 HydrophobicContact CD1-CD2 4.21Å
268	N	95.7	Very high	95.5	Very high	86 Å²	86	63.6 Å²	63.6	46%	0.46	34%	0.335	S	S	.	.			trans	-111.6	169.8	173.5	-55	-71.2	0	0	0	110.8	S266 E270 D271	S266-N268 PolarHBondContact O-ND2 3.28Å; N268-E270 VanDerWaalsContact C-N 3.26Å; N268-E270 HydrophobicContact CB-CG 4.13Å; N268-E270 PolarHBondContact O-N 3.14Å; N268-D271 WeakPolarHBondContact CB-OD2 2.97Å; N268-D271 PolarHBondContact N-OD2 2.78Å; N268-D271 PolarHBondContact ND2-OD2 3.35Å; N268-D271 WeakPolarHBondContact O-CB 3.43Å; N268-D271 PolarHBondContact O-N 3.03Å; N268-D271 VanDerWaalsContact O-N 3.13Å
269	L	93.5	Very high	95.8	Very high	102 Å²	102	57.8 Å²	57.8	53%	0.534	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-33.3	-180	-74.5	174.3	0	0	0	113.3	E212 V213 A216 D271 I272	E212-L269 HydrophobicContact CB-CD1 4.13Å; E212-L269 HydrophobicContact CB-CD2 4.08Å; E212-L269 HydrophobicContact CB-CG 4.33Å; E212-L269 WeakPolarHBondContact O-CD2 3.42Å; V213-L269 HydrophobicContact CG2-CD2 4.27Å; V213-L269 HydrophobicContact CG2-CG 4.31Å; A216-L269 HydrophobicContact CB-CD2 3.84Å; L269-D271 VanDerWaalsContact C-N 3.26Å; L269-D271 PolarHBondContact O-N 3.04Å; L269-I272 PolarHBondContact O-N 2.72Å
270	E	94.6	Very high	95.9	Very high	158 Å²	158	59.2 Å²	59.2	74%	0.738	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-25.3	177.7	59	-170.5	171.4	0	0	112.9	N268 I272	N268-E270 VanDerWaalsContact C-N 3.26Å; N268-E270 HydrophobicContact CB-CG 4.13Å; N268-E270 PolarHBondContact O-N 3.14Å; E270-I272 VanDerWaalsContact C-N 3.32Å; E270-I272 PolarHBondContact O-N 3.02Å
271	D	95.9	Very high	95.9	Very high	56 Å²	56	65.1 Å²	65.1	30%	0.299	34%	0.339	S	S	.	.	H	α-helix	trans	-79.3	-15.6	-178.2	-55.3	-45.8	0	0	0	112.7	L267 N268 L269 D274 L275	L267-D271 HydrophobicContact CD2-CB 4.2Å; N268-D271 WeakPolarHBondContact CB-OD2 2.97Å; N268-D271 PolarHBondContact N-OD2 2.78Å; N268-D271 PolarHBondContact ND2-OD2 3.35Å; N268-D271 WeakPolarHBondContact O-CB 3.43Å; N268-D271 PolarHBondContact O-N 3.03Å; N268-D271 VanDerWaalsContact O-N 3.13Å; L269-D271 VanDerWaalsContact C-N 3.26Å; L269-D271 PolarHBondContact O-N 3.04Å; D271-D274 PolarHBondContact O-N 3.44Å; D271-L275 VanDerWaalsContact O-CB 3.28Å; D271-L275 WeakPolarHBondContact O-CB 3.37Å; D271-L275 PolarHBondContact O-N 3.18Å
272	I	95.4	Very high	96	Very high	15 Å²	15	64.3 Å²	64.3	8%	0.077	33%	0.334	C	S	.	.	H	α-helix	trans	-70	-37.6	-169.7	-58.2	-53.1	0	0	0	112.4	V213 A216 I217 L269 E270 L275 F276	V213-I272 HydrophobicContact CG1-CD1 3.75Å; A216-I272 HydrophobicContact CB-CG1 4.16Å; A216-I272 HydrophobicContact CB-CG2 4.22Å; I217-I272 HydrophobicContact CD1-CD1 4.03Å; I217-I272 HydrophobicContact CG1-CD1 3.66Å; I217-I272 HydrophobicContact CG1-CG2 4.43Å; L269-I272 PolarHBondContact O-N 2.72Å; E270-I272 VanDerWaalsContact C-N 3.32Å; E270-I272 PolarHBondContact O-N 3.02Å; I272-L275 HydrophobicContact CD1-CD2 4.37Å; I272-L275 PolarHBondContact O-N 3.05Å; I272-F276 HydrophobicContact CG2-CD2 3.9Å; I272-F276 HydrophobicContact CG2-CE2 3.97Å; I272-F276 WeakPolarHBondContact O-CD2 3.15Å; I272-F276 PolarHBondContact O-N 3.5Å
273	E	94.6	Very high	96.1	Very high	162 Å²	162	62.4 Å²	62.4	76%	0.757	33%	0.325	S	S	*	.	H	α-helix	trans	-62.8	-46.8	177.6	-174.1	176.9	170.3	0	0	110.9	F276 S277	E273-F276 PolarHBondContact O-N 3.47Å; E273-S277 WeakPolarHBondContact O-CB 3.37Å; E273-S277 PolarHBondContact O-N 3.44Å; E273-S277 PolarHBondContact O-OG 3.05Å
274	D	96.3	Very high	96.1	Very high	101 Å²	101	65 Å²	65	54%	0.54	34%	0.344	S	S	.	.	H	α-helix	trans	-65.2	-41.7	176.9	-74.6	-20.6	0	0	0	111.6	D271 F276 S277 L278	D271-D274 PolarHBondContact O-N 3.44Å; D274-F276 VanDerWaalsContact C-N 3.33Å; D274-F276 PolarHBondContact O-N 3.19Å; D274-S277 WeakPolarHBondContact CA-OG 3.19Å; D274-S277 PolarHBondContact O-N 2.85Å; D274-S277 PolarHBondContact O-OG 3.39Å; D274-L278 VanDerWaalsContact O-CB 3.31Å; D274-L278 WeakPolarHBondContact O-CB 3.47Å; D274-L278 VanDerWaalsContact O-CG 3.26Å; D274-L278 WeakPolarHBondContact O-CG 3.48Å; D274-L278 PolarHBondContact O-N 3.32Å
275	L	97.5	Very high	96.1	Very high	7 Å²	7	67.1 Å²	67.1	4%	0.037	35%	0.353	C	S	.	.	H	α-helix	trans	-56.6	-46.5	175.8	176.5	62.4	0	0	0	111.7	L233 I236 I237 L267 D271 I272 A279	L233-L275 HydrophobicContact CD2-CD1 4.23Å; L233-L275 HydrophobicContact CD2-CD2 4.12Å; L233-L275 HydrophobicContact CD2-CG 3.75Å; I236-L275 HydrophobicContact CB-CD1 3.67Å; I236-L275 HydrophobicContact CG1-CD1 4.37Å; I236-L275 HydrophobicContact CG2-CD1 3.67Å; I237-L275 HydrophobicContact CG1-CD1 4.25Å; L267-L275 HydrophobicContact CD1-CD2 4.21Å; D271-L275 VanDerWaalsContact O-CB 3.28Å; D271-L275 WeakPolarHBondContact O-CB 3.37Å; D271-L275 PolarHBondContact O-N 3.18Å; I272-L275 HydrophobicContact CD1-CD2 4.37Å; I272-L275 PolarHBondContact O-N 3.05Å; L275-A279 WeakPolarHBondContact O-CB 3.45Å; L275-A279 PolarHBondContact O-N 3.16Å
276	F	97.1	Very high	96.2	Very high	22 Å²	22	64.7 Å²	64.7	10%	0.096	34%	0.336	C	S	.	.	H	α-helix	trans	-70.3	-41.2	179.3	-89.4	-108.5	0	0	0	112.4	I217 F229 L233 I272 E273 D274 A279 Q280	I217-F276 HydrophobicContact CG2-CE2 4.36Å; I217-F276 HydrophobicContact CG2-CZ 4.42Å; I217-F276 WeakPolarHBondContact O-CZ 3.49Å; F229-F276 HydrophobicContact CD1-CE1 4.26Å; F229-F276 AromaticContact CE1-CD1 3.54Å; F229-F276 HydrophobicContact CE1-CD1 3.54Å; F229-F276 AromaticContact CE1-CE1 3.6Å; F229-F276 HydrophobicContact CE1-CE1 3.6Å; F229-F276 HydrophobicContact CE1-CG 4.25Å; F229-F276 HydrophobicContact CE1-CZ 4.35Å; F229-F276 HydrophobicContact CZ-CD1 4.11Å; L233-F276 HydrophobicContact CD1-CE2 4.5Å; L233-F276 HydrophobicContact CD1-CZ 4.3Å; L233-F276 HydrophobicContact CD2-CD2 4.05Å; L233-F276 HydrophobicContact CD2-CE2 4Å; L233-F276 HydrophobicContact CD2-CG 4.47Å; L233-F276 HydrophobicContact CD2-CZ 4.36Å; I272-F276 HydrophobicContact CG2-CD2 3.9Å; I272-F276 HydrophobicContact CG2-CE2 3.97Å; I272-F276 WeakPolarHBondContact O-CD2 3.15Å; I272-F276 PolarHBondContact O-N 3.5Å; E273-F276 PolarHBondContact O-N 3.47Å; D274-F276 VanDerWaalsContact C-N 3.33Å; D274-F276 PolarHBondContact O-N 3.19Å; F276-A279 PolarHBondContact O-N 3.3Å; F276-Q280 WeakPolarHBondContact O-CB 3.4Å; F276-Q280 VanDerWaalsContact O-CG 3.26Å; F276-Q280 WeakPolarHBondContact O-CG 3.24Å; F276-Q280 PolarHBondContact O-N 3.02Å
277	S	96.8	Very high	96.3	Very high	59 Å²	59	60.6 Å²	60.6	41%	0.413	31%	0.307	S	S	.	.	H	α-helix	trans	-65.4	-42.2	179.2	71.7	0	0	0	0	111.8	E273 D274 Q280 Y281	E273-S277 WeakPolarHBondContact O-CB 3.37Å; E273-S277 PolarHBondContact O-N 3.44Å; E273-S277 PolarHBondContact O-OG 3.05Å; D274-S277 WeakPolarHBondContact CA-OG 3.19Å; D274-S277 PolarHBondContact O-N 2.85Å; D274-S277 PolarHBondContact O-OG 3.39Å; S277-Q280 PolarHBondContact O-N 3.25Å; S277-Y281 PolarHBondContact O-N 2.8Å
278	L	98.1	Very high	96.3	Very high	69 Å²	69	61.3 Å²	61.3	36%	0.361	32%	0.316	S	S	.	.	H	α-helix	trans	-65.1	-45	173.9	-70.5	172.5	0	0	0	111.3	I236 D274 Q280 Y281 Y282	I236-L278 HydrophobicContact CD1-CB 3.82Å; I236-L278 HydrophobicContact CG1-CB 3.92Å; I236-L278 HydrophobicContact CG2-CB 4.2Å; I236-L278 HydrophobicContact CG2-CD1 4.02Å; D274-L278 VanDerWaalsContact O-CB 3.31Å; D274-L278 WeakPolarHBondContact O-CB 3.47Å; D274-L278 VanDerWaalsContact O-CG 3.26Å; D274-L278 WeakPolarHBondContact O-CG 3.48Å; D274-L278 PolarHBondContact O-N 3.32Å; L278-Q280 VanDerWaalsContact C-N 3.27Å; L278-Q280 PolarHBondContact O-N 3.5Å; L278-Y281 WeakPolarHBondContact O-CB 3.42Å; L278-Y281 PolarHBondContact O-N 2.68Å; L278-Y281 VanDerWaalsContact O-N 3.09Å; L278-Y282 WeakPolarHBondContact O-CD2 3.33Å; L278-Y282 PolarHBondContact O-N 2.88Å
279	A	98.1	Very high	96.2	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.4	-38.3	176.5	0	0	0	0	0	111.9	F229 F232 L233 I236 L275 F276 C283	F229-A279 HydrophobicContact CE1-CB 4.2Å; F229-A279 HydrophobicContact CE2-CB 3.79Å; F229-A279 HydrophobicContact CZ-CB 3.47Å; F229-A279 VanDerWaalsContact CZ-CB 3.47Å; F232-A279 HydrophobicContact CB-CB 3.82Å; L233-A279 HydrophobicContact CD2-CB 3.88Å; L233-A279 HydrophobicContact CG-CB 4.45Å; I236-A279 HydrophobicContact CG1-CB 4.14Å; L275-A279 WeakPolarHBondContact O-CB 3.45Å; L275-A279 PolarHBondContact O-N 3.16Å; F276-A279 PolarHBondContact O-N 3.3Å; A279-C283 WeakPolarHBondContact O-CB 3.32Å; A279-C283 PolarHBondContact O-N 3.46Å
280	Q	96.8	Very high	96.4	Very high	102 Å²	102	52.4 Å²	52.4	48%	0.477	27%	0.269	S	S	.	.	H	α-helix	trans	-65.7	-40	172.7	-74.1	173.2	12.8	0	0	112.3	F229 F276 S277 L278 C283 S284	F229-Q280 HydrophobicContact CE2-CG 3.9Å; F229-Q280 HydrophobicContact CZ-CG 3.89Å; F276-Q280 WeakPolarHBondContact O-CB 3.4Å; F276-Q280 VanDerWaalsContact O-CG 3.26Å; F276-Q280 WeakPolarHBondContact O-CG 3.24Å; F276-Q280 PolarHBondContact O-N 3.02Å; S277-Q280 PolarHBondContact O-N 3.25Å; L278-Q280 VanDerWaalsContact C-N 3.27Å; L278-Q280 PolarHBondContact O-N 3.5Å; Q280-C283 WeakPolarHBondContact O-CB 3.41Å; Q280-C283 PolarHBondContact O-N 2.95Å; Q280-S284 WeakPolarHBondContact O-CB 3.38Å; Q280-S284 PolarHBondContact O-N 3.23Å
281	Y	96.9	Very high	96.3	Very high	124 Å²	124	48.4 Å²	48.4	49%	0.486	25%	0.247	S	C	.	.	H	α-helix	trans	-59.4	-53.5	174.9	171.4	-99.6	0	0	0	111.5	S277 L278 C283 S284 K285	S277-Y281 PolarHBondContact O-N 2.8Å; L278-Y281 WeakPolarHBondContact O-CB 3.42Å; L278-Y281 PolarHBondContact O-N 2.68Å; L278-Y281 VanDerWaalsContact O-N 3.09Å; Y281-C283 VanDerWaalsContact C-N 3.29Å; Y281-C283 PolarHBondContact O-N 3.24Å; Y281-S284 PolarHBondContact O-N 3.19Å; Y281-S284 PolarHBondContact O-OG 3.09Å; Y281-K285 HydrophobicContact CE2-CG 4.45Å; Y281-K285 PolarHBondContact O-N 2.93Å
282	Y	97.6	Very high	96.1	Very high	39 Å²	39	52.1 Å²	52.1	15%	0.153	26%	0.261	C	S	.	.	H	α-helix	trans	-61.6	-38.8	177.6	-84	-96.4	0	0	0	111.7	H178 E179 L235 I236 L278 S284 K285 T286	H178-Y282 HydrophobicContact CB-CD1 3.95Å; H178-Y282 HydrophobicContact CB-CE1 3.86Å; H178-Y282 AromaticContact CE1-CD1 3.9Å; H178-Y282 PolarHBondContact CE1-O 3.48Å; H178-Y282 AromaticContact CG-CD1 3.6Å; H178-Y282 AromaticContact ND1-CD1 3.42Å; H178-Y282 WeakPolarHBondContact ND1-CD1 3.45Å; H178-Y282 AromaticContact ND1-CE1 3.92Å; E179-Y282 PolarHBondContact OE1-OH 2.59Å; L235-Y282 HydrophobicContact CD2-CD1 3.58Å; L235-Y282 HydrophobicContact CD2-CE1 4.17Å; L235-Y282 HydrophobicContact CD2-CG 4.08Å; I236-Y282 HydrophobicContact CD1-CD2 3.37Å; I236-Y282 HydrophobicContact CD1-CE2 3.61Å; I236-Y282 HydrophobicContact CD1-CG 4.07Å; L278-Y282 WeakPolarHBondContact O-CD2 3.33Å; L278-Y282 PolarHBondContact O-N 2.88Å; Y282-S284 PolarHBondContact O-N 2.71Å; Y282-K285 CarbonylContact O-C 3.38Å; Y282-K285 PolarHBondContact O-N 3.11Å; Y282-T286 PolarHBondContact O-N 2.87Å; Y282-T286 PolarHBondContact O-OG1 2.83Å
283	C	96.9	Very high	95.8	Very high	18 Å²	18	54 Å²	54	12%	0.122	27%	0.271	C	S	.	.	H	α-helix	trans	-58.6	-44.6	172.2	165.6	0	0	0	0	112.5	F232 A279 Q280 Y281 K285 T286 R291	F232-C283 HydrophobicContact CD1-CB 4.15Å; F232-C283 HydrophobicContact CD2-CB 3.87Å; F232-C283 HydrophobicContact CE1-CB 4.14Å; F232-C283 HydrophobicContact CE2-CB 3.86Å; F232-C283 HydrophobicContact CG-CB 4.03Å; F232-C283 HydrophobicContact CZ-CB 4.01Å; A279-C283 WeakPolarHBondContact O-CB 3.32Å; A279-C283 PolarHBondContact O-N 3.46Å; Q280-C283 WeakPolarHBondContact O-CB 3.41Å; Q280-C283 PolarHBondContact O-N 2.95Å; Y281-C283 VanDerWaalsContact C-N 3.29Å; Y281-C283 PolarHBondContact O-N 3.24Å; C283-K285 PolarHBondContact O-N 2.81Å; C283-T286 PolarHBondContact O-N 3.09Å; C283-R291 PolarHBondContact SG-NH1 3.12Å; C283-R291 PolarHBondContact SG-NH2 3.28Å
284	S	95.1	Very high	95.6	Very high	71 Å²	71	47 Å²	47	50%	0.497	24%	0.239	S	C	.	.	H	α-helix	trans	-65.1	-22.8	-179.8	77.3	0	0	0	0	113	Q280 Y281 Y282 V336	Q280-S284 WeakPolarHBondContact O-CB 3.38Å; Q280-S284 PolarHBondContact O-N 3.23Å; Y281-S284 PolarHBondContact O-N 3.19Å; Y281-S284 PolarHBondContact O-OG 3.09Å; Y282-S284 PolarHBondContact O-N 2.71Å; S284-V336 WeakPolarHBondContact O-CG2 3.37Å
285	K	95.9	Very high	95.3	Very high	45 Å²	45	47 Å²	47	20%	0.196	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	16.3	174.7	-66	-66.5	-166	170.2	0	112.9	Y281 Y282 C283 E396 H397	Y281-K285 HydrophobicContact CE2-CG 4.45Å; Y281-K285 PolarHBondContact O-N 2.93Å; Y282-K285 CarbonylContact O-C 3.38Å; Y282-K285 PolarHBondContact O-N 3.11Å; C283-K285 PolarHBondContact O-N 2.81Å; K285-E396 IonicContact NZ-OE1 3.04Å; K285-E396 IonicContact NZ-OE2 2.68Å; K285-E396 PolarHBondContact NZ-OE2 3.15Å; K285-H397 PolarHBondContact O-CE1 2.86Å
286	T	97.6	Very high	94.7	Very high	11 Å²	11	48.8 Å²	48.8	7%	0.067	24%	0.243	C	C	.	.	S	Bend	trans	-115.9	134.8	178.7	-57	0	0	0	0	110.7	L174 H178 F232 Y282 C283 A288 F290	L174-T286 HydrophobicContact CD1-CG2 3.93Å; H178-T286 PolarHBondContact CE1-OG1 3.35Å; H178-T286 PolarHBondContact NE2-OG1 3.47Å; F232-T286 HydrophobicContact CE1-CG2 4.12Å; F232-T286 VanDerWaalsContact CE1-OG1 3.3Å; F232-T286 WeakPolarHBondContact CE1-OG1 3.4Å; F232-T286 HydrophobicContact CZ-CG2 4.03Å; Y282-T286 PolarHBondContact O-N 2.87Å; Y282-T286 PolarHBondContact O-OG1 2.83Å; C283-T286 PolarHBondContact O-N 3.09Å; T286-A288 PolarHBondContact O-N 2.85Å; T286-F290 HydrophobicContact CG2-CB 3.83Å; T286-F290 HydrophobicContact CG2-CD2 4.46Å; T286-F290 HydrophobicContact CG2-CG 4.03Å
287	P	96.5	Very high	94.3	Very high	2 Å²	2	48.2 Å²	48.2	1%	0.013	24%	0.241	C	C	.	.			trans	-51.9	138.7	175.6	-29.4	36.4	0	0	0	113	Y177 S289 F290 L318 V320 E324 V336 F338	Y177-P287 HydrophobicContact CE1-CG 4.29Å; Y177-P287 HydrophobicContact CE2-CG 4.47Å; Y177-P287 WeakPolarHBondContact OH-CD 3.4Å; Y177-P287 VanDerWaalsContact OH-CG 3.27Å; Y177-P287 WeakPolarHBondContact OH-CG 3.49Å; P287-S289 PolarHBondContact O-N 3.45Å; P287-F290 WeakPolarHBondContact O-CB 3.23Å; P287-F290 PolarHBondContact O-N 2.98Å; P287-L318 HydrophobicContact CG-CD2 4.45Å; P287-V320 HydrophobicContact CB-CG2 3.98Å; P287-V320 HydrophobicContact CG-CG2 3.99Å; P287-E324 VanDerWaalsContact CA-OE1 3.27Å; P287-E324 WeakPolarHBondContact CA-OE1 3.33Å; P287-V336 HydrophobicContact CG-CG1 4.3Å; P287-F338 HydrophobicContact CB-CE1 4.4Å; P287-F338 HydrophobicContact CB-CZ 3.97Å; P287-F338 HydrophobicContact CG-CE1 3.88Å; P287-F338 HydrophobicContact CG-CZ 3.91Å
288	A	94.6	Very high	93.9	Very high	38 Å²	38	45.6 Å²	45.6	31%	0.314	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-26.7	177	0	0	0	0	0	112.5	T286 F290 R291 K292 E324	T286-A288 PolarHBondContact O-N 2.85Å; A288-F290 PolarHBondContact O-N 2.85Å; A288-R291 PolarHBondContact O-N 2.8Å; A288-K292 PolarHBondContact O-N 3.3Å; A288-E324 VanDerWaalsContact N-CD 3.33Å; A288-E324 PolarHBondContact N-OE1 3.05Å; A288-E324 PolarHBondContact N-OE2 3.47Å
289	S	95.1	Very high	92.9	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-55.1	-30.7	172.9	-62.5	0	0	0	0	111.8	P287 R291 K292 D293 S321 E324	P287-S289 PolarHBondContact O-N 3.45Å; S289-R291 PolarHBondContact O-N 3.02Å; S289-K292 PolarHBondContact O-N 3.19Å; S289-D293 WeakPolarHBondContact CB-OD2 3.22Å; S289-D293 WeakPolarHBondContact O-CB 3.02Å; S289-D293 PolarHBondContact O-N 2.64Å; S289-S321 PolarHBondContact OG-N 2.93Å; S289-S321 PolarHBondContact OG-OG 3.11Å; S289-E324 VanDerWaalsContact CB-OE2 3.23Å; S289-E324 WeakPolarHBondContact CB-OE2 3.5Å; S289-E324 PolarHBondContact N-OE2 2.89Å; S289-E324 PolarHBondContact OG-OE2 3.47Å
290	F	96.1	Very high	91.1	Very high	1 Å²	1	46.9 Å²	46.9	0%	0.004	24%	0.242	C	C	.	.	H	α-helix	trans	-51.8	-42.6	173.5	-178.8	-98.1	0	0	0	112	L170 L174 F228 Y231 F232 T286 P287 A288 N294 L318	L170-F290 HydrophobicContact CD1-CD2 3.78Å; L170-F290 HydrophobicContact CD1-CE2 3.41Å; L170-F290 VanDerWaalsContact CD1-CE2 3.41Å; L170-F290 HydrophobicContact CD1-CZ 4.17Å; L170-F290 HydrophobicContact CD2-CE2 4.02Å; L170-F290 HydrophobicContact CD2-CZ 3.93Å; L170-F290 HydrophobicContact CG-CD2 4.34Å; L170-F290 HydrophobicContact CG-CE2 3.51Å; L170-F290 HydrophobicContact CG-CZ 3.81Å; L174-F290 HydrophobicContact CB-CE2 3.93Å; L174-F290 HydrophobicContact CB-CZ 4.32Å; L174-F290 HydrophobicContact CD1-CD2 4.34Å; L174-F290 HydrophobicContact CD1-CE2 4.07Å; L174-F290 HydrophobicContact CD1-CZ 4.36Å; L174-F290 HydrophobicContact CD2-CE2 4.36Å; L174-F290 HydrophobicContact CD2-CZ 3.99Å; L174-F290 HydrophobicContact CG-CE2 4.34Å; L174-F290 HydrophobicContact CG-CZ 4.46Å; F228-F290 HydrophobicContact CB-CE1 4.22Å; F228-F290 HydrophobicContact CD1-CD1 4.15Å; F228-F290 AromaticContact CD1-CE1 3.8Å; F228-F290 HydrophobicContact CD1-CE1 3.8Å; F228-F290 HydrophobicContact CG-CE1 4.45Å; Y231-F290 HydrophobicContact CD2-CE1 4.09Å; Y231-F290 AromaticContact CD2-CZ 3.99Å; Y231-F290 HydrophobicContact CD2-CZ 3.99Å; Y231-F290 HydrophobicContact CG-CE1 4.38Å; Y231-F290 AromaticContact CG-CZ 3.97Å; Y231-F290 HydrophobicContact CG-CZ 3.97Å; F232-F290 HydrophobicContact CE2-CD1 4.42Å; F232-F290 HydrophobicContact CE2-CE1 4.25Å; F232-F290 HydrophobicContact CZ-CD1 4.06Å; F232-F290 HydrophobicContact CZ-CE1 4.08Å; T286-F290 HydrophobicContact CG2-CB 3.83Å; T286-F290 HydrophobicContact CG2-CD2 4.46Å; T286-F290 HydrophobicContact CG2-CG 4.03Å; P287-F290 WeakPolarHBondContact O-CB 3.23Å; P287-F290 PolarHBondContact O-N 2.98Å; A288-F290 PolarHBondContact O-N 2.85Å; F290-N294 WeakPolarHBondContact O-CB 3.39Å; F290-N294 PolarHBondContact O-ND2 3.05Å; F290-L318 HydrophobicContact CB-CD2 4.31Å; F290-L318 HydrophobicContact CD2-CD1 3.82Å; F290-L318 HydrophobicContact CD2-CD2 4.13Å; F290-L318 HydrophobicContact CE2-CD1 4.44Å
291	R	93.4	Very high	88.9	Confident	75 Å²	75	46.4 Å²	46.4	28%	0.283	25%	0.246	S	C	.	.	H	α-helix	trans	-87	-46.8	179.5	-65.3	-176.2	170	123.5	-6.3	112.7	D226 F228 C283 A288 S289 H295	D226-R291 IonicContact OD1-NE 3.93Å; D226-R291 IonicContact OD2-CZ 2.8Å; D226-R291 IonicContact OD2-NE 3.58Å; D226-R291 PolarHBondContact OD2-NE 3.05Å; D226-R291 IonicContact OD2-NH2 3.07Å; D226-R291 PolarHBondContact OD2-NH2 3.31Å; F228-R291 HydrophobicContact CB-CG 3.87Å; F228-R291 HydrophobicContact CD2-CB 4.19Å; F228-R291 HydrophobicContact CD2-CG 4.13Å; F228-R291 HydrophobicContact CG-CB 4.33Å; F228-R291 HydrophobicContact CG-CG 3.92Å; C283-R291 PolarHBondContact SG-NH1 3.12Å; C283-R291 PolarHBondContact SG-NH2 3.28Å; A288-R291 PolarHBondContact O-N 2.8Å; S289-R291 PolarHBondContact O-N 3.02Å; R291-H295 PolarHBondContact O-N 2.76Å
292	K	91.3	Very high	86.8	Confident	133 Å²	133	47.2 Å²	47.2	58%	0.578	26%	0.258	S	S	*	.	H	α-helix	trans	-66.4	-44.1	-170.3	-72.2	-177.3	178	178.9	0	111.6	A288 S289 N294	A288-K292 PolarHBondContact O-N 3.3Å; S289-K292 PolarHBondContact O-N 3.19Å; K292-N294 VanDerWaalsContact C-N 3.34Å
293	D	89.8	Confident	84.6	Confident	55 Å²	55	51.2 Å²	51.2	29%	0.294	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-18.2	-170.9	-57.1	-7.4	0	0	0	111.4	S289 H296	S289-D293 WeakPolarHBondContact CB-OD2 3.22Å; S289-D293 WeakPolarHBondContact O-CB 3.02Å; S289-D293 PolarHBondContact O-N 2.64Å; D293-H296 PolarHBondContact O-CD2 3.43Å; D293-H296 VanDerWaalsContact O-CD2 3.32Å
294	N	91	Very high	82.1	Confident	15 Å²	15	51.2 Å²	51.2	8%	0.08	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.3	9.4	-178	-63.4	-77.3	0	0	0	113.6	L170 F228 F290 K292 H296 L297	L170-N294 HydrophobicContact CD2-CB 3.91Å; F228-N294 HydrophobicContact CE1-CB 3.73Å; F228-N294 HydrophobicContact CZ-CB 3.99Å; F228-N294 WeakPolarHBondContact CZ-O 3.41Å; F290-N294 WeakPolarHBondContact O-CB 3.39Å; F290-N294 PolarHBondContact O-ND2 3.05Å; K292-N294 VanDerWaalsContact C-N 3.34Å; N294-H296 PolarHBondContact O-N 3.49Å; N294-L297 HydrophobicContact CB-CD1 4.07Å; N294-L297 HydrophobicContact CB-CG 4.41Å; N294-L297 WeakPolarHBondContact O-CB 3.37Å; N294-L297 WeakPolarHBondContact O-CG 3.32Å; N294-L297 PolarHBondContact O-N 2.89Å
295	H	88.4	Confident	80	Confident	102 Å²	102	52.6 Å²	52.6	47%	0.472	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-57.8	-24.9	-174.7	-142.5	81.8	0	0	0	113	F228 R291 L297 F298	F228-H295 AromaticContact CE2-ND1 3.89Å; R291-H295 PolarHBondContact O-N 2.76Å; H295-L297 PolarHBondContact O-N 3.3Å; H295-F298 PolarHBondContact O-N 3.12Å; H295-F298 VanDerWaalsContact O-N 3.17Å
296	H	85.6	Confident	77.7	Confident	44 Å²	44	59.5 Å²	59.5	20%	0.204	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-63.9	-14.8	175.6	68.1	73	0	0	0	114.5	D293 N294 F298	D293-H296 PolarHBondContact O-CD2 3.43Å; D293-H296 VanDerWaalsContact O-CD2 3.32Å; N294-H296 PolarHBondContact O-N 3.49Å; H296-F298 PolarHBondContact O-N 3.14Å
297	L	89.1	Confident	75.4	Confident	9 Å²	9	63.7 Å²	63.7	5%	0.047	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-68	-26.5	173.8	-65.6	-179.6	0	0	0	112	P158 R159 R166 L170 N294 H295 L312	P158-L297 WeakPolarHBondContact CA-O 3.32Å; R159-L297 PolarHBondContact N-O 3.32Å; R166-L297 HydrophobicContact CB-CD2 3.79Å; L170-L297 HydrophobicContact CB-CD1 4.33Å; L170-L297 HydrophobicContact CD2-CD1 3.5Å; L170-L297 VanDerWaalsContact CD2-CD1 3.5Å; N294-L297 HydrophobicContact CB-CD1 4.07Å; N294-L297 HydrophobicContact CB-CG 4.41Å; N294-L297 WeakPolarHBondContact O-CB 3.37Å; N294-L297 WeakPolarHBondContact O-CG 3.32Å; N294-L297 PolarHBondContact O-N 2.89Å; H295-L297 PolarHBondContact O-N 3.3Å; L297-L312 HydrophobicContact CD1-CD1 4.46Å
298	F	89.1	Confident	73.1	Confident	5 Å²	5	69.3 Å²	69.3	2%	0.022	37%	0.368	C	S	.	.	S	Bend	trans	-112.6	170	177.1	-56.8	-85.5	0	0	0	110	Y156 P158 P227 F228 Y231 H295 H296	Y156-F298 WeakPolarHBondContact O-CE1 3.33Å; P158-F298 HydrophobicContact CB-CE1 4.18Å; P158-F298 HydrophobicContact CG-CD1 4.34Å; P158-F298 HydrophobicContact CG-CE1 3.54Å; P158-F298 HydrophobicContact CG-CZ 3.8Å; P227-F298 HydrophobicContact CB-CD1 3.93Å; P227-F298 HydrophobicContact CB-CD2 3.99Å; P227-F298 HydrophobicContact CB-CE1 4Å; P227-F298 HydrophobicContact CB-CE2 4.07Å; P227-F298 HydrophobicContact CB-CG 3.91Å; P227-F298 HydrophobicContact CB-CZ 4.07Å; P227-F298 WeakPolarHBondContact O-CZ 3.25Å; F228-F298 HydrophobicContact CD1-CE2 4.11Å; F228-F298 HydrophobicContact CD2-CD2 4.42Å; F228-F298 HydrophobicContact CD2-CE2 4.17Å; F228-F298 HydrophobicContact CE1-CD2 4.32Å; F228-F298 AromaticContact CE1-CE2 3.83Å; F228-F298 HydrophobicContact CE1-CE2 3.83Å; F228-F298 AromaticContact CE2-CD2 3.8Å; F228-F298 HydrophobicContact CE2-CD2 3.8Å; F228-F298 AromaticContact CE2-CE2 3.89Å; F228-F298 HydrophobicContact CE2-CE2 3.89Å; F228-F298 HydrophobicContact CG-CE2 4.27Å; F228-F298 AromaticContact CZ-CD2 3.74Å; F228-F298 HydrophobicContact CZ-CD2 3.74Å; F228-F298 AromaticContact CZ-CE2 3.71Å; F228-F298 HydrophobicContact CZ-CE2 3.71Å; Y231-F298 HydrophobicContact CE2-CE2 4.16Å; Y231-F298 HydrophobicContact CE2-CZ 4.01Å; H295-F298 PolarHBondContact O-N 3.12Å; H295-F298 VanDerWaalsContact O-N 3.17Å; H296-F298 PolarHBondContact O-N 3.14Å
299	G	76.4	Confident	70.9	Confident	32 Å²	32	77 Å²	77	33%	0.33	40%	0.397	S	S	.	.	S	Bend	trans	78.3	-137.1	171.7	0	0	0	0	0	115.1	N154 R159	N154-G299 PolarHBondContact O-N 2.89Å; R159-G299 PolarHBondContact NE-O 3.07Å; R159-G299 PolarHBondContact NH2-O 3.01Å
300	S	59.5	Low	69.2	Low	63 Å²	63	80.2 Å²	80.2	44%	0.441	42%	0.424	S	S	.	.			trans	-110.3	140.2	-174.2	-167.9	0	0	0	0	113.8	L302 L303	S300-L302 PolarHBondContact O-N 3.06Å; S300-L303 PolarHBondContact O-N 3.31Å
301	T	51.9	Low	68.4	Low	92 Å²	92	82.6 Å²	82.6	56%	0.564	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-53.4	-25.5	-175.3	-37.3	0	0	0	0	113.9	R159 L303 G304	R159-T301 PolarHBondContact NH1-OG1 3.15Å; T301-L303 PolarHBondContact O-N 2.67Å; T301-L303 VanDerWaalsContact O-N 3.15Å; T301-G304 PolarHBondContact O-N 3.22Å
302	L	51.6	Low	68.1	Low	142 Å²	142	80 Å²	80	74%	0.743	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-66	-17.6	-172.2	-63.3	175	0	0	0	113.8	S300	S300-L302 PolarHBondContact O-N 3.06Å
303	L	50.8	Low	67.9	Low	122 Å²	122	76.3 Å²	76.3	64%	0.639	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-83.4	-21.4	-179.4	-68.6	170	0	0	0	113.8	S300 T301	S300-L303 PolarHBondContact O-N 3.31Å; T301-L303 PolarHBondContact O-N 2.67Å; T301-L303 VanDerWaalsContact O-N 3.15Å
304	G	46	Very low	67.7	Low	19 Å²	19	79.7 Å²	79.7	20%	0.196	43%	0.433	C	S	.	.	S	Bend	trans	-93.7	-3.4	-172	0	0	0	0	0	116.6	T301 K306 D307	T301-G304 PolarHBondContact O-N 3.22Å; G304-K306 PolarHBondContact O-N 3.19Å; G304-K306 VanDerWaalsContact O-N 3.17Å; G304-D307 PolarHBondContact O-N 3.49Å
305	I	49.4	Very low	67.7	Low	100 Å²	100	80.3 Å²	80.3	51%	0.513	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-9	-173.3	-57.2	170.4	0	0	0	112.3
306	K	49.6	Very low	67.8	Low	189 Å²	189	78.7 Å²	78.7	82%	0.822	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-24.9	178.9	-72.4	-174	176.6	-177.5	0	113.8	G304	G304-K306 PolarHBondContact O-N 3.19Å; G304-K306 VanDerWaalsContact O-N 3.17Å
307	D	49.1	Very low	68.3	Low	100 Å²	100	76.8 Å²	76.8	54%	0.535	43%	0.427	S	S	.	.			trans	-109.5	33.3	-174	-62.8	-36.6	0	0	0	112.4	G304 E309 A310	G304-D307 PolarHBondContact O-N 3.49Å; D307-E309 PolarHBondContact O-N 3.37Å; D307-A310 PolarHBondContact O-N 3.05Å
308	D	46.7	Very low	68.6	Low	119 Å²	119	76.6 Å²	76.6	64%	0.636	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-3.7	-179.7	-89	-21.4	0	0	0	113.9
309	E	49.4	Very low	68.9	Low	199 Å²	199	78.3 Å²	78.3	93%	0.93	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-22.8	-179.8	-71	-170.5	168.6	0	0	114.7	D307 D311	D307-E309 PolarHBondContact O-N 3.37Å; E309-D311 PolarHBondContact O-N 3.18Å
310	A	59.9	Low	69.8	Low	68 Å²	68	76.8 Å²	76.8	56%	0.562	43%	0.425	S	S	*	.			trans	-97	85.1	-175	0	0	0	0	0	112.3	D307 L312	D307-A310 PolarHBondContact O-N 3.05Å; A310-L312 PolarHBondContact O-N 3.02Å
311	D	79.5	Confident	71.5	Confident	52 Å²	52	74.6 Å²	74.6	28%	0.278	41%	0.41	S	S	.	.			trans	-75.1	105.2	173.6	-172.2	7.7	0	0	0	111.4	E309 S313 Q314 A315	E309-D311 PolarHBondContact O-N 3.18Å; D311-S313 PolarHBondContact O-N 3.04Å; D311-S313 WeakPolarHBondContact OD1-CB 3.42Å; D311-S313 PolarHBondContact OD1-N 3.32Å; D311-S313 PolarHBondContact OD1-OG 3Å; D311-S313 VanDerWaalsContact OD1-OG 3.09Å; D311-S313 PolarHBondContact OD2-OG 2.95Å; D311-Q314 HydrophobicContact CB-CG 4.3Å; D311-Q314 PolarHBondContact O-N 3.45Å; D311-Q314 PolarHBondContact OD2-NE2 3.19Å; D311-A315 PolarHBondContact O-N 3.2Å
312	L	87.1	Confident	73.4	Confident	20 Å²	20	71 Å²	71	11%	0.105	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-25.2	174.5	-66.9	174.7	0	0	0	113.1	R166 H169 L170 L173 L297 A310 Q314 A315	R166-L312 HydrophobicContact CB-CD1 4.27Å; H169-L312 HydrophobicContact CB-CB 4Å; L170-L312 HydrophobicContact CB-CD1 4.15Å; L173-L312 HydrophobicContact CD1-CD2 4.04Å; L297-L312 HydrophobicContact CD1-CD1 4.46Å; A310-L312 PolarHBondContact O-N 3.02Å; L312-Q314 PolarHBondContact O-N 3.48Å; L312-A315 PolarHBondContact O-N 2.92Å
313	S	85.7	Confident	75.2	Confident	56 Å²	56	65.7 Å²	65.7	39%	0.392	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-27.3	177.8	88.5	0	0	0	0	113	D311	D311-S313 PolarHBondContact O-N 3.04Å; D311-S313 WeakPolarHBondContact OD1-CB 3.42Å; D311-S313 PolarHBondContact OD1-N 3.32Å; D311-S313 PolarHBondContact OD1-OG 3Å; D311-S313 VanDerWaalsContact OD1-OG 3.09Å; D311-S313 PolarHBondContact OD2-OG 2.95Å
314	Q	85.1	Confident	77.2	Confident	126 Å²	126	60.9 Å²	60.9	59%	0.589	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	-10.7	-178.4	-59	-179.8	26.1	0	0	112.8	D311 L312 L316	D311-Q314 HydrophobicContact CB-CG 4.3Å; D311-Q314 PolarHBondContact O-N 3.45Å; D311-Q314 PolarHBondContact OD2-NE2 3.19Å; L312-Q314 PolarHBondContact O-N 3.48Å; Q314-L316 PolarHBondContact O-N 3.26Å
315	A	91	Very high	79.4	Confident	28 Å²	28	60.4 Å²	60.4	23%	0.231	33%	0.329	C	S	.	.			trans	-64.9	125.8	-177.9	0	0	0	0	0	112.1	R172 L173 D311 L312	R172-A315 PolarHBondContact NH2-O 2.52Å; L173-A315 HydrophobicContact CD1-CB 3.87Å; L173-A315 HydrophobicContact CD2-CB 4.23Å; D311-A315 PolarHBondContact O-N 3.2Å; L312-A315 PolarHBondContact O-N 2.92Å
316	L	91.9	Very high	81.2	Confident	68 Å²	68	56.2 Å²	56.2	36%	0.356	31%	0.308	S	S	.	.	S	Bend	trans	-77.5	-32.1	176.5	-76.3	161.3	0	0	0	112.9	Q176 Q314 N413	Q176-L316 PolarHBondContact NE2-O 2.94Å; Q176-L316 PolarHBondContact OE1-O 2.88Å; Q314-L316 PolarHBondContact O-N 3.26Å; L316-N413 HydrophobicContact CD1-CB 3.69Å
317	C	95.2	Very high	82.9	Confident	4 Å²	4	51.9 Å²	51.9	3%	0.027	29%	0.291	C	S	.	.	S	Bend	trans	-153.4	178.8	179.2	64.1	0	0	0	0	109.5	V427	C317-V427 HydrophobicContact CB-CG1 4.41Å
318	L	96.3	Very high	84.5	Confident	4 Å²	4	47.5 Å²	47.5	2%	0.021	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	133.6	-177.4	-159.5	70.2	0	0	0	111.3	L170 L173 Y177 P287 F290 S428 I429	L170-L318 HydrophobicContact CD1-CD1 4.23Å; L173-L318 HydrophobicContact CB-CD1 3.98Å; L173-L318 HydrophobicContact CD1-CD1 4.35Å; Y177-L318 HydrophobicContact CD2-CB 4.08Å; Y177-L318 HydrophobicContact CD2-CD2 4.35Å; P287-L318 HydrophobicContact CG-CD2 4.45Å; F290-L318 HydrophobicContact CB-CD2 4.31Å; F290-L318 HydrophobicContact CD2-CD1 3.82Å; F290-L318 HydrophobicContact CD2-CD2 4.13Å; F290-L318 HydrophobicContact CE2-CD1 4.44Å; L318-S428 CarbonylContact O-C 3.58Å; L318-S428 WeakPolarHBondContact O-CA 3.17Å; L318-S428 WeakPolarHBondContact O-CB 3.18Å; L318-I429 PolarHBondContact O-N 3.03Å
319	A	94.8	Very high	85.7	Confident	42 Å²	42	42.5 Å²	42.5	35%	0.347	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	140	174.6	0	0	0	0	0	111	I429	A319-I429 CarbonylContact C-O 3.43Å; A319-I429 WeakPolarHBondContact CA-O 3.43Å; A319-I429 HydrophobicContact CB-CG2 4.15Å
320	V	95.8	Very high	86.8	Confident	0 Å²	0	38 Å²	38	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	130.1	178.8	-179.8	0	0	0	0	109.3	P287 E324 I325 F338 I429 S431	P287-V320 HydrophobicContact CB-CG2 3.98Å; P287-V320 HydrophobicContact CG-CG2 3.99Å; V320-E324 HydrophobicContact CG1-CB 4.27Å; V320-I325 HydrophobicContact CG1-CD1 4.37Å; V320-I325 HydrophobicContact CG1-CG1 3.8Å; V320-F338 HydrophobicContact CG1-CE1 3.97Å; V320-F338 HydrophobicContact CG1-CE2 4.24Å; V320-F338 HydrophobicContact CG1-CZ 3.7Å; V320-F338 HydrophobicContact CG2-CE1 4Å; V320-F338 HydrophobicContact CG2-CZ 4.35Å; V320-I429 PolarHBondContact N-O 2.83Å; V320-S431 PolarHBondContact O-N 3.2Å
321	S	94.1	Very high	87	Confident	17 Å²	17	41.2 Å²	41.2	12%	0.119	23%	0.228	C	C	.	.			trans	-67.2	142.1	178	72.6	0	0	0	0	111.8	S289 S323 E324 I325	S289-S321 PolarHBondContact OG-N 2.93Å; S289-S321 PolarHBondContact OG-OG 3.11Å; S321-S323 PolarHBondContact O-N 3.12Å; S321-S323 PolarHBondContact OG-OG 3.1Å; S321-E324 PolarHBondContact O-N 3.24Å; S321-E324 PolarHBondContact OG-N 2.95Å; S321-I325 PolarHBondContact O-N 3.32Å
322	V	92.1	Very high	85.9	Confident	16 Å²	16	43.6 Å²	43.6	10%	0.097	24%	0.237	C	C	.	.	H	α-helix	trans	-59.8	-28.8	176.1	-63.9	0	0	0	0	112.6	E324 I325 L326 A436 L437 H440	V322-E324 VanDerWaalsContact C-N 3.33Å; V322-E324 PolarHBondContact O-N 3.31Å; V322-I325 PolarHBondContact O-N 3.24Å; V322-L326 WeakPolarHBondContact O-CG 3.19Å; V322-L326 PolarHBondContact O-N 3.1Å; V322-A436 HydrophobicContact CG1-CB 4.21Å; V322-A436 HydrophobicContact CG2-CB 4.46Å; V322-L437 HydrophobicContact CB-CD1 4.43Å; V322-L437 HydrophobicContact CG1-CB 4.15Å; V322-H440 HydrophobicContact CG2-CB 3.72Å
323	S	90.4	Very high	84.6	Confident	31 Å²	31	54.4 Å²	54.4	22%	0.217	28%	0.277	C	S	.	.	H	α-helix	trans	-61.3	-41.9	175.1	77.6	0	0	0	0	112	S321 Q327 H440	S321-S323 PolarHBondContact O-N 3.12Å; S321-S323 PolarHBondContact OG-OG 3.1Å; S323-Q327 WeakPolarHBondContact O-CB 3.34Å; S323-Q327 VanDerWaalsContact O-CG 3.24Å; S323-Q327 WeakPolarHBondContact O-CG 3.39Å; S323-Q327 PolarHBondContact O-N 3.43Å; S323-H440 VanDerWaalsContact CB-NE2 3.34Å; S323-H440 WeakPolarHBondContact CB-NE2 3.33Å
324	E	92.6	Very high	83.6	Confident	20 Å²	20	61.4 Å²	61.4	9%	0.093	30%	0.303	C	S	.	.	H	α-helix	trans	-71.7	-43.7	178.8	-173.3	-179.4	175.1	0	0	111	P287 A288 S289 V320 S321 V322 L326 Q327 A328 F338	P287-E324 VanDerWaalsContact CA-OE1 3.27Å; P287-E324 WeakPolarHBondContact CA-OE1 3.33Å; A288-E324 VanDerWaalsContact N-CD 3.33Å; A288-E324 PolarHBondContact N-OE1 3.05Å; A288-E324 PolarHBondContact N-OE2 3.47Å; S289-E324 VanDerWaalsContact CB-OE2 3.23Å; S289-E324 WeakPolarHBondContact CB-OE2 3.5Å; S289-E324 PolarHBondContact N-OE2 2.89Å; S289-E324 PolarHBondContact OG-OE2 3.47Å; V320-E324 HydrophobicContact CG1-CB 4.27Å; S321-E324 PolarHBondContact O-N 3.24Å; S321-E324 PolarHBondContact OG-N 2.95Å; V322-E324 VanDerWaalsContact C-N 3.33Å; V322-E324 PolarHBondContact O-N 3.31Å; E324-L326 PolarHBondContact O-N 2.85Å; E324-Q327 PolarHBondContact O-N 3Å; E324-Q327 VanDerWaalsContact O-N 3.12Å; E324-A328 HydrophobicContact CG-CB 4.45Å; E324-A328 WeakPolarHBondContact O-CB 3.38Å; E324-A328 PolarHBondContact O-N 3.33Å; E324-F338 HydrophobicContact CG-CE2 4.02Å; E324-F338 HydrophobicContact CG-CZ 4.43Å
325	I	91.3	Very high	83.5	Confident	9 Å²	9	56.5 Å²	56.5	5%	0.046	29%	0.286	C	S	.	.	H	α-helix	trans	-53.4	-44	178.4	-62.9	171.4	0	0	0	110.8	V320 S321 V322 V340 C399 A430	V320-I325 HydrophobicContact CG1-CD1 4.37Å; V320-I325 HydrophobicContact CG1-CG1 3.8Å; S321-I325 PolarHBondContact O-N 3.32Å; V322-I325 PolarHBondContact O-N 3.24Å; I325-V340 HydrophobicContact CG2-CG2 3.58Å; I325-C399 VanDerWaalsContact CD1-SG 3.54Å; I325-A430 HydrophobicContact CD1-CB 3.75Å
326	L	87.1	Confident	83.5	Confident	13 Å²	13	55.7 Å²	55.7	7%	0.068	28%	0.278	C	S	.	.	H	α-helix	trans	-71.3	-39.8	179.7	-67.7	174.4	0	0	0	112.9	V322 E324 Q330 L354 L437 L441 W456	V322-L326 WeakPolarHBondContact O-CG 3.19Å; V322-L326 PolarHBondContact O-N 3.1Å; E324-L326 PolarHBondContact O-N 2.85Å; L326-Q330 WeakPolarHBondContact O-CG 3.23Å; L326-Q330 PolarHBondContact O-NE2 3.44Å; L326-L354 HydrophobicContact CD2-CD1 4.08Å; L326-L437 HydrophobicContact CD1-CD1 3.83Å; L326-L437 HydrophobicContact CD2-CD1 4.09Å; L326-L437 HydrophobicContact CG-CD1 4.13Å; L326-L441 HydrophobicContact CD1-CD2 3.74Å; L326-L441 HydrophobicContact CD1-CG 4.46Å; L326-W456 HydrophobicContact CD2-CD2 4.33Å; L326-W456 HydrophobicContact CD2-CE3 4.14Å
327	Q	85.8	Confident	83.5	Confident	97 Å²	97	54.3 Å²	54.3	45%	0.453	27%	0.268	S	S	.	.	H	α-helix	trans	-77.2	-43.4	-176.6	-71.8	173.9	15	0	0	112.8	S323 E324 N329 Q330 L331	S323-Q327 WeakPolarHBondContact O-CB 3.34Å; S323-Q327 VanDerWaalsContact O-CG 3.24Å; S323-Q327 WeakPolarHBondContact O-CG 3.39Å; S323-Q327 PolarHBondContact O-N 3.43Å; E324-Q327 PolarHBondContact O-N 3Å; E324-Q327 VanDerWaalsContact O-N 3.12Å; Q327-N329 VanDerWaalsContact C-N 3.33Å; Q327-N329 PolarHBondContact O-N 3.16Å; Q327-Q330 PolarHBondContact O-N 2.97Å; Q327-Q330 VanDerWaalsContact O-N 3.13Å; Q327-L331 HydrophobicContact CB-CD1 4.3Å; Q327-L331 PolarHBondContact O-N 3.22Å; Q327-L331 VanDerWaalsContact O-N 3.13Å
328	A	82	Confident	83.5	Confident	8 Å²	8	54.1 Å²	54.1	7%	0.066	27%	0.267	C	S	.	.	H	α-helix	trans	-58.8	-43.7	-174.3	0	0	0	0	0	112.1	E324 Q330 Q332 V336 F338	E324-A328 HydrophobicContact CG-CB 4.45Å; E324-A328 WeakPolarHBondContact O-CB 3.38Å; E324-A328 PolarHBondContact O-N 3.33Å; A328-Q330 VanDerWaalsContact C-N 3.3Å; A328-Q330 PolarHBondContact O-N 2.88Å; A328-Q332 PolarHBondContact O-N 3.19Å; A328-V336 WeakPolarHBondContact CB-O 3.37Å; A328-F338 HydrophobicContact CB-CD2 3.88Å; A328-F338 HydrophobicContact CB-CE2 3.76Å
329	N	73.6	Confident	83.5	Confident	14 Å²	14	54.1 Å²	54.1	8%	0.075	27%	0.267	C	S	.	.	H	α-helix	trans	-74.1	-18.1	-178.8	-73.3	-8.6	0	0	0	113.7	Q327 F338 I392	Q327-N329 VanDerWaalsContact C-N 3.33Å; Q327-N329 PolarHBondContact O-N 3.16Å; N329-F338 PolarHBondContact ND2-O 2.77Å; N329-F338 PolarHBondContact OD1-N 3.07Å; N329-I392 HydrophobicContact CB-CG1 4.32Å
330	Q	72.3	Confident	83.5	Confident	104 Å²	104	52.2 Å²	52.2	49%	0.486	25%	0.251	S	S	.	.	H	α-helix	trans	-90.2	-39.2	179.1	-71.5	177.3	56.8	0	0	113.5	L326 Q327 A328 I392 W456	L326-Q330 WeakPolarHBondContact O-CG 3.23Å; L326-Q330 PolarHBondContact O-NE2 3.44Å; Q327-Q330 PolarHBondContact O-N 2.97Å; Q327-Q330 VanDerWaalsContact O-N 3.13Å; A328-Q330 VanDerWaalsContact C-N 3.3Å; A328-Q330 PolarHBondContact O-N 2.88Å; Q330-I392 HydrophobicContact CG-CD1 4.22Å; Q330-W456 VanDerWaalsContact CD-CZ2 3.42Å; Q330-W456 HydrophobicContact CG-CH2 3.6Å; Q330-W456 HydrophobicContact CG-CZ2 4.05Å
331	L	63.8	Low	83.6	Confident	136 Å²	136	52.2 Å²	52.2	71%	0.712	25%	0.251	S	S	*	.	H	α-helix	trans	-101.7	-28	-161.9	-69.5	165.4	0	0	0	114.2	Q327	Q327-L331 HydrophobicContact CB-CD1 4.3Å; Q327-L331 PolarHBondContact O-N 3.22Å; Q327-L331 VanDerWaalsContact O-N 3.13Å
332	Q	57.1	Low	83.7	Confident	102 Å²	102	51.4 Å²	51.4	48%	0.477	25%	0.245	S	C	.	.			trans	-118.2	110.4	-164.6	-65.8	-175.1	-15.1	0	0	112.4	A328 R337	A328-Q332 PolarHBondContact O-N 3.19Å; Q332-R337 WeakPolarHBondContact O-CD 3.45Å
333	R	59.6	Low	83.9	Confident	248 Å²	248	50.7 Å²	50.7	94%	0.936	24%	0.241	S	C	*	.	S	Bend	trans	-76.1	-25.6	166.9	-79.7	-172	178	-177.1	-0.2	113.1
334	E	65	Low	84	Confident	203 Å²	203	49.9 Å²	49.9	95%	0.949	23%	0.233	S	C	*	.	S	Bend	trans	-118.3	20.9	-175.7	-69.3	-173.6	160.2	0	0	113.5
335	G	80.9	Confident	84	Confident	22 Å²	22	50.7 Å²	50.7	23%	0.227	24%	0.24	C	C	.	.	S	Bend	trans	-118.5	-174.2	179.9	0	0	0	0	0	114	R337	G335-R337 PolarHBondContact O-N 3.48Å
336	V	91.8	Very high	83.9	Confident	11 Å²	11	52 Å²	52	7%	0.067	25%	0.252	C	S	.	.			trans	-60.1	123.3	173.8	175.9	0	0	0	0	109	S284 P287 A328 F338	S284-V336 WeakPolarHBondContact O-CG2 3.37Å; P287-V336 HydrophobicContact CG-CG1 4.3Å; A328-V336 WeakPolarHBondContact CB-O 3.37Å; V336-F338 HydrophobicContact CG1-CE1 3.93Å; V336-F338 HydrophobicContact CG1-CE2 3.93Å; V336-F338 HydrophobicContact CG1-CZ 3.51Å
337	R	92.3	Very high	84.1	Confident	39 Å²	39	59.4 Å²	59.4	15%	0.147	29%	0.286	C	S	.	.			trans	-126.2	141.9	175.5	-64.6	-155.7	-56.5	152.6	4.5	111	Q332 G335 S391 G394 G395 E396 H397	Q332-R337 WeakPolarHBondContact O-CD 3.45Å; G335-R337 PolarHBondContact O-N 3.48Å; R337-S391 PolarHBondContact NH1-O 3.31Å; R337-G394 PolarHBondContact NE-O 2.97Å; R337-G394 PolarHBondContact NH1-O 3.07Å; R337-G394 PolarHBondContact NH2-O 3.07Å; R337-G394 VanDerWaalsContact NH2-O 3.1Å; R337-G395 CarbonylContact O-C 3.57Å; R337-G395 WeakPolarHBondContact O-CA 3.45Å; R337-E396 PolarHBondContact O-N 3.22Å; R337-H397 WeakPolarHBondContact O-CB 3.39Å; R337-H397 PolarHBondContact O-CD2 2.94Å; R337-H397 PolarHBondContact O-N 3.23Å; R337-H397 VanDerWaalsContact O-N 3.07Å
338	F	94.7	Very high	84.3	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	125.5	-172.9	-58.9	-80.1	0	0	0	111.7	P287 V320 E324 A328 N329 V336 V340 H397 C399	P287-F338 HydrophobicContact CB-CE1 4.4Å; P287-F338 HydrophobicContact CB-CZ 3.97Å; P287-F338 HydrophobicContact CG-CE1 3.88Å; P287-F338 HydrophobicContact CG-CZ 3.91Å; V320-F338 HydrophobicContact CG1-CE1 3.97Å; V320-F338 HydrophobicContact CG1-CE2 4.24Å; V320-F338 HydrophobicContact CG1-CZ 3.7Å; V320-F338 HydrophobicContact CG2-CE1 4Å; V320-F338 HydrophobicContact CG2-CZ 4.35Å; E324-F338 HydrophobicContact CG-CE2 4.02Å; E324-F338 HydrophobicContact CG-CZ 4.43Å; A328-F338 HydrophobicContact CB-CD2 3.88Å; A328-F338 HydrophobicContact CB-CE2 3.76Å; N329-F338 PolarHBondContact ND2-O 2.77Å; N329-F338 PolarHBondContact OD1-N 3.07Å; V336-F338 HydrophobicContact CG1-CE1 3.93Å; V336-F338 HydrophobicContact CG1-CE2 3.93Å; V336-F338 HydrophobicContact CG1-CZ 3.51Å; F338-V340 HydrophobicContact CB-CG2 4.19Å; F338-H397 CarbonylContact C-O 3.4Å; F338-H397 WeakPolarHBondContact CA-O 3.46Å; F338-H397 HydrophobicContact CD1-CB 3.79Å; F338-H397 HydrophobicContact CE1-CB 4.07Å; F338-C399 HydrophobicContact CB-CB 4.21Å; F338-C399 HydrophobicContact CD1-CB 3.96Å; F338-C399 HydrophobicContact CG-CB 4.41Å
339	F	96.2	Very high	84.9	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.018	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	106.6	161	-172.7	-93.8	0	0	0	108	V341 F358 L379 A382 Q383 A393 G395 H397 L398 C399	F339-V341 HydrophobicContact CD1-CG2 3.95Å; F339-V341 HydrophobicContact CE1-CG2 4.1Å; F339-F358 HydrophobicContact CE1-CB 3.71Å; F339-F358 HydrophobicContact CE1-CG 4.28Å; F339-F358 HydrophobicContact CZ-CB 3.67Å; F339-F358 HydrophobicContact CZ-CD2 4.29Å; F339-F358 HydrophobicContact CZ-CG 4.19Å; F339-L379 HydrophobicContact CD1-CD2 4.45Å; F339-L379 HydrophobicContact CE1-CD2 4.04Å; F339-L379 HydrophobicContact CE1-CG 4.02Å; F339-A382 HydrophobicContact CZ-CB 4.13Å; F339-Q383 HydrophobicContact CB-CG 3.97Å; F339-Q383 HydrophobicContact CD1-CB 4.1Å; F339-Q383 HydrophobicContact CD1-CG 4.25Å; F339-Q383 HydrophobicContact CD2-CB 3.95Å; F339-Q383 HydrophobicContact CD2-CG 3.98Å; F339-Q383 HydrophobicContact CE1-CB 4.18Å; F339-Q383 HydrophobicContact CE2-CB 4.04Å; F339-Q383 HydrophobicContact CG-CB 3.97Å; F339-Q383 HydrophobicContact CG-CG 3.8Å; F339-Q383 HydrophobicContact CZ-CB 4.14Å; F339-A393 VanDerWaalsContact CD2-O 3.28Å; F339-A393 WeakPolarHBondContact CD2-O 3.4Å; F339-G395 WeakPolarHBondContact CB-O 3.19Å; F339-H397 PolarHBondContact N-O 3.2Å; F339-L398 HydrophobicContact CB-CD2 4.35Å; F339-L398 HydrophobicContact CD1-CD2 3.89Å; F339-C399 PolarHBondContact O-N 2.94Å; F339-C399 VanDerWaalsContact O-N 3.07Å
340	V	96.2	Very high	85.7	Confident	2 Å²	2	61 Å²	61	1%	0.012	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	131.5	-171.3	-172.3	0	0	0	0	110.2	I325 F338 L354 A357 F358 C399 M401	I325-V340 HydrophobicContact CG2-CG2 3.58Å; F338-V340 HydrophobicContact CB-CG2 4.19Å; V340-L354 HydrophobicContact CB-CD2 4.23Å; V340-L354 HydrophobicContact CG1-CD2 4.08Å; V340-L354 HydrophobicContact CG2-CD2 4.16Å; V340-A357 HydrophobicContact CB-CB 4.25Å; V340-A357 HydrophobicContact CG1-CB 4.1Å; V340-A357 CarbonylContact O-C 3.44Å; V340-A357 VanDerWaalsContact O-CA 3.29Å; V340-A357 WeakPolarHBondContact O-CA 3.23Å; V340-F358 PolarHBondContact O-N 2.88Å; V340-C399 CarbonylContact C-O 3.57Å; V340-C399 WeakPolarHBondContact CA-O 3.22Å; V340-M401 HydrophobicContact CB-CE 4.47Å; V340-M401 HydrophobicContact CG1-CE 3.14Å; V340-M401 HydrophobicContact CG1-CG 4.48Å
341	V	96.9	Very high	86.6	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	113.7	-178.2	-175.1	0	0	0	0	108.7	F339 F358 L360 L379 L398 C399 F400 M401	F339-V341 HydrophobicContact CD1-CG2 3.95Å; F339-V341 HydrophobicContact CE1-CG2 4.1Å; V341-F358 CarbonylContact C-O 3.57Å; V341-F358 WeakPolarHBondContact CA-O 3.26Å; V341-L360 HydrophobicContact CG1-CB 3.61Å; V341-L360 HydrophobicContact CG1-CD2 4.17Å; V341-L379 HydrophobicContact CB-CD1 4.41Å; V341-L379 HydrophobicContact CG1-CD1 3.65Å; V341-L379 HydrophobicContact CG2-CD1 3.81Å; V341-L379 HydrophobicContact CG2-CD2 4.41Å; V341-L379 HydrophobicContact CG2-CG 4.29Å; V341-L398 HydrophobicContact CG2-CD2 4.45Å; V341-C399 PolarHBondContact N-O 2.99Å; V341-F400 HydrophobicContact CB-CD1 3.78Å; V341-F400 HydrophobicContact CB-CE1 4.04Å; V341-F400 HydrophobicContact CB-CG 4.43Å; V341-F400 HydrophobicContact CG1-CD1 3.86Å; V341-F400 HydrophobicContact CG1-CE1 3.94Å; V341-F400 HydrophobicContact CG2-CD1 4.36Å; V341-F400 HydrophobicContact CG2-CE1 4.21Å; V341-F400 CarbonylContact O-C 3.48Å; V341-F400 WeakPolarHBondContact O-CA 3.48Å; V341-M401 PolarHBondContact O-N 2.92Å
342	D	96.4	Very high	87.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	113.9	174.8	-166	-31.2	0	0	0	109.4	R344 Y349 A357 F358 H359 L360 M401	D342-R344 VanDerWaalsContact OD1-CB 3.31Å; D342-R344 WeakPolarHBondContact OD1-CB 3.27Å; D342-R344 VanDerWaalsContact OD1-CG 3.3Å; D342-R344 WeakPolarHBondContact OD1-CG 3.39Å; D342-R344 IonicContact OD1-CZ 3.83Å; D342-R344 PolarHBondContact OD1-N 3.25Å; D342-R344 IonicContact OD1-NE 3.95Å; D342-R344 PolarHBondContact OD1-NE 2.95Å; D342-R344 IonicContact OD1-NH2 2.84Å; D342-R344 IonicContact OD2-CZ 3.6Å; D342-R344 IonicContact OD2-NE 3.99Å; D342-R344 PolarHBondContact OD2-NE 3.23Å; D342-R344 IonicContact OD2-NH2 3.77Å; D342-R344 PolarHBondContact OD2-NH2 3.22Å; D342-Y349 HydrophobicContact CB-CD2 3.78Å; D342-Y349 HydrophobicContact CB-CE2 3.94Å; D342-Y349 WeakPolarHBondContact OD2-CD2 3.28Å; D342-A357 HydrophobicContact CB-CB 4.2Å; D342-F358 PolarHBondContact N-O 3.33Å; D342-H359 PolarHBondContact O-CD2 3.27Å; D342-L360 PolarHBondContact O-N 2.75Å; D342-M401 HydrophobicContact CB-CG 3.92Å; D342-M401 HydrophobicContact CB-SD 4.21Å
343	C	95.6	Very high	89.3	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.007	24%	0.244	C	C	.	.			trans	-95.6	3.5	-176	-78.7	0	0	0	0	114.4	L360 S362 M401 M412	C343-L360 VanDerWaalsContact CA-O 3.26Å; C343-L360 WeakPolarHBondContact CA-O 3.32Å; C343-S362 VanDerWaalsContact O-CB 3.24Å; C343-S362 WeakPolarHBondContact O-CB 3.42Å; C343-S362 PolarHBondContact O-N 3.43Å; C343-S362 PolarHBondContact O-OG 3.06Å; C343-M401 PolarHBondContact N-O 3.22Å; C343-M412 HydrophobicContact CB-CB 4.13Å; C343-M412 HydrophobicContact CB-CG 4.12Å
344	R	94.1	Very high	90.8	Very high	14 Å²	14	37.1 Å²	37.1	5%	0.053	20%	0.201	C	C	.	.	S	Bend	trans	-73	157.3	-178.3	-60.5	176.8	-60.7	148.8	-1.6	111.3	D342 Q348 G352 H359 F434	D342-R344 VanDerWaalsContact OD1-CB 3.31Å; D342-R344 WeakPolarHBondContact OD1-CB 3.27Å; D342-R344 VanDerWaalsContact OD1-CG 3.3Å; D342-R344 WeakPolarHBondContact OD1-CG 3.39Å; D342-R344 IonicContact OD1-CZ 3.83Å; D342-R344 PolarHBondContact OD1-N 3.25Å; D342-R344 IonicContact OD1-NE 3.95Å; D342-R344 PolarHBondContact OD1-NE 2.95Å; D342-R344 IonicContact OD1-NH2 2.84Å; D342-R344 IonicContact OD2-CZ 3.6Å; D342-R344 IonicContact OD2-NE 3.99Å; D342-R344 PolarHBondContact OD2-NE 3.23Å; D342-R344 IonicContact OD2-NH2 3.77Å; D342-R344 PolarHBondContact OD2-NH2 3.22Å; R344-Q348 HydrophobicContact CB-CB 4.02Å; R344-G352 PolarHBondContact NH2-O 3.31Å; R344-H359 PolarHBondContact O-NE2 2.83Å; R344-F434 VanDerWaalsContact CZ-CG 3.48Å
345	P	91.7	Very high	91.8	Very high	37 Å²	37	30.2 Å²	30.2	24%	0.24	18%	0.175	C	C	.	.			trans	-54.3	149.5	173.9	-26.5	35	0	0	0	112.3	E347 Q348 Y349	P345-E347 PolarHBondContact O-N 3.38Å; P345-Q348 PolarHBondContact O-N 3.19Å; P345-Y349 PolarHBondContact O-N 2.97Å; P345-Y349 VanDerWaalsContact O-N 3.08Å
346	A	90.1	Very high	92.1	Very high	36 Å²	36	30.3 Å²	30.3	30%	0.298	17%	0.171	S	C	.	.	H	α-helix	trans	-51.1	-35.9	-178.2	0	0	0	0	0	113.7	N350 D361	A346-N350 WeakPolarHBondContact O-CB 3.47Å; A346-N350 PolarHBondContact O-N 2.85Å; A346-N350 PolarHBondContact O-ND2 3.23Å; A346-D361 PolarHBondContact N-OD2 3.06Å
347	E	90.3	Very high	92.2	Very high	170 Å²	170	30.1 Å²	30.1	79%	0.794	17%	0.171	S	C	*	.	H	α-helix	trans	-61.6	-45.3	177.3	-63.7	-171.9	173.6	0	0	112.4	P345 A351	P345-E347 PolarHBondContact O-N 3.38Å; E347-A351 PolarHBondContact O-N 2.71Å; E347-A351 VanDerWaalsContact O-N 3.1Å
348	Q	90.9	Very high	92.4	Very high	60 Å²	60	30.6 Å²	30.6	28%	0.28	17%	0.174	S	C	.	.	H	α-helix	trans	-69.8	-41.7	179.4	-60.9	-168.2	10.2	0	0	111.7	R344 P345 N350 A351 G352 E408	R344-Q348 HydrophobicContact CB-CB 4.02Å; P345-Q348 PolarHBondContact O-N 3.19Å; Q348-N350 VanDerWaalsContact C-N 3.35Å; Q348-N350 PolarHBondContact O-N 2.65Å; Q348-A351 WeakPolarHBondContact O-CB 3.31Å; Q348-A351 PolarHBondContact O-N 3Å; Q348-G352 PolarHBondContact O-N 2.65Å; Q348-E408 PolarHBondContact NE2-OE2 3.44Å
349	Y	92.7	Very high	92.4	Very high	34 Å²	34	33.1 Å²	33.1	13%	0.133	19%	0.185	C	C	.	.	H	α-helix	trans	-58.9	-46.5	175.5	179.4	-93.9	0	0	0	111.5	D342 P345 A351 G352 H353 A357 H359	D342-Y349 HydrophobicContact CB-CD2 3.78Å; D342-Y349 HydrophobicContact CB-CE2 3.94Å; D342-Y349 WeakPolarHBondContact OD2-CD2 3.28Å; P345-Y349 PolarHBondContact O-N 2.97Å; P345-Y349 VanDerWaalsContact O-N 3.08Å; Y349-A351 VanDerWaalsContact C-N 3.32Å; Y349-A351 PolarHBondContact O-N 3.34Å; Y349-G352 CarbonylContact O-C 3.58Å; Y349-G352 VanDerWaalsContact O-C 3.29Å; Y349-G352 PolarHBondContact O-N 3.01Å; Y349-H353 AromaticContact CD1-ND1 3.86Å; Y349-H353 HydrophobicContact CD2-CB 3.42Å; Y349-H353 VanDerWaalsContact CD2-CB 3.42Å; Y349-H353 AromaticContact CD2-CG 3.72Å; Y349-H353 AromaticContact CE1-CD2 3.89Å; Y349-H353 AromaticContact CE1-CE1 3.62Å; Y349-H353 AromaticContact CE1-CG 3.82Å; Y349-H353 AromaticContact CE1-ND1 3.64Å; Y349-H353 AromaticContact CE1-NE2 3.8Å; Y349-H353 HydrophobicContact CE2-CB 3.42Å; Y349-H353 VanDerWaalsContact CE2-CB 3.42Å; Y349-H353 AromaticContact CE2-CD2 3.44Å; Y349-H353 VanDerWaalsContact CE2-CD2 3.44Å; Y349-H353 WeakPolarHBondContact CE2-CD2 3.47Å; Y349-H353 AromaticContact CE2-CG 3.35Å; Y349-H353 HydrophobicContact CG-CB 4.05Å; Y349-H353 AromaticContact CZ-CD2 3.21Å; Y349-H353 AromaticContact CZ-CE1 3.76Å; Y349-H353 AromaticContact CZ-CG 3.41Å; Y349-H353 VanDerWaalsContact CZ-CG 3.41Å; Y349-H353 AromaticContact CZ-ND1 3.73Å; Y349-H353 AromaticContact CZ-NE2 3.49Å; Y349-H353 PolarHBondContact O-ND1 2.89Å; Y349-H353 PolarHBondContact OH-CD2 3.48Å; Y349-H353 PolarHBondContact OH-NE2 3.46Å; Y349-A357 PolarHBondContact OH-O 3.33Å; Y349-H359 HydrophobicContact CD1-CB 4.2Å; Y349-H359 AromaticContact CD1-CG 3.91Å; Y349-H359 HydrophobicContact CD2-CB 3.94Å; Y349-H359 AromaticContact CD2-CD2 3.51Å; Y349-H359 AromaticContact CD2-CG 3.8Å; Y349-H359 HydrophobicContact CE1-CB 3.93Å; Y349-H359 HydrophobicContact CE2-CB 3.65Å; Y349-H359 HydrophobicContact CG-CB 4.2Å; Y349-H359 AromaticContact CG-CD2 3.53Å; Y349-H359 AromaticContact CG-CG 3.73Å; Y349-H359 AromaticContact CG-NE2 3.99Å
350	N	92.1	Very high	92.4	Very high	59 Å²	59	32.9 Å²	32.9	32%	0.316	18%	0.184	S	C	.	.	H	α-helix	trans	-69.6	-27.3	-179.1	-77	-49	0	0	0	113.6	A346 Q348 G352 T460	A346-N350 WeakPolarHBondContact O-CB 3.47Å; A346-N350 PolarHBondContact O-N 2.85Å; A346-N350 PolarHBondContact O-ND2 3.23Å; Q348-N350 VanDerWaalsContact C-N 3.35Å; Q348-N350 PolarHBondContact O-N 2.65Å; N350-G352 VanDerWaalsContact C-N 3.33Å; N350-T460 WeakPolarHBondContact CA-OG1 3.47Å; N350-T460 WeakPolarHBondContact CB-OG1 3.29Å; N350-T460 VanDerWaalsContact CG-OG1 3.23Å; N350-T460 PolarHBondContact O-N 3.32Å; N350-T460 VanDerWaalsContact O-N 3.12Å; N350-T460 PolarHBondContact O-OG1 2.96Å; N350-T460 PolarHBondContact OD1-OG1 2.69Å
351	A	90.1	Very high	92.1	Very high	63 Å²	63	34 Å²	34	52%	0.521	19%	0.19	S	C	.	.	H	α-helix	trans	-65.3	-38.5	172.6	0	0	0	0	0	111.6	E347 Q348 Y349 S459	E347-A351 PolarHBondContact O-N 2.71Å; E347-A351 VanDerWaalsContact O-N 3.1Å; Q348-A351 WeakPolarHBondContact O-CB 3.31Å; Q348-A351 PolarHBondContact O-N 3Å; Y349-A351 VanDerWaalsContact C-N 3.32Å; Y349-A351 PolarHBondContact O-N 3.34Å; A351-S459 WeakPolarHBondContact O-CB 3.09Å; A351-S459 PolarHBondContact O-OG 3.03Å
352	G	88.1	Confident	91.7	Very high	6 Å²	6	34.2 Å²	34.2	6%	0.062	19%	0.192	C	C	.	.			trans	177.6	133.9	173.4	0	0	0	0	0	111.2	R344 Q348 Y349 N350 F434 A458	R344-G352 PolarHBondContact NH2-O 3.31Å; Q348-G352 PolarHBondContact O-N 2.65Å; Y349-G352 CarbonylContact O-C 3.58Å; Y349-G352 VanDerWaalsContact O-C 3.29Å; Y349-G352 PolarHBondContact O-N 3.01Å; N350-G352 VanDerWaalsContact C-N 3.33Å; G352-F434 WeakPolarHBondContact O-CE1 3.43Å; G352-F434 WeakPolarHBondContact O-CZ 3.32Å; G352-A458 CarbonylContact C-O 3.58Å; G352-A458 VanDerWaalsContact CA-O 3.3Å; G352-A458 WeakPolarHBondContact CA-O 3.18Å
353	H	90.6	Very high	91.2	Very high	15 Å²	15	36.4 Å²	36.4	7%	0.069	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	164.2	-179.8	59.7	-83.3	0	0	0	111.4	Y349 S355 I457 A458	Y349-H353 AromaticContact CD1-ND1 3.86Å; Y349-H353 HydrophobicContact CD2-CB 3.42Å; Y349-H353 VanDerWaalsContact CD2-CB 3.42Å; Y349-H353 AromaticContact CD2-CG 3.72Å; Y349-H353 AromaticContact CE1-CD2 3.89Å; Y349-H353 AromaticContact CE1-CE1 3.62Å; Y349-H353 AromaticContact CE1-CG 3.82Å; Y349-H353 AromaticContact CE1-ND1 3.64Å; Y349-H353 AromaticContact CE1-NE2 3.8Å; Y349-H353 HydrophobicContact CE2-CB 3.42Å; Y349-H353 VanDerWaalsContact CE2-CB 3.42Å; Y349-H353 AromaticContact CE2-CD2 3.44Å; Y349-H353 VanDerWaalsContact CE2-CD2 3.44Å; Y349-H353 WeakPolarHBondContact CE2-CD2 3.47Å; Y349-H353 AromaticContact CE2-CG 3.35Å; Y349-H353 HydrophobicContact CG-CB 4.05Å; Y349-H353 AromaticContact CZ-CD2 3.21Å; Y349-H353 AromaticContact CZ-CE1 3.76Å; Y349-H353 AromaticContact CZ-CG 3.41Å; Y349-H353 VanDerWaalsContact CZ-CG 3.41Å; Y349-H353 AromaticContact CZ-ND1 3.73Å; Y349-H353 AromaticContact CZ-NE2 3.49Å; Y349-H353 PolarHBondContact O-ND1 2.89Å; Y349-H353 PolarHBondContact OH-CD2 3.48Å; Y349-H353 PolarHBondContact OH-NE2 3.46Å; H353-S355 PolarHBondContact O-N 3.35Å; H353-I457 CarbonylContact O-C 3.57Å; H353-I457 WeakPolarHBondContact O-CA 3.19Å; H353-A458 PolarHBondContact CE1-O 3.05Å; H353-A458 PolarHBondContact N-O 2.84Å; H353-A458 PolarHBondContact ND1-O 2.8Å; H353-A458 VanDerWaalsContact ND1-O 3.15Å; H353-A458 PolarHBondContact O-N 2.81Å
354	L	89.6	Confident	90.8	Very high	4 Å²	4	37.7 Å²	37.7	2%	0.021	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	124.9	171.9	-177.8	70.4	0	0	0	109.6	L326 V340 T356 A357 M401 L437 W456	L326-L354 HydrophobicContact CD2-CD1 4.08Å; V340-L354 HydrophobicContact CB-CD2 4.23Å; V340-L354 HydrophobicContact CG1-CD2 4.08Å; V340-L354 HydrophobicContact CG2-CD2 4.16Å; L354-T356 PolarHBondContact O-N 3.11Å; L354-A357 HydrophobicContact CB-CB 4.02Å; L354-A357 HydrophobicContact CD2-CB 4.5Å; L354-A357 WeakPolarHBondContact O-CB 3.46Å; L354-A357 PolarHBondContact O-N 3.02Å; L354-M401 HydrophobicContact CB-CE 3.78Å; L354-M401 HydrophobicContact CD2-CE 3.89Å; L354-L437 HydrophobicContact CB-CD2 4.13Å; L354-L437 HydrophobicContact CD1-CD2 4.22Å; L354-W456 CarbonylContact C-O 3.48Å; L354-W456 WeakPolarHBondContact CA-O 3.29Å; L354-W456 HydrophobicContact CD1-CB 4.35Å; L354-W456 HydrophobicContact CD1-CE3 4.28Å
355	S	86.7	Confident	90.4	Very high	58 Å²	58	38.4 Å²	38.4	41%	0.406	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-20	-172.1	61.2	0	0	0	0	115	H353 W456	H353-S355 PolarHBondContact O-N 3.35Å; S355-W456 PolarHBondContact N-O 2.99Å; S355-W456 PolarHBondContact OG-O 2.98Å
356	T	88.2	Confident	90	Very high	23 Å²	23	41.4 Å²	41.4	14%	0.141	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-1.4	179	58.6	0	0	0	0	113.3	L354 I392 A393	L354-T356 PolarHBondContact O-N 3.11Å; T356-I392 HydrophobicContact CG2-CG2 3.85Å; T356-A393 HydrophobicContact CG2-CB 4.3Å
357	A	93.1	Very high	89.9	Confident	8 Å²	8	46.8 Å²	46.8	7%	0.066	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-84.5	136.5	-175.6	0	0	0	0	0	112.1	V340 D342 Y349 L354 M401	V340-A357 HydrophobicContact CB-CB 4.25Å; V340-A357 HydrophobicContact CG1-CB 4.1Å; V340-A357 CarbonylContact O-C 3.44Å; V340-A357 VanDerWaalsContact O-CA 3.29Å; V340-A357 WeakPolarHBondContact O-CA 3.23Å; D342-A357 HydrophobicContact CB-CB 4.2Å; Y349-A357 PolarHBondContact OH-O 3.33Å; L354-A357 HydrophobicContact CB-CB 4.02Å; L354-A357 HydrophobicContact CD2-CB 4.5Å; L354-A357 WeakPolarHBondContact O-CB 3.46Å; L354-A357 PolarHBondContact O-N 3.02Å; A357-M401 HydrophobicContact CB-CE 4.18Å
358	F	95.6	Very high	89.9	Confident	49 Å²	49	41.4 Å²	41.4	22%	0.215	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	130.9	169	-176	-83.5	0	0	0	109.5	F339 V340 V341 D342 L360 L379 A382	F339-F358 HydrophobicContact CE1-CB 3.71Å; F339-F358 HydrophobicContact CE1-CG 4.28Å; F339-F358 HydrophobicContact CZ-CB 3.67Å; F339-F358 HydrophobicContact CZ-CD2 4.29Å; F339-F358 HydrophobicContact CZ-CG 4.19Å; V340-F358 PolarHBondContact O-N 2.88Å; V341-F358 CarbonylContact C-O 3.57Å; V341-F358 WeakPolarHBondContact CA-O 3.26Å; D342-F358 PolarHBondContact N-O 3.33Å; F358-L360 HydrophobicContact CD1-CB 4.44Å; F358-L360 HydrophobicContact CE1-CB 4.46Å; F358-L379 HydrophobicContact CD1-CB 3.91Å; F358-L379 HydrophobicContact CD1-CD1 3.87Å; F358-L379 HydrophobicContact CD1-CG 3.82Å; F358-L379 HydrophobicContact CE1-CB 3.58Å; F358-L379 HydrophobicContact CE1-CD1 4.1Å; F358-L379 HydrophobicContact CE1-CG 4.02Å; F358-L379 HydrophobicContact CE2-CB 4.45Å; F358-L379 HydrophobicContact CG-CB 4.49Å; F358-L379 HydrophobicContact CG-CG 4.31Å; F358-L379 HydrophobicContact CZ-CB 3.88Å; F358-A382 HydrophobicContact CD2-CB 3.93Å; F358-A382 HydrophobicContact CE2-CB 4.03Å
359	H	96.1	Very high	89.8	Confident	52 Å²	52	42.4 Å²	42.4	24%	0.241	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	122.8	177.3	-173.9	-133.2	0	0	0	111.1	D342 R344 Y349	D342-H359 PolarHBondContact O-CD2 3.27Å; R344-H359 PolarHBondContact O-NE2 2.83Å; Y349-H359 HydrophobicContact CD1-CB 4.2Å; Y349-H359 AromaticContact CD1-CG 3.91Å; Y349-H359 HydrophobicContact CD2-CB 3.94Å; Y349-H359 AromaticContact CD2-CD2 3.51Å; Y349-H359 AromaticContact CD2-CG 3.8Å; Y349-H359 HydrophobicContact CE1-CB 3.93Å; Y349-H359 HydrophobicContact CE2-CB 3.65Å; Y349-H359 HydrophobicContact CG-CB 4.2Å; Y349-H359 AromaticContact CG-CD2 3.53Å; Y349-H359 AromaticContact CG-CG 3.73Å; Y349-H359 AromaticContact CG-NE2 3.99Å
360	L	94.7	Very high	89.7	Confident	0 Å²	0	45 Å²	45	0%	0	26%	0.259	C	S	.	.			trans	-127.7	91.2	171.9	179.1	67.3	0	0	0	108.7	V341 D342 C343 F358 S362 F372 V376 L379 F400 V415 F419	V341-L360 HydrophobicContact CG1-CB 3.61Å; V341-L360 HydrophobicContact CG1-CD2 4.17Å; D342-L360 PolarHBondContact O-N 2.75Å; C343-L360 VanDerWaalsContact CA-O 3.26Å; C343-L360 WeakPolarHBondContact CA-O 3.32Å; F358-L360 HydrophobicContact CD1-CB 4.44Å; F358-L360 HydrophobicContact CE1-CB 4.46Å; L360-S362 PolarHBondContact O-N 2.96Å; L360-S362 VanDerWaalsContact O-N 3.11Å; L360-F372 HydrophobicContact CD1-CD2 4.14Å; L360-F372 HydrophobicContact CD1-CE2 3.96Å; L360-F372 HydrophobicContact CD2-CE2 4.04Å; L360-F372 HydrophobicContact CD2-CZ 4.45Å; L360-F372 HydrophobicContact CG-CE2 4.07Å; L360-V376 HydrophobicContact CD1-CG2 4.24Å; L360-V376 HydrophobicContact CD2-CG2 4.39Å; L360-L379 HydrophobicContact CB-CD1 4.29Å; L360-L379 HydrophobicContact CD2-CD1 3.86Å; L360-F400 HydrophobicContact CD2-CE1 4.46Å; L360-V415 HydrophobicContact CD2-CG1 3.82Å; L360-F419 HydrophobicContact CD2-CE2 4.19Å; L360-F419 HydrophobicContact CD2-CZ 4.49Å
361	D	91.8	Very high	89.7	Confident	25 Å²	25	45.7 Å²	45.7	13%	0.134	26%	0.26	C	S	.	.			trans	-59.3	116.6	-179	-163.4	-31.8	0	0	0	111.4	A346 D363 L364	A346-D361 PolarHBondContact N-OD2 3.06Å; D361-D363 VanDerWaalsContact C-N 3.27Å; D361-D363 PolarHBondContact O-N 3.15Å; D361-D363 WeakPolarHBondContact OD1-CB 3.42Å; D361-D363 PolarHBondContact OD1-N 3.1Å; D361-L364 HydrophobicContact CB-CD1 3.92Å; D361-L364 HydrophobicContact CB-CG 3.99Å; D361-L364 WeakPolarHBondContact O-CB 3.31Å; D361-L364 PolarHBondContact O-N 3.2Å
362	S	87.5	Confident	89.7	Confident	5 Å²	5	43.1 Å²	43.1	4%	0.035	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-22.4	-176.9	53.9	0	0	0	0	113.1	C343 L360 L364 M365	C343-S362 VanDerWaalsContact O-CB 3.24Å; C343-S362 WeakPolarHBondContact O-CB 3.42Å; C343-S362 PolarHBondContact O-N 3.43Å; C343-S362 PolarHBondContact O-OG 3.06Å; L360-S362 PolarHBondContact O-N 2.96Å; L360-S362 VanDerWaalsContact O-N 3.11Å; S362-L364 PolarHBondContact O-N 2.83Å; S362-M365 WeakPolarHBondContact O-CB 3.2Å; S362-M365 PolarHBondContact O-N 3.38Å
363	D	86	Confident	89.8	Confident	45 Å²	45	44.4 Å²	44.4	24%	0.241	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-29.6	177.1	-72.3	-20.4	0	0	0	111.8	D361 M365 L366 Q367	D361-D363 VanDerWaalsContact C-N 3.27Å; D361-D363 PolarHBondContact O-N 3.15Å; D361-D363 WeakPolarHBondContact OD1-CB 3.42Å; D361-D363 PolarHBondContact OD1-N 3.1Å; D363-M365 PolarHBondContact O-N 2.86Å; D363-L366 PolarHBondContact O-N 2.84Å; D363-Q367 WeakPolarHBondContact O-CB 3.4Å; D363-Q367 WeakPolarHBondContact O-CG 3.41Å; D363-Q367 PolarHBondContact O-N 2.87Å
364	L	86.8	Confident	89.9	Confident	29 Å²	29	48.7 Å²	48.7	15%	0.152	27%	0.267	C	S	.	.	H	α-helix	trans	-60.6	-29.2	179.1	-67.9	175	0	0	0	112.3	D361 S362 L366 N368 E371 F372	D361-L364 HydrophobicContact CB-CD1 3.92Å; D361-L364 HydrophobicContact CB-CG 3.99Å; D361-L364 WeakPolarHBondContact O-CB 3.31Å; D361-L364 PolarHBondContact O-N 3.2Å; S362-L364 PolarHBondContact O-N 2.83Å; L364-L366 VanDerWaalsContact C-N 3.26Å; L364-L366 PolarHBondContact O-N 3.44Å; L364-N368 CarbonylContact O-C 2.97Å; L364-N368 WeakPolarHBondContact O-CA 3.49Å; L364-N368 PolarHBondContact O-N 3.08Å; L364-N368 VanDerWaalsContact O-O 3.05Å; L364-E371 HydrophobicContact CD1-CG 4.28Å; L364-E371 HydrophobicContact CD2-CG 4.26Å; L364-F372 HydrophobicContact CB-CB 4.06Å; L364-F372 HydrophobicContact CB-CD2 4.37Å
365	M	85.3	Confident	90	Very high	28 Å²	28	49.9 Å²	49.9	14%	0.138	28%	0.276	C	S	.	.	H	α-helix	trans	-63.5	-33.1	-176.9	-174.4	-169.6	60.7	0	0	112.3	S362 D363 F372 M414 V415	S362-M365 WeakPolarHBondContact O-CB 3.2Å; S362-M365 PolarHBondContact O-N 3.38Å; D363-M365 PolarHBondContact O-N 2.86Å; M365-F372 HydrophobicContact CB-CD1 4.33Å; M365-F372 HydrophobicContact CB-CD2 3.82Å; M365-F372 HydrophobicContact CB-CE1 4.46Å; M365-F372 HydrophobicContact CB-CE2 3.97Å; M365-F372 HydrophobicContact CB-CG 4.01Å; M365-F372 HydrophobicContact CB-CZ 4.28Å; M365-F372 HydrophobicContact CG-CD1 4.21Å; M365-F372 HydrophobicContact CG-CD2 4.49Å; M365-F372 HydrophobicContact CG-CE1 4.11Å; M365-F372 HydrophobicContact CG-CE2 4.4Å; M365-F372 HydrophobicContact CG-CG 4.39Å; M365-F372 HydrophobicContact CG-CZ 4.21Å; M365-F372 HydrophobicContact SD-CZ 4.48Å; M365-M414 HydrophobicContact CE-CB 3.18Å; M365-M414 HydrophobicContact CE-CE 3.62Å; M365-M414 HydrophobicContact CE-CG 4Å; M365-M414 HydrophobicContact CE-SD 3.63Å; M365-M414 HydrophobicContact SD-CB 3.85Å; M365-V415 HydrophobicContact SD-CG2 4.13Å
366	L	84.5	Confident	90.3	Very high	100 Å²	100	47.4 Å²	47.4	52%	0.524	26%	0.258	S	S	.	.	H	α-helix	trans	-95.3	-38.9	175.9	-67	177.5	0	0	0	112.5	D363 L364 Y411 M414	D363-L366 PolarHBondContact O-N 2.84Å; L364-L366 VanDerWaalsContact C-N 3.26Å; L364-L366 PolarHBondContact O-N 3.44Å; L366-Y411 HydrophobicContact CD1-CD1 3.78Å; L366-Y411 HydrophobicContact CD1-CE1 3.44Å; L366-Y411 VanDerWaalsContact CD1-CE1 3.44Å; L366-M414 HydrophobicContact CD2-CE 4.09Å
367	Q	87.8	Confident	90.5	Very high	149 Å²	149	51 Å²	51	70%	0.696	27%	0.272	S	S	*	.	H	α-helix	trans	-79.1	-41.1	-173.8	-63.8	-178.6	15.2	0	0	112.6	D363	D363-Q367 WeakPolarHBondContact O-CB 3.4Å; D363-Q367 WeakPolarHBondContact O-CG 3.41Å; D363-Q367 PolarHBondContact O-N 2.87Å
368	N	89.6	Confident	90.6	Very high	57 Å²	57	52.9 Å²	52.9	31%	0.305	28%	0.284	S	S	.	.			trans	-146.4	79.5	-177.6	-166.7	-4.1	0	0	0	112.3	L364 S370 E371 F372	L364-N368 CarbonylContact O-C 2.97Å; L364-N368 WeakPolarHBondContact O-CA 3.49Å; L364-N368 PolarHBondContact O-N 3.08Å; L364-N368 VanDerWaalsContact O-O 3.05Å; N368-S370 PolarHBondContact O-N 3.16Å; N368-S370 PolarHBondContact OD1-OG 2.89Å; N368-E371 HydrophobicContact CB-CB 4.1Å; N368-E371 WeakPolarHBondContact ND2-CB 3.21Å; N368-E371 PolarHBondContact ND2-OE2 2.98Å; N368-E371 PolarHBondContact O-N 3.39Å; N368-F372 PolarHBondContact O-N 3.45Å
369	P	89.9	Confident	90.5	Very high	81 Å²	81	50.5 Å²	50.5	53%	0.526	27%	0.274	S	S	.	.	H	α-helix	trans	-57.6	-28.2	-176.2	-26.3	33.9	0	0	0	114.5	A373	P369-A373 WeakPolarHBondContact O-CB 3.43Å; P369-A373 PolarHBondContact O-N 3.1Å
370	S	89.9	Confident	90.4	Very high	90 Å²	90	49.4 Å²	49.4	63%	0.629	27%	0.27	S	S	*	.	H	α-helix	trans	-68.6	-40.4	178.9	69.9	0	0	0	0	112.3	N368 Q374	N368-S370 PolarHBondContact O-N 3.16Å; N368-S370 PolarHBondContact OD1-OG 2.89Å; S370-Q374 PolarHBondContact O-N 3.36Å
371	E	91.1	Very high	90.4	Very high	73 Å²	73	54.5 Å²	54.5	34%	0.341	29%	0.294	S	S	.	.	H	α-helix	trans	-74	-37.4	177.1	-174.7	173.9	-174.8	0	0	111.3	L364 N368 A373 Q374 S375	L364-E371 HydrophobicContact CD1-CG 4.28Å; L364-E371 HydrophobicContact CD2-CG 4.26Å; N368-E371 HydrophobicContact CB-CB 4.1Å; N368-E371 WeakPolarHBondContact ND2-CB 3.21Å; N368-E371 PolarHBondContact ND2-OE2 2.98Å; N368-E371 PolarHBondContact O-N 3.39Å; E371-A373 PolarHBondContact O-N 2.85Å; E371-Q374 PolarHBondContact O-N 2.76Å; E371-S375 WeakPolarHBondContact O-CB 3.47Å; E371-S375 PolarHBondContact O-N 3.49Å; E371-S375 PolarHBondContact O-OG 2.8Å
372	F	91.1	Very high	90.4	Very high	8 Å²	8	54.5 Å²	54.5	4%	0.035	30%	0.297	C	S	.	.	H	α-helix	trans	-57.9	-48.4	170.9	179.6	-100.1	0	0	0	111.5	L360 L364 M365 N368 Q374 S375 V376 V415	L360-F372 HydrophobicContact CD1-CD2 4.14Å; L360-F372 HydrophobicContact CD1-CE2 3.96Å; L360-F372 HydrophobicContact CD2-CE2 4.04Å; L360-F372 HydrophobicContact CD2-CZ 4.45Å; L360-F372 HydrophobicContact CG-CE2 4.07Å; L364-F372 HydrophobicContact CB-CB 4.06Å; L364-F372 HydrophobicContact CB-CD2 4.37Å; M365-F372 HydrophobicContact CB-CD1 4.33Å; M365-F372 HydrophobicContact CB-CD2 3.82Å; M365-F372 HydrophobicContact CB-CE1 4.46Å; M365-F372 HydrophobicContact CB-CE2 3.97Å; M365-F372 HydrophobicContact CB-CG 4.01Å; M365-F372 HydrophobicContact CB-CZ 4.28Å; M365-F372 HydrophobicContact CG-CD1 4.21Å; M365-F372 HydrophobicContact CG-CD2 4.49Å; M365-F372 HydrophobicContact CG-CE1 4.11Å; M365-F372 HydrophobicContact CG-CE2 4.4Å; M365-F372 HydrophobicContact CG-CG 4.39Å; M365-F372 HydrophobicContact CG-CZ 4.21Å; M365-F372 HydrophobicContact SD-CZ 4.48Å; N368-F372 PolarHBondContact O-N 3.45Å; F372-Q374 VanDerWaalsContact C-N 3.31Å; F372-Q374 PolarHBondContact O-N 3.29Å; F372-S375 WeakPolarHBondContact O-CB 3.46Å; F372-S375 PolarHBondContact O-N 3.16Å; F372-S375 VanDerWaalsContact O-N 3.08Å; F372-V376 HydrophobicContact CD1-CG2 4.14Å; F372-V376 HydrophobicContact CE1-CG2 3.7Å; F372-V376 HydrophobicContact CE2-CG2 4.21Å; F372-V376 HydrophobicContact CZ-CG2 3.74Å; F372-V376 WeakPolarHBondContact O-CG2 3.44Å; F372-V376 PolarHBondContact O-N 2.68Å; F372-V415 HydrophobicContact CE2-CG1 4.5Å; F372-V415 HydrophobicContact CE2-CG2 3.94Å; F372-V415 HydrophobicContact CZ-CG1 4.26Å; F372-V415 HydrophobicContact CZ-CG2 4.09Å
373	A	90.2	Very high	90.7	Very high	34 Å²	34	55.5 Å²	55.5	28%	0.281	30%	0.301	S	S	.	.	H	α-helix	trans	-60.5	-39.2	178.2	0	0	0	0	0	112.7	P369 E371 S375 V376 K377 L523	P369-A373 WeakPolarHBondContact O-CB 3.43Å; P369-A373 PolarHBondContact O-N 3.1Å; E371-A373 PolarHBondContact O-N 2.85Å; A373-S375 VanDerWaalsContact C-N 3.35Å; A373-V376 PolarHBondContact O-N 3.04Å; A373-K377 PolarHBondContact O-N 2.69Å; A373-L523 HydrophobicContact CB-CD1 4.38Å
374	Q	91.8	Very high	91	Very high	104 Å²	104	59.5 Å²	59.5	49%	0.486	32%	0.316	S	S	.	.	H	α-helix	trans	-68.3	-35.5	175.2	-175.1	58.8	25.4	0	0	112.1	S370 E371 F372 K377 S378	S370-Q374 PolarHBondContact O-N 3.36Å; E371-Q374 PolarHBondContact O-N 2.76Å; F372-Q374 VanDerWaalsContact C-N 3.31Å; F372-Q374 PolarHBondContact O-N 3.29Å; Q374-K377 PolarHBondContact O-N 2.81Å; Q374-S378 WeakPolarHBondContact O-CB 3.4Å; Q374-S378 PolarHBondContact O-N 3.18Å; Q374-S378 PolarHBondContact O-OG 3.15Å
375	S	92.3	Very high	91.3	Very high	30 Å²	30	63.3 Å²	63.3	21%	0.21	33%	0.333	C	S	.	.	H	α-helix	trans	-67	-42.6	175.2	-59	0	0	0	0	111.5	E371 F372 A373 K377 S378 L379	E371-S375 WeakPolarHBondContact O-CB 3.47Å; E371-S375 PolarHBondContact O-N 3.49Å; E371-S375 PolarHBondContact O-OG 2.8Å; F372-S375 WeakPolarHBondContact O-CB 3.46Å; F372-S375 PolarHBondContact O-N 3.16Å; F372-S375 VanDerWaalsContact O-N 3.08Å; A373-S375 VanDerWaalsContact C-N 3.35Å; S375-K377 VanDerWaalsContact C-N 3.34Å; S375-K377 PolarHBondContact O-N 3.35Å; S375-S378 WeakPolarHBondContact O-CB 3.36Å; S375-S378 PolarHBondContact O-N 3.16Å; S375-L379 WeakPolarHBondContact O-CB 3.41Å; S375-L379 PolarHBondContact O-N 2.89Å
376	V	92.9	Very high	91.5	Very high	5 Å²	5	63 Å²	63	3%	0.03	33%	0.334	C	S	.	.	H	α-helix	trans	-61.7	-40.9	173.6	171.9	0	0	0	0	111.6	L360 F372 A373 S378 L379 L380 F419	L360-V376 HydrophobicContact CD1-CG2 4.24Å; L360-V376 HydrophobicContact CD2-CG2 4.39Å; F372-V376 HydrophobicContact CD1-CG2 4.14Å; F372-V376 HydrophobicContact CE1-CG2 3.7Å; F372-V376 HydrophobicContact CE2-CG2 4.21Å; F372-V376 HydrophobicContact CZ-CG2 3.74Å; F372-V376 WeakPolarHBondContact O-CG2 3.44Å; F372-V376 PolarHBondContact O-N 2.68Å; A373-V376 PolarHBondContact O-N 3.04Å; V376-S378 VanDerWaalsContact C-N 3.34Å; V376-S378 PolarHBondContact O-N 2.79Å; V376-L379 WeakPolarHBondContact O-CB 3.48Å; V376-L379 PolarHBondContact O-N 2.92Å; V376-L380 WeakPolarHBondContact O-CG 3.44Å; V376-L380 PolarHBondContact O-N 2.94Å; V376-L380 VanDerWaalsContact O-N 3.13Å; V376-F419 HydrophobicContact CG1-CE1 4.31Å; V376-F419 HydrophobicContact CG1-CZ 3.9Å; V376-F419 HydrophobicContact CG2-CE2 4.33Å; V376-F419 HydrophobicContact CG2-CZ 4.19Å
377	K	92.6	Very high	91.7	Very high	100 Å²	100	60.9 Å²	60.9	44%	0.435	32%	0.323	S	S	.	.	H	α-helix	trans	-61	-45.6	174.1	-173.8	-176.4	176.8	-176.5	0	111.4	A373 Q374 S375 L379 L380 E381	A373-K377 PolarHBondContact O-N 2.69Å; Q374-K377 PolarHBondContact O-N 2.81Å; S375-K377 VanDerWaalsContact C-N 3.34Å; S375-K377 PolarHBondContact O-N 3.35Å; K377-L379 VanDerWaalsContact C-N 3.31Å; K377-L379 PolarHBondContact O-N 3.11Å; K377-L380 PolarHBondContact O-N 3.41Å; K377-E381 PolarHBondContact O-N 3Å; K377-E381 VanDerWaalsContact O-N 3.07Å
378	S	94.4	Very high	91.8	Very high	46 Å²	46	60.6 Å²	60.6	32%	0.322	32%	0.322	S	S	.	.	H	α-helix	trans	-64.9	-35.9	178.9	-54.2	0	0	0	0	111.8	Q374 S375 V376 E381 A382	Q374-S378 WeakPolarHBondContact O-CB 3.4Å; Q374-S378 PolarHBondContact O-N 3.18Å; Q374-S378 PolarHBondContact O-OG 3.15Å; S375-S378 WeakPolarHBondContact O-CB 3.36Å; S375-S378 PolarHBondContact O-N 3.16Å; V376-S378 VanDerWaalsContact C-N 3.34Å; V376-S378 PolarHBondContact O-N 2.79Å; S378-E381 PolarHBondContact O-N 3.49Å; S378-A382 VanDerWaalsContact O-CB 3.27Å; S378-A382 WeakPolarHBondContact O-CB 3.48Å; S378-A382 PolarHBondContact O-N 3.36Å
379	L	94.8	Very high	91.6	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-59.5	-51.7	174.6	-177.6	161.7	0	0	0	111.3	F339 V341 F358 L360 S375 V376 K377 E381 A382 Q383 L398 F419	F339-L379 HydrophobicContact CD1-CD2 4.45Å; F339-L379 HydrophobicContact CE1-CD2 4.04Å; F339-L379 HydrophobicContact CE1-CG 4.02Å; V341-L379 HydrophobicContact CB-CD1 4.41Å; V341-L379 HydrophobicContact CG1-CD1 3.65Å; V341-L379 HydrophobicContact CG2-CD1 3.81Å; V341-L379 HydrophobicContact CG2-CD2 4.41Å; V341-L379 HydrophobicContact CG2-CG 4.29Å; F358-L379 HydrophobicContact CD1-CB 3.91Å; F358-L379 HydrophobicContact CD1-CD1 3.87Å; F358-L379 HydrophobicContact CD1-CG 3.82Å; F358-L379 HydrophobicContact CE1-CB 3.58Å; F358-L379 HydrophobicContact CE1-CD1 4.1Å; F358-L379 HydrophobicContact CE1-CG 4.02Å; F358-L379 HydrophobicContact CE2-CB 4.45Å; F358-L379 HydrophobicContact CG-CB 4.49Å; F358-L379 HydrophobicContact CG-CG 4.31Å; F358-L379 HydrophobicContact CZ-CB 3.88Å; L360-L379 HydrophobicContact CB-CD1 4.29Å; L360-L379 HydrophobicContact CD2-CD1 3.86Å; S375-L379 WeakPolarHBondContact O-CB 3.41Å; S375-L379 PolarHBondContact O-N 2.89Å; V376-L379 WeakPolarHBondContact O-CB 3.48Å; V376-L379 PolarHBondContact O-N 2.92Å; K377-L379 VanDerWaalsContact C-N 3.31Å; K377-L379 PolarHBondContact O-N 3.11Å; L379-E381 VanDerWaalsContact C-N 3.32Å; L379-E381 PolarHBondContact O-N 3.46Å; L379-A382 PolarHBondContact O-N 2.95Å; L379-Q383 PolarHBondContact O-N 3.38Å; L379-L398 HydrophobicContact CD2-CD2 4.1Å; L379-F419 HydrophobicContact CD1-CZ 4.22Å
380	L	93.6	Very high	91.3	Very high	29 Å²	29	60.6 Å²	60.6	15%	0.152	34%	0.337	C	S	.	.	H	α-helix	trans	-67.2	-34.1	-179.4	-65.2	177.9	0	0	0	112.3	V376 K377 K384 W525	V376-L380 WeakPolarHBondContact O-CG 3.44Å; V376-L380 PolarHBondContact O-N 2.94Å; V376-L380 VanDerWaalsContact O-N 3.13Å; K377-L380 PolarHBondContact O-N 3.41Å; L380-K384 WeakPolarHBondContact O-CB 3.25Å; L380-K384 PolarHBondContact O-N 3.45Å; L380-W525 HydrophobicContact CD1-CH2 3.4Å; L380-W525 VanDerWaalsContact CD1-CH2 3.4Å; L380-W525 HydrophobicContact CD1-CZ3 3.56Å
381	E	93.6	Very high	91	Very high	107 Å²	107	58.1 Å²	58.1	50%	0.5	32%	0.319	S	S	.	.	H	α-helix	trans	-67.5	-42.9	173.3	-171.2	170.4	179.6	0	0	111.6	K377 S378 L379 Q383 K384 Q385	K377-E381 PolarHBondContact O-N 3Å; K377-E381 VanDerWaalsContact O-N 3.07Å; S378-E381 PolarHBondContact O-N 3.49Å; L379-E381 VanDerWaalsContact C-N 3.32Å; L379-E381 PolarHBondContact O-N 3.46Å; E381-Q383 PolarHBondContact O-N 2.96Å; E381-K384 PolarHBondContact O-N 3.49Å; E381-Q385 WeakPolarHBondContact O-CG 3.43Å; E381-Q385 PolarHBondContact O-N 2.86Å; E381-Q385 PolarHBondContact OE1-NE2 3.22Å
382	A	93	Very high	90.5	Very high	24 Å²	24	58.5 Å²	58.5	20%	0.198	32%	0.323	C	S	.	.	H	α-helix	trans	-63	-40.5	175	0	0	0	0	0	111.9	F339 F358 S378 L379 Q385 S386	F339-A382 HydrophobicContact CZ-CB 4.13Å; F358-A382 HydrophobicContact CD2-CB 3.93Å; F358-A382 HydrophobicContact CE2-CB 4.03Å; S378-A382 VanDerWaalsContact O-CB 3.27Å; S378-A382 WeakPolarHBondContact O-CB 3.48Å; S378-A382 PolarHBondContact O-N 3.36Å; L379-A382 PolarHBondContact O-N 2.95Å; A382-Q385 PolarHBondContact O-N 2.99Å; A382-S386 WeakPolarHBondContact O-CB 3.02Å; A382-S386 PolarHBondContact O-N 3.27Å; A382-S386 PolarHBondContact O-OG 3.47Å
383	Q	94	Very high	90	Very high	26 Å²	26	59.1 Å²	59.1	12%	0.121	33%	0.329	C	S	.	.	H	α-helix	trans	-58.7	-50.5	173.5	-175.2	-173.5	24.8	0	0	110.8	F339 L379 E381 Q385 S386 L387 G395 E396	F339-Q383 HydrophobicContact CB-CG 3.97Å; F339-Q383 HydrophobicContact CD1-CB 4.1Å; F339-Q383 HydrophobicContact CD1-CG 4.25Å; F339-Q383 HydrophobicContact CD2-CB 3.95Å; F339-Q383 HydrophobicContact CD2-CG 3.98Å; F339-Q383 HydrophobicContact CE1-CB 4.18Å; F339-Q383 HydrophobicContact CE2-CB 4.04Å; F339-Q383 HydrophobicContact CG-CB 3.97Å; F339-Q383 HydrophobicContact CG-CG 3.8Å; F339-Q383 HydrophobicContact CZ-CB 4.14Å; L379-Q383 PolarHBondContact O-N 3.38Å; E381-Q383 PolarHBondContact O-N 2.96Å; Q383-Q385 PolarHBondContact O-N 3.29Å; Q383-S386 PolarHBondContact O-N 3.42Å; Q383-L387 HydrophobicContact CG-CD1 4.2Å; Q383-L387 WeakPolarHBondContact O-CG 3.02Å; Q383-L387 PolarHBondContact O-N 3.38Å; Q383-G395 WeakPolarHBondContact CG-O 3.45Å; Q383-G395 PolarHBondContact NE2-O 3.01Å; Q383-E396 PolarHBondContact NE2-O 3.4Å
384	K	92.8	Very high	89.8	Confident	130 Å²	130	57.5 Å²	57.5	57%	0.565	32%	0.316	S	S	*	.	H	α-helix	trans	-58.6	-48.5	178.9	-175.6	-179.3	175.2	-178	0	112	L380 E381 S386 L387 E388	L380-K384 WeakPolarHBondContact O-CB 3.25Å; L380-K384 PolarHBondContact O-N 3.45Å; E381-K384 PolarHBondContact O-N 3.49Å; K384-S386 VanDerWaalsContact C-N 3.32Å; K384-S386 PolarHBondContact O-N 3.17Å; K384-L387 PolarHBondContact O-N 2.84Å; K384-E388 WeakPolarHBondContact CE-OE1 3.27Å; K384-E388 WeakPolarHBondContact O-CG 3.25Å; K384-E388 PolarHBondContact O-N 3.42Å
385	Q	92.1	Very high	89.7	Confident	108 Å²	108	52.5 Å²	52.5	51%	0.505	29%	0.293	S	S	.	.	H	α-helix	trans	-64	-37.4	178	-69.9	178	6.5	0	0	112.2	E381 A382 Q383 L387 E388 S389	E381-Q385 WeakPolarHBondContact O-CG 3.43Å; E381-Q385 PolarHBondContact O-N 2.86Å; E381-Q385 PolarHBondContact OE1-NE2 3.22Å; A382-Q385 PolarHBondContact O-N 2.99Å; Q383-Q385 PolarHBondContact O-N 3.29Å; Q385-L387 VanDerWaalsContact C-N 3.34Å; Q385-E388 PolarHBondContact O-N 3.46Å; Q385-S389 VanDerWaalsContact O-CB 3.31Å; Q385-S389 WeakPolarHBondContact O-CB 3.33Å; Q385-S389 PolarHBondContact O-N 2.99Å; Q385-S389 PolarHBondContact O-OG 2.91Å
386	S	89.4	Confident	89.7	Confident	22 Å²	22	55.4 Å²	55.4	15%	0.154	30%	0.303	C	S	.	.	H	α-helix	trans	-69.3	-33.1	179	-60.2	0	0	0	0	112.2	A382 Q383 K384 S389 G390 S391	A382-S386 WeakPolarHBondContact O-CB 3.02Å; A382-S386 PolarHBondContact O-N 3.27Å; A382-S386 PolarHBondContact O-OG 3.47Å; Q383-S386 PolarHBondContact O-N 3.42Å; K384-S386 VanDerWaalsContact C-N 3.32Å; K384-S386 PolarHBondContact O-N 3.17Å; S386-S389 WeakPolarHBondContact CA-OG 3.3Å; S386-S389 PolarHBondContact O-OG 3.35Å; S386-G390 PolarHBondContact O-N 2.85Å; S386-S391 WeakPolarHBondContact CB-OG 3.12Å; S386-S391 PolarHBondContact O-N 3.05Å; S386-S391 VanDerWaalsContact O-N 3.14Å; S386-S391 PolarHBondContact O-OG 2.8Å; S386-S391 VanDerWaalsContact O-OG 3.11Å
387	L	88.9	Confident	89.9	Confident	56 Å²	56	55.1 Å²	55.1	29%	0.293	30%	0.301	S	S	.	.	H	α-helix	trans	-69	-51.1	171.6	-76.6	170.5	0	0	0	111.6	Q383 K384 Q385 S389 G390 E396	Q383-L387 HydrophobicContact CG-CD1 4.2Å; Q383-L387 WeakPolarHBondContact O-CG 3.02Å; Q383-L387 PolarHBondContact O-N 3.38Å; K384-L387 PolarHBondContact O-N 2.84Å; Q385-L387 VanDerWaalsContact C-N 3.34Å; L387-S389 VanDerWaalsContact C-N 3.26Å; L387-S389 PolarHBondContact O-N 3.32Å; L387-G390 PolarHBondContact O-N 2.84Å; L387-E396 HydrophobicContact CD1-CG 4.31Å; L387-E396 HydrophobicContact CD2-CG 4.05Å
388	E	89.4	Confident	90.1	Very high	143 Å²	143	50.6 Å²	50.6	67%	0.668	28%	0.282	S	S	*	.	H	α-helix	trans	-60.7	-34.9	179.5	-73.5	175.3	-178.3	0	0	112.6	K384 Q385 G390	K384-E388 WeakPolarHBondContact CE-OE1 3.27Å; K384-E388 WeakPolarHBondContact O-CG 3.25Å; K384-E388 PolarHBondContact O-N 3.42Å; Q385-E388 PolarHBondContact O-N 3.46Å; E388-G390 VanDerWaalsContact C-N 3.31Å
389	S	86.9	Confident	90.2	Very high	84 Å²	84	48.4 Å²	48.4	59%	0.587	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-9.1	176.9	58.3	0	0	0	0	114.2	Q385 S386 L387 S391	Q385-S389 VanDerWaalsContact O-CB 3.31Å; Q385-S389 WeakPolarHBondContact O-CB 3.33Å; Q385-S389 PolarHBondContact O-N 2.99Å; Q385-S389 PolarHBondContact O-OG 2.91Å; S386-S389 WeakPolarHBondContact CA-OG 3.3Å; S386-S389 PolarHBondContact O-OG 3.35Å; L387-S389 VanDerWaalsContact C-N 3.26Å; L387-S389 PolarHBondContact O-N 3.32Å; S389-S391 PolarHBondContact O-N 2.92Å
390	G	82.6	Confident	90.4	Very high	54 Å²	54	48.4 Å²	48.4	56%	0.557	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	27.2	-175.4	0	0	0	0	0	113.3	S386 L387 E388	S386-G390 PolarHBondContact O-N 2.85Å; L387-G390 PolarHBondContact O-N 2.84Å; E388-G390 VanDerWaalsContact C-N 3.31Å
391	S	83.2	Confident	90.5	Very high	38 Å²	38	47.3 Å²	47.3	27%	0.266	26%	0.261	S	S	.	.			trans	-69.1	161.3	-178.7	72.6	0	0	0	0	111.8	R337 S386 S389 A393 G394	R337-S391 PolarHBondContact NH1-O 3.31Å; S386-S391 WeakPolarHBondContact CB-OG 3.12Å; S386-S391 PolarHBondContact O-N 3.05Å; S386-S391 VanDerWaalsContact O-N 3.14Å; S386-S391 PolarHBondContact O-OG 2.8Å; S386-S391 VanDerWaalsContact O-OG 3.11Å; S389-S391 PolarHBondContact O-N 2.92Å; S391-A393 PolarHBondContact O-N 2.86Å; S391-G394 PolarHBondContact O-N 3.07Å; S391-G394 VanDerWaalsContact O-N 3.12Å; S391-G394 PolarHBondContact OG-N 2.83Å
392	I	80.6	Confident	90.5	Very high	81 Å²	81	42.3 Å²	42.3	42%	0.415	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-23.2	175.1	-166.2	154.9	0	0	0	113.1	N329 Q330 T356 W456	N329-I392 HydrophobicContact CB-CG1 4.32Å; Q330-I392 HydrophobicContact CG-CD1 4.22Å; T356-I392 HydrophobicContact CG2-CG2 3.85Å; I392-W456 HydrophobicContact CD1-CH2 4.13Å
393	A	81.9	Confident	90.4	Very high	20 Å²	20	41.6 Å²	41.6	17%	0.165	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-14.4	175.8	0	0	0	0	0	112.9	F339 T356 S391	F339-A393 VanDerWaalsContact CD2-O 3.28Å; F339-A393 WeakPolarHBondContact CD2-O 3.4Å; T356-A393 HydrophobicContact CG2-CB 4.3Å; S391-A393 PolarHBondContact O-N 2.86Å
394	G	84.8	Confident	90.1	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.236	C	C	.	.			trans	-75.4	131.2	-178.9	0	0	0	0	0	111.9	R337 S391	R337-G394 PolarHBondContact NE-O 2.97Å; R337-G394 PolarHBondContact NH1-O 3.07Å; R337-G394 PolarHBondContact NH2-O 3.07Å; R337-G394 VanDerWaalsContact NH2-O 3.1Å; S391-G394 PolarHBondContact O-N 3.07Å; S391-G394 VanDerWaalsContact O-N 3.12Å; S391-G394 PolarHBondContact OG-N 2.83Å
395	G	89.4	Confident	89.8	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.234	C	C	.	.			trans	-157	144.7	173.6	0	0	0	0	0	111.6	R337 F339 Q383 H397	R337-G395 CarbonylContact O-C 3.57Å; R337-G395 WeakPolarHBondContact O-CA 3.45Å; F339-G395 WeakPolarHBondContact CB-O 3.19Å; Q383-G395 WeakPolarHBondContact CG-O 3.45Å; Q383-G395 PolarHBondContact NE2-O 3.01Å; G395-H397 VanDerWaalsContact C-N 3.28Å
396	E	92.8	Very high	89.2	Confident	90 Å²	90	44.8 Å²	44.8	42%	0.421	25%	0.248	S	C	.	.	S	Bend	trans	-70.8	-32.4	176.6	-67.1	179.4	169	0	0	110.3	K285 R337 Q383 L387	K285-E396 IonicContact NZ-OE1 3.04Å; K285-E396 IonicContact NZ-OE2 2.68Å; K285-E396 PolarHBondContact NZ-OE2 3.15Å; R337-E396 PolarHBondContact O-N 3.22Å; Q383-E396 PolarHBondContact NE2-O 3.4Å; L387-E396 HydrophobicContact CD1-CG 4.31Å; L387-E396 HydrophobicContact CD2-CG 4.05Å
397	H	96.4	Very high	88.7	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	125.7	-172.2	-56.8	-101.6	0	0	0	110.7	Y177 K285 R337 F338 F339 G395 Y426	Y177-H397 AromaticContact CE1-ND1 3.71Å; Y177-H397 AromaticContact CZ-ND1 3.56Å; Y177-H397 PolarHBondContact OH-ND1 3.21Å; K285-H397 PolarHBondContact O-CE1 2.86Å; R337-H397 WeakPolarHBondContact O-CB 3.39Å; R337-H397 PolarHBondContact O-CD2 2.94Å; R337-H397 PolarHBondContact O-N 3.23Å; R337-H397 VanDerWaalsContact O-N 3.07Å; F338-H397 CarbonylContact C-O 3.4Å; F338-H397 WeakPolarHBondContact CA-O 3.46Å; F338-H397 HydrophobicContact CD1-CB 3.79Å; F338-H397 HydrophobicContact CE1-CB 4.07Å; F339-H397 PolarHBondContact N-O 3.2Å; G395-H397 VanDerWaalsContact C-N 3.28Å; H397-Y426 AromaticContact CE1-CD1 3.9Å; H397-Y426 AromaticContact CE1-CD2 3.82Å; H397-Y426 AromaticContact CE1-CG 3.7Å; H397-Y426 WeakPolarHBondContact ND1-CB 3.39Å; H397-Y426 AromaticContact ND1-CD1 3.88Å; H397-Y426 AromaticContact ND1-CD2 3.89Å; H397-Y426 AromaticContact ND1-CG 3.47Å
398	L	97.6	Very high	88.4	Confident	5 Å²	5	53 Å²	53	3%	0.026	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	122.5	177.5	-69.7	172.2	0	0	0	109.7	F339 V341 L379 F400 F419 Y426 S428	F339-L398 HydrophobicContact CB-CD2 4.35Å; F339-L398 HydrophobicContact CD1-CD2 3.89Å; V341-L398 HydrophobicContact CG2-CD2 4.45Å; L379-L398 HydrophobicContact CD2-CD2 4.1Å; L398-F400 HydrophobicContact CB-CE2 3.92Å; L398-F419 HydrophobicContact CD1-CD1 4.04Å; L398-F419 HydrophobicContact CD1-CE1 4.16Å; L398-Y426 PolarHBondContact N-O 3.36Å; L398-Y426 VanDerWaalsContact O-O 3.09Å; L398-S428 PolarHBondContact O-N 3Å; L398-S428 PolarHBondContact O-OG 2.94Å
399	C	97.4	Very high	88.2	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	109.7	176.5	-168.8	0	0	0	0	110.1	I325 F338 F339 V340 V341 S428	I325-C399 VanDerWaalsContact CD1-SG 3.54Å; F338-C399 HydrophobicContact CB-CB 4.21Å; F338-C399 HydrophobicContact CD1-CB 3.96Å; F338-C399 HydrophobicContact CG-CB 4.41Å; F339-C399 PolarHBondContact O-N 2.94Å; F339-C399 VanDerWaalsContact O-N 3.07Å; V340-C399 CarbonylContact C-O 3.57Å; V340-C399 WeakPolarHBondContact CA-O 3.22Å; V341-C399 PolarHBondContact N-O 2.99Å; C399-S428 WeakPolarHBondContact CA-O 3.36Å; C399-S428 WeakPolarHBondContact CA-OG 3.38Å
400	F	97.1	Very high	88.1	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	130.3	-179.8	-64	-93.5	0	0	0	109.9	V341 L360 L398 M412 V415 L416 F419 V427 S428 I429 A430	V341-F400 HydrophobicContact CB-CD1 3.78Å; V341-F400 HydrophobicContact CB-CE1 4.04Å; V341-F400 HydrophobicContact CB-CG 4.43Å; V341-F400 HydrophobicContact CG1-CD1 3.86Å; V341-F400 HydrophobicContact CG1-CE1 3.94Å; V341-F400 HydrophobicContact CG2-CD1 4.36Å; V341-F400 HydrophobicContact CG2-CE1 4.21Å; V341-F400 CarbonylContact O-C 3.48Å; V341-F400 WeakPolarHBondContact O-CA 3.48Å; L360-F400 HydrophobicContact CD2-CE1 4.46Å; L398-F400 HydrophobicContact CB-CE2 3.92Å; F400-M412 HydrophobicContact CB-SD 4.4Å; F400-V415 HydrophobicContact CD1-CG1 4.23Å; F400-V415 HydrophobicContact CE1-CG1 3.99Å; F400-L416 HydrophobicContact CB-CD2 3.89Å; F400-L416 HydrophobicContact CB-CG 4.45Å; F400-L416 HydrophobicContact CD2-CD2 3.34Å; F400-L416 HydrophobicContact CE2-CD2 4.02Å; F400-L416 HydrophobicContact CG-CD2 3.7Å; F400-L416 HydrophobicContact CG-CG 4.48Å; F400-F419 AromaticContact CE1-CD2 3.92Å; F400-F419 HydrophobicContact CE1-CD2 3.92Å; F400-F419 AromaticContact CE1-CE2 3.66Å; F400-F419 HydrophobicContact CE1-CE2 3.66Å; F400-F419 HydrophobicContact CE1-CZ 4.06Å; F400-F419 HydrophobicContact CE2-CD2 4.41Å; F400-F419 HydrophobicContact CE2-CG 4.32Å; F400-F419 HydrophobicContact CZ-CB 4.44Å; F400-F419 AromaticContact CZ-CD1 3.89Å; F400-F419 HydrophobicContact CZ-CD1 3.89Å; F400-F419 AromaticContact CZ-CD2 3.5Å; F400-F419 HydrophobicContact CZ-CD2 3.5Å; F400-F419 VanDerWaalsContact CZ-CD2 3.5Å; F400-F419 AromaticContact CZ-CE1 3.95Å; F400-F419 HydrophobicContact CZ-CE1 3.95Å; F400-F419 AromaticContact CZ-CE2 3.57Å; F400-F419 HydrophobicContact CZ-CE2 3.57Å; F400-F419 AromaticContact CZ-CG 3.68Å; F400-F419 HydrophobicContact CZ-CG 3.68Å; F400-F419 AromaticContact CZ-CZ 3.79Å; F400-F419 HydrophobicContact CZ-CZ 3.79Å; F400-V427 HydrophobicContact CD2-CG1 4.26Å; F400-V427 HydrophobicContact CE2-CG1 4.01Å; F400-S428 PolarHBondContact N-O 3.29Å; F400-I429 CarbonylContact O-C 3.51Å; F400-I429 WeakPolarHBondContact O-CA 3.44Å; F400-A430 PolarHBondContact O-N 2.89Å
401	M	95.8	Very high	88	Confident	6 Å²	6	48 Å²	48	3%	0.03	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	133.5	174.5	77.7	163.1	80.3	0	0	110.8	V340 V341 D342 C343 L354 A357 M412 A430 F434	V340-M401 HydrophobicContact CB-CE 4.47Å; V340-M401 HydrophobicContact CG1-CE 3.14Å; V340-M401 HydrophobicContact CG1-CG 4.48Å; V341-M401 PolarHBondContact O-N 2.92Å; D342-M401 HydrophobicContact CB-CG 3.92Å; D342-M401 HydrophobicContact CB-SD 4.21Å; C343-M401 PolarHBondContact N-O 3.22Å; L354-M401 HydrophobicContact CB-CE 3.78Å; L354-M401 HydrophobicContact CD2-CE 3.89Å; A357-M401 HydrophobicContact CB-CE 4.18Å; M401-M412 VanDerWaalsContact C-SD 3.58Å; M401-A430 HydrophobicContact CB-CB 3.86Å; M401-F434 HydrophobicContact SD-CB 4.41Å; M401-F434 HydrophobicContact SD-CD2 4.08Å
402	G	94.5	Very high	88.2	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.01	22%	0.221	C	C	.	.			trans	-104.8	-160.7	169.3	0	0	0	0	0	111.7	G404 D409 M412 F434	G402-G404 VanDerWaalsContact C-N 3.33Å; G402-D409 WeakPolarHBondContact CA-OD1 3.43Å; G402-M412 VanDerWaalsContact CA-CE 3.45Å; G402-M412 PolarHBondContact N-SD 2.8Å; G402-F434 WeakPolarHBondContact O-CB 3.39Å; G402-F434 PolarHBondContact O-N 3Å
403	S	91.4	Very high	88.5	Confident	10 Å²	10	44.2 Å²	44.2	7%	0.07	21%	0.211	C	C	.	.			trans	-66.1	-35.8	172.6	67.5	0	0	0	0	111.9	R405 E408 D409 F434 M435	S403-R405 PolarHBondContact OG-N 2.68Å; S403-R405 PolarHBondContact OG-O 3.29Å; S403-E408 WeakPolarHBondContact OG-CB 3.48Å; S403-D409 WeakPolarHBondContact CB-OD1 3.43Å; S403-D409 PolarHBondContact N-OD1 3.1Å; S403-D409 PolarHBondContact OG-OD1 3.45Å; S403-F434 PolarHBondContact O-N 3.4Å; S403-M435 WeakPolarHBondContact O-CB 3.34Å; S403-M435 PolarHBondContact O-N 3.02Å
404	G	87.7	Confident	88.9	Confident	21 Å²	21	46.4 Å²	46.4	22%	0.216	22%	0.218	C	C	.	.	S	Bend	trans	94	5.4	-165.8	0	0	0	0	0	113.5	G402 D409 G432	G402-G404 VanDerWaalsContact C-N 3.33Å; G404-D409 WeakPolarHBondContact CA-OD2 3.29Å; G404-D409 PolarHBondContact N-OD2 3.37Å; G404-G432 VanDerWaalsContact CA-O 3.24Å; G404-G432 WeakPolarHBondContact CA-O 3.36Å
405	R	85.5	Confident	89.2	Confident	140 Å²	140	46.4 Å²	46.4	53%	0.528	22%	0.218	S	C	.	.			trans	-111.3	123.6	175.1	-62.8	173.2	179.7	177.1	0	108.8	S403 E407 E408 D409	S403-R405 PolarHBondContact OG-N 2.68Å; S403-R405 PolarHBondContact OG-O 3.29Å; R405-E407 PolarHBondContact O-N 2.86Å; R405-E408 HydrophobicContact CB-CB 4.42Å; R405-E408 HydrophobicContact CB-CG 4.39Å; R405-E408 WeakPolarHBondContact CD-OE1 3.31Å; R405-E408 IonicContact CZ-OE1 3.73Å; R405-E408 IonicContact NE-OE1 3.89Å; R405-E408 IonicContact NH1-OE1 2.81Å; R405-E408 PolarHBondContact NH1-OE1 2.95Å; R405-E408 PolarHBondContact O-N 3.5Å; R405-D409 PolarHBondContact N-OD2 2.89Å; R405-D409 WeakPolarHBondContact O-CB 3.4Å; R405-D409 VanDerWaalsContact O-CG 3.25Å; R405-D409 PolarHBondContact O-N 3.47Å
406	E	79.3	Confident	89.3	Confident	170 Å²	170	46.4 Å²	46.4	79%	0.794	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-36.8	-175.9	-163.6	179.5	-179	0	0	112.9	E408 D409	E406-E408 VanDerWaalsContact C-N 3.35Å; E406-E408 PolarHBondContact O-N 3.22Å; E406-D409 PolarHBondContact O-N 3.47Å
407	E	79.9	Confident	89.2	Confident	185 Å²	185	44.3 Å²	44.3	86%	0.864	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-37	178.1	-62.6	176.2	-175.3	0	0	113.3	R405	R405-E407 PolarHBondContact O-N 2.86Å
408	E	81.8	Confident	89	Confident	66 Å²	66	47 Å²	47	31%	0.308	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-25	-176.9	-62.7	178.7	-151.1	0	0	111.5	Q348 S403 R405 E406 M410	Q348-E408 PolarHBondContact NE2-OE2 3.44Å; S403-E408 WeakPolarHBondContact OG-CB 3.48Å; R405-E408 HydrophobicContact CB-CB 4.42Å; R405-E408 HydrophobicContact CB-CG 4.39Å; R405-E408 WeakPolarHBondContact CD-OE1 3.31Å; R405-E408 IonicContact CZ-OE1 3.73Å; R405-E408 IonicContact NE-OE1 3.89Å; R405-E408 IonicContact NH1-OE1 2.81Å; R405-E408 PolarHBondContact NH1-OE1 2.95Å; R405-E408 PolarHBondContact O-N 3.5Å; E406-E408 VanDerWaalsContact C-N 3.35Å; E406-E408 PolarHBondContact O-N 3.22Å; E408-M410 VanDerWaalsContact C-N 3.32Å; E408-M410 PolarHBondContact O-N 2.95Å
409	D	85.3	Confident	88.8	Confident	22 Å²	22	47 Å²	47	12%	0.118	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	1.3	-172.2	-73.7	-5.7	0	0	0	113.8	G402 S403 G404 R405 E406 Y411 M412 N413	G402-D409 WeakPolarHBondContact CA-OD1 3.43Å; S403-D409 WeakPolarHBondContact CB-OD1 3.43Å; S403-D409 PolarHBondContact N-OD1 3.1Å; S403-D409 PolarHBondContact OG-OD1 3.45Å; G404-D409 WeakPolarHBondContact CA-OD2 3.29Å; G404-D409 PolarHBondContact N-OD2 3.37Å; R405-D409 PolarHBondContact N-OD2 2.89Å; R405-D409 WeakPolarHBondContact O-CB 3.4Å; R405-D409 VanDerWaalsContact O-CG 3.25Å; R405-D409 PolarHBondContact O-N 3.47Å; E406-D409 PolarHBondContact O-N 3.47Å; D409-Y411 VanDerWaalsContact C-N 3.31Å; D409-Y411 PolarHBondContact O-N 2.91Å; D409-M412 HydrophobicContact CB-CE 3.44Å; D409-M412 VanDerWaalsContact CB-CE 3.44Å; D409-M412 WeakPolarHBondContact O-CB 3.27Å; D409-M412 PolarHBondContact O-N 3.32Å; D409-M412 VanDerWaalsContact O-N 3.15Å; D409-M412 WeakPolarHBondContact OD2-CE 3.34Å; D409-N413 PolarHBondContact O-N 3.41Å; D409-N413 VanDerWaalsContact O-N 3.1Å
410	M	84.4	Confident	88.6	Confident	68 Å²	68	48 Å²	48	34%	0.335	23%	0.234	S	C	.	.	H	α-helix	trans	-57.1	-40.4	177.7	-174.3	-179.2	61.8	0	0	112.8	E408 N413 M414 F552	E408-M410 VanDerWaalsContact C-N 3.32Å; E408-M410 PolarHBondContact O-N 2.95Å; M410-N413 WeakPolarHBondContact O-CB 3.48Å; M410-N413 PolarHBondContact O-N 2.72Å; M410-M414 PolarHBondContact O-N 2.89Å; M410-F552 HydrophobicContact CG-CD1 4.09Å; M410-F552 HydrophobicContact CG-CE1 4.04Å; M410-F552 HydrophobicContact SD-CD1 4.19Å
411	Y	81.2	Confident	88.4	Confident	85 Å²	85	54.4 Å²	54.4	33%	0.333	26%	0.264	S	S	.	.	H	α-helix	trans	-72	-33	178.7	-58.9	-56.3	0	0	0	112.4	L366 D409 N413 M414 V415	L366-Y411 HydrophobicContact CD1-CD1 3.78Å; L366-Y411 HydrophobicContact CD1-CE1 3.44Å; L366-Y411 VanDerWaalsContact CD1-CE1 3.44Å; D409-Y411 VanDerWaalsContact C-N 3.31Å; D409-Y411 PolarHBondContact O-N 2.91Å; Y411-N413 VanDerWaalsContact C-N 3.31Å; Y411-N413 PolarHBondContact O-N 3.42Å; Y411-M414 HydrophobicContact CD1-SD 4.35Å; Y411-M414 WeakPolarHBondContact O-CB 3.37Å; Y411-M414 PolarHBondContact O-N 3.12Å; Y411-V415 PolarHBondContact O-N 3.49Å
412	M	87.4	Confident	88.3	Confident	3 Å²	3	58.3 Å²	58.3	2%	0.015	28%	0.281	C	S	.	.	H	α-helix	trans	-61.5	-40.7	171.3	170.6	-176.9	41.5	0	0	111	C343 F400 M401 G402 D409 M414 V415 L416 I429	C343-M412 HydrophobicContact CB-CB 4.13Å; C343-M412 HydrophobicContact CB-CG 4.12Å; F400-M412 HydrophobicContact CB-SD 4.4Å; M401-M412 VanDerWaalsContact C-SD 3.58Å; G402-M412 VanDerWaalsContact CA-CE 3.45Å; G402-M412 PolarHBondContact N-SD 2.8Å; D409-M412 HydrophobicContact CB-CE 3.44Å; D409-M412 VanDerWaalsContact CB-CE 3.44Å; D409-M412 WeakPolarHBondContact O-CB 3.27Å; D409-M412 PolarHBondContact O-N 3.32Å; D409-M412 VanDerWaalsContact O-N 3.15Å; D409-M412 WeakPolarHBondContact OD2-CE 3.34Å; M412-M414 PolarHBondContact O-N 2.93Å; M412-V415 CarbonylContact O-C 3.19Å; M412-V415 WeakPolarHBondContact O-CA 3.35Å; M412-V415 WeakPolarHBondContact O-CB 3.37Å; M412-V415 PolarHBondContact O-N 3.29Å; M412-L416 HydrophobicContact CG-CD1 4.33Å; M412-L416 HydrophobicContact CG-CG 4.49Å; M412-L416 PolarHBondContact O-N 3.04Å; M412-I429 HydrophobicContact CE-CD1 3.85Å; M412-I429 HydrophobicContact CE-CG1 4.47Å; M412-I429 HydrophobicContact SD-CD1 4.02Å; M412-I429 HydrophobicContact SD-CG1 4.14Å
413	N	87.5	Confident	88.2	Confident	36 Å²	36	61.1 Å²	61.1	19%	0.193	30%	0.296	C	S	.	.	H	α-helix	trans	-59.9	-34.8	177	-72.9	-25	0	0	0	112.3	L316 D409 M410 Y411 L416 A417	L316-N413 HydrophobicContact CD1-CB 3.69Å; D409-N413 PolarHBondContact O-N 3.41Å; D409-N413 VanDerWaalsContact O-N 3.1Å; M410-N413 WeakPolarHBondContact O-CB 3.48Å; M410-N413 PolarHBondContact O-N 2.72Å; Y411-N413 VanDerWaalsContact C-N 3.31Å; Y411-N413 PolarHBondContact O-N 3.42Å; N413-L416 PolarHBondContact O-N 2.94Å; N413-A417 PolarHBondContact O-N 3.29Å
414	M	89.3	Confident	88.4	Confident	66 Å²	66	63.6 Å²	63.6	33%	0.325	31%	0.305	S	S	.	.	H	α-helix	trans	-71.2	-36.9	173.2	-62.4	179.5	71.5	0	0	112.6	M365 L366 M410 Y411 M412 A417 H418 F552	M365-M414 HydrophobicContact CE-CB 3.18Å; M365-M414 HydrophobicContact CE-CE 3.62Å; M365-M414 HydrophobicContact CE-CG 4Å; M365-M414 HydrophobicContact CE-SD 3.63Å; M365-M414 HydrophobicContact SD-CB 3.85Å; L366-M414 HydrophobicContact CD2-CE 4.09Å; M410-M414 PolarHBondContact O-N 2.89Å; Y411-M414 HydrophobicContact CD1-SD 4.35Å; Y411-M414 WeakPolarHBondContact O-CB 3.37Å; Y411-M414 PolarHBondContact O-N 3.12Å; M412-M414 PolarHBondContact O-N 2.93Å; M414-A417 PolarHBondContact O-N 2.96Å; M414-H418 PolarHBondContact O-N 3.37Å; M414-F552 HydrophobicContact CG-CE1 4.14Å; M414-F552 HydrophobicContact CG-CZ 4.48Å
415	V	91	Very high	88.9	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-60.2	-47.4	171.3	174.2	0	0	0	0	109.9	L360 M365 F372 F400 Y411 M412 A417 H418 F419	L360-V415 HydrophobicContact CD2-CG1 3.82Å; M365-V415 HydrophobicContact SD-CG2 4.13Å; F372-V415 HydrophobicContact CE2-CG1 4.5Å; F372-V415 HydrophobicContact CE2-CG2 3.94Å; F372-V415 HydrophobicContact CZ-CG1 4.26Å; F372-V415 HydrophobicContact CZ-CG2 4.09Å; F400-V415 HydrophobicContact CD1-CG1 4.23Å; F400-V415 HydrophobicContact CE1-CG1 3.99Å; Y411-V415 PolarHBondContact O-N 3.49Å; M412-V415 CarbonylContact O-C 3.19Å; M412-V415 WeakPolarHBondContact O-CA 3.35Å; M412-V415 WeakPolarHBondContact O-CB 3.37Å; M412-V415 PolarHBondContact O-N 3.29Å; V415-A417 VanDerWaalsContact C-N 3.33Å; V415-A417 PolarHBondContact O-N 2.95Å; V415-H418 VanDerWaalsContact O-CB 3.28Å; V415-H418 WeakPolarHBondContact O-CB 3.44Å; V415-H418 PolarHBondContact O-N 3.49Å; V415-F419 HydrophobicContact CG1-CD2 4.08Å; V415-F419 HydrophobicContact CG1-CE2 3.89Å; V415-F419 WeakPolarHBondContact O-CD2 3.32Å; V415-F419 PolarHBondContact O-N 3.15Å
416	L	92.3	Very high	89.4	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-55.6	-47.8	174.6	-75.5	170.5	0	0	0	111.6	F400 M412 N413 H418 F419 L420 V427 I429	F400-L416 HydrophobicContact CB-CD2 3.89Å; F400-L416 HydrophobicContact CB-CG 4.45Å; F400-L416 HydrophobicContact CD2-CD2 3.34Å; F400-L416 HydrophobicContact CE2-CD2 4.02Å; F400-L416 HydrophobicContact CG-CD2 3.7Å; F400-L416 HydrophobicContact CG-CG 4.48Å; M412-L416 HydrophobicContact CG-CD1 4.33Å; M412-L416 HydrophobicContact CG-CG 4.49Å; M412-L416 PolarHBondContact O-N 3.04Å; N413-L416 PolarHBondContact O-N 2.94Å; L416-H418 VanDerWaalsContact C-N 3.25Å; L416-H418 PolarHBondContact O-N 2.91Å; L416-F419 PolarHBondContact O-N 3.27Å; L416-F419 VanDerWaalsContact O-N 3.15Å; L416-L420 VanDerWaalsContact O-CG 3.28Å; L416-L420 WeakPolarHBondContact O-CG 3.32Å; L416-L420 PolarHBondContact O-N 3.41Å; L416-V427 HydrophobicContact CD2-CG1 3.72Å; L416-I429 HydrophobicContact CD1-CB 4.19Å; L416-I429 HydrophobicContact CD1-CD1 3.93Å; L416-I429 HydrophobicContact CD1-CG1 4.27Å
417	A	90.6	Very high	90.3	Very high	45 Å²	45	54.3 Å²	54.3	37%	0.372	26%	0.261	S	S	.	.	H	α-helix	trans	-58.1	-36.9	176.4	0	0	0	0	0	112.5	N413 M414 V415 L420 Q421	N413-A417 PolarHBondContact O-N 3.29Å; M414-A417 PolarHBondContact O-N 2.96Å; V415-A417 VanDerWaalsContact C-N 3.33Å; V415-A417 PolarHBondContact O-N 2.95Å; A417-L420 PolarHBondContact O-N 2.9Å; A417-Q421 VanDerWaalsContact O-CB 3.31Å; A417-Q421 WeakPolarHBondContact O-CB 3.46Å; A417-Q421 PolarHBondContact O-N 3.38Å
418	H	91.6	Very high	91.2	Very high	57 Å²	57	45.5 Å²	45.5	26%	0.264	22%	0.22	S	C	.	.	H	α-helix	trans	-61.5	-45.6	175.1	-179.9	83.1	0	0	0	112.4	M414 V415 L416 K422	M414-H418 PolarHBondContact O-N 3.37Å; V415-H418 VanDerWaalsContact O-CB 3.28Å; V415-H418 WeakPolarHBondContact O-CB 3.44Å; V415-H418 PolarHBondContact O-N 3.49Å; L416-H418 VanDerWaalsContact C-N 3.25Å; L416-H418 PolarHBondContact O-N 2.91Å; H418-K422 WeakPolarHBondContact O-CG 3.32Å; H418-K422 PolarHBondContact O-N 3.46Å
419	F	94.7	Very high	91.9	Very high	4 Å²	4	44.1 Å²	44.1	2%	0.018	21%	0.214	C	C	.	.	H	α-helix	trans	-67.9	-39.8	178.2	-80.3	-97.6	0	0	0	112.1	L360 V376 L379 L398 F400 V415 L416 K422 K424 V427	L360-F419 HydrophobicContact CD2-CE2 4.19Å; L360-F419 HydrophobicContact CD2-CZ 4.49Å; V376-F419 HydrophobicContact CG1-CE1 4.31Å; V376-F419 HydrophobicContact CG1-CZ 3.9Å; V376-F419 HydrophobicContact CG2-CE2 4.33Å; V376-F419 HydrophobicContact CG2-CZ 4.19Å; L379-F419 HydrophobicContact CD1-CZ 4.22Å; L398-F419 HydrophobicContact CD1-CD1 4.04Å; L398-F419 HydrophobicContact CD1-CE1 4.16Å; F400-F419 AromaticContact CE1-CD2 3.92Å; F400-F419 HydrophobicContact CE1-CD2 3.92Å; F400-F419 AromaticContact CE1-CE2 3.66Å; F400-F419 HydrophobicContact CE1-CE2 3.66Å; F400-F419 HydrophobicContact CE1-CZ 4.06Å; F400-F419 HydrophobicContact CE2-CD2 4.41Å; F400-F419 HydrophobicContact CE2-CG 4.32Å; F400-F419 HydrophobicContact CZ-CB 4.44Å; F400-F419 AromaticContact CZ-CD1 3.89Å; F400-F419 HydrophobicContact CZ-CD1 3.89Å; F400-F419 AromaticContact CZ-CD2 3.5Å; F400-F419 HydrophobicContact CZ-CD2 3.5Å; F400-F419 VanDerWaalsContact CZ-CD2 3.5Å; F400-F419 AromaticContact CZ-CE1 3.95Å; F400-F419 HydrophobicContact CZ-CE1 3.95Å; F400-F419 AromaticContact CZ-CE2 3.57Å; F400-F419 HydrophobicContact CZ-CE2 3.57Å; F400-F419 AromaticContact CZ-CG 3.68Å; F400-F419 HydrophobicContact CZ-CG 3.68Å; F400-F419 AromaticContact CZ-CZ 3.79Å; F400-F419 HydrophobicContact CZ-CZ 3.79Å; V415-F419 HydrophobicContact CG1-CD2 4.08Å; V415-F419 HydrophobicContact CG1-CE2 3.89Å; V415-F419 WeakPolarHBondContact O-CD2 3.32Å; V415-F419 PolarHBondContact O-N 3.15Å; L416-F419 PolarHBondContact O-N 3.27Å; L416-F419 VanDerWaalsContact O-N 3.15Å; F419-K422 CarbonylContact O-C 3.56Å; F419-K422 PolarHBondContact O-N 3.15Å; F419-K424 HydrophobicContact CB-CB 4.49Å; F419-K424 HydrophobicContact CD1-CG 4.16Å; F419-K424 WeakPolarHBondContact O-CB 3.39Å; F419-K424 PolarHBondContact O-N 3.19Å; F419-V427 HydrophobicContact CB-CG2 4.19Å
420	L	93.3	Very high	92.3	Very high	23 Å²	23	43.3 Å²	43.3	12%	0.12	21%	0.211	C	C	.	.	H	α-helix	trans	-65.7	-41.1	177.4	-68.6	168.9	0	0	0	112.2	Q176 L416 A417 K422 N423 V427	Q176-L420 HydrophobicContact CG-CD2 3.92Å; L416-L420 VanDerWaalsContact O-CG 3.28Å; L416-L420 WeakPolarHBondContact O-CG 3.32Å; L416-L420 PolarHBondContact O-N 3.41Å; A417-L420 PolarHBondContact O-N 2.9Å; L420-K422 PolarHBondContact O-N 3.23Å; L420-N423 WeakPolarHBondContact O-CA 3.24Å; L420-N423 PolarHBondContact O-N 3.3Å; L420-V427 HydrophobicContact CD2-CB 4.05Å; L420-V427 HydrophobicContact CD2-CG1 4.09Å; L420-V427 HydrophobicContact CD2-CG2 4.48Å; L420-V427 HydrophobicContact CG-CG1 4.34Å
421	Q	92.6	Very high	92.7	Very high	133 Å²	133	42.6 Å²	42.6	62%	0.621	21%	0.213	S	C	*	.	H	α-helix	trans	-60.4	-29.5	174.4	-168.5	-157	-2.5	0	0	112.1	A417 N423	A417-Q421 VanDerWaalsContact O-CB 3.31Å; A417-Q421 WeakPolarHBondContact O-CB 3.46Å; A417-Q421 PolarHBondContact O-N 3.38Å; Q421-N423 PolarHBondContact O-N 2.88Å
422	K	92.4	Very high	93.2	Very high	88 Å²	88	40.3 Å²	40.3	38%	0.383	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87	16.1	176	-64.1	-62.7	-177.7	-172.9	0	113.1	H418 F419 L420 K424	H418-K422 WeakPolarHBondContact O-CG 3.32Å; H418-K422 PolarHBondContact O-N 3.46Å; F419-K422 CarbonylContact O-C 3.56Å; F419-K422 PolarHBondContact O-N 3.15Å; L420-K422 PolarHBondContact O-N 3.23Å; K422-K424 HydrophobicContact CB-CG 4.49Å; K422-K424 PolarHBondContact O-N 3.41Å
423	N	93.6	Very high	93.4	Very high	61 Å²	61	40.3 Å²	40.3	33%	0.326	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.3	40.8	178.3	-59.3	-28.6	0	0	0	112.5	P180 E181 L420 Q421	P180-N423 HydrophobicContact CB-CB 4.39Å; P180-N423 VanDerWaalsContact CG-C 3.45Å; P180-N423 HydrophobicContact CG-CB 4.16Å; P180-N423 VanDerWaalsContact CG-O 3.24Å; P180-N423 WeakPolarHBondContact CG-O 3.39Å; E181-N423 HydrophobicContact CB-CB 4.41Å; L420-N423 WeakPolarHBondContact O-CA 3.24Å; L420-N423 PolarHBondContact O-N 3.3Å; Q421-N423 PolarHBondContact O-N 2.88Å
424	K	95.6	Very high	93.8	Very high	62 Å²	62	39.1 Å²	39.1	27%	0.27	21%	0.209	S	C	.	.			trans	-77.9	123.3	175.8	-70.5	-61.3	-170.4	-179.3	0	110.6	F419 K422 V427	F419-K424 HydrophobicContact CB-CB 4.49Å; F419-K424 HydrophobicContact CD1-CG 4.16Å; F419-K424 WeakPolarHBondContact O-CB 3.39Å; F419-K424 PolarHBondContact O-N 3.19Å; K422-K424 HydrophobicContact CB-CG 4.49Å; K422-K424 PolarHBondContact O-N 3.41Å; K424-V427 HydrophobicContact CB-CG2 3.84Å; K424-V427 WeakPolarHBondContact O-CG2 3.49Å
425	E	96.9	Very high	93.9	Very high	100 Å²	100	40.6 Å²	40.6	47%	0.467	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	159.5	172.1	-67.1	167.3	-147.7	0	0	110.9	P180 V427	P180-E425 HydrophobicContact CG-CG 3.87Å; E425-V427 PolarHBondContact O-N 3.12Å
426	Y	97.7	Very high	93.9	Very high	32 Å²	32	42 Å²	42	13%	0.125	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	30.6	173.2	-50	-31.9	0	0	0	115.2	Y177 H178 H397 L398	Y177-Y426 AromaticContact CD1-CD1 3.71Å; Y177-Y426 HydrophobicContact CD1-CD1 3.71Å; Y177-Y426 HydrophobicContact CD1-CE1 4.39Å; Y177-Y426 AromaticContact CE1-CD1 3.46Å; Y177-Y426 HydrophobicContact CE1-CD1 3.46Å; Y177-Y426 VanDerWaalsContact CE1-CD1 3.46Å; Y177-Y426 HydrophobicContact CE1-CE1 4.29Å; Y177-Y426 HydrophobicContact CE1-CG 4.16Å; Y177-Y426 VanDerWaalsContact CE2-C 3.45Å; Y177-Y426 WeakPolarHBondContact O-CD1 3.28Å; Y177-Y426 PolarHBondContact O-N 3.11Å; H178-Y426 AromaticContact CE1-CE1 3.9Å; H178-Y426 AromaticContact ND1-CE1 3.48Å; H178-Y426 WeakPolarHBondContact ND1-CE1 3.37Å; H397-Y426 AromaticContact CE1-CD1 3.9Å; H397-Y426 AromaticContact CE1-CD2 3.82Å; H397-Y426 AromaticContact CE1-CG 3.7Å; H397-Y426 WeakPolarHBondContact ND1-CB 3.39Å; H397-Y426 AromaticContact ND1-CD1 3.88Å; H397-Y426 AromaticContact ND1-CD2 3.89Å; H397-Y426 AromaticContact ND1-CG 3.47Å; L398-Y426 PolarHBondContact N-O 3.36Å; L398-Y426 VanDerWaalsContact O-O 3.09Å
427	V	97.9	Very high	93.9	Very high	3 Å²	3	42.3 Å²	42.3	2%	0.018	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81	124.9	174.7	174.5	0	0	0	0	110.2	Y177 C317 F400 L416 F419 L420 K424 E425	Y177-V427 WeakPolarHBondContact CD2-O 3.47Å; C317-V427 HydrophobicContact CB-CG1 4.41Å; F400-V427 HydrophobicContact CD2-CG1 4.26Å; F400-V427 HydrophobicContact CE2-CG1 4.01Å; L416-V427 HydrophobicContact CD2-CG1 3.72Å; F419-V427 HydrophobicContact CB-CG2 4.19Å; L420-V427 HydrophobicContact CD2-CB 4.05Å; L420-V427 HydrophobicContact CD2-CG1 4.09Å; L420-V427 HydrophobicContact CD2-CG2 4.48Å; L420-V427 HydrophobicContact CG-CG1 4.34Å; K424-V427 HydrophobicContact CB-CG2 3.84Å; K424-V427 WeakPolarHBondContact O-CG2 3.49Å; E425-V427 PolarHBondContact O-N 3.12Å
428	S	97.6	Very high	93.8	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	164.3	178.7	56.7	0	0	0	0	112.4	L318 L398 C399 F400	L318-S428 CarbonylContact O-C 3.58Å; L318-S428 WeakPolarHBondContact O-CA 3.17Å; L318-S428 WeakPolarHBondContact O-CB 3.18Å; L398-S428 PolarHBondContact O-N 3Å; L398-S428 PolarHBondContact O-OG 2.94Å; C399-S428 WeakPolarHBondContact CA-O 3.36Å; C399-S428 WeakPolarHBondContact CA-OG 3.38Å; F400-S428 PolarHBondContact N-O 3.29Å
429	I	96.2	Very high	93.7	Very high	37 Å²	37	47.5 Å²	47.5	19%	0.19	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	140.8	173.4	-169	174.1	0	0	0	110.6	L318 A319 V320 F400 M412 L416 S431	L318-I429 PolarHBondContact O-N 3.03Å; A319-I429 CarbonylContact C-O 3.43Å; A319-I429 WeakPolarHBondContact CA-O 3.43Å; A319-I429 HydrophobicContact CB-CG2 4.15Å; V320-I429 PolarHBondContact N-O 2.83Å; F400-I429 CarbonylContact O-C 3.51Å; F400-I429 WeakPolarHBondContact O-CA 3.44Å; M412-I429 HydrophobicContact CE-CD1 3.85Å; M412-I429 HydrophobicContact CE-CG1 4.47Å; M412-I429 HydrophobicContact SD-CD1 4.02Å; M412-I429 HydrophobicContact SD-CG1 4.14Å; L416-I429 HydrophobicContact CD1-CB 4.19Å; L416-I429 HydrophobicContact CD1-CD1 3.93Å; L416-I429 HydrophobicContact CD1-CG1 4.27Å; I429-S431 PolarHBondContact O-N 3.38Å
430	A	95.4	Very high	93.4	Very high	5 Å²	5	49.5 Å²	49.5	4%	0.041	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	115.2	173.1	0	0	0	0	0	110	I325 F400 M401 G432 G433	I325-A430 HydrophobicContact CD1-CB 3.75Å; F400-A430 PolarHBondContact O-N 2.89Å; M401-A430 HydrophobicContact CB-CB 3.86Å; A430-G432 PolarHBondContact O-N 3.39Å; A430-G433 PolarHBondContact O-N 2.97Å
431	S	92.9	Very high	93	Very high	54 Å²	54	48.8 Å²	48.8	38%	0.378	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	121.6	-178.7	-171.1	0	0	0	0	110.9	V320 I429 G433 A436	V320-S431 PolarHBondContact O-N 3.2Å; I429-S431 PolarHBondContact O-N 3.38Å; S431-G433 PolarHBondContact O-N 2.89Å; S431-A436 WeakPolarHBondContact O-CB 3.47Å
432	G	90.2	Very high	92.6	Very high	36 Å²	36	44.7 Å²	44.7	37%	0.371	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	71	8.8	-177.1	0	0	0	0	0	115.6	G404 A430 A436	G404-G432 VanDerWaalsContact CA-O 3.24Å; G404-G432 WeakPolarHBondContact CA-O 3.36Å; A430-G432 PolarHBondContact O-N 3.39Å; G432-A436 WeakPolarHBondContact O-CB 3.24Å; G432-A436 PolarHBondContact O-N 3.1Å
433	G	93.3	Very high	92.1	Very high	4 Å²	4	44.6 Å²	44.6	4%	0.041	24%	0.244	C	C	.	.	H	α-helix	trans	56.4	-153.4	171.8	0	0	0	0	0	115.5	A430 S431 M435 A436 L437	A430-G433 PolarHBondContact O-N 2.97Å; S431-G433 PolarHBondContact O-N 2.89Å; G433-M435 VanDerWaalsContact C-N 3.26Å; G433-M435 PolarHBondContact O-N 3.46Å; G433-A436 PolarHBondContact O-N 2.96Å; G433-L437 PolarHBondContact O-N 3.37Å
434	F	93.8	Very high	91.3	Very high	10 Å²	10	44.4 Å²	44.4	4%	0.044	24%	0.242	C	C	.	.	H	α-helix	trans	-63.9	-31	179.6	-172.6	-105.4	0	0	0	112.6	R344 G352 M401 G402 S403 L437 Q438 I457	R344-F434 VanDerWaalsContact CZ-CG 3.48Å; G352-F434 WeakPolarHBondContact O-CE1 3.43Å; G352-F434 WeakPolarHBondContact O-CZ 3.32Å; M401-F434 HydrophobicContact SD-CB 4.41Å; M401-F434 HydrophobicContact SD-CD2 4.08Å; G402-F434 WeakPolarHBondContact O-CB 3.39Å; G402-F434 PolarHBondContact O-N 3Å; S403-F434 PolarHBondContact O-N 3.4Å; F434-L437 HydrophobicContact CD2-CD2 3.9Å; F434-L437 HydrophobicContact CE2-CD2 4Å; F434-L437 WeakPolarHBondContact O-CB 3.35Å; F434-L437 PolarHBondContact O-N 2.92Å; F434-Q438 HydrophobicContact CD1-CG 4.01Å; F434-Q438 HydrophobicContact CE1-CG 3.65Å; F434-Q438 VanDerWaalsContact CE1-NE2 3.32Å; F434-Q438 HydrophobicContact CZ-CG 3.96Å; F434-Q438 WeakPolarHBondContact O-CG 3.3Å; F434-Q438 PolarHBondContact O-N 2.86Å; F434-I457 HydrophobicContact CE2-CD1 3.89Å; F434-I457 HydrophobicContact CZ-CD1 4.09Å
435	M	92.1	Very high	89.8	Confident	98 Å²	98	44.7 Å²	44.7	48%	0.483	25%	0.247	S	C	.	.	H	α-helix	trans	-61.7	-46.4	175.8	-172.7	176.3	67.8	0	0	112	S403 G433 L437 Q438 Q439	S403-M435 WeakPolarHBondContact O-CB 3.34Å; S403-M435 PolarHBondContact O-N 3.02Å; G433-M435 VanDerWaalsContact C-N 3.26Å; G433-M435 PolarHBondContact O-N 3.46Å; M435-L437 VanDerWaalsContact C-N 3.31Å; M435-L437 PolarHBondContact O-N 2.92Å; M435-Q438 PolarHBondContact O-N 2.88Å; M435-Q439 PolarHBondContact O-N 3.28Å
436	A	91.9	Very high	87.6	Confident	28 Å²	28	45.9 Å²	45.9	23%	0.231	26%	0.26	C	S	.	.	H	α-helix	trans	-64.9	-35.7	175.3	0	0	0	0	0	112.2	V322 S431 G432 G433 Q439 H440	V322-A436 HydrophobicContact CG1-CB 4.21Å; V322-A436 HydrophobicContact CG2-CB 4.46Å; S431-A436 WeakPolarHBondContact O-CB 3.47Å; G432-A436 WeakPolarHBondContact O-CB 3.24Å; G432-A436 PolarHBondContact O-N 3.1Å; G433-A436 PolarHBondContact O-N 2.96Å; A436-Q439 PolarHBondContact O-N 2.94Å; A436-H440 VanDerWaalsContact O-CB 3.24Å; A436-H440 WeakPolarHBondContact O-CB 3.44Å; A436-H440 PolarHBondContact O-N 3.34Å
437	L	91.1	Very high	85.2	Confident	8 Å²	8	53 Å²	53	4%	0.042	29%	0.294	C	S	.	.	H	α-helix	trans	-60.2	-48.1	173.7	176	65.9	0	0	0	111.2	V322 L326 L354 G433 F434 M435 Q439 H440 L441 I457	V322-L437 HydrophobicContact CB-CD1 4.43Å; V322-L437 HydrophobicContact CG1-CB 4.15Å; L326-L437 HydrophobicContact CD1-CD1 3.83Å; L326-L437 HydrophobicContact CD2-CD1 4.09Å; L326-L437 HydrophobicContact CG-CD1 4.13Å; L354-L437 HydrophobicContact CB-CD2 4.13Å; L354-L437 HydrophobicContact CD1-CD2 4.22Å; G433-L437 PolarHBondContact O-N 3.37Å; F434-L437 HydrophobicContact CD2-CD2 3.9Å; F434-L437 HydrophobicContact CE2-CD2 4Å; F434-L437 WeakPolarHBondContact O-CB 3.35Å; F434-L437 PolarHBondContact O-N 2.92Å; M435-L437 VanDerWaalsContact C-N 3.31Å; M435-L437 PolarHBondContact O-N 2.92Å; L437-Q439 PolarHBondContact O-N 3.42Å; L437-H440 PolarHBondContact O-N 2.8Å; L437-L441 HydrophobicContact CD1-CD1 4.23Å; L437-L441 HydrophobicContact CD1-CG 4.29Å; L437-L441 HydrophobicContact CG-CD1 4.32Å; L437-L441 WeakPolarHBondContact O-CG 3.36Å; L437-L441 PolarHBondContact O-N 2.99Å; L437-I457 HydrophobicContact CD2-CD1 4.19Å
438	Q	89.1	Confident	82.1	Confident	102 Å²	102	54.7 Å²	54.7	48%	0.477	31%	0.313	S	S	.	.	H	α-helix	trans	-61.4	-43.9	177.6	-71.4	-175.1	-50.6	0	0	111.9	F434 M435 L441 A442	F434-Q438 HydrophobicContact CD1-CG 4.01Å; F434-Q438 HydrophobicContact CE1-CG 3.65Å; F434-Q438 VanDerWaalsContact CE1-NE2 3.32Å; F434-Q438 HydrophobicContact CZ-CG 3.96Å; F434-Q438 WeakPolarHBondContact O-CG 3.3Å; F434-Q438 PolarHBondContact O-N 2.86Å; M435-Q438 PolarHBondContact O-N 2.88Å; Q438-L441 PolarHBondContact O-N 3Å; Q438-A442 WeakPolarHBondContact O-CB 3.38Å; Q438-A442 PolarHBondContact O-N 3.02Å
439	Q	89.2	Confident	79.4	Confident	109 Å²	109	61.1 Å²	61.1	51%	0.509	36%	0.355	S	S	.	.	H	α-helix	trans	-62.4	-48.4	178.4	-176.1	57.5	41.8	0	0	111.4	M435 A436 L437 L441 A442 D443	M435-Q439 PolarHBondContact O-N 3.28Å; A436-Q439 PolarHBondContact O-N 2.94Å; L437-Q439 PolarHBondContact O-N 3.42Å; Q439-L441 PolarHBondContact O-N 2.75Å; Q439-A442 WeakPolarHBondContact O-CB 3.38Å; Q439-A442 PolarHBondContact O-N 3.37Å; Q439-A442 VanDerWaalsContact O-N 3.11Å; Q439-D443 VanDerWaalsContact NE2-CG 3.26Å; Q439-D443 PolarHBondContact NE2-OD1 3.32Å; Q439-D443 PolarHBondContact NE2-OD2 2.99Å; Q439-D443 VanDerWaalsContact O-CG 3.31Å; Q439-D443 PolarHBondContact O-N 2.98Å
440	H	88.8	Confident	76.8	Confident	46 Å²	46	67.7 Å²	67.7	21%	0.213	38%	0.384	C	S	.	.	H	α-helix	trans	-60.6	-42.9	178.5	178.6	-98.4	0	0	0	112.2	V322 S323 A436 L437 D443 I444	V322-H440 HydrophobicContact CG2-CB 3.72Å; S323-H440 VanDerWaalsContact CB-NE2 3.34Å; S323-H440 WeakPolarHBondContact CB-NE2 3.33Å; A436-H440 VanDerWaalsContact O-CB 3.24Å; A436-H440 WeakPolarHBondContact O-CB 3.44Å; A436-H440 PolarHBondContact O-N 3.34Å; L437-H440 PolarHBondContact O-N 2.8Å; H440-D443 PolarHBondContact O-N 3.49Å; H440-I444 WeakPolarHBondContact CE1-CD1 3.36Å; H440-I444 WeakPolarHBondContact O-CG1 3.36Å; H440-I444 PolarHBondContact O-N 3.46Å; H440-I444 VanDerWaalsContact O-N 3.14Å
441	L	85.1	Confident	74.3	Confident	9 Å²	9	74.1 Å²	74.1	5%	0.047	42%	0.418	C	S	.	.	H	α-helix	trans	-66.3	-36.9	174.8	-68.8	-179.5	0	0	0	112.1	L326 L437 Q438 Q439 N445 Y453 W456 I457	L326-L441 HydrophobicContact CD1-CD2 3.74Å; L326-L441 HydrophobicContact CD1-CG 4.46Å; L437-L441 HydrophobicContact CD1-CD1 4.23Å; L437-L441 HydrophobicContact CD1-CG 4.29Å; L437-L441 HydrophobicContact CG-CD1 4.32Å; L437-L441 WeakPolarHBondContact O-CG 3.36Å; L437-L441 PolarHBondContact O-N 2.99Å; Q438-L441 PolarHBondContact O-N 3Å; Q439-L441 PolarHBondContact O-N 2.75Å; L441-N445 WeakPolarHBondContact O-CB 3.3Å; L441-N445 PolarHBondContact O-N 2.93Å; L441-N445 VanDerWaalsContact O-N 3.12Å; L441-N445 PolarHBondContact O-ND2 2.85Å; L441-Y453 HydrophobicContact CD2-CD1 3.89Å; L441-Y453 HydrophobicContact CD2-CG 4.09Å; L441-W456 HydrophobicContact CD1-CB 4.38Å; L441-I457 HydrophobicContact CD1-CD1 3.94Å; L441-I457 HydrophobicContact CD1-CG1 3.93Å
442	A	83.4	Confident	72.1	Confident	46 Å²	46	74.1 Å²	74.1	38%	0.38	43%	0.427	S	S	.	.	H	α-helix	trans	-64.7	-44	175.8	0	0	0	0	0	111.4	Q438 Q439 I444 N445 V446	Q438-A442 WeakPolarHBondContact O-CB 3.38Å; Q438-A442 PolarHBondContact O-N 3.02Å; Q439-A442 WeakPolarHBondContact O-CB 3.38Å; Q439-A442 PolarHBondContact O-N 3.37Å; Q439-A442 VanDerWaalsContact O-N 3.11Å; A442-I444 PolarHBondContact O-N 3.15Å; A442-N445 PolarHBondContact O-N 2.88Å; A442-V446 WeakPolarHBondContact O-CG2 3.5Å; A442-V446 PolarHBondContact O-N 3.47Å
443	D	82.6	Confident	70.3	Confident	87 Å²	87	76.1 Å²	76.1	47%	0.465	42%	0.424	S	S	.	.	H	α-helix	trans	-64.8	-40.6	-178.9	-68.9	-28.3	0	0	0	112	Q439 H440 V446	Q439-D443 VanDerWaalsContact NE2-CG 3.26Å; Q439-D443 PolarHBondContact NE2-OD1 3.32Å; Q439-D443 PolarHBondContact NE2-OD2 2.99Å; Q439-D443 VanDerWaalsContact O-CG 3.31Å; Q439-D443 PolarHBondContact O-N 2.98Å; H440-D443 PolarHBondContact O-N 3.49Å; D443-V446 PolarHBondContact O-N 2.85Å
444	I	76.9	Confident	68.4	Low	57 Å²	57	78.8 Å²	78.8	29%	0.292	45%	0.451	S	S	.	.	H	α-helix	trans	-68.9	-38.7	176.4	-62	167.9	0	0	0	111.7	H440 A442 V446 E447 Y453	H440-I444 WeakPolarHBondContact CE1-CD1 3.36Å; H440-I444 WeakPolarHBondContact O-CG1 3.36Å; H440-I444 PolarHBondContact O-N 3.46Å; H440-I444 VanDerWaalsContact O-N 3.14Å; A442-I444 PolarHBondContact O-N 3.15Å; I444-V446 PolarHBondContact O-N 3.03Å; I444-E447 PolarHBondContact O-N 3.25Å; I444-Y453 HydrophobicContact CB-CE2 4.31Å; I444-Y453 HydrophobicContact CG2-CD2 4.39Å; I444-Y453 HydrophobicContact CG2-CE1 4.44Å; I444-Y453 HydrophobicContact CG2-CE2 3.46Å; I444-Y453 VanDerWaalsContact CG2-CE2 3.46Å; I444-Y453 VanDerWaalsContact CG2-CZ 3.5Å; I444-Y453 VanDerWaalsContact CG2-OH 3.31Å; I444-Y453 WeakPolarHBondContact CG2-OH 3.35Å
445	N	63.9	Low	66.9	Low	68 Å²	68	83.9 Å²	83.9	36%	0.364	48%	0.475	S	S	.	.	H	α-helix	trans	-65.1	-17.1	177.1	-82.9	-61.8	0	0	0	113.4	L441 A442 E447 Y453	L441-N445 WeakPolarHBondContact O-CB 3.3Å; L441-N445 PolarHBondContact O-N 2.93Å; L441-N445 VanDerWaalsContact O-N 3.12Å; L441-N445 PolarHBondContact O-ND2 2.85Å; A442-N445 PolarHBondContact O-N 2.88Å; N445-E447 VanDerWaalsContact C-N 3.34Å; N445-Y453 WeakPolarHBondContact OD1-CD2 3.29Å
446	V	51.5	Low	65.7	Low	124 Å²	124	80.1 Å²	80.1	75%	0.752	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-17.2	178	171.6	0	0	0	0	112.1	A442 D443 I444	A442-V446 WeakPolarHBondContact O-CG2 3.5Å; A442-V446 PolarHBondContact O-N 3.47Å; D443-V446 PolarHBondContact O-N 2.85Å; I444-V446 PolarHBondContact O-N 3.03Å
447	E	45.3	Very low	65.1	Low	181 Å²	181	81 Å²	81	85%	0.846	46%	0.456	S	S	*	.	S	Bend	trans	-99.3	-5.7	-175.3	-66.4	-166.6	156.1	0	0	115.8	I444 N445	I444-E447 PolarHBondContact O-N 3.25Å; N445-E447 VanDerWaalsContact C-N 3.34Å
448	G	34.5	Very low	64.4	Low	39 Å²	39	82.3 Å²	82.3	40%	0.402	47%	0.468	S	S	.	.			trans	-167.3	145.9	174.9	0	0	0	0	0	115.5
449	P	40.3	Very low	63.6	Low	136 Å²	136	80.9 Å²	80.9	88%	0.883	47%	0.469	S	S	*	.	S	Bend	trans	-92.9	15.7	178.6	38	-34.2	0	0	0	114.3
450	E	42.2	Very low	62.3	Low	174 Å²	174	80 Å²	80	81%	0.813	47%	0.471	S	S	*	.	S	Bend	trans	-108.8	108.6	178.8	-65.9	-160.2	163.6	0	0	110.6
451	N	41.4	Very low	60.2	Low	140 Å²	140	81.7 Å²	81.7	75%	0.749	49%	0.488	S	S	*	.	S	Bend	trans	80.2	84.8	-179.7	-55.7	-19.2	0	0	0	115.8	Y453	N451-Y453 PolarHBondContact O-N 3.35Å
452	G	47.5	Very low	58	Low	54 Å²	54	84.8 Å²	84.8	56%	0.557	52%	0.522	S	S	*	.			trans	-53.8	125.6	169.3	0	0	0	0	0	112.2	G454 H455	G452-G454 PolarHBondContact O-N 3.3Å; G452-H455 PolarHBondContact O-ND1 3.31Å
453	Y	51.5	Low	55.7	Low	78 Å²	78	88.5 Å²	88.5	31%	0.306	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-70.8	8.9	175.8	-66.2	-96.5	0	0	0	113.4	L441 I444 N445 N451 H455 W456	L441-Y453 HydrophobicContact CD2-CD1 3.89Å; L441-Y453 HydrophobicContact CD2-CG 4.09Å; I444-Y453 HydrophobicContact CB-CE2 4.31Å; I444-Y453 HydrophobicContact CG2-CD2 4.39Å; I444-Y453 HydrophobicContact CG2-CE1 4.44Å; I444-Y453 HydrophobicContact CG2-CE2 3.46Å; I444-Y453 VanDerWaalsContact CG2-CE2 3.46Å; I444-Y453 VanDerWaalsContact CG2-CZ 3.5Å; I444-Y453 VanDerWaalsContact CG2-OH 3.31Å; I444-Y453 WeakPolarHBondContact CG2-OH 3.35Å; N445-Y453 WeakPolarHBondContact OD1-CD2 3.29Å; N451-Y453 PolarHBondContact O-N 3.35Å; Y453-H455 PolarHBondContact O-N 3.2Å; Y453-H455 VanDerWaalsContact O-N 3.07Å; Y453-W456 AromaticContact CD1-CD1 3.64Å; Y453-W456 AromaticContact CD1-NE1 3.58Å; Y453-W456 WeakPolarHBondContact O-CB 3.37Å; Y453-W456 PolarHBondContact O-N 3.2Å
454	G	53.8	Low	53.4	Low	60 Å²	60	95.5 Å²	95.5	62%	0.619	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-61.8	-13.4	177.4	0	0	0	0	0	114.5	G452 W456	G452-G454 PolarHBondContact O-N 3.3Å; G454-W456 VanDerWaalsContact C-N 3.34Å
455	H	63.1	Low	51.1	Low	118 Å²	118	97.2 Å²	97.2	55%	0.546	58%	0.582	S	S	.	*	G	3₁₀ helix	trans	-77.2	-18.1	173.9	70.1	-84.2	0	0	0	113.8	G452 Y453	G452-H455 PolarHBondContact O-ND1 3.31Å; Y453-H455 PolarHBondContact O-N 3.2Å; Y453-H455 VanDerWaalsContact O-N 3.07Å
456	W	65.8	Low	49.4	Very low	19 Å²	19	99.2 Å²	99.2	7%	0.072	60%	0.601	C	S	.	*	T	Hydrogen-bonded Turn	trans	-79.3	-25.5	177.4	-64.9	101	0	0	0	112.8	L326 Q330 L354 S355 I392 L441 Y453 G454	L326-W456 HydrophobicContact CD2-CD2 4.33Å; L326-W456 HydrophobicContact CD2-CE3 4.14Å; Q330-W456 VanDerWaalsContact CD-CZ2 3.42Å; Q330-W456 HydrophobicContact CG-CH2 3.6Å; Q330-W456 HydrophobicContact CG-CZ2 4.05Å; L354-W456 CarbonylContact C-O 3.48Å; L354-W456 WeakPolarHBondContact CA-O 3.29Å; L354-W456 HydrophobicContact CD1-CB 4.35Å; L354-W456 HydrophobicContact CD1-CE3 4.28Å; S355-W456 PolarHBondContact N-O 2.99Å; S355-W456 PolarHBondContact OG-O 2.98Å; I392-W456 HydrophobicContact CD1-CH2 4.13Å; L441-W456 HydrophobicContact CD1-CB 4.38Å; Y453-W456 AromaticContact CD1-CD1 3.64Å; Y453-W456 AromaticContact CD1-NE1 3.58Å; Y453-W456 WeakPolarHBondContact O-CB 3.37Å; Y453-W456 PolarHBondContact O-N 3.2Å; G454-W456 VanDerWaalsContact C-N 3.34Å
457	I	79.2	Confident	48.2	Very low	47 Å²	47	101.6 Å²	101.6	24%	0.241	61%	0.608	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-103	117.7	179.4	-55.9	-61.7	0	0	0	109	H353 F434 L437 L441	H353-I457 CarbonylContact O-C 3.57Å; H353-I457 WeakPolarHBondContact O-CA 3.19Å; F434-I457 HydrophobicContact CE2-CD1 3.89Å; F434-I457 HydrophobicContact CZ-CD1 4.09Å; L437-I457 HydrophobicContact CD2-CD1 4.19Å; L441-I457 HydrophobicContact CD1-CD1 3.94Å; L441-I457 HydrophobicContact CD1-CG1 3.93Å
458	A	76.7	Confident	47.3	Very low	35 Å²	35	97.6 Å²	97.6	29%	0.289	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.4	141.2	171.8	0	0	0	0	0	109.9	G352 H353	G352-A458 CarbonylContact C-O 3.58Å; G352-A458 VanDerWaalsContact CA-O 3.3Å; G352-A458 WeakPolarHBondContact CA-O 3.18Å; H353-A458 PolarHBondContact CE1-O 3.05Å; H353-A458 PolarHBondContact N-O 2.84Å; H353-A458 PolarHBondContact ND1-O 2.8Å; H353-A458 VanDerWaalsContact ND1-O 3.15Å; H353-A458 PolarHBondContact O-N 2.81Å
459	S	73.4	Confident	46.9	Very low	71 Å²	71	101 Å²	101	50%	0.497	62%	0.618	S	S	.	*			trans	-129.7	133.2	172.6	-63	0	0	0	0	108.9	A351	A351-S459 WeakPolarHBondContact O-CB 3.09Å; A351-S459 PolarHBondContact O-OG 3.03Å
460	T	60.4	Low	46.4	Very low	90 Å²	90	101.1 Å²	101.1	55%	0.552	62%	0.616	S	S	*	*			trans	-89.5	-9.3	176.3	54.2	0	0	0	0	112	N350 G462	N350-T460 WeakPolarHBondContact CA-OG1 3.47Å; N350-T460 WeakPolarHBondContact CB-OG1 3.29Å; N350-T460 VanDerWaalsContact CG-OG1 3.23Å; N350-T460 PolarHBondContact O-N 3.32Å; N350-T460 VanDerWaalsContact O-N 3.12Å; N350-T460 PolarHBondContact O-OG1 2.96Å; N350-T460 PolarHBondContact OD1-OG1 2.69Å; T460-G462 PolarHBondContact O-N 3.09Å
461	S	45.8	Very low	45.8	Very low	83 Å²	83	100.6 Å²	100.6	58%	0.58	62%	0.618	S	S	*	*	S	Bend	trans	-72.2	114.5	171.4	-61.9	0	0	0	0	110.5
462	G	38	Very low	45.1	Very low	73 Å²	73	97.1 Å²	97.1	75%	0.753	62%	0.616	S	S	*	*			trans	-47.3	132.7	-167.1	0	0	0	0	0	116.9	T460 R464	T460-G462 PolarHBondContact O-N 3.09Å; G462-R464 PolarHBondContact O-N 3.21Å
463	S	36.2	Very low	44.1	Very low	124 Å²	124	104.1 Å²	104.1	87%	0.867	63%	0.634	S	S	*	*			trans	-18.8	112.8	163.1	-65.9	0	0	0	0	116.1
464	R	33.4	Very low	42.9	Very low	234 Å²	234	105.7 Å²	105.7	88%	0.883	66%	0.656	S	S	*	*			trans	-137.8	100.7	146.3	-80.8	-170.4	138	172	-5.9	111	G462	G462-R464 PolarHBondContact O-N 3.21Å
465	S	29.7	Very low	41.5	Very low	93 Å²	93	108.3 Å²	108.3	65%	0.65	66%	0.664	S	S	*	*			trans	56.6	105.5	145.9	56.6	0	0	0	0	119.3	I467	S465-I467 PolarHBondContact O-N 2.91Å
466	S	27.3	Very low	39.8	Very low	110 Å²	110	111 Å²	111	77%	0.769	68%	0.682	S	S	*	*				-13.4	114.4	129.7	48.8	0	0	0	0	114.6	S468	S466-S468 VanDerWaalsContact C-N 3.34Å; S466-S468 PolarHBondContact O-N 2.86Å; S466-S468 VanDerWaalsContact O-N 3.16Å
467	I	27.5	Very low	37.9	Very low	175 Å²	175	113.2 Å²	113.2	90%	0.897	71%	0.711	S	S	*	*			trans	-82	85.9	166.6	-54.2	165.9	0	0	0	106.5	S465	S465-I467 PolarHBondContact O-N 2.91Å
468	S	26.7	Very low	35.4	Very low	96 Å²	96	116.6 Å²	116.6	67%	0.671	74%	0.739	S	S	*	*			trans	-78.3	135.8	160.2	53.4	0	0	0	0	109	S466	S466-S468 VanDerWaalsContact C-N 3.34Å; S466-S468 PolarHBondContact O-N 2.86Å; S466-S468 VanDerWaalsContact O-N 3.16Å
469	S	26.2	Very low	33	Very low	111 Å²	111	122.5 Å²	122.5	78%	0.776	77%	0.766	S	S	*	*			trans	-43.5	137.1	178.7	40.3	0	0	0	0	114.8
470	V	28.2	Very low	30.8	Very low	139 Å²	139	127 Å²	127	84%	0.842	78%	0.784	S	S	*	*			trans	-93.9	107.8	165.5	-175.3	0	0	0	0	107.1
471	D	29.5	Very low	29.4	Very low	162 Å²	162	134.3 Å²	134.3	87%	0.866	80%	0.802	S	S	*	*			trans	-112.4	129	154.6	-92.2	-32.5	0	0	0	107.6
472	G	28.1	Very low	28.5	Very low	67 Å²	67	134 Å²	134	69%	0.691	81%	0.811	S	S	*	*			trans	-93.8	156.2	-178.3	0	0	0	0	0	112.6
473	E	26.6	Very low	28	Very low	202 Å²	202	138.8 Å²	138.8	94%	0.944	82%	0.816	S	S	*	*			trans	-160	148.5	146.3	-114.5	175.6	-173.5	0	0	110.8
474	S	25.1	Very low	27.6	Very low	110 Å²	110	142.3 Å²	142.3	77%	0.769	82%	0.816	S	S	*	*			trans	-100.6	161.8	-157.6	-69.7	0	0	0	0	114.6
475	C	25.3	Very low	27.5	Very low	116 Å²	116	136.1 Å²	136.1	78%	0.784	81%	0.809	S	S	*	*			trans	70.4	109.7	150.1	-60.8	0	0	0	0	120.5
476	N	26.9	Very low	27.5	Very low	173 Å²	173	139.1 Å²	139.1	93%	0.925	82%	0.817	S	S	*	*				-166.2	136.4	110.1	-106.7	-16.8	0	0	0	111.9
477	G	25.5	Very low	27.9	Very low	67 Å²	67	140.2 Å²	140.2	69%	0.691	82%	0.818	S	S	*	*			trans	-91.5	156.1	-177.3	0	0	0	0	0	114.1
478	S	27.4	Very low	28.1	Very low	118 Å²	118	139.7 Å²	139.7	83%	0.825	82%	0.817	S	S	*	*				170.1	133.9	118.1	44.3	0	0	0	0	111.4
479	N	26	Very low	28.5	Very low	159 Å²	159	144.8 Å²	144.8	85%	0.85	83%	0.828	S	S	*	*			trans	27.7	118.1	157.3	-71.4	-9.4	0	0	0	120.4
480	D	27.5	Very low	28.8	Very low	165 Å²	165	148 Å²	148	88%	0.882	83%	0.832	S	S	*	*				-150.9	138.1	106.2	-151	2.9	0	0	0	112.7
481	R	31.2	Very low	28.7	Very low	243 Å²	243	147.7 Å²	147.7	92%	0.917	83%	0.831	S	S	*	*			trans	-96.4	126	176	-92.8	179.9	-178.4	179.6	1.6	107.8
482	G	25.7	Very low	28.8	Very low	76 Å²	76	147.4 Å²	147.4	78%	0.784	84%	0.835	S	S	*	*			trans	-167.6	75.6	174.6	0	0	0	0	0	115.7
483	M	27.2	Very low	29.1	Very low	174 Å²	174	148 Å²	148	86%	0.857	83%	0.833	S	S	*	*			trans	13.9	116.3	147.8	-161.6	84.8	96.3	0	0	118.2
484	K	29.6	Very low	29.4	Very low	198 Å²	198	146 Å²	146	86%	0.861	83%	0.828	S	S	*	*				179	100.6	122	-93.5	159.6	-167.7	-176	0	111.7
485	S	29.5	Very low	29.6	Very low	104 Å²	104	151.2 Å²	151.2	73%	0.727	84%	0.837	S	S	*	*			trans	-57.7	154.5	147.5	169.3	0	0	0	0	110.1
486	L	31.3	Very low	29.8	Very low	157 Å²	157	151.7 Å²	151.7	82%	0.822	84%	0.837	S	S	*	*			trans	111.5	131.2	167.5	-58.8	170.9	0	0	0	115.1
487	V	34.2	Very low	29.9	Very low	132 Å²	132	152.9 Å²	152.9	80%	0.8	83%	0.834	S	S	*	*			trans	88.8	71.5	172.9	-154.9	0	0	0	0	116.1
488	N	31.7	Very low	29.8	Very low	164 Å²	164	155.2 Å²	155.2	88%	0.877	84%	0.839	S	S	*	*			trans	-126.4	36.7	167.5	-140.4	12.3	0	0	0	113
489	K	36.4	Very low	29.8	Very low	204 Å²	204	156.1 Å²	156.1	89%	0.887	84%	0.839	S	S	*	*	S	Bend	trans	-144.1	21.9	-176.8	-84.8	-162.8	174.6	-179.2	0	117.5
490	M	30.9	Very low	29.8	Very low	177 Å²	177	155.7 Å²	155.7	87%	0.872	84%	0.837	S	S	*	*	S	Bend	trans	-158.2	67	175.6	-143.9	164.4	-169.8	0	0	115.1
491	T	27.9	Very low	29.9	Very low	134 Å²	134	154.1 Å²	154.1	82%	0.822	83%	0.833	S	S	*	*			trans	-158.2	61.2	163.3	-35	0	0	0	0	112.9
492	V	30.4	Very low	29.8	Very low	155 Å²	155	154.4 Å²	154.4	94%	0.939	83%	0.834	S	S	*	*	S	Bend	trans	-131.6	33.2	164.4	-174	0	0	0	0	111.1
493	A	34.4	Very low	30.2	Very low	80 Å²	80	160 Å²	160	66%	0.661	84%	0.84	S	S	*	*	S	Bend	trans	-133.9	132.3	165.2	0	0	0	0	0	107.5
494	L	33.1	Very low	30.5	Very low	161 Å²	161	161 Å²	161	84%	0.843	84%	0.84	S	S	*	*			trans	90.4	80.8	176.7	-47.9	172.8	0	0	0	116.2
495	K	28.8	Very low	30.6	Very low	219 Å²	219	158.3 Å²	158.3	95%	0.952	84%	0.839	S	S	*	*			trans	-160.2	79.8	132	-109.2	173.8	-175.4	-176.7	0	110.6
496	T	29.6	Very low	30.8	Very low	126 Å²	126	161.4 Å²	161.4	77%	0.773	85%	0.846	S	S	*	*			trans	-84.4	140.4	157.4	20.7	0	0	0	0	109.7
497	K	28.7	Very low	30.6	Very low	198 Å²	198	158.7 Å²	158.7	86%	0.861	84%	0.84	S	S	*	*			trans	126.4	133.2	150.2	-67.4	-174.5	178.8	-174.9	0	115.4
498	S	24.7	Very low	30.4	Very low	115 Å²	115	162.1 Å²	162.1	80%	0.804	85%	0.845	S	S	*	*			trans	85.6	117.1	-179.7	98.4	0	0	0	0	112.7
499	V	26.6	Very low	30.6	Very low	138 Å²	138	161.9 Å²	161.9	84%	0.836	84%	0.842	S	S	*	*			cis	-149.5	144.4	29.2	170.6	0	0	0	0	111.6
500	N	27.2	Very low	30.1	Very low	150 Å²	150	161.1 Å²	161.1	80%	0.802	84%	0.842	S	S	*	*			trans	-40.7	150.6	174.2	-101.1	-21.7	0	0	0	119.6
501	V	29.1	Very low	30	Very low	132 Å²	132	159.3 Å²	159.3	80%	0.8	84%	0.835	S	S	*	*			trans	88.5	88.2	149.5	-175	0	0	0	0	118.1
502	R	29.1	Very low	30	Very low	249 Å²	249	159.1 Å²	159.1	94%	0.94	83%	0.834	S	S	*	*				-170.6	80.2	120	-109.9	-178.2	176.4	167.6	-1.1	109.3
503	E	33.2	Very low	30.1	Very low	194 Å²	194	157.3 Å²	157.3	91%	0.907	83%	0.828	S	S	*	*			trans	-102.3	94.1	-180	-163	174.5	-151.7	0	0	107.5
504	K	33.4	Very low	29.7	Very low	195 Å²	195	159.9 Å²	159.9	85%	0.848	84%	0.836	S	S	*	*	S	Bend	trans	-178	132.2	157.4	-103.3	176.1	-175.6	-172.9	0	105.5
505	V	31.5	Very low	29.5	Very low	141 Å²	141	158 Å²	158	86%	0.855	83%	0.833	S	S	*	*	S	Bend	trans	87.2	125.9	-169.3	-163.6	0	0	0	0	111.6
506	I	33.7	Very low	29.7	Very low	168 Å²	168	153.5 Å²	153.5	86%	0.862	82%	0.824	S	S	*	*	S	Bend	trans	86.8	61.3	-175.6	-38.5	164.9	0	0	0	114.7
507	S	28.7	Very low	29.4	Very low	101 Å²	101	155.1 Å²	155.1	71%	0.706	83%	0.828	S	S	*	*			trans	-166.1	64.4	148.9	66.1	0	0	0	0	111.1
508	F	28.6	Very low	29.5	Very low	203 Å²	203	156.8 Å²	156.8	89%	0.89	83%	0.829	S	S	*	*			trans	-147.4	94.5	159.5	-83.5	-72.5	0	0	0	107.7
509	I	35.6	Very low	29.5	Very low	160 Å²	160	158 Å²	158	82%	0.821	82%	0.824	S	S	*	*			trans	175.3	88.4	142.6	-78.3	146.3	0	0	0	103.8
510	E	27.5	Very low	29.5	Very low	188 Å²	188	157.5 Å²	157.5	88%	0.879	83%	0.826	S	S	*	*			trans	-125.3	115.3	154.8	-102.7	-175	169.7	0	0	105.7	T512	E510-T512 PolarHBondContact O-N 2.93Å
511	N	28.9	Very low	29.7	Very low	139 Å²	139	158.5 Å²	158.5	74%	0.743	82%	0.824	S	S	*	*			trans	-61.4	116.9	178.9	-80.2	-15.8	0	0	0	110.4
512	T	26.7	Very low	29.8	Very low	129 Å²	129	160 Å²	160	79%	0.791	83%	0.827	S	S	*	*			trans	-123.6	108	161.5	55.9	0	0	0	0	110.2	E510	E510-T512 PolarHBondContact O-N 2.93Å
513	S	32	Very low	30	Very low	118 Å²	118	151.8 Å²	151.8	83%	0.825	80%	0.801	S	S	*	*			trans	-69.5	126.3	171.2	50	0	0	0	0	112.6
514	T	26.8	Very low	29.8	Very low	134 Å²	134	148.1 Å²	148.1	82%	0.822	79%	0.794	S	S	*	*			trans	-151.8	152.5	155.8	44.8	0	0	0	0	111.1
515	P	29.3	Very low	29.9	Very low	120 Å²	120	143.6 Å²	143.6	78%	0.779	77%	0.772	S	S	*	*			trans	-92.1	141.8	-154.1	35.1	-33.6	0	0	0	116.2
516	V	31.8	Very low	29.9	Very low	126 Å²	126	143 Å²	143	76%	0.764	77%	0.771	S	S	*	*			trans	27	126.4	146.4	-158.5	0	0	0	0	120.6
517	D	23.9	Very low	29.7	Very low	159 Å²	159	142.3 Å²	142.3	85%	0.85	77%	0.769	S	S	*	*				-138.3	137.6	128.9	-127.3	-16.7	0	0	0	110.5	M519	D517-M519 PolarHBondContact O-N 3.36Å
518	R	31.1	Very low	29.9	Very low	234 Å²	234	149 Å²	149	88%	0.883	78%	0.779	S	S	*	*			trans	-69.5	107.4	-173.8	-85.1	179.8	172	167.8	-2.8	111.2
519	M	24.7	Very low	29.7	Very low	141 Å²	141	145.1 Å²	145.1	70%	0.695	78%	0.777	S	S	*	*			trans	-123.3	131.1	159.1	-105.8	82.8	-171.1	0	0	110.3	D517 F521	D517-M519 PolarHBondContact O-N 3.36Å; M519-F521 HydrophobicContact CB-CD2 3.92Å; M519-F521 HydrophobicContact CB-CE2 3.41Å; M519-F521 VanDerWaalsContact CB-CE2 3.41Å; M519-F521 HydrophobicContact CB-CZ 3.95Å; M519-F521 VanDerWaalsContact O-CD2 3.27Å; M519-F521 WeakPolarHBondContact O-CD2 3.19Å; M519-F521 PolarHBondContact O-N 2.76Å
520	S	27.7	Very low	29.4	Very low	126 Å²	126	143.1 Å²	143.1	88%	0.881	78%	0.776	S	S	*	*			trans	-68.3	117.8	165.6	-48.9	0	0	0	0	108.6
521	F	29.8	Very low	29.4	Very low	172 Å²	172	140.9 Å²	140.9	75%	0.754	78%	0.775	S	S	*	*			trans	-109.8	107.9	179.8	-81.1	-80.8	0	0	0	110.9	M519	M519-F521 HydrophobicContact CB-CD2 3.92Å; M519-F521 HydrophobicContact CB-CE2 3.41Å; M519-F521 VanDerWaalsContact CB-CE2 3.41Å; M519-F521 HydrophobicContact CB-CZ 3.95Å; M519-F521 VanDerWaalsContact O-CD2 3.27Å; M519-F521 WeakPolarHBondContact O-CD2 3.19Å; M519-F521 PolarHBondContact O-N 2.76Å
522	N	30.8	Very low	29.4	Very low	164 Å²	164	141.3 Å²	141.3	88%	0.877	77%	0.773	S	S	*	*			trans	-76.3	117.2	158.3	-75.8	-11.1	0	0	0	107.7
523	L	34.7	Very low	29.6	Very low	75 Å²	75	146.6 Å²	146.6	39%	0.393	78%	0.778	S	S	.	*			trans	-72.9	139.7	172.6	-72.4	168.2	0	0	0	109.9	A373 W525	A373-L523 HydrophobicContact CB-CD1 4.38Å; L523-W525 PolarHBondContact O-N 3.49Å
524	P	28.7	Very low	29.7	Very low	118 Å²	118	148.9 Å²	148.9	77%	0.766	78%	0.776	S	S	*	*			trans	-78.4	88.2	175.6	31.6	-30.6	0	0	0	109.2
525	W	35.3	Very low	29.9	Very low	100 Å²	100	148.3 Å²	148.3	38%	0.379	77%	0.772	S	S	.	*			trans	-78.8	162.1	155.6	-62.5	91.2	0	0	0	108.1	L380 L523 D527	L380-W525 HydrophobicContact CD1-CH2 3.4Å; L380-W525 VanDerWaalsContact CD1-CH2 3.4Å; L380-W525 HydrophobicContact CD1-CZ3 3.56Å; L523-W525 PolarHBondContact O-N 3.49Å; W525-D527 PolarHBondContact O-N 3.42Å
526	P	32.3	Very low	30.2	Very low	129 Å²	129	145.6 Å²	145.6	84%	0.838	76%	0.755	S	S	*	*			trans	-62.5	104.7	167.7	-4.2	17.3	0	0	0	108	R528	P526-R528 PolarHBondContact O-N 3.18Å
527	D	29.6	Very low	30.3	Very low	152 Å²	152	146.1 Å²	146.1	81%	0.813	77%	0.765	S	S	*	*			trans	-63.1	120.8	-176.5	-96	-28.1	0	0	0	111.2	W525	W525-D527 PolarHBondContact O-N 3.42Å
528	R	32.2	Very low	30.9	Very low	242 Å²	242	142.6 Å²	142.6	91%	0.913	75%	0.753	S	S	*	*			trans	-117.5	118.6	141.5	-81.5	-172.2	176	-174.4	0.3	106.8	P526 C530	P526-R528 PolarHBondContact O-N 3.18Å; R528-C530 PolarHBondContact O-N 2.85Å
529	S	25.3	Very low	31.2	Very low	122 Å²	122	136.1 Å²	136.1	85%	0.853	74%	0.735	S	S	*	*			trans	-60.5	115.5	-168.7	53.1	0	0	0	0	112.9
530	C	28.2	Very low	31.9	Very low	117 Å²	117	141.4 Å²	141.4	79%	0.791	75%	0.748	S	S	*	*			trans	-121.4	124.8	161	-166.3	0	0	0	0	108	R528 E532	R528-C530 PolarHBondContact O-N 2.85Å; C530-E532 PolarHBondContact O-N 2.85Å
531	T	28.2	Very low	32.4	Very low	142 Å²	142	141.8 Å²	141.8	87%	0.871	74%	0.744	S	S	*	*			trans	-77.7	100.3	-177.5	45.6	0	0	0	0	110.7
532	E	29.2	Very low	32.8	Very low	147 Å²	147	137 Å²	137	69%	0.687	74%	0.743	S	S	*	*			trans	-70.4	125.3	172.3	-72.9	179.2	162	0	0	111.3	C530	C530-E532 PolarHBondContact O-N 2.85Å
533	R	29.2	Very low	32.9	Very low	241 Å²	241	139 Å²	139	91%	0.909	74%	0.744	S	S	*	*			trans	-117.3	115.7	160.8	-171.3	-174.6	-93.4	157.5	-6.6	106.8
534	H	34	Very low	33.1	Very low	166 Å²	166	141.2 Å²	141.2	77%	0.769	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-63.4	135.4	176.4	-81.2	-129.3	0	0	0	110.7	S536	H534-S536 PolarHBondContact O-N 3.43Å
535	V	32.3	Very low	33.5	Very low	122 Å²	122	144 Å²	144	74%	0.739	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-70.9	124.9	174.6	-176.9	0	0	0	0	109.2	D539	V535-D539 HydrophobicContact CG1-CB 3.99Å
536	S	36	Very low	33.5	Very low	63 Å²	63	151.5 Å²	151.5	44%	0.441	79%	0.788	S	S	.	*	P	Polyproline II helix	trans	-87.6	150	176.7	172.3	0	0	0	0	109.8	H534 S538 D539	H534-S536 PolarHBondContact O-N 3.43Å; S536-S538 WeakPolarHBondContact CB-OG 3.07Å; S536-S538 PolarHBondContact O-N 3.44Å; S536-S538 PolarHBondContact OG-N 3.34Å; S536-S538 PolarHBondContact OG-OG 2.81Å; S536-D539 PolarHBondContact O-N 3.26Å
537	S	33.7	Very low	33.8	Very low	137 Å²	137	149.1 Å²	149.1	96%	0.958	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-1.2	175.1	62.6	0	0	0	0	114.5
538	S	35.6	Very low	34.1	Very low	85 Å²	85	147 Å²	147	59%	0.594	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-8.8	174.2	54.3	0	0	0	0	114.5	S536 R540	S536-S538 WeakPolarHBondContact CB-OG 3.07Å; S536-S538 PolarHBondContact O-N 3.44Å; S536-S538 PolarHBondContact OG-N 3.34Å; S536-S538 PolarHBondContact OG-OG 2.81Å; S538-R540 PolarHBondContact O-N 2.91Å; S538-R540 VanDerWaalsContact O-N 3.1Å
539	D	38.5	Very low	34.3	Very low	97 Å²	97	144.9 Å²	144.9	52%	0.519	78%	0.776	S	S	.	*			trans	-77.4	97.6	180	-74.2	-26.2	0	0	0	110.6	V535 S536 V541	V535-D539 HydrophobicContact CG1-CB 3.99Å; S536-D539 PolarHBondContact O-N 3.26Å; D539-V541 PolarHBondContact O-N 3.47Å
540	R	39.3	Very low	34.8	Very low	253 Å²	253	143.2 Å²	143.2	96%	0.955	76%	0.763	S	S	*	*			trans	-75.3	88.6	172	-75.7	-175.7	173.7	-176	-1.2	110	S538	S538-R540 PolarHBondContact O-N 2.91Å; S538-R540 VanDerWaalsContact O-N 3.1Å
541	V	37.7	Very low	35.6	Very low	134 Å²	134	142 Å²	142	81%	0.812	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-103.2	146.7	162.7	-159.7	0	0	0	0	108.5	D539	D539-V541 PolarHBondContact O-N 3.47Å
542	G	37	Very low	36.1	Very low	71 Å²	71	141 Å²	141	73%	0.732	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-52.1	160.6	-159.7	0	0	0	0	0	117.6
543	K	34.7	Very low	36.4	Very low	207 Å²	207	137.7 Å²	137.7	90%	0.9	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-48.1	140.7	-177.2	-61.9	177.9	178.3	-178.7	0	112.9
544	P	38.2	Very low	36.7	Very low	120 Å²	120	133.9 Å²	133.9	78%	0.779	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-70.7	158.5	-176.9	28.4	-34.2	0	0	0	113.6	R546	P544-R546 PolarHBondContact O-N 2.72Å
545	Y	36.9	Very low	36.7	Very low	178 Å²	178	129.3 Å²	129.3	70%	0.698	72%	0.722	S	S	*	*			trans	-34.4	122.6	178	-64.3	-92.7	0	0	0	114.8
546	R	35.2	Very low	36.6	Very low	257 Å²	257	131.1 Å²	131.1	97%	0.97	73%	0.727	S	S	*	*	S	Bend	trans	-102.4	109.4	158.5	-145.9	-179.8	-170.6	-173.7	0.3	106.2	P544	P544-R546 PolarHBondContact O-N 2.72Å
547	G	38.7	Very low	36.8	Very low	79 Å²	79	137 Å²	137	81%	0.814	75%	0.748	S	S	*	*	S	Bend	trans	134.3	-1.2	174.4	0	0	0	0	0	117.8
548	V	37	Very low	36.7	Very low	108 Å²	108	139.6 Å²	139.6	66%	0.655	75%	0.745	S	S	*	*	S	Bend	trans	-133.9	128.7	172.8	-174.3	0	0	0	0	108.1
549	K	34.7	Very low	36.5	Very low	196 Å²	196	143.1 Å²	143.1	85%	0.852	75%	0.752	S	S	*	*			trans	-61.4	125.9	173.6	-106.8	-176.3	174.6	-176.3	0	108.3	V551	K549-V551 PolarHBondContact O-N 3.07Å
550	P	36.5	Very low	36.1	Very low	88 Å²	88	147.2 Å²	147.2	57%	0.571	76%	0.762	S	S	*	*			trans	-70.8	123.3	177	-6.8	20.6	0	0	0	109.4	F552 S553	P550-F552 PolarHBondContact O-N 2.56Å; P550-S553 VanDerWaalsContact CB-OG 3.3Å; P550-S553 WeakPolarHBondContact CB-OG 3.4Å; P550-S553 WeakPolarHBondContact CG-OG 3.45Å; P550-S553 PolarHBondContact O-N 3.39Å; P550-S553 PolarHBondContact O-OG 3.13Å; P550-S553 VanDerWaalsContact O-OG 3.1Å
551	V	45.5	Very low	35.7	Very low	92 Å²	92	141.8 Å²	141.8	56%	0.558	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.5	-13.2	179.7	178.9	0	0	0	0	113.3	K549	K549-V551 PolarHBondContact O-N 3.07Å
552	F	37.8	Very low	35.3	Very low	121 Å²	121	141 Å²	141	53%	0.531	75%	0.747	S	S	.	*	T	Hydrogen-bonded Turn	trans	-119.7	25.2	-175.7	-58.7	-72.2	0	0	0	114.7	M410 M414 P550	M410-F552 HydrophobicContact CG-CD1 4.09Å; M410-F552 HydrophobicContact CG-CE1 4.04Å; M410-F552 HydrophobicContact SD-CD1 4.19Å; M414-F552 HydrophobicContact CG-CE1 4.14Å; M414-F552 HydrophobicContact CG-CZ 4.48Å; P550-F552 PolarHBondContact O-N 2.56Å
553	S	36.5	Very low	35.1	Very low	77 Å²	77	144.6 Å²	144.6	54%	0.538	75%	0.749	S	S	.	*			trans	-93.1	116.7	176.4	-36.8	0	0	0	0	110.3	P550 G555	P550-S553 VanDerWaalsContact CB-OG 3.3Å; P550-S553 WeakPolarHBondContact CB-OG 3.4Å; P550-S553 WeakPolarHBondContact CG-OG 3.45Å; P550-S553 PolarHBondContact O-N 3.39Å; P550-S553 PolarHBondContact O-OG 3.13Å; P550-S553 VanDerWaalsContact O-OG 3.1Å; S553-G555 PolarHBondContact O-N 3.24Å
554	I	36.1	Very low	34.8	Very low	161 Å²	161	144 Å²	144	83%	0.826	75%	0.75	S	S	*	*			trans	-69	119.8	164.9	-65.1	169.9	0	0	0	106.8	D556	I554-D556 PolarHBondContact O-N 3.23Å
555	G	32.2	Very low	34.6	Very low	70 Å²	70	145.9 Å²	145.9	72%	0.722	75%	0.752	S	S	*	*			trans	-79.5	107.3	-179.6	0	0	0	0	0	111.5	S553	S553-G555 PolarHBondContact O-N 3.24Å
556	D	31.3	Very low	34	Very low	159 Å²	159	144.3 Å²	144.3	85%	0.85	76%	0.755	S	S	*	*			trans	-87.4	119.1	154.2	-80.3	-23	0	0	0	107.7	I554	I554-D556 PolarHBondContact O-N 3.23Å
557	E	39.7	Very low	33.8	Very low	186 Å²	186	137 Å²	137	87%	0.869	74%	0.744	S	S	*	*			trans	-76.1	130	169.5	-65.7	-171.4	156	0	0	109.7
558	E	31.8	Very low	33.5	Very low	192 Å²	192	138 Å²	138	90%	0.897	74%	0.738	S	S	*	*			trans	-172.2	114.6	142.1	-104.1	172.5	-154	0	0	112.3
559	E	32	Very low	33.2	Very low	159 Å²	159	138.1 Å²	138.1	74%	0.743	74%	0.744	S	S	*	*			trans	40.5	124.8	142.1	-78.8	-171.6	165.5	0	0	126.5
560	Y	30.2	Very low	32.7	Very low	184 Å²	184	136.1 Å²	136.1	72%	0.722	74%	0.74	S	S	*	*			trans	75.8	124	135.4	-67.7	-62.7	0	0	0	126
561	D	31.1	Very low	32.5	Very low	138 Å²	138	135.2 Å²	135.2	74%	0.738	74%	0.735	S	S	*	*			trans	57.9	131.3	144.8	-64.1	-16.8	0	0	0	120.3
562	T	29.3	Very low	32.1	Very low	119 Å²	119	136.8 Å²	136.8	73%	0.73	74%	0.741	S	S	*	*				-169.7	141	59.9	-36.5	0	0	0	0	111.5
563	D	31.2	Very low	32.1	Very low	145 Å²	145	134.1 Å²	134.1	78%	0.775	73%	0.732	S	S	*	*			trans	19.2	107	154	-54.4	-29.3	0	0	0	121.7
564	E	29.5	Very low	32.2	Very low	194 Å²	194	134.7 Å²	134.7	91%	0.907	73%	0.729	S	S	*	*			trans	-140.8	121.1	136.5	-75.5	-167.2	164.2	0	0	109.4	D566	E564-D566 PolarHBondContact O-N 3.19Å
565	I	34	Very low	32.7	Very low	161 Å²	161	137.2 Å²	137.2	83%	0.826	73%	0.728	S	S	*	*			trans	-70.8	115.2	-178.4	-65.4	160.3	0	0	0	108.7
566	D	24.6	Very low	34.1	Very low	144 Å²	144	139 Å²	139	77%	0.77	72%	0.716	S	S	*	*			trans	-123.3	113.8	162	-151	-7	0	0	0	110.2	E564 S568	E564-D566 PolarHBondContact O-N 3.19Å; D566-S568 PolarHBondContact O-N 3.23Å
567	S	31.3	Very low	36.2	Very low	105 Å²	105	136 Å²	136	73%	0.734	70%	0.697	S	S	*	*			trans	-93.9	72.3	-170.9	-54	0	0	0	0	109.5
568	S	31.6	Very low	38.4	Very low	99 Å²	99	129.8 Å²	129.8	69%	0.692	67%	0.669	S	S	*	*			trans	-164.3	25.5	167.9	58.3	0	0	0	0	116.3	D566	D566-S568 PolarHBondContact O-N 3.23Å
569	S	29.7	Very low	41.1	Very low	111 Å²	111	121.2 Å²	121.2	78%	0.776	63%	0.629	S	S	*	*			trans	-99.9	95.3	168.2	-171.2	0	0	0	0	110.1	S571	S569-S571 PolarHBondContact O-N 2.95Å
570	M	26	Very low	43.9	Very low	154 Å²	154	116.9 Å²	116.9	76%	0.759	61%	0.612	S	S	*	*			trans	-75.2	109.6	165.6	-68.1	-79.5	114.8	0	0	107.2
571	S	31.8	Very low	46.7	Very low	68 Å²	68	108.8 Å²	108.8	48%	0.476	58%	0.58	S	S	.	*			trans	-65.4	149.3	175.2	59.7	0	0	0	0	111.2	S569 D573 D574	S569-S571 PolarHBondContact O-N 2.95Å; S571-D573 PolarHBondContact O-N 3.21Å; S571-D574 PolarHBondContact O-N 3.37Å
572	D	36.4	Very low	49.4	Very low	126 Å²	126	107.2 Å²	107.2	67%	0.674	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-52	-12.4	176.1	-84.4	-39.8	0	0	0	115.5	D574 R575	D572-D574 PolarHBondContact O-N 3.39Å; D572-R575 PolarHBondContact O-N 2.85Å
573	D	37.4	Very low	52.2	Low	65 Å²	65	105.8 Å²	105.8	35%	0.348	56%	0.56	S	S	.	*	G	3₁₀ helix	trans	-62.3	-23.1	171.2	-112.1	2.4	0	0	0	113.3	S571 R575 Y631	S571-D573 PolarHBondContact O-N 3.21Å; D573-R575 VanDerWaalsContact C-N 3.33Å; D573-R575 PolarHBondContact O-N 3.4Å; D573-Y631 PolarHBondContact OD1-OH 3.48Å; D573-Y631 PolarHBondContact OD2-OH 3.32Å
574	D	40.1	Very low	54.9	Low	88 Å²	88	100.1 Å²	100.1	47%	0.471	53%	0.528	S	S	.	.	G	3₁₀ helix	trans	-83.1	-2.2	-176.5	-69.5	-38.5	0	0	0	114.3	S571 D572	S571-D574 PolarHBondContact O-N 3.37Å; D572-D574 PolarHBondContact O-N 3.39Å
575	R	46.4	Very low	57.8	Low	214 Å²	214	92.4 Å²	92.4	81%	0.808	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-98.6	-7.4	-177.4	-67.4	-178.8	178.5	-173.7	-0.7	115	D572 D573	D572-R575 PolarHBondContact O-N 2.85Å; D573-R575 VanDerWaalsContact C-N 3.33Å; D573-R575 PolarHBondContact O-N 3.4Å
576	K	59.9	Low	60.4	Low	107 Å²	107	90 Å²	90	47%	0.465	48%	0.481	S	S	.	.	S	Bend	trans	-100.5	133.8	174.9	-69.1	173	-175.6	163.3	0	108.5	I578 Y631	K576-I578 WeakPolarHBondContact O-CG1 3.07Å; K576-I578 PolarHBondContact O-N 2.87Å; K576-Y631 HydrophobicContact CB-CD1 3.29Å; K576-Y631 HydrophobicContact CB-CE1 3.81Å; K576-Y631 HydrophobicContact CB-CG 4.01Å; K576-Y631 HydrophobicContact CD-CD1 4.11Å; K576-Y631 HydrophobicContact CD-CD2 4.5Å; K576-Y631 HydrophobicContact CD-CE1 4.46Å; K576-Y631 HydrophobicContact CD-CG 4.14Å; K576-Y631 HydrophobicContact CG-CD1 4.32Å
577	E	76.6	Confident	63.4	Low	98 Å²	98	86.5 Å²	86.5	46%	0.458	46%	0.459	S	S	.	.			trans	-61.5	104.9	179.5	-166.8	179.8	145.2	0	0	109.7	V579 I632 R635	E577-V579 HydrophobicContact CG-CG1 4.21Å; E577-I632 HydrophobicContact CB-CD1 4.18Å; E577-I632 HydrophobicContact CB-CG1 4.45Å; E577-I632 VanDerWaalsContact CD-CD1 3.49Å; E577-I632 HydrophobicContact CG-CD1 3.97Å; E577-I632 PolarHBondContact O-N 3.46Å; E577-I632 VanDerWaalsContact O-N 3.15Å; E577-I632 VanDerWaalsContact OE1-CD1 3.32Å; E577-I632 WeakPolarHBondContact OE1-CD1 3.45Å; E577-R635 IonicContact OE1-NH2 3.62Å; E577-R635 PolarHBondContact OE1-NH2 3.49Å; E577-R635 IonicContact OE2-CZ 2.64Å; E577-R635 IonicContact OE2-NH1 3.16Å; E577-R635 IonicContact OE2-NH2 2.95Å; E577-R635 PolarHBondContact OE2-NH2 3.19Å
578	I	86.4	Confident	65.7	Low	55 Å²	55	88 Å²	88	28%	0.282	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	126.5	178.1	-59.2	178.4	0	0	0	108.4	K576 I623 L629 Y631	K576-I578 WeakPolarHBondContact O-CG1 3.07Å; K576-I578 PolarHBondContact O-N 2.87Å; I578-I623 HydrophobicContact CD1-CD1 4.24Å; I578-I623 HydrophobicContact CG1-CD1 4.16Å; I578-I623 HydrophobicContact CG2-CD1 3.87Å; I578-L629 HydrophobicContact CG2-CB 4.02Å; I578-L629 HydrophobicContact CG2-CD1 4.05Å; I578-L629 HydrophobicContact CG2-CD2 4.26Å; I578-L629 HydrophobicContact CG2-CG 4.35Å; I578-Y631 HydrophobicContact CD1-CE1 3.97Å; I578-Y631 HydrophobicContact CG1-CD1 3.88Å; I578-Y631 HydrophobicContact CG1-CE1 3.56Å
579	V	87.5	Confident	68.4	Low	11 Å²	11	87 Å²	87	7%	0.067	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	149.2	-179.7	-61.9	0	0	0	0	112	E577 I581 W584 L620 L629 A630 I632	E577-V579 HydrophobicContact CG-CG1 4.21Å; V579-I581 PolarHBondContact O-N 2.75Å; V579-W584 HydrophobicContact CB-CG 4.33Å; V579-W584 HydrophobicContact CG1-CZ2 4.19Å; V579-W584 VanDerWaalsContact CG1-NE1 3.28Å; V579-W584 HydrophobicContact CG2-CD2 4.46Å; V579-W584 HydrophobicContact CG2-CG 4.19Å; V579-L620 HydrophobicContact CG2-CD1 4.27Å; V579-L620 HydrophobicContact CG2-CD2 3.94Å; V579-L629 WeakPolarHBondContact O-CA 3.24Å; V579-A630 WeakPolarHBondContact CG2-O 3.44Å; V579-A630 PolarHBondContact N-O 2.84Å; V579-A630 PolarHBondContact O-N 3.04Å; V579-I632 HydrophobicContact CG1-CD1 3.77Å; V579-I632 HydrophobicContact CG1-CG1 3.96Å; V579-I632 HydrophobicContact CG2-CD1 4.44Å; V579-I632 HydrophobicContact CG2-CG1 3.85Å
580	N	90.4	Very high	71.3	Confident	69 Å²	69	83 Å²	83	37%	0.369	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	123.5	169	-174.4	-73.3	0	0	0	109.7	Q582 T583 W584 L629	N580-Q582 VanDerWaalsContact C-N 3.33Å; N580-Q582 PolarHBondContact O-N 3.4Å; N580-Q582 WeakPolarHBondContact OD1-CB 3.44Å; N580-Q582 PolarHBondContact OD1-N 2.9Å; N580-T583 PolarHBondContact O-N 3.47Å; N580-T583 PolarHBondContact OD1-N 2.99Å; N580-T583 VanDerWaalsContact OD1-N 3.1Å; N580-T583 PolarHBondContact OD1-OG1 3.01Å; N580-W584 PolarHBondContact O-N 3.35Å; N580-W584 VanDerWaalsContact O-N 3.16Å; N580-L629 HydrophobicContact CB-CD2 4.24Å
581	I	88.8	Confident	74.4	Confident	13 Å²	13	80.4 Å²	80.4	7%	0.067	41%	0.407	C	S	.	.	H	α-helix	trans	-59.5	-45.5	-175.5	-64.6	167.3	0	0	0	110.5	V579 W584 I585 E622 G628 A630	V579-I581 PolarHBondContact O-N 2.75Å; I581-W584 PolarHBondContact O-N 3.04Å; I581-I585 HydrophobicContact CG2-CD1 3.57Å; I581-I585 HydrophobicContact CG2-CG1 4.36Å; I581-I585 VanDerWaalsContact O-CG1 3.29Å; I581-I585 WeakPolarHBondContact O-CG1 3.41Å; I581-I585 PolarHBondContact O-N 2.98Å; I581-E622 HydrophobicContact CD1-CG 3.85Å; I581-G628 PolarHBondContact N-O 3.4Å; I581-A630 HydrophobicContact CD1-CB 3.95Å; I581-A630 HydrophobicContact CG1-CB 3.51Å
582	Q	88.4	Confident	77.2	Confident	106 Å²	106	80.3 Å²	80.3	50%	0.495	40%	0.399	S	S	.	.	H	α-helix	trans	-69.7	-37.8	-176	-164.8	63.1	42.4	0	0	112	N580 W584 I585 N586	N580-Q582 VanDerWaalsContact C-N 3.33Å; N580-Q582 PolarHBondContact O-N 3.4Å; N580-Q582 WeakPolarHBondContact OD1-CB 3.44Å; N580-Q582 PolarHBondContact OD1-N 2.9Å; Q582-W584 VanDerWaalsContact C-N 3.3Å; Q582-W584 PolarHBondContact O-N 3.33Å; Q582-I585 PolarHBondContact O-N 3.25Å; Q582-N586 PolarHBondContact NE2-OD1 2.74Å; Q582-N586 VanDerWaalsContact NE2-OD1 3.16Å; Q582-N586 WeakPolarHBondContact O-CB 3.32Å; Q582-N586 PolarHBondContact O-N 2.74Å; Q582-N586 VanDerWaalsContact O-N 3.09Å; Q582-N586 PolarHBondContact O-ND2 2.91Å
583	T	88.3	Confident	80	Confident	89 Å²	89	77.2 Å²	77.2	55%	0.546	38%	0.381	S	S	.	.	H	α-helix	trans	-61.1	-40.9	174.6	-54.3	0	0	0	0	111.4	N580 K587	N580-T583 PolarHBondContact O-N 3.47Å; N580-T583 PolarHBondContact OD1-N 2.99Å; N580-T583 VanDerWaalsContact OD1-N 3.1Å; N580-T583 PolarHBondContact OD1-OG1 3.01Å; T583-K587 WeakPolarHBondContact O-CG 3.47Å; T583-K587 PolarHBondContact O-N 2.97Å
584	W	88.6	Confident	82.7	Confident	26 Å²	26	75.7 Å²	75.7	10%	0.098	37%	0.371	C	S	.	.	H	α-helix	trans	-72.5	-40.9	179.1	-92.2	69.5	0	0	0	113.5	V579 N580 I581 Q582 N586 K587 I590 L611 Y618 L620 I632	V579-W584 HydrophobicContact CB-CG 4.33Å; V579-W584 HydrophobicContact CG1-CZ2 4.19Å; V579-W584 VanDerWaalsContact CG1-NE1 3.28Å; V579-W584 HydrophobicContact CG2-CD2 4.46Å; V579-W584 HydrophobicContact CG2-CG 4.19Å; N580-W584 PolarHBondContact O-N 3.35Å; N580-W584 VanDerWaalsContact O-N 3.16Å; I581-W584 PolarHBondContact O-N 3.04Å; Q582-W584 VanDerWaalsContact C-N 3.3Å; Q582-W584 PolarHBondContact O-N 3.33Å; W584-N586 PolarHBondContact O-N 3.3Å; W584-K587 HydrophobicContact CD2-CD 4.41Å; W584-K587 VanDerWaalsContact CZ2-NZ 3.27Å; W584-K587 PolarHBondContact O-N 3.33Å; W584-I590 VanDerWaalsContact O-CG1 3.23Å; W584-I590 WeakPolarHBondContact O-CG1 3.29Å; W584-L611 HydrophobicContact CB-CD1 4Å; W584-L611 HydrophobicContact CE3-CD1 4.04Å; W584-Y618 HydrophobicContact CH2-CD1 4.13Å; W584-Y618 HydrophobicContact CH2-CE1 4.1Å; W584-Y618 AromaticContact CZ3-CD1 3.7Å; W584-Y618 HydrophobicContact CZ3-CD1 3.7Å; W584-Y618 HydrophobicContact CZ3-CD2 4.48Å; W584-Y618 AromaticContact CZ3-CE1 3.94Å; W584-Y618 HydrophobicContact CZ3-CE1 3.94Å; W584-Y618 HydrophobicContact CZ3-CG 4.01Å; W584-L620 HydrophobicContact CB-CD1 3.83Å; W584-L620 HydrophobicContact CE3-CD2 4.46Å; W584-L620 HydrophobicContact CG-CD1 4.25Å; W584-I632 HydrophobicContact CH2-CD1 3.63Å; W584-I632 HydrophobicContact CZ2-CD1 3.41Å; W584-I632 VanDerWaalsContact CZ2-CD1 3.41Å; W584-I632 HydrophobicContact CZ2-CG1 4.45Å; W584-I632 HydrophobicContact CZ3-CD1 4.5Å
585	I	88.9	Confident	85.2	Confident	31 Å²	31	74.9 Å²	74.9	16%	0.159	37%	0.371	C	S	.	.	H	α-helix	trans	-60.2	-36.8	175.2	-69	165.1	0	0	0	111	I581 Q582 K587 H593 L611	I581-I585 HydrophobicContact CG2-CD1 3.57Å; I581-I585 HydrophobicContact CG2-CG1 4.36Å; I581-I585 VanDerWaalsContact O-CG1 3.29Å; I581-I585 WeakPolarHBondContact O-CG1 3.41Å; I581-I585 PolarHBondContact O-N 2.98Å; Q582-I585 PolarHBondContact O-N 3.25Å; I585-K587 VanDerWaalsContact C-N 3.34Å; I585-K587 PolarHBondContact O-N 3.48Å; I585-H593 WeakPolarHBondContact CD1-NE2 3.33Å; I585-L611 HydrophobicContact CG1-CD2 3.97Å
586	N	88.4	Confident	87.5	Confident	110 Å²	110	65.2 Å²	65.2	59%	0.588	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	3	-176.2	-67.8	-10.8	0	0	0	114.2	Q582 W584	Q582-N586 PolarHBondContact NE2-OD1 2.74Å; Q582-N586 VanDerWaalsContact NE2-OD1 3.16Å; Q582-N586 WeakPolarHBondContact O-CB 3.32Å; Q582-N586 PolarHBondContact O-N 2.74Å; Q582-N586 VanDerWaalsContact O-N 3.09Å; Q582-N586 PolarHBondContact O-ND2 2.91Å; W584-N586 PolarHBondContact O-N 3.3Å
587	K	87.8	Confident	89.1	Confident	71 Å²	71	64.9 Å²	64.9	31%	0.309	33%	0.334	S	S	.	.			trans	-65.7	142.3	177.8	-67.2	-179.9	171.8	179.3	0	110.4	T583 W584 I585 D589 I590	T583-K587 WeakPolarHBondContact O-CG 3.47Å; T583-K587 PolarHBondContact O-N 2.97Å; W584-K587 HydrophobicContact CD2-CD 4.41Å; W584-K587 VanDerWaalsContact CZ2-NZ 3.27Å; W584-K587 PolarHBondContact O-N 3.33Å; I585-K587 VanDerWaalsContact C-N 3.34Å; I585-K587 PolarHBondContact O-N 3.48Å; K587-D589 WeakPolarHBondContact CB-OD1 3.37Å; K587-D589 PolarHBondContact O-N 3.4Å; K587-D589 VanDerWaalsContact O-N 3.13Å; K587-I590 HydrophobicContact CB-CG1 4.15Å; K587-I590 PolarHBondContact O-N 2.9Å; K587-I590 VanDerWaalsContact O-N 3.16Å
588	P	81.3	Confident	90	Very high	138 Å²	138	60.8 Å²	60.8	90%	0.896	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-15.5	-174.5	27.9	-36	0	0	0	113.9
589	D	88.1	Confident	90.2	Very high	76 Å²	76	59.4 Å²	59.4	41%	0.406	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-9.6	178.7	65.9	-36.4	0	0	0	113.8	K587 K591 T613	K587-D589 WeakPolarHBondContact CB-OD1 3.37Å; K587-D589 PolarHBondContact O-N 3.4Å; K587-D589 VanDerWaalsContact O-N 3.13Å; D589-K591 PolarHBondContact O-N 3.34Å; D589-T613 VanDerWaalsContact O-CA 3.3Å; D589-T613 WeakPolarHBondContact O-CA 3.24Å; D589-T613 WeakPolarHBondContact O-CB 3.44Å
590	I	90.7	Very high	90.2	Very high	28 Å²	28	62 Å²	62	14%	0.144	32%	0.32	C	S	.	.			trans	-75.6	119.1	174.3	-56.1	-47.8	0	0	0	109.7	W584 K587 H592 L611 T613	W584-I590 VanDerWaalsContact O-CG1 3.23Å; W584-I590 WeakPolarHBondContact O-CG1 3.29Å; K587-I590 HydrophobicContact CB-CG1 4.15Å; K587-I590 PolarHBondContact O-N 2.9Å; K587-I590 VanDerWaalsContact O-N 3.16Å; I590-H592 WeakPolarHBondContact CG2-O 3.45Å; I590-L611 HydrophobicContact CD1-CB 4.05Å; I590-L611 HydrophobicContact CD1-CD1 4.27Å; I590-L611 HydrophobicContact CG2-CD2 4.34Å; I590-T613 HydrophobicContact CD1-CG2 3.6Å
591	K	90	Very high	89.5	Confident	99 Å²	99	66.5 Å²	66.5	43%	0.43	34%	0.338	S	S	.	.			trans	-90.4	-39.5	174.7	-66.3	-174.3	174.3	-180	0	112.3	D589 V612 Q689	D589-K591 PolarHBondContact O-N 3.34Å; K591-V612 PolarHBondContact N-O 3.49Å; K591-Q689 HydrophobicContact CD-CG 4.24Å; K591-Q689 VanDerWaalsContact CD-OE1 3.24Å; K591-Q689 VanDerWaalsContact NZ-CD 3.26Å
592	H	92	Very high	88.8	Confident	66 Å²	66	70 Å²	70	31%	0.306	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	144.9	-179.7	-56.2	-67.8	0	0	0	111.7	I590 F594 V612	I590-H592 WeakPolarHBondContact CG2-O 3.45Å; H592-F594 HydrophobicContact CB-CD2 4.49Å; H592-F594 HydrophobicContact CB-CE2 3.56Å; H592-F594 HydrophobicContact CB-CZ 3.63Å; H592-V612 HydrophobicContact CB-CB 4.11Å; H592-V612 HydrophobicContact CB-CG2 4.27Å; H592-V612 PolarHBondContact N-O 2.77Å; H592-V612 PolarHBondContact O-N 2.95Å
593	H	94.1	Very high	88.2	Confident	62 Å²	62	67.2 Å²	67.2	29%	0.287	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	129.4	176.1	161.2	-124.8	0	0	0	109.4	I585 H609 L611	I585-H593 WeakPolarHBondContact CD1-NE2 3.33Å; H593-H609 AromaticContact CE1-ND1 3.99Å; H593-H609 AromaticContact NE2-CE1 3.95Å; H593-H609 AromaticContact NE2-CG 3.74Å; H593-H609 AromaticContact NE2-ND1 3.08Å; H593-H609 PolarHBondContact NE2-ND1 2.83Å; H593-L611 HydrophobicContact CB-CD2 3.82Å; H593-L611 VanDerWaalsContact CD2-CD2 3.43Å; H593-L611 WeakPolarHBondContact CD2-CD2 3.41Å
594	F	94.3	Very high	88	Confident	32 Å²	32	68.6 Å²	68.6	14%	0.14	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	111.5	177.8	-53.3	-71.2	0	0	0	110.1	H592 C596 L610 V612 I676 A682 A685 I686	H592-F594 HydrophobicContact CB-CD2 4.49Å; H592-F594 HydrophobicContact CB-CE2 3.56Å; H592-F594 HydrophobicContact CB-CZ 3.63Å; F594-C596 PolarHBondContact O-N 3.27Å; F594-L610 HydrophobicContact CB-CB 4.34Å; F594-L610 PolarHBondContact N-O 3.33Å; F594-L610 PolarHBondContact O-N 2.98Å; F594-V612 HydrophobicContact CD2-CG2 4.43Å; F594-V612 HydrophobicContact CE2-CG2 4.09Å; F594-I676 HydrophobicContact CB-CG2 4.41Å; F594-A682 HydrophobicContact CD1-CB 3.57Å; F594-A682 HydrophobicContact CD2-CB 4.13Å; F594-A682 HydrophobicContact CE1-CB 3.59Å; F594-A682 HydrophobicContact CE2-CB 4.14Å; F594-A682 HydrophobicContact CG-CB 3.85Å; F594-A682 HydrophobicContact CZ-CB 3.89Å; F594-A685 HydrophobicContact CZ-CB 3.95Å; F594-I686 HydrophobicContact CD2-CD1 4.34Å; F594-I686 HydrophobicContact CE2-CD1 4.11Å; F594-I686 HydrophobicContact CE2-CG1 4.05Å
595	P	93.2	Very high	88.1	Confident	72 Å²	72	72.5 Å²	72.5	47%	0.468	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	130.3	164.1	-19.5	31.9	0	0	0	110.1	P677	P595-P677 WeakPolarHBondContact O-CD 3.31Å
596	C	93.8	Very high	88.3	Confident	11 Å²	11	74.2 Å²	74.2	7%	0.074	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	-179.9	-175.3	63.8	0	0	0	0	111.9	F594 S608 L675 I676	F594-C596 PolarHBondContact O-N 3.27Å; C596-S608 CarbonylContact C-O 3.59Å; C596-S608 PolarHBondContact N-O 3.47Å; C596-S608 CarbonylContact O-C 3.54Å; C596-S608 PolarHBondContact O-N 3.05Å; C596-L675 CarbonylContact C-O 3.54Å; C596-L675 VanDerWaalsContact CA-O 3.29Å; C596-L675 WeakPolarHBondContact CA-O 3.44Å; C596-L675 VanDerWaalsContact CB-O 3.31Å; C596-L675 WeakPolarHBondContact CB-O 3.35Å; C596-I676 HydrophobicContact CB-CG1 3.96Å
597	K	94.4	Very high	88.6	Confident	99 Å²	99	71 Å²	71	43%	0.43	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125	165	-61.9	179	-179.6	179.5	0	109.5	F606 Y674 L675	K597-F606 CarbonylContact C-O 3.59Å; K597-F606 WeakPolarHBondContact CA-O 3.37Å; K597-Y674 CarbonylContact O-C 3.29Å; K597-Y674 WeakPolarHBondContact O-CA 3.41Å; K597-L675 HydrophobicContact CB-CB 4.32Å; K597-L675 PolarHBondContact N-O 3.4Å; K597-L675 PolarHBondContact O-N 3.31Å
598	E	93.8	Very high	88.9	Confident	12 Å²	12	67.7 Å²	67.7	6%	0.056	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	131.4	170.4	-176	-170.8	177.2	0	0	109.1	K600 M605 F606 R621 Y674	E598-K600 VanDerWaalsContact OE1-CE 3.27Å; E598-K600 WeakPolarHBondContact OE1-CE 3.27Å; E598-K600 IonicContact OE1-NZ 2.98Å; E598-K600 PolarHBondContact OE1-NZ 3.41Å; E598-M605 CarbonylContact O-C 3.43Å; E598-M605 VanDerWaalsContact O-CA 3.29Å; E598-M605 WeakPolarHBondContact O-CA 3.44Å; E598-F606 PolarHBondContact N-O 3.35Å; E598-F606 PolarHBondContact O-N 3.39Å; E598-R621 IonicContact OE1-NH2 3.43Å; E598-R621 PolarHBondContact OE1-NH2 3.11Å; E598-R621 IonicContact OE2-CZ 3.88Å; E598-R621 IonicContact OE2-NE 2.75Å; E598-R621 PolarHBondContact OE2-NE 3.22Å; E598-R621 IonicContact OE2-NH2 3.87Å; E598-R621 PolarHBondContact OE2-NH2 3.21Å; E598-Y674 HydrophobicContact CB-CD1 4.24Å; E598-Y674 HydrophobicContact CB-CE1 4.08Å; E598-Y674 HydrophobicContact CG-CD1 4.48Å; E598-Y674 HydrophobicContact CG-CE1 4.01Å
599	V	91.1	Very high	89.5	Confident	27 Å²	27	62.2 Å²	62.2	16%	0.164	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	114.2	179.8	-172.2	0	0	0	0	109	M605 L653 R673 L675	V599-M605 HydrophobicContact CG1-CG 4.48Å; V599-M605 HydrophobicContact CG2-CG 4.18Å; V599-L653 HydrophobicContact CB-CD1 4.39Å; V599-L653 HydrophobicContact CG2-CD1 3.83Å; V599-R673 HydrophobicContact CB-CB 4.11Å; V599-R673 PolarHBondContact N-O 2.7Å; V599-L675 HydrophobicContact CG2-CB 4.32Å
600	K	88.1	Confident	89.9	Confident	65 Å²	65	58.6 Å²	58.6	28%	0.283	31%	0.305	S	S	.	.			trans	-77	165.1	175.3	-70	-55.5	-161.7	-168.4	0	112	E598 S602 G603 H604 F606 R621	E598-K600 VanDerWaalsContact OE1-CE 3.27Å; E598-K600 WeakPolarHBondContact OE1-CE 3.27Å; E598-K600 IonicContact OE1-NZ 2.98Å; E598-K600 PolarHBondContact OE1-NZ 3.41Å; K600-S602 PolarHBondContact O-N 2.55Å; K600-G603 PolarHBondContact O-N 3.35Å; K600-H604 PolarHBondContact N-O 2.83Å; K600-F606 HydrophobicContact CG-CD2 4.19Å; K600-F606 HydrophobicContact CG-CE2 3.78Å; K600-R621 VanDerWaalsContact NZ-NH2 3.15Å
601	E	74.9	Confident	90.1	Very high	163 Å²	163	57.2 Å²	57.2	76%	0.762	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-33.1	176.6	-65	-171.8	155.5	0	0	112.4	G603	E601-G603 PolarHBondContact O-N 3.22Å; E601-G603 VanDerWaalsContact O-N 3.1Å
602	S	75.4	Confident	90.2	Very high	86 Å²	86	52.5 Å²	52.5	60%	0.601	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-3.7	171.3	58.7	0	0	0	0	114.4	K600 H604	K600-S602 PolarHBondContact O-N 2.55Å; S602-H604 VanDerWaalsContact C-N 3.26Å; S602-H604 PolarHBondContact O-N 3.34Å; S602-H604 PolarHBondContact OG-ND1 3.34Å
603	G	75.9	Confident	90.3	Very high	49 Å²	49	49.6 Å²	49.6	51%	0.505	27%	0.265	S	S	.	.	S	Bend	trans	83.6	-6.8	-178	0	0	0	0	0	114.7	K600 E601	K600-G603 PolarHBondContact O-N 3.35Å; E601-G603 PolarHBondContact O-N 3.22Å; E601-G603 VanDerWaalsContact O-N 3.1Å
604	H	84.4	Confident	90	Very high	118 Å²	118	48.6 Å²	48.6	55%	0.546	27%	0.267	S	S	.	.			trans	-64.2	139.5	175	-68.3	97.9	0	0	0	111.8	K600 S602 F606	K600-H604 PolarHBondContact N-O 2.83Å; S602-H604 VanDerWaalsContact C-N 3.26Å; S602-H604 PolarHBondContact O-N 3.34Å; S602-H604 PolarHBondContact OG-ND1 3.34Å; H604-F606 HydrophobicContact CB-CE2 4Å; H604-F606 HydrophobicContact CB-CZ 4.27Å
605	M	89.9	Confident	89.7	Confident	108 Å²	108	50.7 Å²	50.7	53%	0.532	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	128.7	-177.1	-64.6	-174.3	-74.4	0	0	111.1	E598 V599	E598-M605 CarbonylContact O-C 3.43Å; E598-M605 VanDerWaalsContact O-CA 3.29Å; E598-M605 WeakPolarHBondContact O-CA 3.44Å; V599-M605 HydrophobicContact CG1-CG 4.48Å; V599-M605 HydrophobicContact CG2-CG 4.18Å
606	F	91.9	Very high	89.7	Confident	66 Å²	66	50.3 Å²	50.3	29%	0.289	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	134.2	178.2	-60.4	-84	0	0	0	110.7	K597 E598 K600 H604 S608 R621	K597-F606 CarbonylContact C-O 3.59Å; K597-F606 WeakPolarHBondContact CA-O 3.37Å; E598-F606 PolarHBondContact N-O 3.35Å; E598-F606 PolarHBondContact O-N 3.39Å; K600-F606 HydrophobicContact CG-CD2 4.19Å; K600-F606 HydrophobicContact CG-CE2 3.78Å; H604-F606 HydrophobicContact CB-CE2 4Å; H604-F606 HydrophobicContact CB-CZ 4.27Å; F606-S608 PolarHBondContact O-N 2.74Å; F606-S608 PolarHBondContact O-OG 3.19Å; F606-R621 HydrophobicContact CB-CG 3.73Å; F606-R621 HydrophobicContact CG-CG 4.39Å
607	P	94.8	Very high	89.7	Confident	44 Å²	44	49.9 Å²	49.9	29%	0.286	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	130.3	169.6	-21.3	32.8	0	0	0	110.5	E622	P607-E622 HydrophobicContact CB-CB 4.23Å; P607-E622 HydrophobicContact CB-CG 4.2Å; P607-E622 PolarHBondContact O-N 3.12Å
608	S	95.2	Very high	89.7	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.007	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	165.3	-173.1	-58.8	0	0	0	0	112.6	C596 F606 L620	C596-S608 CarbonylContact C-O 3.59Å; C596-S608 PolarHBondContact N-O 3.47Å; C596-S608 CarbonylContact O-C 3.54Å; C596-S608 PolarHBondContact O-N 3.05Å; F606-S608 PolarHBondContact O-N 2.74Å; F606-S608 PolarHBondContact O-OG 3.19Å; S608-L620 CarbonylContact C-O 3.59Å; S608-L620 WeakPolarHBondContact CA-O 3.39Å; S608-L620 VanDerWaalsContact CB-O 3.29Å; S608-L620 WeakPolarHBondContact CB-O 3.34Å
609	H	94.6	Very high	89.7	Confident	22 Å²	22	46.3 Å²	46.3	10%	0.102	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	126.6	173.7	-60.8	-79.6	0	0	0	110.2	H593 L620 E622	H593-H609 AromaticContact CE1-ND1 3.99Å; H593-H609 AromaticContact NE2-CE1 3.95Å; H593-H609 AromaticContact NE2-CG 3.74Å; H593-H609 AromaticContact NE2-ND1 3.08Å; H593-H609 PolarHBondContact NE2-ND1 2.83Å; H609-L620 HydrophobicContact CB-CB 4.34Å; H609-L620 PolarHBondContact N-O 3.1Å; H609-L620 PolarHBondContact O-N 3.42Å; H609-E622 IonicContact NE2-OE1 3.25Å; H609-E622 PolarHBondContact NE2-OE1 3.43Å
610	L	94.6	Very high	89.9	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	119.4	172.8	-163.8	69.5	0	0	0	108.9	F594 M617 Y618 F656 Y674 I676 I686	F594-L610 HydrophobicContact CB-CB 4.34Å; F594-L610 PolarHBondContact N-O 3.33Å; F594-L610 PolarHBondContact O-N 2.98Å; L610-M617 HydrophobicContact CD1-CE 4.19Å; L610-M617 HydrophobicContact CD1-CG 3.69Å; L610-M617 HydrophobicContact CD1-SD 3.86Å; L610-M617 HydrophobicContact CD2-CG 4.48Å; L610-M617 HydrophobicContact CD2-SD 3.74Å; L610-M617 HydrophobicContact CG-CG 3.94Å; L610-M617 HydrophobicContact CG-SD 3.87Å; L610-Y618 CarbonylContact C-O 3.42Å; L610-Y618 WeakPolarHBondContact CA-O 3.45Å; L610-F656 HydrophobicContact CD2-CE2 4.38Å; L610-Y674 HydrophobicContact CD1-CD2 4.44Å; L610-Y674 HydrophobicContact CD1-CE1 4.5Å; L610-Y674 HydrophobicContact CD1-CE2 4.03Å; L610-I676 HydrophobicContact CD2-CD1 4.29Å; L610-I686 HydrophobicContact CD2-CD1 3.91Å
611	L	94.9	Very high	90.2	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	134	178.3	-55.7	177.1	0	0	0	109.8	W584 I585 I590 H593 M617 Y618 L620	W584-L611 HydrophobicContact CB-CD1 4Å; W584-L611 HydrophobicContact CE3-CD1 4.04Å; I585-L611 HydrophobicContact CG1-CD2 3.97Å; I590-L611 HydrophobicContact CD1-CB 4.05Å; I590-L611 HydrophobicContact CD1-CD1 4.27Å; I590-L611 HydrophobicContact CG2-CD2 4.34Å; H593-L611 HydrophobicContact CB-CD2 3.82Å; H593-L611 VanDerWaalsContact CD2-CD2 3.43Å; H593-L611 WeakPolarHBondContact CD2-CD2 3.41Å; L611-M617 CarbonylContact O-C 3.51Å; L611-M617 WeakPolarHBondContact O-CA 3.03Å; L611-Y618 PolarHBondContact N-O 2.76Å; L611-Y618 PolarHBondContact O-N 2.7Å; L611-L620 HydrophobicContact CD1-CD1 3.51Å; L611-L620 HydrophobicContact CD1-CG 4.05Å; L611-L620 HydrophobicContact CG-CD1 4.36Å
612	V	93.3	Very high	91	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	120.5	-178.4	-172.7	0	0	0	0	108.6	K591 H592 F594 M617 L638 I686 Q689	K591-V612 PolarHBondContact N-O 3.49Å; H592-V612 HydrophobicContact CB-CB 4.11Å; H592-V612 HydrophobicContact CB-CG2 4.27Å; H592-V612 PolarHBondContact N-O 2.77Å; H592-V612 PolarHBondContact O-N 2.95Å; F594-V612 HydrophobicContact CD2-CG2 4.43Å; F594-V612 HydrophobicContact CE2-CG2 4.09Å; V612-M617 HydrophobicContact CG2-CG 4.29Å; V612-M617 HydrophobicContact CG2-SD 4.36Å; V612-L638 HydrophobicContact CG1-CD1 4.14Å; V612-L638 HydrophobicContact CG1-CD2 4.33Å; V612-I686 HydrophobicContact CG2-CD1 4.33Å; V612-I686 HydrophobicContact CG2-CG1 3.75Å; V612-Q689 HydrophobicContact CG1-CB 4.32Å; V612-Q689 HydrophobicContact CG1-CG 4.04Å
613	T	93.3	Very high	91.7	Very high	4 Å²	4	35.5 Å²	35.5	3%	0.025	19%	0.194	C	C	.	.			trans	-99.2	-169.1	175.7	70.3	0	0	0	0	111.2	D589 I590 T615 H616 Y618 Q689	D589-T613 VanDerWaalsContact O-CA 3.3Å; D589-T613 WeakPolarHBondContact O-CA 3.24Å; D589-T613 WeakPolarHBondContact O-CB 3.44Å; I590-T613 HydrophobicContact CD1-CG2 3.6Å; T613-T615 VanDerWaalsContact C-N 3.26Å; T613-T615 PolarHBondContact O-N 3.08Å; T613-T615 PolarHBondContact OG1-N 2.75Å; T613-H616 PolarHBondContact N-O 3.25Å; T613-H616 PolarHBondContact OG1-N 2.98Å; T613-H616 PolarHBondContact OG1-O 3.47Å; T613-Y618 HydrophobicContact CG2-CD2 3.99Å; T613-Y618 HydrophobicContact CG2-CE2 3.6Å; T613-Q689 WeakPolarHBondContact O-CG 3.44Å
614	A	89.3	Confident	91.9	Very high	42 Å²	42	40.5 Å²	40.5	35%	0.347	21%	0.208	S	C	.	.	S	Bend	trans	-60.8	-35.8	171.9	0	0	0	0	0	112.7	Q689 V693	A614-Q689 PolarHBondContact O-NE2 3.28Å; A614-V693 WeakPolarHBondContact O-CG2 3.44Å
615	T	87.6	Confident	91.7	Very high	76 Å²	76	39.3 Å²	39.3	47%	0.466	21%	0.213	S	C	.	.	S	Bend	trans	-125.5	-20.3	-169.1	52.3	0	0	0	0	114.4	T613 L638	T613-T615 VanDerWaalsContact C-N 3.26Å; T613-T615 PolarHBondContact O-N 3.08Å; T613-T615 PolarHBondContact OG1-N 2.75Å; T615-L638 PolarHBondContact O-N 3.19Å
616	H	93.1	Very high	91.4	Very high	64 Å²	64	40.2 Å²	40.2	30%	0.296	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	160.9	-172	-68.5	77.9	0	0	0	112.5	T613 Y618 Q636	T613-H616 PolarHBondContact N-O 3.25Å; T613-H616 PolarHBondContact OG1-N 2.98Å; T613-H616 PolarHBondContact OG1-O 3.47Å; H616-Y618 HydrophobicContact CB-CD2 4.34Å; H616-Y618 HydrophobicContact CB-CE2 3.62Å; H616-Q636 CarbonylContact C-O 3.47Å; H616-Q636 VanDerWaalsContact CA-O 3.26Å; H616-Q636 WeakPolarHBondContact CA-O 3.28Å
617	M	93.6	Very high	90.8	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.01	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	131.2	168.6	-166.6	163.8	68.6	0	0	109.5	L610 L611 V612 Q636 L638 F656 Y658 I686	L610-M617 HydrophobicContact CD1-CE 4.19Å; L610-M617 HydrophobicContact CD1-CG 3.69Å; L610-M617 HydrophobicContact CD1-SD 3.86Å; L610-M617 HydrophobicContact CD2-CG 4.48Å; L610-M617 HydrophobicContact CD2-SD 3.74Å; L610-M617 HydrophobicContact CG-CG 3.94Å; L610-M617 HydrophobicContact CG-SD 3.87Å; L611-M617 CarbonylContact O-C 3.51Å; L611-M617 WeakPolarHBondContact O-CA 3.03Å; V612-M617 HydrophobicContact CG2-CG 4.29Å; V612-M617 HydrophobicContact CG2-SD 4.36Å; M617-Q636 PolarHBondContact N-O 2.9Å; M617-Q636 PolarHBondContact O-N 3.46Å; M617-L638 HydrophobicContact CB-CD2 4.02Å; M617-F656 HydrophobicContact CE-CD1 4.01Å; M617-F656 HydrophobicContact CE-CD2 4.25Å; M617-F656 HydrophobicContact CE-CE1 4.23Å; M617-F656 HydrophobicContact CE-CE2 4.44Å; M617-F656 HydrophobicContact CE-CG 4.03Å; M617-F656 HydrophobicContact CE-CZ 4.43Å; M617-Y658 HydrophobicContact CE-CE1 4.21Å; M617-Y658 WeakPolarHBondContact CE-OH 3.49Å; M617-I686 HydrophobicContact SD-CD1 4.1Å; M617-I686 HydrophobicContact SD-CG1 4.49Å; M617-I686 HydrophobicContact SD-CG2 4.36Å
618	Y	93.8	Very high	90.3	Very high	35 Å²	35	46.7 Å²	46.7	14%	0.137	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	138.2	-178.1	-61.8	-97	0	0	0	110.3	W584 L610 L611 T613 H616 S634 R635	W584-Y618 HydrophobicContact CH2-CD1 4.13Å; W584-Y618 HydrophobicContact CH2-CE1 4.1Å; W584-Y618 AromaticContact CZ3-CD1 3.7Å; W584-Y618 HydrophobicContact CZ3-CD1 3.7Å; W584-Y618 HydrophobicContact CZ3-CD2 4.48Å; W584-Y618 AromaticContact CZ3-CE1 3.94Å; W584-Y618 HydrophobicContact CZ3-CE1 3.94Å; W584-Y618 HydrophobicContact CZ3-CG 4.01Å; L610-Y618 CarbonylContact C-O 3.42Å; L610-Y618 WeakPolarHBondContact CA-O 3.45Å; L611-Y618 PolarHBondContact N-O 2.76Å; L611-Y618 PolarHBondContact O-N 2.7Å; T613-Y618 HydrophobicContact CG2-CD2 3.99Å; T613-Y618 HydrophobicContact CG2-CE2 3.6Å; H616-Y618 HydrophobicContact CB-CD2 4.34Å; H616-Y618 HydrophobicContact CB-CE2 3.62Å; Y618-S634 WeakPolarHBondContact CA-O 3.17Å; Y618-R635 HydrophobicContact CD1-CB 4.3Å; Y618-R635 HydrophobicContact CD1-CG 3.68Å; Y618-R635 HydrophobicContact CE1-CB 4.17Å; Y618-R635 HydrophobicContact CE1-CG 3.67Å
619	C	94.4	Very high	90	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	117.5	168.9	-178.8	0	0	0	0	110	Q633 S634 Y674	C619-Q633 HydrophobicContact CB-CB 4.38Å; C619-Q633 PolarHBondContact O-N 2.96Å; C619-S634 WeakPolarHBondContact CB-OG 3.24Å; C619-S634 PolarHBondContact N-O 2.87Å; C619-S634 VanDerWaalsContact N-O 3.12Å; C619-S634 PolarHBondContact O-N 3.43Å; C619-Y674 HydrophobicContact CB-CE1 4.23Å; C619-Y674 WeakPolarHBondContact CB-OH 3.35Å; C619-Y674 VanDerWaalsContact SG-CE1 3.53Å
620	L	94.3	Very high	89.8	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	116.4	173.8	-56	-172.8	0	0	0	109.5	V579 W584 S608 H609 L611 A630 Y631 I632	V579-L620 HydrophobicContact CG2-CD1 4.27Å; V579-L620 HydrophobicContact CG2-CD2 3.94Å; W584-L620 HydrophobicContact CB-CD1 3.83Å; W584-L620 HydrophobicContact CE3-CD2 4.46Å; W584-L620 HydrophobicContact CG-CD1 4.25Å; S608-L620 CarbonylContact C-O 3.59Å; S608-L620 WeakPolarHBondContact CA-O 3.39Å; S608-L620 VanDerWaalsContact CB-O 3.29Å; S608-L620 WeakPolarHBondContact CB-O 3.34Å; H609-L620 HydrophobicContact CB-CB 4.34Å; H609-L620 PolarHBondContact N-O 3.1Å; H609-L620 PolarHBondContact O-N 3.42Å; L611-L620 HydrophobicContact CD1-CD1 3.51Å; L611-L620 HydrophobicContact CD1-CG 4.05Å; L611-L620 HydrophobicContact CG-CD1 4.36Å; L620-A630 HydrophobicContact CB-CB 3.89Å; L620-Y631 CarbonylContact C-O 3.55Å; L620-Y631 WeakPolarHBondContact CA-O 3.46Å; L620-I632 HydrophobicContact CD2-CB 4.2Å; L620-I632 HydrophobicContact CD2-CG1 3.66Å; L620-I632 HydrophobicContact CD2-CG2 4.32Å
621	R	94.1	Very high	89.6	Confident	30 Å²	30	48.9 Å²	48.9	11%	0.113	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	125	177.1	-174.1	-173.4	-64.3	159.3	16.8	110.6	E598 K600 F606 A630 Y631 Q633	E598-R621 IonicContact OE1-NH2 3.43Å; E598-R621 PolarHBondContact OE1-NH2 3.11Å; E598-R621 IonicContact OE2-CZ 3.88Å; E598-R621 IonicContact OE2-NE 2.75Å; E598-R621 PolarHBondContact OE2-NE 3.22Å; E598-R621 IonicContact OE2-NH2 3.87Å; E598-R621 PolarHBondContact OE2-NH2 3.21Å; K600-R621 VanDerWaalsContact NZ-NH2 3.15Å; F606-R621 HydrophobicContact CB-CG 3.73Å; F606-R621 HydrophobicContact CG-CG 4.39Å; R621-A630 CarbonylContact O-C 3.02Å; R621-A630 WeakPolarHBondContact O-CA 3.48Å; R621-A630 WeakPolarHBondContact O-CB 3.37Å; R621-Y631 PolarHBondContact N-O 3.28Å; R621-Y631 PolarHBondContact O-N 2.85Å; R621-Q633 HydrophobicContact CB-CB 4.46Å; R621-Q633 VanDerWaalsContact NH2-OE1 3.11Å
622	E	93.3	Very high	89.4	Confident	73 Å²	73	50 Å²	50	34%	0.341	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	142.2	-179.7	-61.4	-175.1	-139.9	0	0	112.4	I581 P607 H609	I581-E622 HydrophobicContact CD1-CG 3.85Å; P607-E622 HydrophobicContact CB-CB 4.23Å; P607-E622 HydrophobicContact CB-CG 4.2Å; P607-E622 PolarHBondContact O-N 3.12Å; H609-E622 IonicContact NE2-OE1 3.25Å; H609-E622 PolarHBondContact NE2-OE1 3.43Å
623	I	89.4	Confident	89.1	Confident	12 Å²	12	52.5 Å²	52.5	6%	0.062	27%	0.272	C	S	.	.			trans	-89.1	113	174.6	-53.2	-178.8	0	0	0	108.6	I578 S625 R626 L629 Y631	I578-I623 HydrophobicContact CD1-CD1 4.24Å; I578-I623 HydrophobicContact CG1-CD1 4.16Å; I578-I623 HydrophobicContact CG2-CD1 3.87Å; I623-S625 VanDerWaalsContact CG2-OG 3.28Å; I623-S625 WeakPolarHBondContact CG2-OG 3.14Å; I623-S625 PolarHBondContact O-N 2.86Å; I623-R626 HydrophobicContact CB-CB 4.34Å; I623-R626 HydrophobicContact CG2-CB 4.13Å; I623-R626 HydrophobicContact CG2-CG 4.41Å; I623-R626 CarbonylContact O-C 3.59Å; I623-R626 PolarHBondContact O-N 3.05Å; I623-R626 VanDerWaalsContact O-N 3.11Å; I623-L629 HydrophobicContact CD1-CB 4.01Å; I623-L629 PolarHBondContact N-O 3.11Å; I623-Y631 HydrophobicContact CB-CE2 4.42Å; I623-Y631 HydrophobicContact CD1-CD1 4.15Å; I623-Y631 HydrophobicContact CD1-CD2 4.28Å; I623-Y631 HydrophobicContact CD1-CE1 3.72Å; I623-Y631 HydrophobicContact CD1-CE2 3.86Å; I623-Y631 HydrophobicContact CD1-CG 4.39Å; I623-Y631 HydrophobicContact CG1-CD2 3.81Å; I623-Y631 HydrophobicContact CG1-CE1 4.3Å; I623-Y631 HydrophobicContact CG1-CE2 3.53Å; I623-Y631 HydrophobicContact CG1-CG 4.29Å; I623-Y631 HydrophobicContact CG2-CE2 4.35Å
624	L	80.3	Confident	88.8	Confident	153 Å²	153	53 Å²	53	80%	0.801	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-32.7	-177.4	-67.4	174.9	0	0	0	113
625	S	79.8	Confident	88.9	Confident	93 Å²	93	57 Å²	57	65%	0.65	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-20.2	179	59.5	0	0	0	0	113.9	I623	I623-S625 VanDerWaalsContact CG2-OG 3.28Å; I623-S625 WeakPolarHBondContact CG2-OG 3.14Å; I623-S625 PolarHBondContact O-N 2.86Å
626	R	82.8	Confident	89.1	Confident	127 Å²	127	55.3 Å²	55.3	48%	0.479	27%	0.269	S	S	.	.	S	Bend	trans	-133	98	-174.7	-61.7	-174.3	-178.4	176.9	2.7	111.8	I623 G628 L629	I623-R626 HydrophobicContact CB-CB 4.34Å; I623-R626 HydrophobicContact CG2-CB 4.13Å; I623-R626 HydrophobicContact CG2-CG 4.41Å; I623-R626 CarbonylContact O-C 3.59Å; I623-R626 PolarHBondContact O-N 3.05Å; I623-R626 VanDerWaalsContact O-N 3.11Å; R626-G628 PolarHBondContact O-N 2.86Å; R626-L629 HydrophobicContact CB-CB 4.29Å; R626-L629 HydrophobicContact CB-CD1 4Å; R626-L629 HydrophobicContact CB-CG 4.48Å; R626-L629 PolarHBondContact O-N 3.24Å
627	K	81.1	Confident	89	Confident	211 Å²	211	53.5 Å²	53.5	92%	0.917	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	130.2	179.8	-67.8	-174.8	178.6	179.6	0	112
628	G	83.1	Confident	88.8	Confident	36 Å²	36	53.4 Å²	53.4	37%	0.371	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.2	-1.7	177.3	0	0	0	0	0	115.3	I581 R626	I581-G628 PolarHBondContact N-O 3.4Å; R626-G628 PolarHBondContact O-N 2.86Å
629	L	89.1	Confident	88.5	Confident	47 Å²	47	55.6 Å²	55.6	25%	0.246	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	147.8	174	-63.6	179.8	0	0	0	110.9	I578 V579 N580 I623 R626	I578-L629 HydrophobicContact CG2-CB 4.02Å; I578-L629 HydrophobicContact CG2-CD1 4.05Å; I578-L629 HydrophobicContact CG2-CD2 4.26Å; I578-L629 HydrophobicContact CG2-CG 4.35Å; V579-L629 WeakPolarHBondContact O-CA 3.24Å; N580-L629 HydrophobicContact CB-CD2 4.24Å; I623-L629 HydrophobicContact CD1-CB 4.01Å; I623-L629 PolarHBondContact N-O 3.11Å; R626-L629 HydrophobicContact CB-CB 4.29Å; R626-L629 HydrophobicContact CB-CD1 4Å; R626-L629 HydrophobicContact CB-CG 4.48Å; R626-L629 PolarHBondContact O-N 3.24Å
630	A	90.5	Very high	88.2	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	151.2	178.3	0	0	0	0	0	111.9	V579 I581 L620 R621	V579-A630 WeakPolarHBondContact CG2-O 3.44Å; V579-A630 PolarHBondContact N-O 2.84Å; V579-A630 PolarHBondContact O-N 3.04Å; I581-A630 HydrophobicContact CD1-CB 3.95Å; I581-A630 HydrophobicContact CG1-CB 3.51Å; L620-A630 HydrophobicContact CB-CB 3.89Å; R621-A630 CarbonylContact O-C 3.02Å; R621-A630 WeakPolarHBondContact O-CA 3.48Å; R621-A630 WeakPolarHBondContact O-CB 3.37Å
631	Y	90.8	Very high	88	Confident	21 Å²	21	57.6 Å²	57.6	8%	0.082	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	137.1	165.6	-62.1	-60.8	0	0	0	110.1	D573 K576 I578 L620 R621 I623 Q633	D573-Y631 PolarHBondContact OD1-OH 3.48Å; D573-Y631 PolarHBondContact OD2-OH 3.32Å; K576-Y631 HydrophobicContact CB-CD1 3.29Å; K576-Y631 HydrophobicContact CB-CE1 3.81Å; K576-Y631 HydrophobicContact CB-CG 4.01Å; K576-Y631 HydrophobicContact CD-CD1 4.11Å; K576-Y631 HydrophobicContact CD-CD2 4.5Å; K576-Y631 HydrophobicContact CD-CE1 4.46Å; K576-Y631 HydrophobicContact CD-CG 4.14Å; K576-Y631 HydrophobicContact CG-CD1 4.32Å; I578-Y631 HydrophobicContact CD1-CE1 3.97Å; I578-Y631 HydrophobicContact CG1-CD1 3.88Å; I578-Y631 HydrophobicContact CG1-CE1 3.56Å; L620-Y631 CarbonylContact C-O 3.55Å; L620-Y631 WeakPolarHBondContact CA-O 3.46Å; R621-Y631 PolarHBondContact N-O 3.28Å; R621-Y631 PolarHBondContact O-N 2.85Å; I623-Y631 HydrophobicContact CB-CE2 4.42Å; I623-Y631 HydrophobicContact CD1-CD1 4.15Å; I623-Y631 HydrophobicContact CD1-CD2 4.28Å; I623-Y631 HydrophobicContact CD1-CE1 3.72Å; I623-Y631 HydrophobicContact CD1-CE2 3.86Å; I623-Y631 HydrophobicContact CD1-CG 4.39Å; I623-Y631 HydrophobicContact CG1-CD2 3.81Å; I623-Y631 HydrophobicContact CG1-CE1 4.3Å; I623-Y631 HydrophobicContact CG1-CE2 3.53Å; I623-Y631 HydrophobicContact CG1-CG 4.29Å; I623-Y631 HydrophobicContact CG2-CE2 4.35Å; Y631-Q633 PolarHBondContact O-N 2.98Å
632	I	89.9	Confident	87.7	Confident	24 Å²	24	57.9 Å²	57.9	12%	0.123	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	105.3	166.1	-52.6	178.9	0	0	0	108.5	E577 V579 W584 L620 R635	E577-I632 HydrophobicContact CB-CD1 4.18Å; E577-I632 HydrophobicContact CB-CG1 4.45Å; E577-I632 VanDerWaalsContact CD-CD1 3.49Å; E577-I632 HydrophobicContact CG-CD1 3.97Å; E577-I632 PolarHBondContact O-N 3.46Å; E577-I632 VanDerWaalsContact O-N 3.15Å; E577-I632 VanDerWaalsContact OE1-CD1 3.32Å; E577-I632 WeakPolarHBondContact OE1-CD1 3.45Å; V579-I632 HydrophobicContact CG1-CD1 3.77Å; V579-I632 HydrophobicContact CG1-CG1 3.96Å; V579-I632 HydrophobicContact CG2-CD1 4.44Å; V579-I632 HydrophobicContact CG2-CG1 3.85Å; W584-I632 HydrophobicContact CH2-CD1 3.63Å; W584-I632 HydrophobicContact CZ2-CD1 3.41Å; W584-I632 VanDerWaalsContact CZ2-CD1 3.41Å; W584-I632 HydrophobicContact CZ2-CG1 4.45Å; W584-I632 HydrophobicContact CZ3-CD1 4.5Å; L620-I632 HydrophobicContact CD2-CB 4.2Å; L620-I632 HydrophobicContact CD2-CG1 3.66Å; L620-I632 HydrophobicContact CD2-CG2 4.32Å; I632-R635 HydrophobicContact CG2-CG 3.97Å
633	Q	87.4	Confident	87.5	Confident	52 Å²	52	60 Å²	60	24%	0.243	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-34.9	-175.3	-176.8	62.6	36	0	0	113	C619 R621 Y631	C619-Q633 HydrophobicContact CB-CB 4.38Å; C619-Q633 PolarHBondContact O-N 2.96Å; R621-Q633 HydrophobicContact CB-CB 4.46Å; R621-Q633 VanDerWaalsContact NH2-OE1 3.11Å; Y631-Q633 PolarHBondContact O-N 2.98Å
634	S	87.3	Confident	87.5	Confident	15 Å²	15	61.2 Å²	61.2	11%	0.105	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	152.8	178.1	71	0	0	0	0	112.9	Y618 C619 E672	Y618-S634 WeakPolarHBondContact CA-O 3.17Å; C619-S634 WeakPolarHBondContact CB-OG 3.24Å; C619-S634 PolarHBondContact N-O 2.87Å; C619-S634 VanDerWaalsContact N-O 3.12Å; C619-S634 PolarHBondContact O-N 3.43Å; S634-E672 WeakPolarHBondContact CB-OE1 3.5Å; S634-E672 PolarHBondContact OG-OE1 3.01Å
635	R	92.2	Very high	87.8	Confident	125 Å²	125	56.1 Å²	56.1	47%	0.472	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	93.6	176.8	-59.4	-173.5	167.7	164.3	-1.5	108.2	E577 Y618 I632	E577-R635 IonicContact OE1-NH2 3.62Å; E577-R635 PolarHBondContact OE1-NH2 3.49Å; E577-R635 IonicContact OE2-CZ 2.64Å; E577-R635 IonicContact OE2-NH1 3.16Å; E577-R635 IonicContact OE2-NH2 2.95Å; E577-R635 PolarHBondContact OE2-NH2 3.19Å; Y618-R635 HydrophobicContact CD1-CB 4.3Å; Y618-R635 HydrophobicContact CD1-CG 3.68Å; Y618-R635 HydrophobicContact CE1-CB 4.17Å; Y618-R635 HydrophobicContact CE1-CG 3.67Å; I632-R635 HydrophobicContact CG2-CG 3.97Å
636	Q	90.8	Very high	88.2	Confident	41 Å²	41	55.2 Å²	55.2	19%	0.192	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	133.2	-175.3	-60.4	-68.7	-4.6	0	0	110.1	H616 M617 Y658 E672	H616-Q636 CarbonylContact C-O 3.47Å; H616-Q636 VanDerWaalsContact CA-O 3.26Å; H616-Q636 WeakPolarHBondContact CA-O 3.28Å; M617-Q636 PolarHBondContact N-O 2.9Å; M617-Q636 PolarHBondContact O-N 3.46Å; Q636-Y658 HydrophobicContact CB-CD1 3.79Å; Q636-Y658 HydrophobicContact CB-CE1 3.34Å; Q636-Y658 HydrophobicContact CB-CE2 4.44Å; Q636-Y658 HydrophobicContact CB-CG 4.48Å; Q636-Y658 HydrophobicContact CG-CD1 4.09Å; Q636-Y658 HydrophobicContact CG-CD2 4.22Å; Q636-Y658 HydrophobicContact CG-CE1 3.69Å; Q636-Y658 HydrophobicContact CG-CE2 3.84Å; Q636-Y658 HydrophobicContact CG-CG 4.32Å; Q636-E672 WeakPolarHBondContact CG-OE1 3.43Å; Q636-E672 PolarHBondContact NE2-OE1 3.03Å
637	A	90.3	Very high	88	Confident	26 Å²	26	55.4 Å²	55.4	22%	0.215	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	141.8	172.6	0	0	0	0	0	109.9	N639 S640	A637-N639 VanDerWaalsContact C-N 3.27Å; A637-N639 WeakPolarHBondContact CB-OD1 3.28Å; A637-N639 PolarHBondContact O-N 3.38Å; A637-S640 PolarHBondContact O-N 3.29Å; A637-S640 PolarHBondContact O-OG 2.97Å
638	L	89.4	Confident	87.8	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-68.9	-28.5	-178.2	-73	175.1	0	0	0	112.5	V612 T615 M617 S640 V641 Q689 I690 V693	V612-L638 HydrophobicContact CG1-CD1 4.14Å; V612-L638 HydrophobicContact CG1-CD2 4.33Å; T615-L638 PolarHBondContact O-N 3.19Å; M617-L638 HydrophobicContact CB-CD2 4.02Å; L638-S640 VanDerWaalsContact C-N 3.27Å; L638-S640 PolarHBondContact O-N 3.06Å; L638-V641 WeakPolarHBondContact O-CG2 3.49Å; L638-V641 PolarHBondContact O-N 3.31Å; L638-Q689 HydrophobicContact CD1-CB 4.37Å; L638-Q689 HydrophobicContact CD1-CG 3.64Å; L638-I690 HydrophobicContact CB-CG1 4.06Å; L638-I690 HydrophobicContact CD2-CG1 3.9Å; L638-I690 HydrophobicContact CG-CG1 4.48Å; L638-V693 HydrophobicContact CB-CG2 4.32Å; L638-V693 HydrophobicContact CD1-CG2 4.21Å
639	N	87.9	Confident	87.4	Confident	82 Å²	82	62.9 Å²	62.9	44%	0.439	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-71.7	-18	176.4	66.4	-15.7	0	0	0	113.4	A637 V641 V693 L694 L697	A637-N639 VanDerWaalsContact C-N 3.27Å; A637-N639 WeakPolarHBondContact CB-OD1 3.28Å; A637-N639 PolarHBondContact O-N 3.38Å; N639-V641 VanDerWaalsContact C-N 3.29Å; N639-V693 HydrophobicContact CB-CG1 4.15Å; N639-L694 HydrophobicContact CB-CD2 4.21Å; N639-L697 HydrophobicContact CB-CD1 3.94Å
640	S	89.5	Confident	87	Confident	22 Å²	22	66.6 Å²	66.6	15%	0.154	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-82.8	-6	176.1	72.8	0	0	0	0	112.6	A637 L638 V642 Y658 G659	A637-S640 PolarHBondContact O-N 3.29Å; A637-S640 PolarHBondContact O-OG 2.97Å; L638-S640 VanDerWaalsContact C-N 3.27Å; L638-S640 PolarHBondContact O-N 3.06Å; S640-V642 PolarHBondContact O-N 2.98Å; S640-Y658 CarbonylContact O-C 3.56Å; S640-Y658 WeakPolarHBondContact O-CA 3.44Å; S640-Y658 WeakPolarHBondContact OG-CD1 3.3Å; S640-G659 PolarHBondContact O-N 2.81Å
641	V	89.5	Confident	86.6	Confident	20 Å²	20	70.5 Å²	70.5	12%	0.121	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	98.3	179.2	-177.2	0	0	0	0	110.3	L638 N639 I644 F656 Y658 I690	L638-V641 WeakPolarHBondContact O-CG2 3.49Å; L638-V641 PolarHBondContact O-N 3.31Å; N639-V641 VanDerWaalsContact C-N 3.29Å; V641-I644 HydrophobicContact CG1-CD1 4.06Å; V641-I644 HydrophobicContact CG1-CG1 3.68Å; V641-F656 HydrophobicContact CG1-CD1 4.37Å; V641-Y658 HydrophobicContact CB-CD1 4.43Å; V641-Y658 HydrophobicContact CG2-CD1 3.65Å; V641-Y658 HydrophobicContact CG2-CE1 3.47Å; V641-Y658 VanDerWaalsContact CG2-CE1 3.47Å; V641-I690 HydrophobicContact CB-CD1 3.85Å; V641-I690 HydrophobicContact CG1-CD1 3.85Å; V641-I690 HydrophobicContact CG2-CD1 3.98Å
642	V	88	Confident	86.4	Confident	36 Å²	36	73.9 Å²	73.9	22%	0.218	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	-30	179.7	-66.3	0	0	0	0	113	S640 K657 G659 I666 I668	S640-V642 PolarHBondContact O-N 2.98Å; V642-K657 HydrophobicContact CG2-CB 4.12Å; V642-K657 VanDerWaalsContact CG2-O 3.28Å; V642-K657 WeakPolarHBondContact CG2-O 3.32Å; V642-K657 PolarHBondContact N-O 3.15Å; V642-G659 WeakPolarHBondContact CG1-O 3.14Å; V642-I666 HydrophobicContact CB-CG2 3.64Å; V642-I666 HydrophobicContact CG1-CG2 3.95Å; V642-I666 HydrophobicContact CG2-CG2 3.65Å; V642-I668 HydrophobicContact CG2-CG1 4.45Å
643	K	87.9	Confident	86.5	Confident	118 Å²	118	74 Å²	74	51%	0.513	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	138.1	-178.1	-160	175.4	-176.4	167	0	112.5	T645 K657	K643-T645 HydrophobicContact CD-CG2 3.93Å; K643-T645 HydrophobicContact CG-CG2 3.89Å; K643-K657 HydrophobicContact CB-CB 4.13Å; K643-K657 HydrophobicContact CB-CD 4.36Å; K643-K657 HydrophobicContact CB-CG 4.48Å; K643-K657 PolarHBondContact N-O 2.8Å; K643-K657 PolarHBondContact O-N 2.74Å
644	I	89.6	Confident	86.8	Confident	37 Å²	37	71.8 Å²	71.8	19%	0.19	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	120.7	171.2	-52.5	174	0	0	0	108	V641 I654 T655 F656 T683 K687 I690	V641-I644 HydrophobicContact CG1-CD1 4.06Å; V641-I644 HydrophobicContact CG1-CG1 3.68Å; I644-I654 HydrophobicContact CG2-CG2 3.74Å; I644-T655 WeakPolarHBondContact CA-O 3.3Å; I644-F656 HydrophobicContact CD1-CD1 4.06Å; I644-F656 HydrophobicContact CD1-CE1 3.79Å; I644-F656 HydrophobicContact CG1-CD1 3.76Å; I644-F656 HydrophobicContact CG1-CE1 3.94Å; I644-F656 HydrophobicContact CG2-CD1 4.22Å; I644-F656 HydrophobicContact CG2-CE1 3.99Å; I644-F656 HydrophobicContact CG2-CZ 4.48Å; I644-T683 HydrophobicContact CG2-CG2 4.28Å; I644-K687 HydrophobicContact CD1-CG 3.82Å; I644-I690 HydrophobicContact CD1-CD1 4.02Å
645	T	87.9	Confident	87	Confident	46 Å²	46	71.7 Å²	71.7	28%	0.282	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	148.2	-179.4	59.5	0	0	0	0	111.8	K643 T655	K643-T645 HydrophobicContact CD-CG2 3.93Å; K643-T645 HydrophobicContact CG-CG2 3.89Å; T645-T655 PolarHBondContact N-O 3.5Å; T645-T655 PolarHBondContact O-N 3Å; T645-T655 WeakPolarHBondContact OG1-CB 3.31Å
646	S	87.9	Confident	87	Confident	74 Å²	74	65.7 Å²	65.7	52%	0.517	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	149.8	170.6	64.7	0	0	0	0	110.2
647	K	78.9	Confident	87	Confident	130 Å²	130	66.3 Å²	66.3	57%	0.565	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.6	131.8	175.9	-71.3	-169.7	178.1	-178.6	0	109.6	K649 H650 L653	K647-K649 PolarHBondContact O-N 3.41Å; K647-K649 VanDerWaalsContact O-N 3.15Å; K647-H650 HydrophobicContact CB-CB 4.47Å; K647-H650 CarbonylContact O-C 3.57Å; K647-H650 PolarHBondContact O-N 3.04Å; K647-H650 VanDerWaalsContact O-O 3.09Å; K647-L653 HydrophobicContact CD-CD2 4.37Å
648	K	75.9	Confident	86.9	Confident	216 Å²	216	65.2 Å²	65.2	94%	0.939	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-35.6	177.6	-75.7	-175.5	178	178.8	0	113.7
649	K	75.8	Confident	86.8	Confident	189 Å²	189	65.4 Å²	65.4	82%	0.822	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-21.4	178.5	-68.3	-173.5	177.3	-177.7	0	113.6	K647	K647-K649 PolarHBondContact O-N 3.41Å; K647-K649 VanDerWaalsContact O-N 3.15Å
650	H	79.9	Confident	86.3	Confident	124 Å²	124	66.3 Å²	66.3	57%	0.574	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.7	77.6	-179.5	-65.1	-69.1	0	0	0	109.2	K647 E652 L653	K647-H650 HydrophobicContact CB-CB 4.47Å; K647-H650 CarbonylContact O-C 3.57Å; K647-H650 PolarHBondContact O-N 3.04Å; K647-H650 VanDerWaalsContact O-O 3.09Å; H650-E652 PolarHBondContact O-N 3.32Å; H650-L653 HydrophobicContact CB-CB 4.17Å; H650-L653 PolarHBondContact O-N 2.88Å
651	P	81.9	Confident	85.3	Confident	83 Å²	83	70 Å²	70	54%	0.539	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	-21.3	-175.8	26.5	-34.6	0	0	0	112.9	L653 I654 A679	P651-L653 VanDerWaalsContact C-N 3.31Å; P651-I654 WeakPolarHBondContact O-CD1 3.39Å; P651-A679 WeakPolarHBondContact O-CB 3.41Å
652	E	87.3	Confident	84.2	Confident	92 Å²	92	72.2 Å²	72.2	43%	0.43	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	-20.1	175.5	-64.1	-177.7	-166.4	0	0	113.4	H650 I654 L675 I676	H650-E652 PolarHBondContact O-N 3.32Å; E652-I654 PolarHBondContact O-N 3.45Å; E652-L675 HydrophobicContact CB-CG 4.39Å; E652-L675 WeakPolarHBondContact O-CA 3.28Å; E652-I676 PolarHBondContact O-N 3.1Å
653	L	90.7	Very high	82.6	Confident	27 Å²	27	76.3 Å²	76.3	14%	0.141	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	102.8	177	-175.6	68.4	0	0	0	109.9	V599 K647 H650 P651 R673 Y674	V599-L653 HydrophobicContact CB-CD1 4.39Å; V599-L653 HydrophobicContact CG2-CD1 3.83Å; K647-L653 HydrophobicContact CD-CD2 4.37Å; H650-L653 HydrophobicContact CB-CB 4.17Å; H650-L653 PolarHBondContact O-N 2.88Å; P651-L653 VanDerWaalsContact C-N 3.31Å; L653-R673 HydrophobicContact CD1-CB 4.45Å; L653-Y674 WeakPolarHBondContact CA-O 3.45Å
654	I	93.6	Very high	80.9	Confident	4 Å²	4	76.3 Å²	76.3	2%	0.021	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	134.1	178.3	-56.1	-53.3	0	0	0	109.6	I644 P651 E652 F656 R673 Y674 I676 A679 T683	I644-I654 HydrophobicContact CG2-CG2 3.74Å; P651-I654 WeakPolarHBondContact O-CD1 3.39Å; E652-I654 PolarHBondContact O-N 3.45Å; I654-F656 HydrophobicContact CB-CE2 4.2Å; I654-F656 HydrophobicContact CG2-CD2 3.98Å; I654-F656 HydrophobicContact CG2-CE1 4.35Å; I654-F656 HydrophobicContact CG2-CE2 3.42Å; I654-F656 VanDerWaalsContact CG2-CE2 3.42Å; I654-F656 HydrophobicContact CG2-CZ 3.63Å; I654-R673 WeakPolarHBondContact O-CA 3.47Å; I654-Y674 PolarHBondContact N-O 2.99Å; I654-Y674 PolarHBondContact O-N 3.42Å; I654-I676 HydrophobicContact CB-CD1 4.32Å; I654-I676 HydrophobicContact CG1-CD1 4.23Å; I654-A679 HydrophobicContact CD1-CB 3.83Å; I654-A679 HydrophobicContact CG1-CB 3.69Å; I654-T683 HydrophobicContact CB-CG2 4.42Å; I654-T683 HydrophobicContact CD1-CG2 3.79Å; I654-T683 HydrophobicContact CG1-CG2 3.76Å; I654-T683 HydrophobicContact CG2-CG2 3.8Å
655	T	92.2	Very high	79.7	Confident	13 Å²	13	76.4 Å²	76.4	8%	0.08	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	120.3	174.2	-54.6	0	0	0	0	109.1	I644 T645 K657 I671 E672 R673	I644-T655 WeakPolarHBondContact CA-O 3.3Å; T645-T655 PolarHBondContact N-O 3.5Å; T645-T655 PolarHBondContact O-N 3Å; T645-T655 WeakPolarHBondContact OG1-CB 3.31Å; T655-K657 HydrophobicContact CG2-CG 4.45Å; T655-I671 HydrophobicContact CG2-CG2 3.49Å; T655-I671 VanDerWaalsContact CG2-CG2 3.49Å; T655-E672 CarbonylContact C-O 3.59Å; T655-E672 WeakPolarHBondContact CA-O 3.5Å; T655-R673 HydrophobicContact CG2-CG 3.93Å
656	F	92.6	Very high	79.1	Confident	0 Å²	0	78.9 Å²	78.9	0%	0	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	131.3	170.9	-63.1	-90.8	0	0	0	108.6	L610 M617 V641 I644 I654 Y658 I671 E672 Y674 I686	L610-F656 HydrophobicContact CD2-CE2 4.38Å; M617-F656 HydrophobicContact CE-CD1 4.01Å; M617-F656 HydrophobicContact CE-CD2 4.25Å; M617-F656 HydrophobicContact CE-CE1 4.23Å; M617-F656 HydrophobicContact CE-CE2 4.44Å; M617-F656 HydrophobicContact CE-CG 4.03Å; M617-F656 HydrophobicContact CE-CZ 4.43Å; V641-F656 HydrophobicContact CG1-CD1 4.37Å; I644-F656 HydrophobicContact CD1-CD1 4.06Å; I644-F656 HydrophobicContact CD1-CE1 3.79Å; I644-F656 HydrophobicContact CG1-CD1 3.76Å; I644-F656 HydrophobicContact CG1-CE1 3.94Å; I644-F656 HydrophobicContact CG2-CD1 4.22Å; I644-F656 HydrophobicContact CG2-CE1 3.99Å; I644-F656 HydrophobicContact CG2-CZ 4.48Å; I654-F656 HydrophobicContact CB-CE2 4.2Å; I654-F656 HydrophobicContact CG2-CD2 3.98Å; I654-F656 HydrophobicContact CG2-CE1 4.35Å; I654-F656 HydrophobicContact CG2-CE2 3.42Å; I654-F656 VanDerWaalsContact CG2-CE2 3.42Å; I654-F656 HydrophobicContact CG2-CZ 3.63Å; F656-Y658 HydrophobicContact CB-CE1 4.45Å; F656-Y658 HydrophobicContact CB-CE2 3.8Å; F656-I671 WeakPolarHBondContact O-CA 3.49Å; F656-E672 PolarHBondContact N-O 3.29Å; F656-E672 PolarHBondContact O-N 2.99Å; F656-Y674 AromaticContact CD2-CD2 3.73Å; F656-Y674 HydrophobicContact CD2-CD2 3.73Å; F656-Y674 HydrophobicContact CD2-CE2 4.05Å; F656-Y674 AromaticContact CE2-CD2 3.89Å; F656-Y674 HydrophobicContact CE2-CD2 3.89Å; F656-Y674 HydrophobicContact CE2-CE2 4.49Å; F656-I686 HydrophobicContact CE1-CD1 4.21Å; F656-I686 HydrophobicContact CE1-CG2 3.96Å; F656-I686 HydrophobicContact CZ-CD1 3.74Å
657	K	89.9	Confident	78.7	Confident	54 Å²	54	81.3 Å²	81.3	24%	0.235	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	128.1	172.5	-59.2	-169.4	168.1	-158.2	0	107.9	V642 K643 T655 I668 A670 I671	V642-K657 HydrophobicContact CG2-CB 4.12Å; V642-K657 VanDerWaalsContact CG2-O 3.28Å; V642-K657 WeakPolarHBondContact CG2-O 3.32Å; V642-K657 PolarHBondContact N-O 3.15Å; K643-K657 HydrophobicContact CB-CB 4.13Å; K643-K657 HydrophobicContact CB-CD 4.36Å; K643-K657 HydrophobicContact CB-CG 4.48Å; K643-K657 PolarHBondContact N-O 2.8Å; K643-K657 PolarHBondContact O-N 2.74Å; T655-K657 HydrophobicContact CG2-CG 4.45Å; K657-I668 HydrophobicContact CB-CG2 4.17Å; K657-I668 HydrophobicContact CD-CD1 3.76Å; K657-I668 HydrophobicContact CD-CG1 4.37Å; K657-A670 WeakPolarHBondContact CA-O 3.46Å; K657-I671 HydrophobicContact CG-CG1 4.23Å; K657-I671 HydrophobicContact CG-CG2 4.5Å
658	Y	89.6	Confident	78.9	Confident	3 Å²	3	78.8 Å²	78.8	1%	0.012	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	147.1	-179.6	-49.8	-91.8	0	0	0	110.5	M617 Q636 S640 V641 F656 I668 L669 A670 E672	M617-Y658 HydrophobicContact CE-CE1 4.21Å; M617-Y658 WeakPolarHBondContact CE-OH 3.49Å; Q636-Y658 HydrophobicContact CB-CD1 3.79Å; Q636-Y658 HydrophobicContact CB-CE1 3.34Å; Q636-Y658 HydrophobicContact CB-CE2 4.44Å; Q636-Y658 HydrophobicContact CB-CG 4.48Å; Q636-Y658 HydrophobicContact CG-CD1 4.09Å; Q636-Y658 HydrophobicContact CG-CD2 4.22Å; Q636-Y658 HydrophobicContact CG-CE1 3.69Å; Q636-Y658 HydrophobicContact CG-CE2 3.84Å; Q636-Y658 HydrophobicContact CG-CG 4.32Å; S640-Y658 CarbonylContact O-C 3.56Å; S640-Y658 WeakPolarHBondContact O-CA 3.44Å; S640-Y658 WeakPolarHBondContact OG-CD1 3.3Å; V641-Y658 HydrophobicContact CB-CD1 4.43Å; V641-Y658 HydrophobicContact CG2-CD1 3.65Å; V641-Y658 HydrophobicContact CG2-CE1 3.47Å; V641-Y658 VanDerWaalsContact CG2-CE1 3.47Å; F656-Y658 HydrophobicContact CB-CE1 4.45Å; F656-Y658 HydrophobicContact CB-CE2 3.8Å; Y658-I668 CarbonylContact O-C 3.53Å; Y658-I668 WeakPolarHBondContact O-CA 3.26Å; Y658-L669 PolarHBondContact O-N 2.92Å; Y658-A670 HydrophobicContact CD2-CB 4.07Å; Y658-A670 PolarHBondContact N-O 3.48Å; Y658-A670 PolarHBondContact O-N 3.43Å; Y658-A670 VanDerWaalsContact O-N 3.17Å; Y658-E672 HydrophobicContact CE2-CB 4Å; Y658-E672 VanDerWaalsContact CE2-CD 3.49Å; Y658-E672 HydrophobicContact CE2-CG 3.77Å; Y658-E672 VanDerWaalsContact CE2-OE2 3.27Å; Y658-E672 WeakPolarHBondContact CE2-OE2 3.41Å; Y658-E672 PolarHBondContact OH-OE2 3Å
659	G	86.1	Confident	79.1	Confident	4 Å²	4	73.5 Å²	73.5	4%	0.041	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164.6	-158.9	178.6	0	0	0	0	0	112.7	S640 V642 E667	S640-G659 PolarHBondContact O-N 2.81Å; V642-G659 WeakPolarHBondContact CG1-O 3.14Å; G659-E667 VanDerWaalsContact CA-O 3.25Å; G659-E667 WeakPolarHBondContact CA-O 3.38Å
660	N	78.6	Confident	79.5	Confident	101 Å²	101	66 Å²	66	54%	0.54	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	138.1	-176.8	-66.3	-9.3	0	0	0	109.9	E667	N660-E667 PolarHBondContact N-O 2.78Å; N660-E667 PolarHBondContact O-N 2.96Å; N660-E667 VanDerWaalsContact O-N 3.14Å
661	S	68.1	Low	79.9	Confident	98 Å²	98	63.2 Å²	63.2	69%	0.685	38%	0.383	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.1	106.7	174.5	-174	0	0	0	0	108.8
662	S	65.9	Low	80.3	Confident	68 Å²	68	60.5 Å²	60.5	48%	0.476	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	168.3	174.7	73.4	0	0	0	0	111	S664 G665	S662-S664 PolarHBondContact O-N 3.43Å; S662-S664 VanDerWaalsContact O-N 3.09Å; S662-S664 PolarHBondContact OG-OG 3.05Å; S662-S664 VanDerWaalsContact OG-OG 3.11Å; S662-G665 PolarHBondContact N-O 3.05Å; S662-G665 VanDerWaalsContact N-O 3.16Å; S662-G665 PolarHBondContact O-N 2.82Å; S662-G665 PolarHBondContact OG-O 3.18Å
663	A	55.1	Low	80.6	Confident	122 Å²	122	60 Å²	60	100%	1.008	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-15.6	179.9	0	0	0	0	0	113.9
664	S	51	Low	80.8	Confident	118 Å²	118	58.8 Å²	58.8	83%	0.825	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-4.9	-179.5	57.7	0	0	0	0	114.5	S662	S662-S664 PolarHBondContact O-N 3.43Å; S662-S664 VanDerWaalsContact O-N 3.09Å; S662-S664 PolarHBondContact OG-OG 3.05Å; S662-S664 VanDerWaalsContact OG-OG 3.11Å
665	G	64.6	Low	80.7	Confident	38 Å²	38	61.1 Å²	61.1	39%	0.392	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	148.2	176.6	-180	0	0	0	0	0	114.1	S662	S662-G665 PolarHBondContact N-O 3.05Å; S662-G665 VanDerWaalsContact N-O 3.16Å; S662-G665 PolarHBondContact O-N 2.82Å; S662-G665 PolarHBondContact OG-O 3.18Å
666	I	75.5	Confident	80.8	Confident	98 Å²	98	60.7 Å²	60.7	50%	0.503	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	114.4	175.7	-59.8	173.3	0	0	0	108.5	V642 I668	V642-I666 HydrophobicContact CB-CG2 3.64Å; V642-I666 HydrophobicContact CG1-CG2 3.95Å; V642-I666 HydrophobicContact CG2-CG2 3.65Å; I666-I668 HydrophobicContact CG2-CG1 4.43Å
667	E	79.5	Confident	80.4	Confident	126 Å²	126	64.3 Å²	64.3	59%	0.589	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.8	128.2	172	-172.7	179.2	-172.9	0	0	109.2	G659 N660 L669	G659-E667 VanDerWaalsContact CA-O 3.25Å; G659-E667 WeakPolarHBondContact CA-O 3.38Å; N660-E667 PolarHBondContact N-O 2.78Å; N660-E667 PolarHBondContact O-N 2.96Å; N660-E667 VanDerWaalsContact O-N 3.14Å; E667-L669 HydrophobicContact CG-CD2 4.48Å
668	I	83.3	Confident	80.2	Confident	76 Å²	76	67.4 Å²	67.4	39%	0.39	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	114.5	-178.2	-60.9	157.8	0	0	0	108.9	V642 K657 Y658 I666 I671	V642-I668 HydrophobicContact CG2-CG1 4.45Å; K657-I668 HydrophobicContact CB-CG2 4.17Å; K657-I668 HydrophobicContact CD-CD1 3.76Å; K657-I668 HydrophobicContact CD-CG1 4.37Å; Y658-I668 CarbonylContact O-C 3.53Å; Y658-I668 WeakPolarHBondContact O-CA 3.26Å; I666-I668 HydrophobicContact CG2-CG1 4.43Å; I668-I671 HydrophobicContact CG2-CD1 4.17Å; I668-I671 HydrophobicContact CG2-CG1 3.71Å
669	L	80.8	Confident	80	Confident	106 Å²	106	67.5 Å²	67.5	56%	0.555	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	-31	179.6	-60.7	176	0	0	0	112.7	Y658 E667	Y658-L669 PolarHBondContact O-N 2.92Å; E667-L669 HydrophobicContact CG-CD2 4.48Å
670	A	82.2	Confident	79.9	Confident	30 Å²	30	69.7 Å²	69.7	25%	0.248	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	149.7	-179.1	0	0	0	0	0	112.6	K657 Y658	K657-A670 WeakPolarHBondContact CA-O 3.46Å; Y658-A670 HydrophobicContact CD2-CB 4.07Å; Y658-A670 PolarHBondContact N-O 3.48Å; Y658-A670 PolarHBondContact O-N 3.43Å; Y658-A670 VanDerWaalsContact O-N 3.17Å
671	I	89.2	Confident	80.3	Confident	66 Å²	66	69.5 Å²	69.5	34%	0.338	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	124.8	175.6	-56.5	-179	0	0	0	108.7	T655 F656 K657 I668	T655-I671 HydrophobicContact CG2-CG2 3.49Å; T655-I671 VanDerWaalsContact CG2-CG2 3.49Å; F656-I671 WeakPolarHBondContact O-CA 3.49Å; K657-I671 HydrophobicContact CG-CG1 4.23Å; K657-I671 HydrophobicContact CG-CG2 4.5Å; I668-I671 HydrophobicContact CG2-CD1 4.17Å; I668-I671 HydrophobicContact CG2-CG1 3.71Å
672	E	91.1	Very high	81.3	Confident	26 Å²	26	64.9 Å²	64.9	12%	0.121	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	137.5	177.2	-65.1	174.2	172.8	0	0	110.1	S634 Q636 T655 F656 Y658 Y674	S634-E672 WeakPolarHBondContact CB-OE1 3.5Å; S634-E672 PolarHBondContact OG-OE1 3.01Å; Q636-E672 WeakPolarHBondContact CG-OE1 3.43Å; Q636-E672 PolarHBondContact NE2-OE1 3.03Å; T655-E672 CarbonylContact C-O 3.59Å; T655-E672 WeakPolarHBondContact CA-O 3.5Å; F656-E672 PolarHBondContact N-O 3.29Å; F656-E672 PolarHBondContact O-N 2.99Å; Y658-E672 HydrophobicContact CE2-CB 4Å; Y658-E672 VanDerWaalsContact CE2-CD 3.49Å; Y658-E672 HydrophobicContact CE2-CG 3.77Å; Y658-E672 VanDerWaalsContact CE2-OE2 3.27Å; Y658-E672 WeakPolarHBondContact CE2-OE2 3.41Å; Y658-E672 PolarHBondContact OH-OE2 3Å; E672-Y674 HydrophobicContact CB-CE2 3.58Å; E672-Y674 PolarHBondContact OE2-OH 3.34Å
673	R	93.1	Very high	82.5	Confident	83 Å²	83	62.7 Å²	62.7	31%	0.313	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129.4	-177.6	-60.9	-177	-178.5	122.3	2.6	110.4	V599 L653 I654 T655	V599-R673 HydrophobicContact CB-CB 4.11Å; V599-R673 PolarHBondContact N-O 2.7Å; L653-R673 HydrophobicContact CD1-CB 4.45Å; I654-R673 WeakPolarHBondContact O-CA 3.47Å; T655-R673 HydrophobicContact CG2-CG 3.93Å
674	Y	94.3	Very high	84.1	Confident	1 Å²	1	64 Å²	64	0%	0.004	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	135.7	-178.4	-58.3	-72.4	0	0	0	111	K597 E598 L610 C619 L653 I654 F656 E672	K597-Y674 CarbonylContact O-C 3.29Å; K597-Y674 WeakPolarHBondContact O-CA 3.41Å; E598-Y674 HydrophobicContact CB-CD1 4.24Å; E598-Y674 HydrophobicContact CB-CE1 4.08Å; E598-Y674 HydrophobicContact CG-CD1 4.48Å; E598-Y674 HydrophobicContact CG-CE1 4.01Å; L610-Y674 HydrophobicContact CD1-CD2 4.44Å; L610-Y674 HydrophobicContact CD1-CE1 4.5Å; L610-Y674 HydrophobicContact CD1-CE2 4.03Å; C619-Y674 HydrophobicContact CB-CE1 4.23Å; C619-Y674 WeakPolarHBondContact CB-OH 3.35Å; C619-Y674 VanDerWaalsContact SG-CE1 3.53Å; L653-Y674 WeakPolarHBondContact CA-O 3.45Å; I654-Y674 PolarHBondContact N-O 2.99Å; I654-Y674 PolarHBondContact O-N 3.42Å; F656-Y674 AromaticContact CD2-CD2 3.73Å; F656-Y674 HydrophobicContact CD2-CD2 3.73Å; F656-Y674 HydrophobicContact CD2-CE2 4.05Å; F656-Y674 AromaticContact CE2-CD2 3.89Å; F656-Y674 HydrophobicContact CE2-CD2 3.89Å; F656-Y674 HydrophobicContact CE2-CE2 4.49Å; E672-Y674 HydrophobicContact CB-CE2 3.58Å; E672-Y674 PolarHBondContact OE2-OH 3.34Å
675	L	92.2	Very high	86	Confident	53 Å²	53	59 Å²	59	28%	0.277	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	110.3	166.9	-168.1	136.8	0	0	0	108.6	C596 K597 V599 E652	C596-L675 CarbonylContact C-O 3.54Å; C596-L675 VanDerWaalsContact CA-O 3.29Å; C596-L675 WeakPolarHBondContact CA-O 3.44Å; C596-L675 VanDerWaalsContact CB-O 3.31Å; C596-L675 WeakPolarHBondContact CB-O 3.35Å; K597-L675 HydrophobicContact CB-CB 4.32Å; K597-L675 PolarHBondContact N-O 3.4Å; K597-L675 PolarHBondContact O-N 3.31Å; V599-L675 HydrophobicContact CG2-CB 4.32Å; E652-L675 HydrophobicContact CB-CG 4.39Å; E652-L675 WeakPolarHBondContact O-CA 3.28Å
676	I	93.8	Very high	87.3	Confident	3 Å²	3	57.2 Å²	57.2	2%	0.015	30%	0.304	C	S	.	.			trans	-116.2	115.2	-172.8	-52.2	176.4	0	0	0	108.7	F594 C596 L610 E652 I654 N678 A679 A682	F594-I676 HydrophobicContact CB-CG2 4.41Å; C596-I676 HydrophobicContact CB-CG1 3.96Å; L610-I676 HydrophobicContact CD2-CD1 4.29Å; E652-I676 PolarHBondContact O-N 3.1Å; I654-I676 HydrophobicContact CB-CD1 4.32Å; I654-I676 HydrophobicContact CG1-CD1 4.23Å; I676-N678 PolarHBondContact O-N 3.15Å; I676-A679 HydrophobicContact CB-CB 4.16Å; I676-A679 WeakPolarHBondContact O-CB 3.49Å; I676-A679 PolarHBondContact O-N 3.34Å; I676-A679 VanDerWaalsContact O-N 3.1Å; I676-A682 HydrophobicContact CD1-CB 4.41Å; I676-A682 HydrophobicContact CG2-CB 3.81Å
677	P	84.3	Confident	88	Confident	77 Å²	77	57.7 Å²	57.7	50%	0.5	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-26.5	-175.6	-28	35.5	0	0	0	115.2	P595	P595-P677 WeakPolarHBondContact O-CD 3.31Å
678	N	85.1	Confident	88.6	Confident	118 Å²	118	57.1 Å²	57.1	63%	0.631	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.8	52.6	174.5	-69.1	-41.6	0	0	0	111.3	I676 G680 D681 A682	I676-N678 PolarHBondContact O-N 3.15Å; N678-G680 PolarHBondContact O-N 3.36Å; N678-G680 VanDerWaalsContact O-N 3.09Å; N678-D681 PolarHBondContact O-N 3.21Å; N678-A682 PolarHBondContact O-N 3.4Å; N678-A682 VanDerWaalsContact O-N 3.11Å
679	A	86.8	Confident	88.9	Confident	6 Å²	6	53.8 Å²	53.8	5%	0.05	28%	0.282	C	S	.	.	H	α-helix	trans	-55	-31.1	-172.5	0	0	0	0	0	114.9	P651 I654 I676 T683	P651-A679 WeakPolarHBondContact O-CB 3.41Å; I654-A679 HydrophobicContact CD1-CB 3.83Å; I654-A679 HydrophobicContact CG1-CB 3.69Å; I676-A679 HydrophobicContact CB-CB 4.16Å; I676-A679 WeakPolarHBondContact O-CB 3.49Å; I676-A679 PolarHBondContact O-N 3.34Å; I676-A679 VanDerWaalsContact O-N 3.1Å; A679-T683 VanDerWaalsContact O-CB 3.32Å; A679-T683 WeakPolarHBondContact O-CB 3.4Å; A679-T683 VanDerWaalsContact O-CG2 3.24Å; A679-T683 WeakPolarHBondContact O-CG2 3.27Å; A679-T683 PolarHBondContact O-N 3.27Å; A679-T683 PolarHBondContact O-OG1 2.86Å
680	G	84.2	Confident	89.4	Confident	49 Å²	49	49.4 Å²	49.4	51%	0.505	26%	0.259	S	S	.	.	H	α-helix	trans	-63.5	-46.1	178.2	0	0	0	0	0	113.5	N678 T683 R684	N678-G680 PolarHBondContact O-N 3.36Å; N678-G680 VanDerWaalsContact O-N 3.09Å; G680-T683 PolarHBondContact O-OG1 3.41Å; G680-R684 WeakPolarHBondContact O-CB 3.24Å; G680-R684 PolarHBondContact O-N 3.06Å
681	D	86.6	Confident	89.6	Confident	98 Å²	98	53 Å²	53	52%	0.524	27%	0.272	S	S	.	.	H	α-helix	trans	-76	-38.7	179.2	-66.9	-29.9	0	0	0	111.3	N678 R684 A685	N678-D681 PolarHBondContact O-N 3.21Å; D681-R684 PolarHBondContact O-N 3.08Å; D681-R684 IonicContact OD1-NH1 2.61Å; D681-R684 IonicContact OD1-NH2 2.91Å; D681-A685 WeakPolarHBondContact O-CB 3.44Å; D681-A685 PolarHBondContact O-N 2.88Å
682	A	89.4	Confident	89.6	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61.4	-48.5	177	0	0	0	0	0	112.1	F594 I676 N678 R684 A685 I686	F594-A682 HydrophobicContact CD1-CB 3.57Å; F594-A682 HydrophobicContact CD2-CB 4.13Å; F594-A682 HydrophobicContact CE1-CB 3.59Å; F594-A682 HydrophobicContact CE2-CB 4.14Å; F594-A682 HydrophobicContact CG-CB 3.85Å; F594-A682 HydrophobicContact CZ-CB 3.89Å; I676-A682 HydrophobicContact CD1-CB 4.41Å; I676-A682 HydrophobicContact CG2-CB 3.81Å; N678-A682 PolarHBondContact O-N 3.4Å; N678-A682 VanDerWaalsContact O-N 3.11Å; A682-R684 VanDerWaalsContact C-N 3.31Å; A682-R684 PolarHBondContact O-N 3.35Å; A682-A685 PolarHBondContact O-N 3.29Å; A682-I686 WeakPolarHBondContact O-CB 3.19Å; A682-I686 WeakPolarHBondContact O-CD1 3.32Å; A682-I686 VanDerWaalsContact O-CG1 3.25Å; A682-I686 WeakPolarHBondContact O-CG1 3.22Å; A682-I686 PolarHBondContact O-N 3.5Å
683	T	90	Very high	89.5	Confident	22 Å²	22	55.4 Å²	55.4	14%	0.135	28%	0.281	C	S	.	.	H	α-helix	trans	-66.7	-32.6	178.2	53.9	0	0	0	0	112.5	I644 I654 A679 G680 K687	I644-T683 HydrophobicContact CG2-CG2 4.28Å; I654-T683 HydrophobicContact CB-CG2 4.42Å; I654-T683 HydrophobicContact CD1-CG2 3.79Å; I654-T683 HydrophobicContact CG1-CG2 3.76Å; I654-T683 HydrophobicContact CG2-CG2 3.8Å; A679-T683 VanDerWaalsContact O-CB 3.32Å; A679-T683 WeakPolarHBondContact O-CB 3.4Å; A679-T683 VanDerWaalsContact O-CG2 3.24Å; A679-T683 WeakPolarHBondContact O-CG2 3.27Å; A679-T683 PolarHBondContact O-N 3.27Å; A679-T683 PolarHBondContact O-OG1 2.86Å; G680-T683 PolarHBondContact O-OG1 3.41Å; T683-K687 VanDerWaalsContact O-CB 3.3Å; T683-K687 WeakPolarHBondContact O-CB 3.43Å; T683-K687 WeakPolarHBondContact O-CG 3.48Å; T683-K687 PolarHBondContact O-N 3.31Å
684	R	90.1	Very high	89	Confident	149 Å²	149	54.5 Å²	54.5	56%	0.562	28%	0.282	S	S	*	.	H	α-helix	trans	-64.5	-48.1	173.7	-172.3	-173.3	-58.1	160	8	111.4	G680 D681 A682 K687 Q688	G680-R684 WeakPolarHBondContact O-CB 3.24Å; G680-R684 PolarHBondContact O-N 3.06Å; D681-R684 PolarHBondContact O-N 3.08Å; D681-R684 IonicContact OD1-NH1 2.61Å; D681-R684 IonicContact OD1-NH2 2.91Å; A682-R684 VanDerWaalsContact C-N 3.31Å; A682-R684 PolarHBondContact O-N 3.35Å; R684-K687 PolarHBondContact O-N 3.07Å; R684-Q688 WeakPolarHBondContact O-CG 3.46Å; R684-Q688 PolarHBondContact O-N 3.19Å
685	A	90.1	Very high	88.5	Confident	14 Å²	14	58.8 Å²	58.8	12%	0.116	31%	0.305	C	S	.	.	H	α-helix	trans	-62.4	-45.3	178.8	0	0	0	0	0	111.8	F594 D681 A682 Q688 Q689	F594-A685 HydrophobicContact CZ-CB 3.95Å; D681-A685 WeakPolarHBondContact O-CB 3.44Å; D681-A685 PolarHBondContact O-N 2.88Å; A682-A685 PolarHBondContact O-N 3.29Å; A685-Q688 PolarHBondContact O-N 2.99Å; A685-Q689 PolarHBondContact O-N 3.27Å
686	I	92.1	Very high	88	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-62.3	-46.5	177.3	-67.5	163	0	0	0	110.8	F594 L610 V612 M617 F656 A682 Q688 Q689 I690	F594-I686 HydrophobicContact CD2-CD1 4.34Å; F594-I686 HydrophobicContact CE2-CD1 4.11Å; F594-I686 HydrophobicContact CE2-CG1 4.05Å; L610-I686 HydrophobicContact CD2-CD1 3.91Å; V612-I686 HydrophobicContact CG2-CD1 4.33Å; V612-I686 HydrophobicContact CG2-CG1 3.75Å; M617-I686 HydrophobicContact SD-CD1 4.1Å; M617-I686 HydrophobicContact SD-CG1 4.49Å; M617-I686 HydrophobicContact SD-CG2 4.36Å; F656-I686 HydrophobicContact CE1-CD1 4.21Å; F656-I686 HydrophobicContact CE1-CG2 3.96Å; F656-I686 HydrophobicContact CZ-CD1 3.74Å; A682-I686 WeakPolarHBondContact O-CB 3.19Å; A682-I686 WeakPolarHBondContact O-CD1 3.32Å; A682-I686 VanDerWaalsContact O-CG1 3.25Å; A682-I686 WeakPolarHBondContact O-CG1 3.22Å; A682-I686 PolarHBondContact O-N 3.5Å; I686-Q688 PolarHBondContact O-N 3.21Å; I686-Q689 PolarHBondContact O-N 3.1Å; I686-Q689 VanDerWaalsContact O-N 3.13Å; I686-I690 HydrophobicContact CG2-CD1 3.72Å; I686-I690 HydrophobicContact CG2-CG1 4.32Å; I686-I690 VanDerWaalsContact O-CG1 3.32Å; I686-I690 WeakPolarHBondContact O-CG1 3.34Å; I686-I690 PolarHBondContact O-N 3.04Å
687	K	90	Very high	87	Confident	109 Å²	109	64.5 Å²	64.5	47%	0.474	34%	0.344	S	S	.	.	H	α-helix	trans	-59.6	-44.8	177	-78.2	177.6	179.9	-173.8	0	112.5	I644 T683 R684 Q689 I690 M691	I644-K687 HydrophobicContact CD1-CG 3.82Å; T683-K687 VanDerWaalsContact O-CB 3.3Å; T683-K687 WeakPolarHBondContact O-CB 3.43Å; T683-K687 WeakPolarHBondContact O-CG 3.48Å; T683-K687 PolarHBondContact O-N 3.31Å; R684-K687 PolarHBondContact O-N 3.07Å; K687-Q689 PolarHBondContact O-N 2.95Å; K687-I690 PolarHBondContact O-N 3.27Å; K687-M691 WeakPolarHBondContact O-CG 3.3Å; K687-M691 PolarHBondContact O-N 2.81Å
688	Q	91.2	Very high	86.2	Confident	113 Å²	113	68.9 Å²	68.9	53%	0.528	36%	0.358	S	S	.	.	H	α-helix	trans	-60.4	-37.6	176.4	-75.1	177.4	-7.2	0	0	111.8	R684 A685 I686 K692	R684-Q688 WeakPolarHBondContact O-CG 3.46Å; R684-Q688 PolarHBondContact O-N 3.19Å; A685-Q688 PolarHBondContact O-N 2.99Å; I686-Q688 PolarHBondContact O-N 3.21Å; Q688-K692 WeakPolarHBondContact O-CG 3.35Å; Q688-K692 PolarHBondContact O-N 3.37Å
689	Q	91.3	Very high	84.5	Confident	7 Å²	7	70 Å²	70	3%	0.033	38%	0.375	C	S	.	.	H	α-helix	trans	-73.2	-36.3	178	-169.2	48.9	44.2	0	0	112.3	K591 V612 T613 A614 L638 A685 I686 K687 K692 V693	K591-Q689 HydrophobicContact CD-CG 4.24Å; K591-Q689 VanDerWaalsContact CD-OE1 3.24Å; K591-Q689 VanDerWaalsContact NZ-CD 3.26Å; V612-Q689 HydrophobicContact CG1-CB 4.32Å; V612-Q689 HydrophobicContact CG1-CG 4.04Å; T613-Q689 WeakPolarHBondContact O-CG 3.44Å; A614-Q689 PolarHBondContact O-NE2 3.28Å; L638-Q689 HydrophobicContact CD1-CB 4.37Å; L638-Q689 HydrophobicContact CD1-CG 3.64Å; A685-Q689 PolarHBondContact O-N 3.27Å; I686-Q689 PolarHBondContact O-N 3.1Å; I686-Q689 VanDerWaalsContact O-N 3.13Å; K687-Q689 PolarHBondContact O-N 2.95Å; Q689-K692 PolarHBondContact O-N 3.06Å; Q689-V693 WeakPolarHBondContact O-CG2 3.41Å; Q689-V693 PolarHBondContact O-N 2.86Å
690	I	89.6	Confident	84.4	Confident	13 Å²	13	73.2 Å²	73.2	7%	0.067	39%	0.391	C	S	.	.	H	α-helix	trans	-61.4	-48.5	172.9	-66.9	163	0	0	0	110.6	L638 V641 I644 I686 K687 K692 V693 L694	L638-I690 HydrophobicContact CB-CG1 4.06Å; L638-I690 HydrophobicContact CD2-CG1 3.9Å; L638-I690 HydrophobicContact CG-CG1 4.48Å; V641-I690 HydrophobicContact CB-CD1 3.85Å; V641-I690 HydrophobicContact CG1-CD1 3.85Å; V641-I690 HydrophobicContact CG2-CD1 3.98Å; I644-I690 HydrophobicContact CD1-CD1 4.02Å; I686-I690 HydrophobicContact CG2-CD1 3.72Å; I686-I690 HydrophobicContact CG2-CG1 4.32Å; I686-I690 VanDerWaalsContact O-CG1 3.32Å; I686-I690 WeakPolarHBondContact O-CG1 3.34Å; I686-I690 PolarHBondContact O-N 3.04Å; K687-I690 PolarHBondContact O-N 3.27Å; I690-K692 VanDerWaalsContact C-N 3.29Å; I690-K692 PolarHBondContact O-N 3.05Å; I690-V693 WeakPolarHBondContact O-CB 3.44Å; I690-V693 PolarHBondContact O-N 3.19Å; I690-L694 HydrophobicContact CG2-CD1 4Å; I690-L694 HydrophobicContact CG2-CG 4.34Å; I690-L694 PolarHBondContact O-N 3.31Å
691	M	88	Confident	84.4	Confident	105 Å²	105	74.5 Å²	74.5	52%	0.517	39%	0.385	S	S	.	.	H	α-helix	trans	-57.3	-43.4	178.7	-67.8	-57.9	-59.3	0	0	111.6	K687 V693 L694 D695	K687-M691 WeakPolarHBondContact O-CG 3.3Å; K687-M691 PolarHBondContact O-N 2.81Å; M691-V693 PolarHBondContact O-N 2.8Å; M691-L694 PolarHBondContact O-N 3.48Å; M691-D695 WeakPolarHBondContact O-CB 3.46Å; M691-D695 PolarHBondContact O-N 3.37Å
692	K	89.2	Confident	84.3	Confident	125 Å²	125	73.2 Å²	73.2	54%	0.543	38%	0.378	S	S	.	.	H	α-helix	trans	-60.8	-31.4	175.7	-72.8	175.4	-177.5	179	0	113.8	Q688 Q689 I690 A696	Q688-K692 WeakPolarHBondContact O-CG 3.35Å; Q688-K692 PolarHBondContact O-N 3.37Å; Q689-K692 PolarHBondContact O-N 3.06Å; I690-K692 VanDerWaalsContact C-N 3.29Å; I690-K692 PolarHBondContact O-N 3.05Å; K692-A696 WeakPolarHBondContact O-CB 3.4Å; K692-A696 PolarHBondContact O-N 2.97Å
693	V	88.6	Confident	84	Confident	19 Å²	19	77.5 Å²	77.5	12%	0.115	40%	0.4	C	S	.	.	H	α-helix	trans	-76.1	-40.1	177.3	173.9	0	0	0	0	110.5	A614 L638 N639 Q689 I690 M691 A696 L697	A614-V693 WeakPolarHBondContact O-CG2 3.44Å; L638-V693 HydrophobicContact CB-CG2 4.32Å; L638-V693 HydrophobicContact CD1-CG2 4.21Å; N639-V693 HydrophobicContact CB-CG1 4.15Å; Q689-V693 WeakPolarHBondContact O-CG2 3.41Å; Q689-V693 PolarHBondContact O-N 2.86Å; I690-V693 WeakPolarHBondContact O-CB 3.44Å; I690-V693 PolarHBondContact O-N 3.19Å; M691-V693 PolarHBondContact O-N 2.8Å; V693-A696 PolarHBondContact O-N 3.05Å; V693-L697 HydrophobicContact CG1-CD1 4.17Å; V693-L697 VanDerWaalsContact O-CG 3.31Å; V693-L697 WeakPolarHBondContact O-CG 3.27Å; V693-L697 PolarHBondContact O-N 3.47Å
694	L	82.9	Confident	83.6	Confident	63 Å²	63	80.9 Å²	80.9	33%	0.33	42%	0.416	S	S	.	.	H	α-helix	trans	-66.5	-45.9	176.5	-64.8	175.4	0	0	0	111.3	N639 I690 M691 A696 L697 E698	N639-L694 HydrophobicContact CB-CD2 4.21Å; I690-L694 HydrophobicContact CG2-CD1 4Å; I690-L694 HydrophobicContact CG2-CG 4.34Å; I690-L694 PolarHBondContact O-N 3.31Å; M691-L694 PolarHBondContact O-N 3.48Å; L694-A696 PolarHBondContact O-N 3.1Å; L694-L697 PolarHBondContact O-N 3.39Å; L694-E698 PolarHBondContact O-N 3.36Å; L694-E698 VanDerWaalsContact O-N 3.17Å
695	D	83.8	Confident	83.2	Confident	92 Å²	92	76.4 Å²	76.4	49%	0.492	41%	0.407	S	S	.	.	H	α-helix	trans	-57.5	-38.8	176.2	-65.9	-16	0	0	0	111.4	M691 L697 E698 S699	M691-D695 WeakPolarHBondContact O-CB 3.46Å; M691-D695 PolarHBondContact O-N 3.37Å; D695-L697 VanDerWaalsContact C-N 3.3Å; D695-L697 PolarHBondContact O-N 3.19Å; D695-E698 PolarHBondContact O-N 2.84Å; D695-S699 PolarHBondContact O-N 3.49Å; D695-S699 PolarHBondContact O-OG 2.86Å; D695-S699 VanDerWaalsContact O-OG 3.1Å
696	A	80.4	Confident	82.7	Confident	62 Å²	62	80.9 Å²	80.9	51%	0.512	43%	0.428	S	S	.	.	H	α-helix	trans	-75	-14.1	178.6	0	0	0	0	0	114.4	K692 V693 L694 S699	K692-A696 WeakPolarHBondContact O-CB 3.4Å; K692-A696 PolarHBondContact O-N 2.97Å; V693-A696 PolarHBondContact O-N 3.05Å; L694-A696 PolarHBondContact O-N 3.1Å; A696-S699 WeakPolarHBondContact CA-OG 3.46Å
697	L	74.4	Confident	82	Confident	113 Å²	113	87.1 Å²	87.1	59%	0.592	46%	0.46	S	S	*	.	H	α-helix	trans	-92	-22.4	174.7	-72.8	167.2	0	0	0	111.9	N639 V693 L694 D695	N639-L697 HydrophobicContact CB-CD1 3.94Å; V693-L697 HydrophobicContact CG1-CD1 4.17Å; V693-L697 VanDerWaalsContact O-CG 3.31Å; V693-L697 WeakPolarHBondContact O-CG 3.27Å; V693-L697 PolarHBondContact O-N 3.47Å; L694-L697 PolarHBondContact O-N 3.39Å; D695-L697 VanDerWaalsContact C-N 3.3Å; D695-L697 PolarHBondContact O-N 3.19Å
698	E	66.2	Low	81.3	Confident	169 Å²	169	85.3 Å²	85.3	79%	0.79	46%	0.459	S	S	*	.	H	α-helix	trans	-90.8	-18.6	176.8	-67.9	-176.2	178.5	0	0	113.4	L694 D695	L694-E698 PolarHBondContact O-N 3.36Å; L694-E698 VanDerWaalsContact O-N 3.17Å; D695-E698 PolarHBondContact O-N 2.84Å
699	S	50.3	Low	80.4	Confident	142 Å²	142	82.7 Å²	82.7	99%	0.993	45%	0.453	S	S	*	.			trans	-92.4	0	173.4	62.7	0	0	0	0	112.5	D695 A696	D695-S699 PolarHBondContact O-N 3.49Å; D695-S699 PolarHBondContact O-OG 2.86Å; D695-S699 VanDerWaalsContact O-OG 3.1Å; A696-S699 WeakPolarHBondContact CA-OG 3.46Å

Retrieved 699 of 699 residues in 458.1 ms (Link to these results)

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