A0A096NT59_PAPAN Loading...

Neuronal acetylcholine receptor subunit alpha-7

AlphaFold DB , UniProt , Accession A0A096NT59, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 502 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.7	Very low	52.1	Low	238 Å²	238	134.2 Å²	134.2	100%	1.172	74%	0.74	S	S	*	*				0	89.4	0	-71	172.3	174.5	0	0	109.3
2	R	47.8	Very low	52.4	Low	246 Å²	246	130.5 Å²	130.5	93%	0.928	72%	0.718	S	S	*	*			trans	-176.5	63.9	169.8	-107.8	177.8	-155	-168.2	5.8	109.8
3	C	46.8	Very low	52.7	Low	137 Å²	137	124.9 Å²	124.9	93%	0.926	70%	0.699	S	S	*	*			trans	-155.3	61.8	170.4	-96.1	0	0	0	0	108.7
4	S	50.6	Low	52.9	Low	108 Å²	108	120.4 Å²	120.4	76%	0.755	69%	0.686	S	S	*	*	S	Bend	trans	-159.8	19.2	174.5	-166.8	0	0	0	0	114.8
5	Q	52.5	Low	53	Low	163 Å²	163	118.2 Å²	118.2	76%	0.762	68%	0.681	S	S	*	*	S	Bend	trans	-112.5	-23.7	177.6	-89.8	178.2	-15.4	0	0	114	W9	Q5-W9 VanDerWaalsContact O-CD1 3.27Å
6	G	52.7	Low	53.1	Low	55 Å²	55	119.6 Å²	119.6	57%	0.567	68%	0.684	S	S	*	*	H	α-helix	trans	-71.6	-31.2	-178.4	0	0	0	0	0	115.3
7	G	54.9	Low	53.1	Low	55 Å²	55	120.3 Å²	120.3	57%	0.567	69%	0.685	S	S	*	*	H	α-helix	trans	-73.8	-28	-177.2	0	0	0	0	0	114.4	A11	G7-A11 PolarHBondContact O-N 3.08Å
8	V	57.1	Low	53.3	Low	87 Å²	87	123.7 Å²	123.7	53%	0.527	69%	0.693	S	S	.	*	H	α-helix	trans	-74.5	-36	-176.9	-180	0	0	0	0	111.3	L12	V8-L12 HydrophobicContact CG1-CD1 4.01Å; V8-L12 WeakPolarHBondContact O-CB 3.36Å; V8-L12 PolarHBondContact O-N 3.13Å; V8-L12 VanDerWaalsContact O-N 3.07Å
9	W	54.5	Low	53.5	Low	193 Å²	193	123.4 Å²	123.4	73%	0.731	70%	0.695	S	S	*	*	H	α-helix	trans	-71.8	-32.6	176.5	-69.4	101.3	0	0	0	113.1	Q5 A13	Q5-W9 VanDerWaalsContact O-CD1 3.27Å; W9-A13 WeakPolarHBondContact O-CB 3.39Å; W9-A13 PolarHBondContact O-N 3.13Å
10	L	56	Low	53.8	Low	131 Å²	131	121.5 Å²	121.5	69%	0.686	69%	0.69	S	S	*	*	H	α-helix	trans	-70.7	-37.1	174.4	-88.6	154.1	0	0	0	112.5	A13 A14	L10-A13 PolarHBondContact O-N 3.23Å; L10-A14 WeakPolarHBondContact O-CB 3.48Å; L10-A14 PolarHBondContact O-N 3.08Å
11	A	56	Low	54.1	Low	63 Å²	63	121.7 Å²	121.7	52%	0.521	69%	0.688	S	S	.	*	H	α-helix	trans	-70.9	-33.9	174.5	0	0	0	0	0	112.8	G7 S15	G7-A11 PolarHBondContact O-N 3.08Å; A11-S15 PolarHBondContact O-N 3.31Å; A11-S15 VanDerWaalsContact O-N 3.15Å; A11-S15 PolarHBondContact O-OG 3.15Å
12	L	55.6	Low	55.2	Low	90 Å²	90	117.1 Å²	117.1	47%	0.471	66%	0.664	S	S	.	*	H	α-helix	trans	-70.8	-35.6	172.4	-82.2	159.1	0	0	0	112.4	V8 S15 L16	V8-L12 HydrophobicContact CG1-CD1 4.01Å; V8-L12 WeakPolarHBondContact O-CB 3.36Å; V8-L12 PolarHBondContact O-N 3.13Å; V8-L12 VanDerWaalsContact O-N 3.07Å; L12-S15 WeakPolarHBondContact CA-OG 3.47Å; L12-S15 PolarHBondContact O-OG 3.19Å; L12-S15 VanDerWaalsContact O-OG 3.11Å; L12-L16 WeakPolarHBondContact O-CD1 3.4Å; L12-L16 PolarHBondContact O-N 3.37Å
13	A	56	Low	56.6	Low	58 Å²	58	107.6 Å²	107.6	48%	0.479	64%	0.643	S	S	.	*	H	α-helix	trans	-69.2	-34.6	173.3	0	0	0	0	0	112.7	W9 L10 L16 L17	W9-A13 WeakPolarHBondContact O-CB 3.39Å; W9-A13 PolarHBondContact O-N 3.13Å; L10-A13 PolarHBondContact O-N 3.23Å; A13-L16 PolarHBondContact O-N 3.42Å; A13-L17 PolarHBondContact O-N 3.13Å
14	A	55	Low	58.4	Low	62 Å²	62	107 Å²	107	51%	0.512	63%	0.626	S	S	.	*	H	α-helix	trans	-73	-29.3	176.9	0	0	0	0	0	113.6	L10 L16	L10-A14 WeakPolarHBondContact O-CB 3.48Å; L10-A14 PolarHBondContact O-N 3.08Å; A14-L16 VanDerWaalsContact C-N 3.33Å
15	S	55.2	Low	60.1	Low	87 Å²	87	105.5 Å²	105.5	61%	0.608	61%	0.606	S	S	*	*	H	α-helix	trans	-80.6	-13.3	174.8	43.4	0	0	0	0	113.7	A11 L12	A11-S15 PolarHBondContact O-N 3.31Å; A11-S15 VanDerWaalsContact O-N 3.15Å; A11-S15 PolarHBondContact O-OG 3.15Å; L12-S15 WeakPolarHBondContact CA-OG 3.47Å; L12-S15 PolarHBondContact O-OG 3.19Å; L12-S15 VanDerWaalsContact O-OG 3.11Å
16	L	54	Low	61.8	Low	141 Å²	141	101.6 Å²	101.6	74%	0.738	59%	0.588	S	S	*	*	S	Bend	trans	-93.6	-4.5	172	-76.7	163.8	0	0	0	113.6	L12 A13 A14 H18	L12-L16 WeakPolarHBondContact O-CD1 3.4Å; L12-L16 PolarHBondContact O-N 3.37Å; A13-L16 PolarHBondContact O-N 3.42Å; A14-L16 VanDerWaalsContact C-N 3.33Å; L16-H18 PolarHBondContact O-N 3.38Å
17	L	53	Low	63.5	Low	131 Å²	131	106.6 Å²	106.6	69%	0.686	59%	0.589	S	S	*	*			trans	-73.9	75.7	165.7	-85.3	155.5	0	0	0	108.4	A13 V19	A13-L17 PolarHBondContact O-N 3.13Å; L17-V19 PolarHBondContact O-N 2.87Å
18	H	56.3	Low	65.2	Low	181 Å²	181	109.2 Å²	109.2	84%	0.838	59%	0.585	S	S	*	*			trans	-55.6	98.7	155.2	-108.9	-76.2	0	0	0	106.2	L16 S20	L16-H18 PolarHBondContact O-N 3.38Å; H18-S20 PolarHBondContact O-N 2.7Å
19	V	57.9	Low	66.8	Low	119 Å²	119	105.1 Å²	105.1	72%	0.721	56%	0.561	S	S	*	*			trans	-52.6	111.3	166.2	176.3	0	0	0	0	104.9	L17 L21	L17-V19 PolarHBondContact O-N 2.87Å; V19-L21 PolarHBondContact O-N 2.9Å
20	S	59.6	Low	68.6	Low	85 Å²	85	98.7 Å²	98.7	59%	0.594	54%	0.536	S	S	*	.			trans	-60.1	109.4	176.2	178.9	0	0	0	0	106.7	H18 Q22	H18-S20 PolarHBondContact O-N 2.7Å; S20-Q22 PolarHBondContact O-N 2.97Å; S20-Q22 WeakPolarHBondContact OG-CG 3.43Å
21	L	59.6	Low	70.2	Confident	125 Å²	125	99.7 Å²	99.7	65%	0.654	54%	0.535	S	S	*	.			trans	-67.7	77	165.1	-90.8	121.4	0	0	0	107.1	V19 G23 F25	V19-L21 PolarHBondContact O-N 2.9Å; L21-G23 PolarHBondContact O-N 3.43Å; L21-F25 HydrophobicContact CD2-CE2 4.27Å
22	Q	68.1	Low	71.9	Confident	142 Å²	142	101.6 Å²	101.6	66%	0.664	53%	0.533	S	S	*	.			trans	-65.5	100	178.4	-70	179.8	-4	0	0	109.2	S20 E24	S20-Q22 PolarHBondContact O-N 2.97Å; S20-Q22 WeakPolarHBondContact OG-CG 3.43Å; Q22-E24 WeakPolarHBondContact O-CA 3.42Å; Q22-E24 PolarHBondContact O-N 2.83Å
23	G	76.7	Confident	73.5	Confident	47 Å²	47	98.4 Å²	98.4	49%	0.485	52%	0.517	S	S	.	.	S	Bend	trans	42.1	26.8	161.6	0	0	0	0	0	118	L21 F25 Q26 R27	L21-G23 PolarHBondContact O-N 3.43Å; G23-F25 PolarHBondContact O-N 3.42Å; G23-Q26 PolarHBondContact O-N 3.43Å; G23-R27 PolarHBondContact O-N 3.46Å; G23-R27 VanDerWaalsContact O-N 3.14Å
24	E	84.3	Confident	75.1	Confident	124 Å²	124	98.7 Å²	98.7	58%	0.579	51%	0.512	S	S	*	.	H	α-helix	trans	-66.3	-43.2	-166.3	-174.8	-178.7	171.2	0	0	110.9	Q22 Q26 R27 K28	Q22-E24 WeakPolarHBondContact O-CA 3.42Å; Q22-E24 PolarHBondContact O-N 2.83Å; E24-Q26 PolarHBondContact O-N 2.8Å; E24-R27 PolarHBondContact O-N 2.75Å; E24-K28 WeakPolarHBondContact O-CB 3.47Å; E24-K28 PolarHBondContact O-N 3.37Å
25	F	87	Confident	76.7	Confident	77 Å²	77	103.7 Å²	103.7	34%	0.338	52%	0.523	S	S	.	.	H	α-helix	trans	-60.2	-44.5	177.9	-62.8	-63.7	0	0	0	112.3	L21 G23 K28 L29 Y94 P95 V97	L21-F25 HydrophobicContact CD2-CE2 4.27Å; G23-F25 PolarHBondContact O-N 3.42Å; F25-K28 PolarHBondContact O-N 3.39Å; F25-L29 WeakPolarHBondContact O-CB 3.3Å; F25-L29 PolarHBondContact O-N 3.21Å; F25-Y94 HydrophobicContact CB-CD1 4.08Å; F25-Y94 HydrophobicContact CD1-CD1 4.4Å; F25-Y94 WeakPolarHBondContact O-CD1 3.37Å; F25-P95 HydrophobicContact CD1-CG 4.47Å; F25-P95 HydrophobicContact CD2-CG 4.16Å; F25-P95 HydrophobicContact CE1-CG 4.19Å; F25-P95 HydrophobicContact CE2-CG 3.85Å; F25-P95 HydrophobicContact CG-CG 4.46Å; F25-P95 HydrophobicContact CZ-CG 3.88Å; F25-V97 HydrophobicContact CB-CG2 4.05Å
26	Q	88	Confident	78.2	Confident	81 Å²	81	106.4 Å²	106.4	38%	0.379	53%	0.53	S	S	.	.	H	α-helix	trans	-65.6	-42.8	179	-173.2	175.5	-6.9	0	0	111	G23 E24 K28 L29 Y30 V97	G23-Q26 PolarHBondContact O-N 3.43Å; E24-Q26 PolarHBondContact O-N 2.8Å; Q26-K28 PolarHBondContact O-N 2.88Å; Q26-L29 PolarHBondContact O-N 2.6Å; Q26-Y30 HydrophobicContact CG-CD2 3.99Å; Q26-Y30 HydrophobicContact CG-CE2 3.69Å; Q26-Y30 WeakPolarHBondContact O-CD2 3.45Å; Q26-Y30 PolarHBondContact O-N 3.05Å; Q26-V97 HydrophobicContact CB-CG2 4.1Å; Q26-V97 HydrophobicContact CG-CG1 4.5Å
27	R	88.6	Confident	80.1	Confident	159 Å²	159	100.9 Å²	100.9	60%	0.6	50%	0.5	S	S	*	.	H	α-helix	trans	-63.3	-41.6	177.3	-173.6	-177	-61.6	165.3	3.4	112.3	G23 E24 K31	G23-R27 PolarHBondContact O-N 3.46Å; G23-R27 VanDerWaalsContact O-N 3.14Å; E24-R27 PolarHBondContact O-N 2.75Å; R27-K31 PolarHBondContact O-N 3.22Å
28	K	90.3	Very high	82	Confident	110 Å²	110	98.2 Å²	98.2	48%	0.478	49%	0.486	S	S	.	.	H	α-helix	trans	-63.3	-47	176.5	-175.6	-178.9	171.3	-168.3	0	110.6	E24 F25 Q26 Y30 K31 E32 Y94	E24-K28 WeakPolarHBondContact O-CB 3.47Å; E24-K28 PolarHBondContact O-N 3.37Å; F25-K28 PolarHBondContact O-N 3.39Å; Q26-K28 PolarHBondContact O-N 2.88Å; K28-Y30 PolarHBondContact O-N 3.06Å; K28-K31 PolarHBondContact O-N 3.05Å; K28-K31 VanDerWaalsContact O-N 3.14Å; K28-E32 WeakPolarHBondContact CE-OE1 3.42Å; K28-E32 IonicContact NZ-OE1 3.08Å; K28-E32 PolarHBondContact O-N 2.71Å; K28-E32 VanDerWaalsContact O-N 3.09Å; K28-Y94 HydrophobicContact CB-CE1 4.17Å; K28-Y94 HydrophobicContact CD-CE1 4.04Å; K28-Y94 HydrophobicContact CG-CE1 4.09Å
29	L	91.7	Very high	83.6	Confident	2 Å²	2	91.8 Å²	91.8	1%	0.01	46%	0.46	C	S	.	.	H	α-helix	trans	-57.9	-46.7	179	-178.6	64.2	0	0	0	112.3	F25 Q26 K31 E32 L33 W89 Y94 V97 V100	F25-L29 WeakPolarHBondContact O-CB 3.3Å; F25-L29 PolarHBondContact O-N 3.21Å; Q26-L29 PolarHBondContact O-N 2.6Å; L29-K31 VanDerWaalsContact C-N 3.3Å; L29-K31 PolarHBondContact O-N 3.24Å; L29-E32 PolarHBondContact O-N 2.95Å; L29-E32 VanDerWaalsContact O-N 3.15Å; L29-L33 HydrophobicContact CD1-CD1 3.82Å; L29-L33 HydrophobicContact CD1-CD2 4.35Å; L29-L33 HydrophobicContact CD1-CG 3.85Å; L29-L33 HydrophobicContact CD2-CD1 4.31Å; L29-L33 HydrophobicContact CG-CD1 3.74Å; L29-L33 HydrophobicContact CG-CG 4.16Å; L29-L33 WeakPolarHBondContact O-CG 3.09Å; L29-L33 PolarHBondContact O-N 3.04Å; L29-W89 HydrophobicContact CD1-CB 3.78Å; L29-W89 HydrophobicContact CD1-CD2 4.09Å; L29-W89 HydrophobicContact CD1-CG 3.71Å; L29-W89 HydrophobicContact CD2-CD2 3.82Å; L29-W89 HydrophobicContact CD2-CE3 4.45Å; L29-W89 HydrophobicContact CD2-CG 4.01Å; L29-W89 HydrophobicContact CD2-CZ2 4.12Å; L29-Y94 HydrophobicContact CB-CD1 3.98Å; L29-Y94 HydrophobicContact CB-CE1 3.98Å; L29-Y94 HydrophobicContact CB-CG 4.39Å; L29-Y94 HydrophobicContact CD1-CD2 3.97Å; L29-Y94 HydrophobicContact CD1-CE2 3.87Å; L29-Y94 HydrophobicContact CD1-CG 4.35Å; L29-V97 HydrophobicContact CD2-CG1 3.71Å; L29-V100 HydrophobicContact CD2-CG1 3.86Å
30	Y	91.1	Very high	85.2	Confident	57 Å²	57	93 Å²	93	22%	0.224	46%	0.463	C	S	.	.	H	α-helix	trans	-57.6	-42.4	176.3	-86.5	-72.5	0	0	0	112.8	Q26 K28 E32 V34 V100 R101 F102	Q26-Y30 HydrophobicContact CG-CD2 3.99Å; Q26-Y30 HydrophobicContact CG-CE2 3.69Å; Q26-Y30 WeakPolarHBondContact O-CD2 3.45Å; Q26-Y30 PolarHBondContact O-N 3.05Å; K28-Y30 PolarHBondContact O-N 3.06Å; Y30-E32 VanDerWaalsContact C-N 3.3Å; Y30-E32 PolarHBondContact O-N 3.12Å; Y30-V34 WeakPolarHBondContact O-CB 3.4Å; Y30-V34 VanDerWaalsContact O-CG2 3.29Å; Y30-V34 WeakPolarHBondContact O-CG2 3.38Å; Y30-V34 PolarHBondContact O-N 2.71Å; Y30-V34 VanDerWaalsContact O-N 3.13Å; Y30-V100 HydrophobicContact CE1-CB 4.44Å; Y30-V100 HydrophobicContact CE2-CB 4.46Å; Y30-V100 HydrophobicContact CE2-CG1 4.49Å; Y30-R101 WeakPolarHBondContact CE1-O 3.41Å; Y30-R101 PolarHBondContact OH-N 3.07Å; Y30-R101 PolarHBondContact OH-O 3.1Å; Y30-F102 HydrophobicContact CD1-CD1 4.22Å; Y30-F102 AromaticContact CD1-CE1 3.57Å; Y30-F102 HydrophobicContact CD1-CE1 3.57Å; Y30-F102 HydrophobicContact CD1-CZ 4.01Å; Y30-F102 AromaticContact CE1-CD1 3.86Å; Y30-F102 HydrophobicContact CE1-CD1 3.86Å; Y30-F102 AromaticContact CE1-CE1 3.57Å; Y30-F102 HydrophobicContact CE1-CE1 3.57Å; Y30-F102 HydrophobicContact CE1-CE2 4.47Å; Y30-F102 HydrophobicContact CE1-CG 4.43Å; Y30-F102 AromaticContact CE1-CZ 3.9Å; Y30-F102 HydrophobicContact CE1-CZ 3.9Å
31	K	90.3	Very high	86.7	Confident	153 Å²	153	92 Å²	92	67%	0.665	45%	0.448	S	S	*	.	H	α-helix	trans	-65.5	-34.5	179.1	-72.6	-177.7	177.9	-174.8	0	112.2	R27 K28 L29 K35	R27-K31 PolarHBondContact O-N 3.22Å; K28-K31 PolarHBondContact O-N 3.05Å; K28-K31 VanDerWaalsContact O-N 3.14Å; L29-K31 VanDerWaalsContact C-N 3.3Å; L29-K31 PolarHBondContact O-N 3.24Å; K31-K35 WeakPolarHBondContact O-CB 3.45Å
32	E	91.2	Very high	88.3	Confident	102 Å²	102	87.9 Å²	87.9	48%	0.477	42%	0.424	S	S	.	.	H	α-helix	trans	-74.8	-48.4	178.4	-71.9	-174.4	-173.2	0	0	111.6	K28 L29 Y30 V34 K35 Y94	K28-E32 WeakPolarHBondContact CE-OE1 3.42Å; K28-E32 IonicContact NZ-OE1 3.08Å; K28-E32 PolarHBondContact O-N 2.71Å; K28-E32 VanDerWaalsContact O-N 3.09Å; L29-E32 PolarHBondContact O-N 2.95Å; L29-E32 VanDerWaalsContact O-N 3.15Å; Y30-E32 VanDerWaalsContact C-N 3.3Å; Y30-E32 PolarHBondContact O-N 3.12Å; E32-V34 VanDerWaalsContact C-N 3.35Å; E32-V34 PolarHBondContact O-N 2.8Å; E32-K35 PolarHBondContact O-N 2.89Å; E32-Y94 PolarHBondContact OE1-OH 3Å; E32-Y94 PolarHBondContact OE2-OH 2.83Å
33	L	90.7	Very high	89.5	Confident	23 Å²	23	81.2 Å²	81.2	12%	0.12	39%	0.393	C	S	.	.	H	α-helix	trans	-62.6	-39.5	-178.1	-69.3	177.6	0	0	0	112.6	L29 Y37 L87 W89 F102	L29-L33 HydrophobicContact CD1-CD1 3.82Å; L29-L33 HydrophobicContact CD1-CD2 4.35Å; L29-L33 HydrophobicContact CD1-CG 3.85Å; L29-L33 HydrophobicContact CD2-CD1 4.31Å; L29-L33 HydrophobicContact CG-CD1 3.74Å; L29-L33 HydrophobicContact CG-CG 4.16Å; L29-L33 WeakPolarHBondContact O-CG 3.09Å; L29-L33 PolarHBondContact O-N 3.04Å; L33-Y37 WeakPolarHBondContact O-CB 3.49Å; L33-L87 HydrophobicContact CB-CD2 4.32Å; L33-W89 HydrophobicContact CD1-CE3 3.95Å; L33-W89 HydrophobicContact CD1-CZ3 4.19Å; L33-W89 HydrophobicContact CD2-CE3 4.49Å; L33-F102 HydrophobicContact CB-CZ 4.47Å; L33-F102 HydrophobicContact CD1-CZ 4.06Å
34	V	89.1	Confident	90.3	Very high	64 Å²	64	79.5 Å²	79.5	39%	0.388	37%	0.373	S	S	.	.	H	α-helix	trans	-82.9	-15.4	-175.9	179.7	0	0	0	0	112.7	Y30 E32 N36 Y37 F102	Y30-V34 WeakPolarHBondContact O-CB 3.4Å; Y30-V34 VanDerWaalsContact O-CG2 3.29Å; Y30-V34 WeakPolarHBondContact O-CG2 3.38Å; Y30-V34 PolarHBondContact O-N 2.71Å; Y30-V34 VanDerWaalsContact O-N 3.13Å; E32-V34 VanDerWaalsContact C-N 3.35Å; E32-V34 PolarHBondContact O-N 2.8Å; V34-N36 VanDerWaalsContact C-N 3.29Å; V34-N36 PolarHBondContact O-N 3.05Å; V34-N36 VanDerWaalsContact O-N 3.17Å; V34-Y37 PolarHBondContact O-N 2.83Å; V34-F102 HydrophobicContact CG2-CE1 3.85Å
35	K	88.4	Confident	90.7	Very high	167 Å²	167	77.1 Å²	77.1	73%	0.726	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-37.6	-169.9	-171.9	177.8	174.7	-174.3	0	114.1	K31 E32	K31-K35 WeakPolarHBondContact O-CB 3.45Å; E32-K35 PolarHBondContact O-N 2.89Å
36	N	87.4	Confident	91	Very high	145 Å²	145	77.1 Å²	77.1	78%	0.775	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126	12.4	-175.3	-65.7	-23.1	0	0	0	112.9	V34	V34-N36 VanDerWaalsContact C-N 3.29Å; V34-N36 PolarHBondContact O-N 3.05Å; V34-N36 VanDerWaalsContact O-N 3.17Å
37	Y	93	Very high	91.1	Very high	25 Å²	25	79.4 Å²	79.4	10%	0.098	39%	0.393	C	S	.	.			trans	-85.6	127.7	-175.7	-171.8	-83	0	0	0	110.4	L33 V34 P39 D84 L87 I107 W108	L33-Y37 WeakPolarHBondContact O-CB 3.49Å; V34-Y37 PolarHBondContact O-N 2.83Å; Y37-P39 HydrophobicContact CD1-CG 4.36Å; Y37-P39 HydrophobicContact CE1-CG 4.48Å; Y37-D84 WeakPolarHBondContact CE2-OD2 3.48Å; Y37-D84 PolarHBondContact OH-OD2 2.78Å; Y37-L87 HydrophobicContact CD2-CD2 3.78Å; Y37-L87 HydrophobicContact CD2-CG 4.17Å; Y37-L87 HydrophobicContact CE2-CD1 4.08Å; Y37-L87 HydrophobicContact CE2-CD2 3.82Å; Y37-L87 HydrophobicContact CE2-CG 3.7Å; Y37-I107 HydrophobicContact CE1-CB 3.92Å; Y37-I107 HydrophobicContact CE1-CG2 4.14Å; Y37-W108 WeakPolarHBondContact OH-CB 3.48Å; Y37-W108 PolarHBondContact OH-N 2.72Å
38	N	92	Very high	91.2	Very high	74 Å²	74	76.2 Å²	76.2	40%	0.396	40%	0.395	S	S	.	.			trans	-106.2	112.3	174.5	-176.1	-1.8	0	0	0	110.8	L40 E41	N38-L40 PolarHBondContact O-N 2.78Å; N38-L40 PolarHBondContact OD1-N 2.83Å; N38-L40 VanDerWaalsContact OD1-N 3.17Å; N38-E41 HydrophobicContact CB-CB 4.36Å; N38-E41 HydrophobicContact CB-CG 4.25Å; N38-E41 PolarHBondContact N-OE1 2.62Å; N38-E41 VanDerWaalsContact O-CG 3.26Å; N38-E41 WeakPolarHBondContact O-CG 3.45Å; N38-E41 PolarHBondContact O-N 2.88Å
39	P	91.2	Very high	91.3	Very high	46 Å²	46	76.2 Å²	76.2	30%	0.299	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-15.9	-178.7	-22.5	33.7	0	0	0	115.6	Y37 W108	Y37-P39 HydrophobicContact CD1-CG 4.36Å; Y37-P39 HydrophobicContact CE1-CG 4.48Å; P39-W108 WeakPolarHBondContact O-CA 3.26Å; P39-W108 WeakPolarHBondContact O-CB 3.44Å; P39-W108 VanDerWaalsContact O-CD1 3.31Å
40	L	90.4	Very high	91.4	Very high	146 Å²	146	79 Å²	79	76%	0.764	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-16.6	178.2	-58	177.5	0	0	0	112.7	N38	N38-L40 PolarHBondContact O-N 2.78Å; N38-L40 PolarHBondContact OD1-N 2.83Å; N38-L40 VanDerWaalsContact OD1-N 3.17Å
41	E	91.1	Very high	91.6	Very high	64 Å²	64	76.8 Å²	76.8	30%	0.299	41%	0.407	S	S	.	.	S	Bend	trans	-85.9	135.5	-178.1	87.4	-158.8	144.4	0	0	110.8	N38 Y86	N38-E41 HydrophobicContact CB-CB 4.36Å; N38-E41 HydrophobicContact CB-CG 4.25Å; N38-E41 PolarHBondContact N-OE1 2.62Å; N38-E41 VanDerWaalsContact O-CG 3.26Å; N38-E41 WeakPolarHBondContact O-CG 3.45Å; N38-E41 PolarHBondContact O-N 2.88Å; E41-Y86 HydrophobicContact CG-CE2 4.12Å
42	R	93.4	Very high	91.9	Very high	37 Å²	37	72 Å²	72	14%	0.14	39%	0.39	C	S	.	.			trans	-72.2	128.4	177.4	-173.5	174.5	46.7	103.8	12.8	108.5	V44 D47 Q49 L51 W108 S177	R42-V44 HydrophobicContact CG-CG1 4.31Å; R42-V44 PolarHBondContact O-N 3.49Å; R42-D47 PolarHBondContact NH2-O 3.35Å; R42-Q49 PolarHBondContact NH1-O 3.33Å; R42-L51 HydrophobicContact CG-CB 4.32Å; R42-L51 HydrophobicContact CG-CD2 4.45Å; R42-W108 HydrophobicContact CG-CZ2 4.26Å; R42-S177 WeakPolarHBondContact CD-O 3.34Å; R42-S177 PolarHBondContact NH1-O 3.22Å
43	P	94.2	Very high	92.2	Very high	2 Å²	2	67.1 Å²	67.1	1%	0.013	37%	0.368	C	S	.	.			trans	-82.9	62.2	-166.9	33.6	-38.8	0	0	0	113.2	L51 D84 H85 Y86 W108	P43-L51 HydrophobicContact CG-CD2 4.23Å; P43-D84 HydrophobicContact CB-CB 3.97Å; P43-D84 VanDerWaalsContact CB-OD1 3.32Å; P43-D84 WeakPolarHBondContact CB-OD1 3.46Å; P43-D84 VanDerWaalsContact CB-OD2 3.29Å; P43-D84 WeakPolarHBondContact CB-OD2 3.26Å; P43-D84 HydrophobicContact CG-CB 4.29Å; P43-H85 PolarHBondContact O-N 2.83Å; P43-Y86 HydrophobicContact CB-CD2 4.14Å; P43-W108 HydrophobicContact CG-CD2 4.04Å; P43-W108 HydrophobicContact CG-CE3 3.68Å; P43-W108 HydrophobicContact CG-CG 4.41Å; P43-W108 HydrophobicContact CG-CZ3 4.26Å
44	V	93.9	Very high	92.5	Very high	11 Å²	11	71.1 Å²	71.1	7%	0.067	38%	0.382	C	S	.	.			trans	-110.6	148.4	178.3	-68.2	0	0	0	0	111.2	R42 N46 L51 Y86	R42-V44 HydrophobicContact CG-CG1 4.31Å; R42-V44 PolarHBondContact O-N 3.49Å; V44-N46 VanDerWaalsContact C-N 3.32Å; V44-N46 WeakPolarHBondContact CG2-O 3.42Å; V44-L51 HydrophobicContact CG1-CB 3.98Å; V44-L51 HydrophobicContact CG1-CD1 4.12Å; V44-Y86 PolarHBondContact O-OH 3.17Å
45	A	90.8	Very high	92.9	Very high	74 Å²	74	68 Å²	68	61%	0.612	36%	0.363	S	S	*	.	S	Bend	trans	-72.5	-27.6	174.6	0	0	0	0	0	112.7
46	N	93.3	Very high	93.3	Very high	78 Å²	78	60.2 Å²	60.2	42%	0.417	33%	0.33	S	S	.	.	S	Bend	trans	-135.8	126.6	177.1	-178.6	-3.3	0	0	0	109.2	V44 S48 Q49	V44-N46 VanDerWaalsContact C-N 3.32Å; V44-N46 WeakPolarHBondContact CG2-O 3.42Å; N46-S48 PolarHBondContact ND2-OG 2.8Å; N46-S48 VanDerWaalsContact ND2-OG 3.08Å; N46-S48 PolarHBondContact O-N 2.84Å; N46-S48 VanDerWaalsContact O-N 3.13Å; N46-S48 PolarHBondContact OD1-N 3.39Å; N46-S48 VanDerWaalsContact OD1-N 3.13Å; N46-S48 PolarHBondContact OD1-OG 3.13Å; N46-Q49 HydrophobicContact CB-CG 4.35Å; N46-Q49 PolarHBondContact O-N 2.79Å; N46-Q49 VanDerWaalsContact O-N 3.08Å
47	D	90	Very high	93.7	Very high	128 Å²	128	53.4 Å²	53.4	68%	0.684	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-27.5	-178.6	-67.9	-44.5	0	0	0	113.4	R42 Q49	R42-D47 PolarHBondContact NH2-O 3.35Å; D47-Q49 VanDerWaalsContact C-N 3.27Å; D47-Q49 PolarHBondContact O-N 2.82Å
48	S	91.3	Very high	93.8	Very high	92 Å²	92	53 Å²	53	64%	0.643	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-11.1	-179.8	76.7	0	0	0	0	114.4	N46	N46-S48 PolarHBondContact ND2-OG 2.8Å; N46-S48 VanDerWaalsContact ND2-OG 3.08Å; N46-S48 PolarHBondContact O-N 2.84Å; N46-S48 VanDerWaalsContact O-N 3.13Å; N46-S48 PolarHBondContact OD1-N 3.39Å; N46-S48 VanDerWaalsContact OD1-N 3.13Å; N46-S48 PolarHBondContact OD1-OG 3.13Å
49	Q	93.3	Very high	94	Very high	111 Å²	111	49.6 Å²	49.6	52%	0.519	28%	0.276	S	S	.	.	S	Bend	trans	-96.8	138.9	-179.4	-67.9	-178.3	-7.7	0	0	110.5	R42 N46 D47	R42-Q49 PolarHBondContact NH1-O 3.33Å; N46-Q49 HydrophobicContact CB-CG 4.35Å; N46-Q49 PolarHBondContact O-N 2.79Å; N46-Q49 VanDerWaalsContact O-N 3.08Å; D47-Q49 VanDerWaalsContact C-N 3.27Å; D47-Q49 PolarHBondContact O-N 2.82Å
50	P	94	Very high	94.1	Very high	60 Å²	60	48.9 Å²	48.9	39%	0.39	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-71.4	148.6	172.9	29.7	-33.7	0	0	0	110.8	S177 D179	P50-S177 WeakPolarHBondContact CA-O 3.29Å; P50-D179 HydrophobicContact CB-CB 4.4Å
51	L	95.3	Very high	94.4	Very high	11 Å²	11	45 Å²	45	6%	0.058	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	121.2	169.4	-177.5	73.4	0	0	0	109.1	R42 P43 V44 V53 W108 S177 L178 D179	R42-L51 HydrophobicContact CG-CB 4.32Å; R42-L51 HydrophobicContact CG-CD2 4.45Å; P43-L51 HydrophobicContact CG-CD2 4.23Å; V44-L51 HydrophobicContact CG1-CB 3.98Å; V44-L51 HydrophobicContact CG1-CD1 4.12Å; L51-V53 HydrophobicContact CD2-CG2 4.23Å; L51-V53 HydrophobicContact CG-CG2 4.42Å; L51-W108 HydrophobicContact CD2-CE3 4.16Å; L51-W108 HydrophobicContact CD2-CH2 3.19Å; L51-W108 HydrophobicContact CD2-CZ2 4.07Å; L51-W108 HydrophobicContact CD2-CZ3 3.23Å; L51-S177 PolarHBondContact N-O 3.4Å; L51-L178 WeakPolarHBondContact O-CA 3.43Å; L51-D179 PolarHBondContact O-N 2.92Å
52	T	96.1	Very high	94.6	Very high	51 Å²	51	42 Å²	42	31%	0.313	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	120.4	174.3	-52.5	0	0	0	0	110.5	Y54 D179 Q181	T52-Y54 HydrophobicContact CG2-CE2 4.14Å; T52-D179 WeakPolarHBondContact CA-O 3.32Å; T52-Q181 HydrophobicContact CG2-CB 4.32Å; T52-Q181 HydrophobicContact CG2-CG 3.58Å
53	V	97.3	Very high	94.6	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	118.8	174.5	-179.5	0	0	0	0	108.3	L51 W82 P110 L178 D179 L180 Q181	L51-V53 HydrophobicContact CD2-CG2 4.23Å; L51-V53 HydrophobicContact CG-CG2 4.42Å; V53-W82 HydrophobicContact CG2-CB 4.28Å; V53-P110 HydrophobicContact CG1-CG 4.16Å; V53-P110 HydrophobicContact CG2-CB 4.23Å; V53-P110 HydrophobicContact CG2-CG 4.43Å; V53-L178 HydrophobicContact CG2-CD1 4.09Å; V53-L178 HydrophobicContact CG2-CD2 4.31Å; V53-L178 HydrophobicContact CG2-CG 4.05Å; V53-D179 PolarHBondContact N-O 2.89Å; V53-L180 HydrophobicContact CB-CD1 4.25Å; V53-L180 HydrophobicContact CG1-CD1 4.21Å; V53-Q181 PolarHBondContact O-N 2.91Å
54	Y	97.6	Very high	94.6	Very high	107 Å²	107	48.7 Å²	48.7	42%	0.42	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	129.2	171.6	-62.7	-84.7	0	0	0	109.9	T52 M80 S81 Q181 Q183	T52-Y54 HydrophobicContact CG2-CE2 4.14Å; Y54-M80 WeakPolarHBondContact O-CA 3.44Å; Y54-S81 WeakPolarHBondContact CB-OG 3.37Å; Y54-S81 PolarHBondContact N-O 3.13Å; Y54-S81 PolarHBondContact O-N 2.92Å; Y54-Q181 CarbonylContact C-O 3.57Å; Y54-Q181 WeakPolarHBondContact CA-O 3.21Å; Y54-Q181 HydrophobicContact CD1-CB 3.72Å; Y54-Q181 HydrophobicContact CE1-CB 4Å; Y54-Q181 HydrophobicContact CE1-CG 4.44Å; Y54-Q181 HydrophobicContact CG-CB 4.47Å; Y54-Q183 HydrophobicContact CD1-CG 4.5Å
55	F	97.3	Very high	94.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	127.5	-175.2	-179	-108.5	0	0	0	111	L78 Q79 M80 I112 F168 L180 Q181 Q183 V220 F222	F55-L78 HydrophobicContact CE2-CB 4.33Å; F55-L78 HydrophobicContact CE2-CD1 4.36Å; F55-L78 HydrophobicContact CE2-CD2 4.01Å; F55-L78 HydrophobicContact CE2-CG 4.47Å; F55-L78 HydrophobicContact CZ-CD2 3.92Å; F55-Q79 WeakPolarHBondContact CA-O 3.45Å; F55-M80 HydrophobicContact CD2-CG 3.8Å; F55-M80 HydrophobicContact CE2-CG 4.33Å; F55-I112 HydrophobicContact CD2-CG2 4.27Å; F55-I112 HydrophobicContact CE2-CG2 3.92Å; F55-I112 HydrophobicContact CZ-CG2 4.25Å; F55-F168 HydrophobicContact CE1-CB 3.61Å; F55-F168 AromaticContact CE1-CD2 3.76Å; F55-F168 HydrophobicContact CE1-CD2 3.76Å; F55-F168 AromaticContact CE1-CG 3.75Å; F55-F168 HydrophobicContact CE1-CG 3.75Å; F55-F168 HydrophobicContact CZ-CB 3.7Å; F55-F168 AromaticContact CZ-CD1 3.92Å; F55-F168 HydrophobicContact CZ-CD1 3.92Å; F55-F168 AromaticContact CZ-CD2 3.76Å; F55-F168 HydrophobicContact CZ-CD2 3.76Å; F55-F168 HydrophobicContact CZ-CE1 4.48Å; F55-F168 HydrophobicContact CZ-CE2 4.33Å; F55-F168 AromaticContact CZ-CG 3.51Å; F55-F168 HydrophobicContact CZ-CG 3.51Å; F55-L180 HydrophobicContact CB-CD1 3.65Å; F55-L180 HydrophobicContact CB-CG 4.35Å; F55-L180 HydrophobicContact CG-CD1 4.31Å; F55-Q181 PolarHBondContact N-O 3.27Å; F55-Q183 PolarHBondContact O-N 3.45Å; F55-V220 HydrophobicContact CD1-CB 4.11Å; F55-V220 HydrophobicContact CD1-CG1 4.11Å; F55-V220 HydrophobicContact CD1-CG2 4.45Å; F55-V220 HydrophobicContact CE1-CB 4.47Å; F55-V220 HydrophobicContact CE1-CG1 4.44Å; F55-F222 AromaticContact CD1-CE2 3.98Å; F55-F222 HydrophobicContact CD1-CE2 3.98Å; F55-F222 HydrophobicContact CE1-CD2 4.32Å; F55-F222 AromaticContact CE1-CE2 3.68Å; F55-F222 HydrophobicContact CE1-CE2 3.68Å
56	S	96.3	Very high	94.6	Very high	3 Å²	3	47.2 Å²	47.2	2%	0.021	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	166.8	167.7	-174.8	0	0	0	0	109.3	Q79 E184	S56-Q79 PolarHBondContact N-O 3.15Å; S56-Q79 PolarHBondContact O-N 3.09Å; S56-E184 PolarHBondContact OG-O 2.89Å
57	L	95.4	Very high	94.3	Very high	1 Å²	1	45 Å²	45	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	149.7	168.1	70.1	79.4	0	0	0	110.4	L59 I76 W77 L78 F168 A185 D186 I201 F222	L57-L59 HydrophobicContact CD1-CB 4.4Å; L57-I76 HydrophobicContact CB-CG2 3.75Å; L57-I76 HydrophobicContact CD1-CG2 4.35Å; L57-I76 HydrophobicContact CG-CG2 4.46Å; L57-W77 WeakPolarHBondContact CA-O 3.49Å; L57-L78 HydrophobicContact CB-CD2 4.37Å; L57-F168 HydrophobicContact CD2-CE2 3.97Å; L57-A185 HydrophobicContact CD1-CB 3.9Å; L57-A185 HydrophobicContact CG-CB 4.23Å; L57-A185 CarbonylContact O-C 3.58Å; L57-A185 VanDerWaalsContact O-CA 3.29Å; L57-A185 WeakPolarHBondContact O-CA 3.47Å; L57-D186 PolarHBondContact O-N 3.42Å; L57-I201 HydrophobicContact CD1-CD1 4.4Å; L57-F222 HydrophobicContact CD2-CB 3.74Å; L57-F222 HydrophobicContact CD2-CD1 4.16Å; L57-F222 HydrophobicContact CD2-CD2 3.22Å; L57-F222 HydrophobicContact CD2-CE2 3.75Å; L57-F222 HydrophobicContact CD2-CG 3.44Å; L57-F222 VanDerWaalsContact CD2-CG 3.44Å; L57-F222 HydrophobicContact CD2-CZ 4.42Å; L57-F222 HydrophobicContact CG-CD1 4.28Å; L57-F222 HydrophobicContact CG-CD2 3.91Å; L57-F222 HydrophobicContact CG-CE1 4.37Å; L57-F222 HydrophobicContact CG-CE2 3.97Å; L57-F222 HydrophobicContact CG-CG 4.04Å; L57-F222 HydrophobicContact CG-CZ 4.22Å
58	S	95.9	Very high	94	Very high	17 Å²	17	45.8 Å²	45.8	12%	0.119	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	114.8	168.2	-50.9	0	0	0	0	108.9	L60 I76 W77 D186	S58-L60 PolarHBondContact O-N 3.07Å; S58-I76 WeakPolarHBondContact O-CA 3.21Å; S58-W77 PolarHBondContact N-O 2.85Å; S58-W77 PolarHBondContact O-N 3.11Å; S58-D186 VanDerWaalsContact CA-O 3.27Å; S58-D186 WeakPolarHBondContact CA-O 3Å
59	L	95.9	Very high	93.9	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	113.2	177	-179.4	67.5	0	0	0	109	L57 I62 T74 I76 D186 Y190 L198 I201 V224	L57-L59 HydrophobicContact CD1-CB 4.4Å; L59-I62 HydrophobicContact CD2-CG1 4.18Å; L59-T74 HydrophobicContact CD1-CG2 3.89Å; L59-I76 HydrophobicContact CD1-CD1 4.35Å; L59-I76 HydrophobicContact CD1-CG1 3.77Å; L59-D186 PolarHBondContact N-O 3.42Å; L59-Y190 HydrophobicContact CD2-CD2 4.19Å; L59-Y190 HydrophobicContact CD2-CE2 4.1Å; L59-Y190 HydrophobicContact CG-CD2 4.14Å; L59-Y190 HydrophobicContact CG-CE2 4.36Å; L59-L198 HydrophobicContact CD2-CD1 4.01Å; L59-L198 HydrophobicContact CD2-CD2 4.06Å; L59-I201 HydrophobicContact CB-CD1 3.56Å; L59-I201 HydrophobicContact CD2-CD1 3.58Å; L59-I201 HydrophobicContact CD2-CG1 4.5Å; L59-I201 HydrophobicContact CG-CD1 4.2Å; L59-V224 HydrophobicContact CD2-CG1 4.37Å
60	L	94.3	Very high	93.8	Very high	32 Å²	32	43.9 Å²	43.9	17%	0.168	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-45.2	176.6	-70.1	-174.8	0	0	0	112.1	S58 N75 W77 G189 Y190 I191	S58-L60 PolarHBondContact O-N 3.07Å; L60-N75 HydrophobicContact CB-CB 4.5Å; L60-N75 PolarHBondContact N-O 3.33Å; L60-W77 HydrophobicContact CD1-CD2 4.07Å; L60-W77 VanDerWaalsContact CD1-CE2 3.48Å; L60-W77 HydrophobicContact CD1-CG 4.17Å; L60-W77 HydrophobicContact CD1-CZ2 3.94Å; L60-W77 HydrophobicContact CG-CG 4.49Å; L60-G189 WeakPolarHBondContact CD2-O 3.31Å; L60-Y190 WeakPolarHBondContact O-CA 3.3Å; L60-I191 PolarHBondContact O-N 2.82Å
61	Q	95.2	Very high	93.8	Very high	63 Å²	63	42.4 Å²	42.4	29%	0.294	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	139.4	-174.3	-170.3	176.7	-1.6	0	0	111.4	M63 N75	Q61-M63 HydrophobicContact CB-SD 4.24Å; Q61-M63 HydrophobicContact CG-SD 3.96Å; Q61-M63 PolarHBondContact OE1-SD 3.37Å; Q61-M63 VanDerWaalsContact OE1-SD 3.37Å; Q61-N75 HydrophobicContact CB-CB 4.25Å; Q61-N75 PolarHBondContact N-O 2.82Å; Q61-N75 PolarHBondContact O-N 2.94Å
62	I	95.7	Very high	93.8	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.005	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	107.3	161.1	-60.3	171.4	0	0	0	105.8	L59 V65 L72 T74 Y190 L198 V224 M226	L59-I62 HydrophobicContact CD2-CG1 4.18Å; I62-V65 HydrophobicContact CG2-CG2 3.9Å; I62-L72 HydrophobicContact CG2-CD1 4.02Å; I62-T74 HydrophobicContact CG1-CG2 4.48Å; I62-Y190 HydrophobicContact CD1-CE2 4.49Å; I62-Y190 HydrophobicContact CG1-CE2 4.2Å; I62-L198 HydrophobicContact CD1-CD1 4.5Å; I62-V224 HydrophobicContact CD1-CG1 4.36Å; I62-M226 HydrophobicContact CD1-CB 4.31Å; I62-M226 HydrophobicContact CD1-SD 4.3Å
63	M	93.5	Very high	93.8	Very high	93 Å²	93	40.4 Å²	40.4	46%	0.458	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-47.9	-173.5	-67.3	-66.9	-59.9	0	0	110.9	Q61 T73 N75	Q61-M63 HydrophobicContact CB-SD 4.24Å; Q61-M63 HydrophobicContact CG-SD 3.96Å; Q61-M63 PolarHBondContact OE1-SD 3.37Å; Q61-M63 VanDerWaalsContact OE1-SD 3.37Å; M63-T73 HydrophobicContact CB-CG2 4.04Å; M63-T73 WeakPolarHBondContact CB-O 3.4Å; M63-T73 PolarHBondContact N-O 3.29Å; M63-N75 HydrophobicContact CG-CB 4.23Å; M63-N75 HydrophobicContact SD-CB 4.4Å
64	D	93.6	Very high	93.7	Very high	88 Å²	88	40.4 Å²	40.4	47%	0.471	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	147.3	-174.6	-170.9	30.5	0	0	0	110.8	T73	D64-T73 PolarHBondContact N-O 3.5Å; D64-T73 PolarHBondContact O-N 3.45Å
65	V	93.2	Very high	93.6	Very high	5 Å²	5	37.2 Å²	37.2	3%	0.03	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	100.7	174.4	-175.6	0	0	0	0	106.8	I62 E67 L72 I152 W196 M226	I62-V65 HydrophobicContact CG2-CG2 3.9Å; V65-E67 HydrophobicContact CG1-CG 4.44Å; V65-E67 PolarHBondContact O-N 2.93Å; V65-L72 HydrophobicContact CG2-CD1 3.77Å; V65-I152 HydrophobicContact CG1-CD1 4.13Å; V65-W196 HydrophobicContact CB-CZ2 4.14Å; V65-W196 HydrophobicContact CG1-CZ2 4Å; V65-W196 HydrophobicContact CG2-CD2 4.41Å; V65-W196 HydrophobicContact CG2-CG 4.43Å; V65-W196 HydrophobicContact CG2-CZ2 4.36Å; V65-M226 HydrophobicContact CB-CE 4.36Å; V65-M226 HydrophobicContact CG1-CE 3.69Å; V65-M226 HydrophobicContact CG2-CE 3.69Å; V65-M226 HydrophobicContact CG2-SD 3.99Å
66	D	91.8	Very high	93.5	Very high	49 Å²	49	37.2 Å²	37.2	26%	0.262	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	96.6	177.7	-172.4	-28.4	0	0	0	108.7	K68 N69 Q70 V71	D66-K68 VanDerWaalsContact C-N 3.27Å; D66-K68 PolarHBondContact O-N 3.14Å; D66-K68 WeakPolarHBondContact OD1-CB 3.45Å; D66-K68 PolarHBondContact OD1-N 2.92Å; D66-K68 VanDerWaalsContact OD1-N 3.14Å; D66-N69 HydrophobicContact CB-CB 4.45Å; D66-N69 PolarHBondContact OD1-N 3.49Å; D66-N69 PolarHBondContact OD2-ND2 3.39Å; D66-Q70 WeakPolarHBondContact O-CA 3.42Å; D66-Q70 PolarHBondContact O-N 2.9Å; D66-V71 HydrophobicContact CB-CB 4.43Å; D66-V71 PolarHBondContact N-O 3.46Å; D66-V71 PolarHBondContact O-N 3.33Å
67	E	87.6	Confident	93.5	Very high	31 Å²	31	42.8 Å²	42.8	15%	0.145	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-30.9	-178.7	-57.2	96.5	152.7	0	0	112.3	V65 I152 R228 P284	V65-E67 HydrophobicContact CG1-CG 4.44Å; V65-E67 PolarHBondContact O-N 2.93Å; E67-I152 HydrophobicContact CB-CG2 4.29Å; E67-I152 HydrophobicContact CG-CG2 4.06Å; E67-R228 IonicContact OE1-CZ 3.3Å; E67-R228 VanDerWaalsContact OE1-CZ 3.24Å; E67-R228 IonicContact OE1-NH1 3.22Å; E67-R228 PolarHBondContact OE1-NH1 2.81Å; E67-R228 IonicContact OE1-NH2 3.62Å; E67-R228 PolarHBondContact OE1-NH2 2.85Å; E67-P284 HydrophobicContact CB-CG 4.45Å; E67-P284 VanDerWaalsContact O-CB 3.29Å; E67-P284 WeakPolarHBondContact O-CB 3.42Å; E67-P284 WeakPolarHBondContact O-CG 3.43Å
68	K	84.8	Confident	93.5	Very high	144 Å²	144	42.8 Å²	42.8	63%	0.626	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-47.2	-179.1	-178.5	178.3	177.6	176.4	0	111.4	D66	D66-K68 VanDerWaalsContact C-N 3.27Å; D66-K68 PolarHBondContact O-N 3.14Å; D66-K68 WeakPolarHBondContact OD1-CB 3.45Å; D66-K68 PolarHBondContact OD1-N 2.92Å; D66-K68 VanDerWaalsContact OD1-N 3.14Å
69	N	88	Confident	93.5	Very high	106 Å²	106	45.1 Å²	45.1	57%	0.567	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91	-3.1	180	-62.8	-46.8	0	0	0	113	D66 V71	D66-N69 HydrophobicContact CB-CB 4.45Å; D66-N69 PolarHBondContact OD1-N 3.49Å; D66-N69 PolarHBondContact OD2-ND2 3.39Å; N69-V71 HydrophobicContact CB-CG2 4.3Å
70	Q	91.3	Very high	93.5	Very high	58 Å²	58	45.3 Å²	45.3	27%	0.271	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	44.5	179.4	-62	-172.1	-25.6	0	0	113	D66 C150	D66-Q70 WeakPolarHBondContact O-CA 3.42Å; D66-Q70 PolarHBondContact O-N 2.9Å; Q70-C150 CarbonylContact C-O 3.6Å; Q70-C150 WeakPolarHBondContact CB-O 3.47Å; Q70-C150 PolarHBondContact O-N 2.8Å
71	V	94.1	Very high	93.6	Very high	28 Å²	28	44.3 Å²	44.3	17%	0.17	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	128.4	-177.1	-179.4	0	0	0	0	111.1	D66 N69 A118 K147 S148	D66-V71 HydrophobicContact CB-CB 4.43Å; D66-V71 PolarHBondContact N-O 3.46Å; D66-V71 PolarHBondContact O-N 3.33Å; N69-V71 HydrophobicContact CB-CG2 4.3Å; V71-A118 HydrophobicContact CG1-CB 4.08Å; V71-A118 HydrophobicContact CG2-CB 3.89Å; V71-K147 HydrophobicContact CG1-CB 4Å; V71-S148 WeakPolarHBondContact CA-O 3.29Å
72	L	95.6	Very high	93.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	123.9	170.2	168.8	68.2	0	0	0	109.6	I62 V65 T74 K147 S148 C150 C164 V224 M226	I62-L72 HydrophobicContact CG2-CD1 4.02Å; V65-L72 HydrophobicContact CG2-CD1 3.77Å; L72-T74 HydrophobicContact CD1-CG2 3.84Å; L72-T74 HydrophobicContact CD2-CG2 3.96Å; L72-T74 HydrophobicContact CG-CG2 3.8Å; L72-K147 WeakPolarHBondContact O-CA 3.48Å; L72-S148 PolarHBondContact N-O 3.1Å; L72-S148 PolarHBondContact O-N 2.86Å; L72-S148 PolarHBondContact O-OG 2.85Å; L72-C150 HydrophobicContact CB-CB 4.22Å; L72-C164 HydrophobicContact CD2-CB 3.41Å; L72-C164 VanDerWaalsContact CD2-CB 3.41Å; L72-V224 HydrophobicContact CD2-CB 4.47Å; L72-M226 HydrophobicContact CD1-CE 4.42Å; L72-M226 HydrophobicContact CD1-SD 4.31Å
73	T	95.4	Very high	93.6	Very high	21 Å²	21	44.8 Å²	44.8	13%	0.129	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	121.4	174.5	-54.4	0	0	0	0	110.7	M63 D64 I145 F146 K147	M63-T73 HydrophobicContact CB-CG2 4.04Å; M63-T73 WeakPolarHBondContact CB-O 3.4Å; M63-T73 PolarHBondContact N-O 3.29Å; D64-T73 PolarHBondContact N-O 3.5Å; D64-T73 PolarHBondContact O-N 3.45Å; T73-I145 HydrophobicContact CG2-CG2 3.71Å; T73-F146 WeakPolarHBondContact CA-O 3.48Å; T73-K147 HydrophobicContact CG2-CG 4.15Å
74	T	95.6	Very high	93.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	140.8	-175.2	47.2	0	0	0	0	112	L59 I62 L72 I76 I145 F146	L59-T74 HydrophobicContact CD1-CG2 3.89Å; I62-T74 HydrophobicContact CG1-CG2 4.48Å; L72-T74 HydrophobicContact CD1-CG2 3.84Å; L72-T74 HydrophobicContact CD2-CG2 3.96Å; L72-T74 HydrophobicContact CG-CG2 3.8Å; T74-I76 VanDerWaalsContact OG1-CD1 3.26Å; T74-I76 WeakPolarHBondContact OG1-CD1 3.4Å; T74-I145 CarbonylContact O-C 3.55Å; T74-I145 WeakPolarHBondContact O-CA 3.44Å; T74-F146 PolarHBondContact N-O 3.17Å; T74-F146 PolarHBondContact O-N 2.91Å; T74-F146 PolarHBondContact OG1-O 2.9Å
75	N	95.1	Very high	93.7	Very high	39 Å²	39	40.4 Å²	40.4	21%	0.209	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	112.5	168.7	-175.3	-1.8	0	0	0	108.8	L60 Q61 M63	L60-N75 HydrophobicContact CB-CB 4.5Å; L60-N75 PolarHBondContact N-O 3.33Å; Q61-N75 HydrophobicContact CB-CB 4.25Å; Q61-N75 PolarHBondContact N-O 2.82Å; Q61-N75 PolarHBondContact O-N 2.94Å; M63-N75 HydrophobicContact CG-CB 4.23Å; M63-N75 HydrophobicContact SD-CB 4.4Å
76	I	95.8	Very high	93.7	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	137.3	-172.5	-58.2	176.3	0	0	0	109	L57 S58 L59 T74 L78 G144 F146 L166	L57-I76 HydrophobicContact CB-CG2 3.75Å; L57-I76 HydrophobicContact CD1-CG2 4.35Å; L57-I76 HydrophobicContact CG-CG2 4.46Å; S58-I76 WeakPolarHBondContact O-CA 3.21Å; L59-I76 HydrophobicContact CD1-CD1 4.35Å; L59-I76 HydrophobicContact CD1-CG1 3.77Å; T74-I76 VanDerWaalsContact OG1-CD1 3.26Å; T74-I76 WeakPolarHBondContact OG1-CD1 3.4Å; I76-L78 HydrophobicContact CG2-CD2 3.99Å; I76-G144 PolarHBondContact N-O 3.44Å; I76-G144 PolarHBondContact O-N 3.34Å; I76-G144 VanDerWaalsContact O-O 3.11Å; I76-F146 HydrophobicContact CB-CD2 3.77Å; I76-F146 HydrophobicContact CB-CE2 3.98Å; I76-F146 HydrophobicContact CD1-CB 4.48Å; I76-F146 HydrophobicContact CD1-CD2 4.12Å; I76-F146 HydrophobicContact CG1-CD2 4.22Å; I76-F146 HydrophobicContact CG2-CE2 4.49Å; I76-L166 HydrophobicContact CD1-CD1 3.53Å
77	W	95.4	Very high	93.8	Very high	121 Å²	121	42.8 Å²	42.8	46%	0.458	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	121.3	163.7	-68.6	8.5	0	0	0	108.3	L57 S58 L60 P143	L57-W77 WeakPolarHBondContact CA-O 3.49Å; S58-W77 PolarHBondContact N-O 2.85Å; S58-W77 PolarHBondContact O-N 3.11Å; L60-W77 HydrophobicContact CD1-CD2 4.07Å; L60-W77 VanDerWaalsContact CD1-CE2 3.48Å; L60-W77 HydrophobicContact CD1-CG 4.17Å; L60-W77 HydrophobicContact CD1-CZ2 3.94Å; L60-W77 HydrophobicContact CG-CG 4.49Å; W77-P143 VanDerWaalsContact CD1-CB 3.43Å; W77-P143 HydrophobicContact CG-CB 4.28Å; W77-P143 VanDerWaalsContact NE1-CB 3.35Å
78	L	95.4	Very high	94	Very high	1 Å²	1	45.5 Å²	45.5	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	139.5	172.2	-59.3	-174.5	0	0	0	108.3	F55 L57 I76 M80 T125 L141 P142 F146 F168	F55-L78 HydrophobicContact CE2-CB 4.33Å; F55-L78 HydrophobicContact CE2-CD1 4.36Å; F55-L78 HydrophobicContact CE2-CD2 4.01Å; F55-L78 HydrophobicContact CE2-CG 4.47Å; F55-L78 HydrophobicContact CZ-CD2 3.92Å; L57-L78 HydrophobicContact CB-CD2 4.37Å; I76-L78 HydrophobicContact CG2-CD2 3.99Å; L78-M80 HydrophobicContact CB-CE 4.05Å; L78-M80 HydrophobicContact CD1-CE 4.31Å; L78-T125 HydrophobicContact CD1-CG2 3.99Å; L78-L141 VanDerWaalsContact O-CA 3.27Å; L78-L141 WeakPolarHBondContact O-CA 3.47Å; L78-P142 HydrophobicContact CB-CG 4.17Å; L78-P142 PolarHBondContact N-O 3.15Å; L78-P142 VanDerWaalsContact N-O 3.1Å; L78-P142 WeakPolarHBondContact O-CD 3.34Å; L78-F146 HydrophobicContact CD1-CE1 4.43Å; L78-F146 HydrophobicContact CD1-CE2 4.45Å; L78-F146 HydrophobicContact CD1-CZ 3.67Å; L78-F146 HydrophobicContact CD2-CE2 4.17Å; L78-F146 HydrophobicContact CD2-CZ 4.06Å; L78-F146 HydrophobicContact CG-CE2 4.13Å; L78-F146 HydrophobicContact CG-CZ 3.84Å; L78-F168 HydrophobicContact CD2-CE1 4.04Å; L78-F168 HydrophobicContact CD2-CZ 4.03Å
79	Q	95.5	Very high	94.4	Very high	65 Å²	65	39.8 Å²	39.8	30%	0.304	19%	0.19	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	108.9	173.5	-179.5	175.3	-22.3	0	0	108.4	F55 S56 L141	F55-Q79 WeakPolarHBondContact CA-O 3.45Å; S56-Q79 PolarHBondContact N-O 3.15Å; S56-Q79 PolarHBondContact O-N 3.09Å; Q79-L141 HydrophobicContact CG-CD2 4.44Å; Q79-L141 HydrophobicContact CG-CG 4.41Å
80	M	95.8	Very high	94.6	Very high	7 Å²	7	39 Å²	39	3%	0.034	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	137	177.2	-71	169.6	-82.6	0	0	109.5	Y54 F55 L78 W82 P110 I112 Y140 P142	Y54-M80 WeakPolarHBondContact O-CA 3.44Å; F55-M80 HydrophobicContact CD2-CG 3.8Å; F55-M80 HydrophobicContact CE2-CG 4.33Å; L78-M80 HydrophobicContact CB-CE 4.05Å; L78-M80 HydrophobicContact CD1-CE 4.31Å; M80-W82 HydrophobicContact CB-CE3 4.45Å; M80-W82 HydrophobicContact CB-CZ3 4.16Å; M80-P110 HydrophobicContact SD-CG 4.18Å; M80-I112 HydrophobicContact SD-CB 4.17Å; M80-I112 HydrophobicContact SD-CG1 4Å; M80-Y140 HydrophobicContact CE-CD1 3.32Å; M80-Y140 HydrophobicContact CE-CE1 3.69Å; M80-Y140 HydrophobicContact CE-CG 4.33Å; M80-Y140 PolarHBondContact N-O 3.07Å; M80-Y140 PolarHBondContact O-N 2.87Å; M80-Y140 HydrophobicContact SD-CD1 4.29Å; M80-P142 HydrophobicContact CE-CG 3.71Å
81	S	96.8	Very high	94.6	Very high	11 Å²	11	38.5 Å²	38.5	8%	0.077	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	139.1	170.2	63.3	0	0	0	0	111.9	Y54 C138	Y54-S81 WeakPolarHBondContact CB-OG 3.37Å; Y54-S81 PolarHBondContact N-O 3.13Å; Y54-S81 PolarHBondContact O-N 2.92Å; S81-C138 WeakPolarHBondContact CA-O 3.37Å; S81-C138 WeakPolarHBondContact CB-O 3.45Å
82	W	96.4	Very high	94.4	Very high	1 Å²	1	42 Å²	42	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	174.1	178	66.7	97.9	0	0	0	108.9	V53 M80 W108 K109 P110 V130 H137 C138 Y140	V53-W82 HydrophobicContact CG2-CB 4.28Å; M80-W82 HydrophobicContact CB-CE3 4.45Å; M80-W82 HydrophobicContact CB-CZ3 4.16Å; W82-W108 HydrophobicContact CD2-CZ3 4.49Å; W82-W108 HydrophobicContact CG-CZ3 4.38Å; W82-W108 WeakPolarHBondContact CZ2-O 3.37Å; W82-W108 AromaticContact NE1-CE3 3.87Å; W82-W108 AromaticContact NE1-CZ3 3.98Å; W82-K109 HydrophobicContact CH2-CB 4.39Å; W82-P110 HydrophobicContact CE3-CG 4.21Å; W82-P110 HydrophobicContact CZ3-CG 4.21Å; W82-V130 HydrophobicContact CH2-CG1 3.99Å; W82-V130 HydrophobicContact CH2-CG2 4.43Å; W82-V130 HydrophobicContact CZ2-CG1 4.18Å; W82-H137 PolarHBondContact O-ND1 3.18Å; W82-C138 HydrophobicContact CD2-CB 3.78Å; W82-C138 VanDerWaalsContact CE2-CB 3.44Å; W82-C138 HydrophobicContact CE3-CB 4.31Å; W82-C138 HydrophobicContact CG-CB 4.19Å; W82-C138 HydrophobicContact CH2-CB 4.27Å; W82-C138 HydrophobicContact CZ2-CB 3.72Å; W82-C138 PolarHBondContact N-O 3.2Å; W82-C138 VanDerWaalsContact N-O 3.13Å; W82-C138 PolarHBondContact O-N 2.85Å; W82-Y140 HydrophobicContact CH2-CG 4.45Å
83	T	96.1	Very high	94.1	Very high	73 Å²	73	48 Å²	48	45%	0.448	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	121.9	175.5	-57.3	0	0	0	0	108.5	G136	T83-G136 CarbonylContact C-O 3.57Å; T83-G136 WeakPolarHBondContact CA-O 3.26Å
84	D	95.4	Very high	93.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.235	C	C	.	.			trans	-94.6	123.4	174.5	-171.2	-42.7	0	0	0	109.5	Y37 P43 Y86 L87 G136	Y37-D84 WeakPolarHBondContact CE2-OD2 3.48Å; Y37-D84 PolarHBondContact OH-OD2 2.78Å; P43-D84 HydrophobicContact CB-CB 3.97Å; P43-D84 VanDerWaalsContact CB-OD1 3.32Å; P43-D84 WeakPolarHBondContact CB-OD1 3.46Å; P43-D84 VanDerWaalsContact CB-OD2 3.29Å; P43-D84 WeakPolarHBondContact CB-OD2 3.26Å; P43-D84 HydrophobicContact CG-CB 4.29Å; D84-Y86 WeakPolarHBondContact OD1-CA 3.43Å; D84-Y86 WeakPolarHBondContact OD1-CB 3.49Å; D84-Y86 PolarHBondContact OD1-N 3.02Å; D84-L87 HydrophobicContact CB-CB 4.16Å; D84-L87 HydrophobicContact CB-CD1 4.15Å; D84-L87 HydrophobicContact CB-CG 4.25Å; D84-L87 PolarHBondContact OD1-N 3.05Å; D84-L87 WeakPolarHBondContact OD2-CD1 3.39Å; D84-G136 PolarHBondContact N-O 3.11Å; D84-G136 WeakPolarHBondContact O-CA 3.47Å
85	H	93	Very high	93.2	Very high	89 Å²	89	50.8 Å²	50.8	41%	0.412	26%	0.258	S	S	.	.	S	Bend	trans	-71.4	-31.5	-180	-175.8	59.1	0	0	0	113.3	P43 Q88	P43-H85 PolarHBondContact O-N 2.83Å; H85-Q88 WeakPolarHBondContact O-CG 3.05Å
86	Y	92.8	Very high	92.7	Very high	102 Å²	102	52.5 Å²	52.5	40%	0.4	29%	0.286	S	S	.	.	S	Bend	trans	-83.2	-20.7	-175	-57.4	-63.4	0	0	0	112.6	E41 P43 V44 D84 Q88	E41-Y86 HydrophobicContact CG-CE2 4.12Å; P43-Y86 HydrophobicContact CB-CD2 4.14Å; V44-Y86 PolarHBondContact O-OH 3.17Å; D84-Y86 WeakPolarHBondContact OD1-CA 3.43Å; D84-Y86 WeakPolarHBondContact OD1-CB 3.49Å; D84-Y86 PolarHBondContact OD1-N 3.02Å; Y86-Q88 PolarHBondContact O-N 3.44Å
87	L	93.1	Very high	92.3	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.005	29%	0.29	C	S	.	.	S	Bend	trans	-95.9	46	-179.8	-59.8	177	0	0	0	113.5	L33 Y37 D84 W89 F102 I107 V132 G136	L33-L87 HydrophobicContact CB-CD2 4.32Å; Y37-L87 HydrophobicContact CD2-CD2 3.78Å; Y37-L87 HydrophobicContact CD2-CG 4.17Å; Y37-L87 HydrophobicContact CE2-CD1 4.08Å; Y37-L87 HydrophobicContact CE2-CD2 3.82Å; Y37-L87 HydrophobicContact CE2-CG 3.7Å; D84-L87 HydrophobicContact CB-CB 4.16Å; D84-L87 HydrophobicContact CB-CD1 4.15Å; D84-L87 HydrophobicContact CB-CG 4.25Å; D84-L87 PolarHBondContact OD1-N 3.05Å; D84-L87 WeakPolarHBondContact OD2-CD1 3.39Å; L87-W89 WeakPolarHBondContact O-CZ3 3.48Å; L87-F102 HydrophobicContact CD1-CE2 4.47Å; L87-F102 HydrophobicContact CD2-CE2 4.5Å; L87-F102 HydrophobicContact CD2-CZ 4.36Å; L87-I107 HydrophobicContact CD1-CB 4.3Å; L87-I107 HydrophobicContact CD1-CD1 4.13Å; L87-I107 HydrophobicContact CD1-CG2 3.93Å; L87-V132 HydrophobicContact CB-CG1 4Å; L87-V132 HydrophobicContact CD1-CG1 4.36Å; L87-V132 HydrophobicContact CD1-CG2 4.3Å; L87-G136 VanDerWaalsContact O-CA 3.3Å; L87-G136 WeakPolarHBondContact O-CA 3.11Å
88	Q	93.2	Very high	92.1	Very high	89 Å²	89	54.1 Å²	54.1	42%	0.416	30%	0.297	S	S	.	.			trans	-110.3	139.8	178.9	-59.7	-174.5	4.7	0	0	110.9	H85 Y86 S135	H85-Q88 WeakPolarHBondContact O-CG 3.05Å; Y86-Q88 PolarHBondContact O-N 3.44Å; Q88-S135 PolarHBondContact NE2-O 2.59Å
89	W	93.3	Very high	91.9	Very high	24 Å²	24	57.5 Å²	57.5	9%	0.091	32%	0.318	C	S	.	.			trans	-147.1	155.6	175.1	68.1	94.8	0	0	0	111.9	L29 L33 L87 V97 K98 V100 V132 N133 S134	L29-W89 HydrophobicContact CD1-CB 3.78Å; L29-W89 HydrophobicContact CD1-CD2 4.09Å; L29-W89 HydrophobicContact CD1-CG 3.71Å; L29-W89 HydrophobicContact CD2-CD2 3.82Å; L29-W89 HydrophobicContact CD2-CE3 4.45Å; L29-W89 HydrophobicContact CD2-CG 4.01Å; L29-W89 HydrophobicContact CD2-CZ2 4.12Å; L33-W89 HydrophobicContact CD1-CE3 3.95Å; L33-W89 HydrophobicContact CD1-CZ3 4.19Å; L33-W89 HydrophobicContact CD2-CE3 4.49Å; L87-W89 WeakPolarHBondContact O-CZ3 3.48Å; W89-V97 PolarHBondContact NE1-O 3.31Å; W89-K98 WeakPolarHBondContact CZ2-O 3.48Å; W89-V100 HydrophobicContact CH2-CG1 4.38Å; W89-V100 HydrophobicContact CH2-CG2 3.69Å; W89-V100 HydrophobicContact CZ2-CG1 4.28Å; W89-V100 HydrophobicContact CZ2-CG2 4.4Å; W89-V100 HydrophobicContact CZ3-CG2 4.13Å; W89-V132 HydrophobicContact CH2-CG1 4.43Å; W89-V132 HydrophobicContact CZ3-CG1 4.12Å; W89-N133 WeakPolarHBondContact CH2-O 3.47Å; W89-N133 WeakPolarHBondContact CZ3-O 3.39Å; W89-S134 VanDerWaalsContact CZ2-CA 3.46Å; W89-S134 PolarHBondContact N-O 3.26Å
90	N	92.5	Very high	91.8	Very high	88 Å²	88	54.4 Å²	54.4	47%	0.471	30%	0.303	S	S	.	.			trans	-84.9	123.1	176.4	-165.5	-11.9	0	0	0	110.8	S92 E93	N90-S92 PolarHBondContact O-N 3Å; N90-S92 PolarHBondContact OD1-N 2.83Å; N90-S92 VanDerWaalsContact OD1-N 3.15Å; N90-S92 PolarHBondContact OD1-OG 3.45Å; N90-E93 HydrophobicContact CB-CG 4.37Å; N90-E93 PolarHBondContact O-N 3.19Å; N90-E93 VanDerWaalsContact O-N 3.13Å
91	V	89.9	Confident	91.8	Very high	49 Å²	49	60.5 Å²	60.5	30%	0.297	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-25.4	178.5	-175.8	0	0	0	0	111.6	E93 Y94 S134	V91-E93 VanDerWaalsContact C-N 3.29Å; V91-E93 PolarHBondContact O-N 3.01Å; V91-Y94 CarbonylContact O-C 3.26Å; V91-Y94 VanDerWaalsContact O-C 3.26Å; V91-Y94 PolarHBondContact O-N 3.17Å; V91-S134 WeakPolarHBondContact CG2-OG 3.16Å
92	S	89.9	Confident	91.6	Very high	101 Å²	101	60 Å²	60	71%	0.706	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-30.4	176.6	-57	0	0	0	0	113.5	N90	N90-S92 PolarHBondContact O-N 3Å; N90-S92 PolarHBondContact OD1-N 2.83Å; N90-S92 VanDerWaalsContact OD1-N 3.15Å; N90-S92 PolarHBondContact OD1-OG 3.45Å
93	E	88.9	Confident	91.4	Very high	125 Å²	125	62.1 Å²	62.1	58%	0.584	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-24	179.6	-66.2	177.3	-166.1	0	0	112.4	N90 V91 P95	N90-E93 HydrophobicContact CB-CG 4.37Å; N90-E93 PolarHBondContact O-N 3.19Å; N90-E93 VanDerWaalsContact O-N 3.13Å; V91-E93 VanDerWaalsContact C-N 3.29Å; V91-E93 PolarHBondContact O-N 3.01Å; E93-P95 WeakPolarHBondContact O-CD 3.41Å
94	Y	88	Confident	90.9	Very high	6 Å²	6	61.2 Å²	61.2	2%	0.024	33%	0.329	C	S	.	.	S	Bend	trans	-125.5	73	-177.9	-63.2	-79.3	0	0	0	110.2	F25 K28 L29 E32 V91 G96 V97	F25-Y94 HydrophobicContact CB-CD1 4.08Å; F25-Y94 HydrophobicContact CD1-CD1 4.4Å; F25-Y94 WeakPolarHBondContact O-CD1 3.37Å; K28-Y94 HydrophobicContact CB-CE1 4.17Å; K28-Y94 HydrophobicContact CD-CE1 4.04Å; K28-Y94 HydrophobicContact CG-CE1 4.09Å; L29-Y94 HydrophobicContact CB-CD1 3.98Å; L29-Y94 HydrophobicContact CB-CE1 3.98Å; L29-Y94 HydrophobicContact CB-CG 4.39Å; L29-Y94 HydrophobicContact CD1-CD2 3.97Å; L29-Y94 HydrophobicContact CD1-CE2 3.87Å; L29-Y94 HydrophobicContact CD1-CG 4.35Å; E32-Y94 PolarHBondContact OE1-OH 3Å; E32-Y94 PolarHBondContact OE2-OH 2.83Å; V91-Y94 CarbonylContact O-C 3.26Å; V91-Y94 VanDerWaalsContact O-C 3.26Å; V91-Y94 PolarHBondContact O-N 3.17Å; Y94-G96 PolarHBondContact O-N 2.83Å; Y94-V97 PolarHBondContact O-N 2.86Å; Y94-V97 VanDerWaalsContact O-N 3.1Å
95	P	84.8	Confident	90.5	Very high	74 Å²	74	63.8 Å²	63.8	48%	0.481	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	126.3	-174.8	22.9	-32.5	0	0	0	111	F25 E93	F25-P95 HydrophobicContact CD1-CG 4.47Å; F25-P95 HydrophobicContact CD2-CG 4.16Å; F25-P95 HydrophobicContact CE1-CG 4.19Å; F25-P95 HydrophobicContact CE2-CG 3.85Å; F25-P95 HydrophobicContact CG-CG 4.46Å; F25-P95 HydrophobicContact CZ-CG 3.88Å; E93-P95 WeakPolarHBondContact O-CD 3.41Å
96	G	84.6	Confident	90.4	Very high	76 Å²	76	63.9 Å²	63.9	78%	0.784	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.4	-9.4	179.3	0	0	0	0	0	115.7	Y94 K98	Y94-G96 PolarHBondContact O-N 2.83Å; G96-K98 PolarHBondContact O-N 2.88Å
97	V	88.5	Confident	90.4	Very high	14 Å²	14	59.4 Å²	59.4	9%	0.085	34%	0.339	C	S	.	.			trans	-100.5	89.4	-178.9	-170.4	0	0	0	0	110.6	F25 Q26 L29 W89 Y94 V100	F25-V97 HydrophobicContact CB-CG2 4.05Å; Q26-V97 HydrophobicContact CB-CG2 4.1Å; Q26-V97 HydrophobicContact CG-CG1 4.5Å; L29-V97 HydrophobicContact CD2-CG1 3.71Å; W89-V97 PolarHBondContact NE1-O 3.31Å; Y94-V97 PolarHBondContact O-N 2.86Å; Y94-V97 VanDerWaalsContact O-N 3.1Å; V97-V100 HydrophobicContact CG1-CG1 3.69Å
98	K	89.4	Confident	90.5	Very high	141 Å²	141	59.6 Å²	59.6	61%	0.613	34%	0.339	S	S	*	.			trans	-90	-36.3	176.8	-64.7	-175.9	179.9	-178.1	0	113.3	W89 G96 N133 S134	W89-K98 WeakPolarHBondContact CZ2-O 3.48Å; G96-K98 PolarHBondContact O-N 2.88Å; K98-N133 PolarHBondContact O-OD1 2.72Å; K98-N133 VanDerWaalsContact O-OD1 3.05Å; K98-S134 PolarHBondContact O-N 2.65Å
99	T	93	Very high	90.5	Very high	71 Å²	71	58.4 Å²	58.4	44%	0.436	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	137.1	-175.8	57.2	0	0	0	0	110.5	V132	T99-V132 CarbonylContact C-O 3.59Å; T99-V132 VanDerWaalsContact CA-O 3.26Å; T99-V132 WeakPolarHBondContact CA-O 3.19Å
100	V	93.4	Very high	90.6	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.006	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	162.4	174.9	-62.6	0	0	0	0	110.4	L29 Y30 W89 V97 F102 V132	L29-V100 HydrophobicContact CD2-CG1 3.86Å; Y30-V100 HydrophobicContact CE1-CB 4.44Å; Y30-V100 HydrophobicContact CE2-CB 4.46Å; Y30-V100 HydrophobicContact CE2-CG1 4.49Å; W89-V100 HydrophobicContact CH2-CG1 4.38Å; W89-V100 HydrophobicContact CH2-CG2 3.69Å; W89-V100 HydrophobicContact CZ2-CG1 4.28Å; W89-V100 HydrophobicContact CZ2-CG2 4.4Å; W89-V100 HydrophobicContact CZ3-CG2 4.13Å; V97-V100 HydrophobicContact CG1-CG1 3.69Å; V100-F102 HydrophobicContact CG2-CD2 4.15Å; V100-F102 HydrophobicContact CG2-CE2 3.43Å; V100-F102 VanDerWaalsContact CG2-CE2 3.43Å; V100-F102 HydrophobicContact CG2-CZ 4.07Å; V100-V132 HydrophobicContact CG2-CB 4.13Å; V100-V132 PolarHBondContact N-O 2.82Å; V100-V132 PolarHBondContact O-N 3.17Å
101	R	94.3	Very high	90.6	Very high	134 Å²	134	55.1 Å²	55.1	51%	0.506	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	122.4	-177.4	-68.9	176.2	176.9	83.2	0.1	110.1	Y30 N129 V130 L131	Y30-R101 WeakPolarHBondContact CE1-O 3.41Å; Y30-R101 PolarHBondContact OH-N 3.07Å; Y30-R101 PolarHBondContact OH-O 3.1Å; R101-N129 HydrophobicContact CB-CB 4.25Å; R101-V130 CarbonylContact C-O 3.56Å; R101-V130 WeakPolarHBondContact CA-O 3.48Å; R101-L131 HydrophobicContact CG-CG 4.3Å
102	F	93.9	Very high	90.8	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	131.6	174.7	-69.8	-83.6	0	0	0	109.7	Y30 L33 V34 L87 V100 I107 N129 V130 V132	Y30-F102 HydrophobicContact CD1-CD1 4.22Å; Y30-F102 AromaticContact CD1-CE1 3.57Å; Y30-F102 HydrophobicContact CD1-CE1 3.57Å; Y30-F102 HydrophobicContact CD1-CZ 4.01Å; Y30-F102 AromaticContact CE1-CD1 3.86Å; Y30-F102 HydrophobicContact CE1-CD1 3.86Å; Y30-F102 AromaticContact CE1-CE1 3.57Å; Y30-F102 HydrophobicContact CE1-CE1 3.57Å; Y30-F102 HydrophobicContact CE1-CE2 4.47Å; Y30-F102 HydrophobicContact CE1-CG 4.43Å; Y30-F102 AromaticContact CE1-CZ 3.9Å; Y30-F102 HydrophobicContact CE1-CZ 3.9Å; L33-F102 HydrophobicContact CB-CZ 4.47Å; L33-F102 HydrophobicContact CD1-CZ 4.06Å; V34-F102 HydrophobicContact CG2-CE1 3.85Å; L87-F102 HydrophobicContact CD1-CE2 4.47Å; L87-F102 HydrophobicContact CD2-CE2 4.5Å; L87-F102 HydrophobicContact CD2-CZ 4.36Å; V100-F102 HydrophobicContact CG2-CD2 4.15Å; V100-F102 HydrophobicContact CG2-CE2 3.43Å; V100-F102 VanDerWaalsContact CG2-CE2 3.43Å; V100-F102 HydrophobicContact CG2-CZ 4.07Å; F102-I107 HydrophobicContact CB-CD1 4Å; F102-I107 HydrophobicContact CB-CG1 4.09Å; F102-I107 HydrophobicContact CB-CG2 3.96Å; F102-I107 HydrophobicContact CD1-CG2 3.81Å; F102-I107 HydrophobicContact CD2-CD1 4.32Å; F102-I107 HydrophobicContact CD2-CG2 4.15Å; F102-I107 HydrophobicContact CE1-CG2 4.33Å; F102-I107 HydrophobicContact CG-CD1 4.37Å; F102-I107 HydrophobicContact CG-CG2 3.71Å; F102-N129 CarbonylContact O-C 3.59Å; F102-N129 WeakPolarHBondContact O-CA 3.4Å; F102-N129 WeakPolarHBondContact O-CB 3.34Å; F102-V130 PolarHBondContact N-O 2.96Å; F102-V130 PolarHBondContact O-N 3.46Å; F102-V132 HydrophobicContact CD2-CB 4.29Å; F102-V132 HydrophobicContact CD2-CG2 3.66Å; F102-V132 HydrophobicContact CE2-CB 4.24Å; F102-V132 HydrophobicContact CE2-CG2 4.03Å
103	P	92.6	Very high	90.9	Very high	47 Å²	47	50.6 Å²	50.6	31%	0.305	28%	0.283	S	S	.	.			trans	-69.2	163	171.8	32.7	-35	0	0	0	110.6	Q106 N129	P103-Q106 HydrophobicContact CG-CB 4.41Å; P103-Q106 HydrophobicContact CG-CG 3.83Å; P103-Q106 PolarHBondContact O-N 2.92Å; P103-N129 WeakPolarHBondContact CA-OD1 3.44Å
104	D	85.4	Confident	91.2	Very high	54 Å²	54	44.8 Å²	44.8	29%	0.289	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	140.9	-179.8	-168	42.6	0	0	0	112.5	Q106 K109 H127	D104-Q106 VanDerWaalsContact C-N 3.29Å; D104-Q106 PolarHBondContact O-N 3.34Å; D104-K109 VanDerWaalsContact OD1-CD 3.28Å; D104-K109 WeakPolarHBondContact OD1-CD 3.45Å; D104-K109 VanDerWaalsContact OD1-CE 3.3Å; D104-K109 WeakPolarHBondContact OD1-CE 3.34Å; D104-K109 IonicContact OD1-NZ 3.99Å; D104-K109 PolarHBondContact OD1-NZ 2.88Å; D104-K109 IonicContact OD2-NZ 3.74Å; D104-K109 PolarHBondContact OD2-NZ 2.93Å; D104-H127 HydrophobicContact CB-CB 3.79Å; D104-H127 IonicContact OD2-CD2 3.5Å; D104-H127 IonicContact OD2-CG 2.78Å; D104-H127 VanDerWaalsContact OD2-CG 3.3Å; D104-H127 IonicContact OD2-ND1 2.78Å
105	G	86.1	Confident	91.5	Very high	53 Å²	53	46.9 Å²	46.9	55%	0.546	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	-7.6	179.6	0	0	0	0	0	116.4
106	Q	90.5	Very high	91.9	Very high	92 Å²	92	45.1 Å²	45.1	43%	0.43	25%	0.251	S	S	.	.	S	Bend	trans	-82.6	-22.7	173.5	-76.1	-169.9	12.4	0	0	113.9	P103 D104	P103-Q106 HydrophobicContact CG-CB 4.41Å; P103-Q106 HydrophobicContact CG-CG 3.83Å; P103-Q106 PolarHBondContact O-N 2.92Å; D104-Q106 VanDerWaalsContact C-N 3.29Å; D104-Q106 PolarHBondContact O-N 3.34Å
107	I	94	Very high	92.4	Very high	8 Å²	8	42.6 Å²	42.6	4%	0.041	22%	0.221	C	C	.	.	S	Bend	trans	-129.5	162.7	178.8	64.5	167.2	0	0	0	110.5	Y37 L87 F102 V130 V132	Y37-I107 HydrophobicContact CE1-CB 3.92Å; Y37-I107 HydrophobicContact CE1-CG2 4.14Å; L87-I107 HydrophobicContact CD1-CB 4.3Å; L87-I107 HydrophobicContact CD1-CD1 4.13Å; L87-I107 HydrophobicContact CD1-CG2 3.93Å; F102-I107 HydrophobicContact CB-CD1 4Å; F102-I107 HydrophobicContact CB-CG1 4.09Å; F102-I107 HydrophobicContact CB-CG2 3.96Å; F102-I107 HydrophobicContact CD1-CG2 3.81Å; F102-I107 HydrophobicContact CD2-CD1 4.32Å; F102-I107 HydrophobicContact CD2-CG2 4.15Å; F102-I107 HydrophobicContact CE1-CG2 4.33Å; F102-I107 HydrophobicContact CG-CD1 4.37Å; F102-I107 HydrophobicContact CG-CG2 3.71Å; I107-V130 HydrophobicContact CD1-CB 3.81Å; I107-V130 HydrophobicContact CD1-CG1 3.84Å; I107-V130 HydrophobicContact CD1-CG2 4.09Å; I107-V130 HydrophobicContact CG1-CG2 4.46Å; I107-V132 HydrophobicContact CD1-CG2 4.15Å
108	W	94.8	Very high	92.5	Very high	4 Å²	4	44 Å²	44	2%	0.015	23%	0.234	C	C	.	.			trans	-63.9	138.8	174.4	-177.5	95.4	0	0	0	110	Y37 P39 R42 P43 L51 W82 P110 Y173 L178	Y37-W108 WeakPolarHBondContact OH-CB 3.48Å; Y37-W108 PolarHBondContact OH-N 2.72Å; P39-W108 WeakPolarHBondContact O-CA 3.26Å; P39-W108 WeakPolarHBondContact O-CB 3.44Å; P39-W108 VanDerWaalsContact O-CD1 3.31Å; R42-W108 HydrophobicContact CG-CZ2 4.26Å; P43-W108 HydrophobicContact CG-CD2 4.04Å; P43-W108 HydrophobicContact CG-CE3 3.68Å; P43-W108 HydrophobicContact CG-CG 4.41Å; P43-W108 HydrophobicContact CG-CZ3 4.26Å; L51-W108 HydrophobicContact CD2-CE3 4.16Å; L51-W108 HydrophobicContact CD2-CH2 3.19Å; L51-W108 HydrophobicContact CD2-CZ2 4.07Å; L51-W108 HydrophobicContact CD2-CZ3 3.23Å; W82-W108 HydrophobicContact CD2-CZ3 4.49Å; W82-W108 HydrophobicContact CG-CZ3 4.38Å; W82-W108 WeakPolarHBondContact CZ2-O 3.37Å; W82-W108 AromaticContact NE1-CE3 3.87Å; W82-W108 AromaticContact NE1-CZ3 3.98Å; W108-P110 HydrophobicContact CH2-CB 3.78Å; W108-P110 HydrophobicContact CH2-CG 4.46Å; W108-P110 HydrophobicContact CZ3-CB 4.2Å; W108-P110 HydrophobicContact CZ3-CG 4.39Å; W108-Y173 HydrophobicContact CZ2-CE2 4.13Å; W108-Y173 PolarHBondContact NE1-OH 3.44Å; W108-L178 HydrophobicContact CH2-CD1 4.41Å
109	K	93.6	Very high	92.5	Very high	65 Å²	65	39.1 Å²	39.1	28%	0.283	22%	0.215	S	C	.	.			trans	-137.4	147.4	173.1	70.6	178.4	-178.7	-177.9	0	110.1	W82 D104	W82-K109 HydrophobicContact CH2-CB 4.39Å; D104-K109 VanDerWaalsContact OD1-CD 3.28Å; D104-K109 WeakPolarHBondContact OD1-CD 3.45Å; D104-K109 VanDerWaalsContact OD1-CE 3.3Å; D104-K109 WeakPolarHBondContact OD1-CE 3.34Å; D104-K109 IonicContact OD1-NZ 3.99Å; D104-K109 PolarHBondContact OD1-NZ 2.88Å; D104-K109 IonicContact OD2-NZ 3.74Å; D104-K109 PolarHBondContact OD2-NZ 2.93Å
110	P	94.4	Very high	92	Very high	7 Å²	7	44.5 Å²	44.5	5%	0.045	24%	0.235	C	C	.	.			trans	-70.7	146.5	175.2	30.4	-34.3	0	0	0	111.2	V53 M80 W82 W108 I112 L178	V53-P110 HydrophobicContact CG1-CG 4.16Å; V53-P110 HydrophobicContact CG2-CB 4.23Å; V53-P110 HydrophobicContact CG2-CG 4.43Å; M80-P110 HydrophobicContact SD-CG 4.18Å; W82-P110 HydrophobicContact CE3-CG 4.21Å; W82-P110 HydrophobicContact CZ3-CG 4.21Å; W108-P110 HydrophobicContact CH2-CB 3.78Å; W108-P110 HydrophobicContact CH2-CG 4.46Å; W108-P110 HydrophobicContact CZ3-CB 4.2Å; W108-P110 HydrophobicContact CZ3-CG 4.39Å; P110-I112 HydrophobicContact CB-CD1 4.34Å; P110-I112 HydrophobicContact CB-CG1 4.13Å; P110-I112 HydrophobicContact CG-CG1 4.4Å; P110-I112 PolarHBondContact O-N 2.9Å; P110-L178 HydrophobicContact CB-CD1 4.13Å
111	D	92.1	Very high	91.6	Very high	36 Å²	36	53.8 Å²	53.8	19%	0.193	27%	0.27	C	S	.	.			trans	-93.4	59.5	-179.5	64.7	-21	0	0	0	111.8	L113 S170 W171 S172 Y173	D111-L113 PolarHBondContact O-N 2.89Å; D111-S170 WeakPolarHBondContact O-CA 3.46Å; D111-S170 PolarHBondContact OD1-OG 2.79Å; D111-W171 PolarHBondContact O-N 2.9Å; D111-W171 PolarHBondContact OD2-N 3.39Å; D111-S172 WeakPolarHBondContact OD2-CB 3.47Å; D111-S172 PolarHBondContact OD2-N 3.36Å; D111-S172 PolarHBondContact OD2-OG 3.45Å; D111-Y173 WeakPolarHBondContact OD1-CD2 3.45Å
112	I	93.9	Very high	90.9	Very high	14 Å²	14	53.2 Å²	53.2	7%	0.072	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	113	179.1	-52.2	-55.9	0	0	0	110	F55 M80 P110 F168 G169 L180	F55-I112 HydrophobicContact CD2-CG2 4.27Å; F55-I112 HydrophobicContact CE2-CG2 3.92Å; F55-I112 HydrophobicContact CZ-CG2 4.25Å; M80-I112 HydrophobicContact SD-CB 4.17Å; M80-I112 HydrophobicContact SD-CG1 4Å; P110-I112 HydrophobicContact CB-CD1 4.34Å; P110-I112 HydrophobicContact CB-CG1 4.13Å; P110-I112 HydrophobicContact CG-CG1 4.4Å; P110-I112 PolarHBondContact O-N 2.9Å; I112-F168 HydrophobicContact CG2-CB 4.01Å; I112-F168 HydrophobicContact CG2-CD1 4.48Å; I112-G169 WeakPolarHBondContact CA-O 3.43Å; I112-L180 HydrophobicContact CD1-CD1 3.89Å; I112-L180 HydrophobicContact CD1-CD2 4.44Å
113	L	93.7	Very high	90.4	Very high	41 Å²	41	56.6 Å²	56.6	22%	0.215	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	158.3	-177.6	-62	179.6	0	0	0	111.8	D111 D123 F168 G169 W171	D111-L113 PolarHBondContact O-N 2.89Å; L113-D123 HydrophobicContact CD2-CB 4.5Å; L113-F168 WeakPolarHBondContact O-CA 3.26Å; L113-G169 PolarHBondContact N-O 2.99Å; L113-G169 PolarHBondContact O-N 2.88Å; L113-G169 VanDerWaalsContact O-N 3.11Å; L113-W171 HydrophobicContact CD1-CB 4.01Å; L113-W171 HydrophobicContact CD1-CG 4.29Å
114	L	95.1	Very high	89.7	Confident	3 Å²	3	55.5 Å²	55.5	2%	0.016	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	113.6	173.8	-179.2	72	0	0	0	109.8	N116 F146 L166 K167 F168	L114-N116 WeakPolarHBondContact CD1-OD1 3.44Å; L114-F146 HydrophobicContact CB-CD1 4.34Å; L114-F146 HydrophobicContact CD2-CB 4.34Å; L114-F146 HydrophobicContact CD2-CD1 4.16Å; L114-L166 HydrophobicContact CD1-CB 4.2Å; L114-L166 HydrophobicContact CD1-CD2 4.31Å; L114-K167 CarbonylContact C-O 3.58Å; L114-K167 WeakPolarHBondContact CA-O 3.21Å; L114-F168 HydrophobicContact CB-CD1 4.27Å; L114-F168 HydrophobicContact CB-CE1 4Å; L114-F168 HydrophobicContact CD1-CD1 4.35Å; L114-F168 HydrophobicContact CD1-CE1 4.02Å; L114-F168 HydrophobicContact CD1-CE2 4.26Å; L114-F168 HydrophobicContact CD1-CZ 3.98Å
115	Y	92.9	Very high	89.8	Confident	49 Å²	49	54.1 Å²	54.1	19%	0.192	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-35.1	-177.4	-69.8	-10.2	0	0	0	113.5	S117 K167 S170 W171 D219	Y115-S117 VanDerWaalsContact C-N 3.31Å; Y115-S117 PolarHBondContact O-N 2.8Å; Y115-K167 HydrophobicContact CD2-CD 3.77Å; Y115-K167 HydrophobicContact CD2-CG 3.92Å; Y115-K167 HydrophobicContact CG-CG 4.46Å; Y115-K167 PolarHBondContact N-O 2.93Å; Y115-S170 PolarHBondContact OH-O 2.89Å; Y115-W171 HydrophobicContact CD1-CE3 4.23Å; Y115-W171 HydrophobicContact CD1-CZ3 4.3Å; Y115-W171 HydrophobicContact CE1-CE3 4.03Å; Y115-W171 HydrophobicContact CE1-CZ3 4.45Å; Y115-D219 HydrophobicContact CE2-CB 4.29Å
116	N	94.4	Very high	89.9	Confident	38 Å²	38	58.7 Å²	58.7	20%	0.203	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	41	178.3	66.9	-54.2	0	0	0	112	L114 S148 S149 K165 K167	L114-N116 WeakPolarHBondContact CD1-OD1 3.44Å; N116-S148 WeakPolarHBondContact O-CA 3.44Å; N116-S149 PolarHBondContact ND2-O 2.9Å; N116-S149 VanDerWaalsContact ND2-O 3.16Å; N116-S149 PolarHBondContact O-N 3.28Å; N116-K165 PolarHBondContact ND2-O 2.96Å; N116-K167 PolarHBondContact OD1-N 3.01Å
117	S	94.3	Very high	89.8	Confident	22 Å²	22	58.5 Å²	58.5	15%	0.154	28%	0.282	C	S	.	.	B	Isolated β-bridge	trans	-67.8	135.3	174.1	-173.4	0	0	0	0	111	Y115 D119 K147	Y115-S117 VanDerWaalsContact C-N 3.31Å; Y115-S117 PolarHBondContact O-N 2.8Å; S117-D119 PolarHBondContact OG-N 2.56Å; S117-K147 WeakPolarHBondContact CA-O 3.46Å
118	A	91.2	Very high	89.8	Confident	44 Å²	44	59.9 Å²	59.9	36%	0.364	29%	0.291	S	S	.	.			trans	-101.9	-1.3	171.5	0	0	0	0	0	112.4	V71 K147	V71-A118 HydrophobicContact CG1-CB 4.08Å; V71-A118 HydrophobicContact CG2-CB 3.89Å; A118-K147 PolarHBondContact N-O 2.97Å
119	D	88.8	Confident	89.8	Confident	39 Å²	39	63.4 Å²	63.4	21%	0.209	31%	0.31	C	S	.	.	S	Bend	trans	-88.8	150.4	178.8	-145	-27.4	0	0	0	111.8	S117 R121 K147	S117-D119 PolarHBondContact OG-N 2.56Å; D119-R121 PolarHBondContact O-N 2.95Å; D119-K147 HydrophobicContact CB-CB 4.13Å; D119-K147 HydrophobicContact CB-CD 4.2Å; D119-K147 HydrophobicContact CB-CG 4.42Å; D119-K147 IonicContact OD1-NZ 2.66Å; D119-K147 PolarHBondContact OD1-NZ 3.36Å; D119-K147 WeakPolarHBondContact OD2-CD 3.19Å; D119-K147 VanDerWaalsContact OD2-CE 3.27Å; D119-K147 WeakPolarHBondContact OD2-CE 3.43Å; D119-K147 IonicContact OD2-NZ 3.14Å; D119-K147 PolarHBondContact OD2-NZ 3.14Å
120	E	83.6	Confident	89.8	Confident	184 Å²	184	60.4 Å²	60.4	86%	0.86	30%	0.298	S	S	*	.	S	Bend	trans	-65	-28.7	173.3	-64	-179.2	177.7	0	0	111.3
121	R	84.1	Confident	89.9	Confident	196 Å²	196	62.9 Å²	62.9	74%	0.74	31%	0.31	S	S	*	.			trans	-93.5	102.5	174.8	-62.2	-177.3	-173.9	-177	2.3	109.9	D119 D123	D119-R121 PolarHBondContact O-N 2.95Å; R121-D123 VanDerWaalsContact C-N 3.31Å; R121-D123 PolarHBondContact O-N 2.7Å
122	F	80	Confident	90	Very high	121 Å²	121	61.2 Å²	61.2	53%	0.531	30%	0.301	S	S	.	.	S	Bend	trans	-63.5	-34.2	177.6	-77.5	-87.3	0	0	0	113.4
123	D	82.1	Confident	90.1	Very high	71 Å²	71	63.5 Å²	63.5	38%	0.38	31%	0.313	S	S	.	.			trans	-92.4	101.5	169.1	-166.6	-11.3	0	0	0	109.8	L113 R121 T125 H127	L113-D123 HydrophobicContact CD2-CB 4.5Å; R121-D123 VanDerWaalsContact C-N 3.31Å; R121-D123 PolarHBondContact O-N 2.7Å; D123-T125 WeakPolarHBondContact OD1-CB 3.38Å; D123-T125 PolarHBondContact OD1-N 3Å; D123-T125 PolarHBondContact OD1-OG1 2.79Å; D123-H127 IonicContact OD2-CE1 3.5Å; D123-H127 PolarHBondContact OD2-CE1 2.92Å; D123-H127 VanDerWaalsContact OD2-CE1 3.3Å
124	A	77.9	Confident	90.1	Very high	25 Å²	25	62.8 Å²	62.8	21%	0.207	31%	0.312	C	S	.	.			trans	-94.3	5.2	-179.8	0	0	0	0	0	113.3	G144 I145 F146	A124-G144 VanDerWaalsContact O-CA 3.3Å; A124-G144 WeakPolarHBondContact O-CA 3.29Å; A124-I145 VanDerWaalsContact CB-O 3.31Å; A124-I145 WeakPolarHBondContact CB-O 3.37Å; A124-I145 PolarHBondContact O-N 2.86Å; A124-F146 HydrophobicContact CB-CD1 4.1Å; A124-F146 HydrophobicContact CB-CE1 4.21Å
125	T	87.6	Confident	90.1	Very high	25 Å²	25	65.7 Å²	65.7	15%	0.153	33%	0.332	C	S	.	.	B	Isolated β-bridge	trans	-86.7	145.3	-175.2	67.1	0	0	0	0	112.4	L78 D123 P142 F146	L78-T125 HydrophobicContact CD1-CG2 3.99Å; D123-T125 WeakPolarHBondContact OD1-CB 3.38Å; D123-T125 PolarHBondContact OD1-N 3Å; D123-T125 PolarHBondContact OD1-OG1 2.79Å; T125-P142 HydrophobicContact CG2-CB 4.39Å; T125-P142 HydrophobicContact CG2-CG 4.28Å; T125-F146 HydrophobicContact CG2-CE1 4.42Å; T125-F146 HydrophobicContact CG2-CZ 3.76Å
126	F	89.4	Confident	90.1	Very high	148 Å²	148	63.3 Å²	63.3	65%	0.649	32%	0.323	S	S	*	.			trans	-87.2	119.5	166.4	-172.2	-93.5	0	0	0	109.1	T128 P142 P143	F126-T128 HydrophobicContact CD1-CG2 4.12Å; F126-T128 PolarHBondContact O-N 3.03Å; F126-P142 WeakPolarHBondContact O-CB 3.28Å; F126-P143 HydrophobicContact CB-CG 4.08Å; F126-P143 PolarHBondContact N-O 3.45Å
127	H	88.8	Confident	90.2	Very high	89 Å²	89	64 Å²	64	41%	0.412	33%	0.325	S	S	.	.			trans	-68.7	102.7	-176.1	-55.3	-43.4	0	0	0	111.7	D104 D123	D104-H127 HydrophobicContact CB-CB 3.79Å; D104-H127 IonicContact OD2-CD2 3.5Å; D104-H127 IonicContact OD2-CG 2.78Å; D104-H127 VanDerWaalsContact OD2-CG 3.3Å; D104-H127 IonicContact OD2-ND1 2.78Å; D123-H127 IonicContact OD2-CE1 3.5Å; D123-H127 PolarHBondContact OD2-CE1 2.92Å; D123-H127 VanDerWaalsContact OD2-CE1 3.3Å
128	T	92.6	Very high	90.3	Very high	36 Å²	36	63 Å²	63	22%	0.221	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-93	173.3	172.6	58	0	0	0	0	111.6	F126 Y140 L141 P143	F126-T128 HydrophobicContact CD1-CG2 4.12Å; F126-T128 PolarHBondContact O-N 3.03Å; T128-Y140 WeakPolarHBondContact O-CE2 3.3Å; T128-L141 PolarHBondContact OG1-O 2.76Å; T128-P143 HydrophobicContact CG2-CG 4.4Å
129	N	94.5	Very high	90.5	Very high	79 Å²	79	65 Å²	65	42%	0.422	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-76.4	140.4	174.6	-62.4	-21.3	0	0	0	110.8	R101 F102 P103	R101-N129 HydrophobicContact CB-CB 4.25Å; F102-N129 CarbonylContact O-C 3.59Å; F102-N129 WeakPolarHBondContact O-CA 3.4Å; F102-N129 WeakPolarHBondContact O-CB 3.34Å; P103-N129 WeakPolarHBondContact CA-OD1 3.44Å
130	V	95	Very high	90.8	Very high	2 Å²	2	63.5 Å²	63.5	1%	0.012	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	130.6	171	-173.7	0	0	0	0	109.2	W82 R101 F102 I107 V132 C138 Y140	W82-V130 HydrophobicContact CH2-CG1 3.99Å; W82-V130 HydrophobicContact CH2-CG2 4.43Å; W82-V130 HydrophobicContact CZ2-CG1 4.18Å; R101-V130 CarbonylContact C-O 3.56Å; R101-V130 WeakPolarHBondContact CA-O 3.48Å; F102-V130 PolarHBondContact N-O 2.96Å; F102-V130 PolarHBondContact O-N 3.46Å; I107-V130 HydrophobicContact CD1-CB 3.81Å; I107-V130 HydrophobicContact CD1-CG1 3.84Å; I107-V130 HydrophobicContact CD1-CG2 4.09Å; I107-V130 HydrophobicContact CG1-CG2 4.46Å; V130-V132 HydrophobicContact CG1-CG2 4.19Å; V130-C138 HydrophobicContact CG1-CB 4.11Å; V130-Y140 HydrophobicContact CG2-CD2 3.71Å; V130-Y140 HydrophobicContact CG2-CE2 4.27Å; V130-Y140 HydrophobicContact CG2-CG 4.1Å
131	L	95.5	Very high	91.3	Very high	59 Å²	59	58.1 Å²	58.1	31%	0.309	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	125.7	174.3	-72.3	83	0	0	0	108.8	R101 C138 Q139	R101-L131 HydrophobicContact CG-CG 4.3Å; L131-C138 CarbonylContact O-C 3.46Å; L131-C138 WeakPolarHBondContact O-CA 3.35Å; L131-Q139 HydrophobicContact CB-CB 4.46Å; L131-Q139 PolarHBondContact N-O 3.37Å; L131-Q139 PolarHBondContact O-N 3.34Å
132	V	95.6	Very high	91.9	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.006	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	128.9	179.5	-173.3	0	0	0	0	109.1	L87 W89 T99 V100 F102 I107 V130 H137 C138	L87-V132 HydrophobicContact CB-CG1 4Å; L87-V132 HydrophobicContact CD1-CG1 4.36Å; L87-V132 HydrophobicContact CD1-CG2 4.3Å; W89-V132 HydrophobicContact CH2-CG1 4.43Å; W89-V132 HydrophobicContact CZ3-CG1 4.12Å; T99-V132 CarbonylContact C-O 3.59Å; T99-V132 VanDerWaalsContact CA-O 3.26Å; T99-V132 WeakPolarHBondContact CA-O 3.19Å; V100-V132 HydrophobicContact CG2-CB 4.13Å; V100-V132 PolarHBondContact N-O 2.82Å; V100-V132 PolarHBondContact O-N 3.17Å; F102-V132 HydrophobicContact CD2-CB 4.29Å; F102-V132 HydrophobicContact CD2-CG2 3.66Å; F102-V132 HydrophobicContact CE2-CB 4.24Å; F102-V132 HydrophobicContact CE2-CG2 4.03Å; I107-V132 HydrophobicContact CD1-CG2 4.15Å; V130-V132 HydrophobicContact CG1-CG2 4.19Å; V132-H137 WeakPolarHBondContact CA-O 3.44Å; V132-C138 HydrophobicContact CG2-CB 4.46Å
133	N	95.8	Very high	92.6	Very high	61 Å²	61	44.9 Å²	44.9	33%	0.326	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	160.9	175.9	-167.1	10.8	0	0	0	110.9	W89 K98 S135 G136 H137	W89-N133 WeakPolarHBondContact CH2-O 3.47Å; W89-N133 WeakPolarHBondContact CZ3-O 3.39Å; K98-N133 PolarHBondContact O-OD1 2.72Å; K98-N133 VanDerWaalsContact O-OD1 3.05Å; N133-S135 PolarHBondContact O-N 3.46Å; N133-G136 PolarHBondContact O-N 3.37Å; N133-H137 HydrophobicContact CB-CB 4.29Å; N133-H137 PolarHBondContact N-O 3.29Å
134	S	93.9	Very high	93.1	Very high	26 Å²	26	41.7 Å²	41.7	18%	0.182	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-23.3	-178.3	64.8	0	0	0	0	114.6	W89 V91 K98 G136	W89-S134 VanDerWaalsContact CZ2-CA 3.46Å; W89-S134 PolarHBondContact N-O 3.26Å; V91-S134 WeakPolarHBondContact CG2-OG 3.16Å; K98-S134 PolarHBondContact O-N 2.65Å; S134-G136 PolarHBondContact O-N 2.87Å
135	S	93.9	Very high	94	Very high	64 Å²	64	45 Å²	45	45%	0.448	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	1.2	174.2	65.5	0	0	0	0	114.2	Q88 N133 H137	Q88-S135 PolarHBondContact NE2-O 2.59Å; N133-S135 PolarHBondContact O-N 3.46Å; S135-H137 VanDerWaalsContact C-N 3.28Å
136	G	93.2	Very high	94.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.231	C	C	.	.	S	Bend	trans	78.7	7.3	-171.4	0	0	0	0	0	114	T83 D84 L87 N133 S134 C138	T83-G136 CarbonylContact C-O 3.57Å; T83-G136 WeakPolarHBondContact CA-O 3.26Å; D84-G136 PolarHBondContact N-O 3.11Å; D84-G136 WeakPolarHBondContact O-CA 3.47Å; L87-G136 VanDerWaalsContact O-CA 3.3Å; L87-G136 WeakPolarHBondContact O-CA 3.11Å; N133-G136 PolarHBondContact O-N 3.37Å; S134-G136 PolarHBondContact O-N 2.87Å; G136-C138 PolarHBondContact O-N 2.93Å
137	H	96.5	Very high	94.6	Very high	53 Å²	53	40.5 Å²	40.5	25%	0.245	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	119.6	176.1	-174	64.8	0	0	0	110.2	W82 V132 N133 S135	W82-H137 PolarHBondContact O-ND1 3.18Å; V132-H137 WeakPolarHBondContact CA-O 3.44Å; N133-H137 HydrophobicContact CB-CB 4.29Å; N133-H137 PolarHBondContact N-O 3.29Å; S135-H137 VanDerWaalsContact C-N 3.28Å
138	C	96.3	Very high	94.9	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	133.9	-179.4	-58.3	0	0	0	0	110	S81 W82 V130 L131 V132 G136	S81-C138 WeakPolarHBondContact CA-O 3.37Å; S81-C138 WeakPolarHBondContact CB-O 3.45Å; W82-C138 HydrophobicContact CD2-CB 3.78Å; W82-C138 VanDerWaalsContact CE2-CB 3.44Å; W82-C138 HydrophobicContact CE3-CB 4.31Å; W82-C138 HydrophobicContact CG-CB 4.19Å; W82-C138 HydrophobicContact CH2-CB 4.27Å; W82-C138 HydrophobicContact CZ2-CB 3.72Å; W82-C138 PolarHBondContact N-O 3.2Å; W82-C138 VanDerWaalsContact N-O 3.13Å; W82-C138 PolarHBondContact O-N 2.85Å; V130-C138 HydrophobicContact CG1-CB 4.11Å; L131-C138 CarbonylContact O-C 3.46Å; L131-C138 WeakPolarHBondContact O-CA 3.35Å; V132-C138 HydrophobicContact CG2-CB 4.46Å; G136-C138 PolarHBondContact O-N 2.93Å
139	Q	95.9	Very high	95	Very high	87 Å²	87	37.7 Å²	37.7	41%	0.407	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	125.6	174.5	-67.7	-175.8	-21.4	0	0	109.3	L131 L141	L131-Q139 HydrophobicContact CB-CB 4.46Å; L131-Q139 PolarHBondContact N-O 3.37Å; L131-Q139 PolarHBondContact O-N 3.34Å; Q139-L141 HydrophobicContact CB-CD1 4.11Å
140	Y	95.5	Very high	95	Very high	7 Å²	7	34.2 Å²	34.2	3%	0.027	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	119.6	179.5	-175.4	-136.7	0	0	0	109.9	M80 W82 T128 V130 P142	M80-Y140 HydrophobicContact CE-CD1 3.32Å; M80-Y140 HydrophobicContact CE-CE1 3.69Å; M80-Y140 HydrophobicContact CE-CG 4.33Å; M80-Y140 PolarHBondContact N-O 3.07Å; M80-Y140 PolarHBondContact O-N 2.87Å; M80-Y140 HydrophobicContact SD-CD1 4.29Å; W82-Y140 HydrophobicContact CH2-CG 4.45Å; T128-Y140 WeakPolarHBondContact O-CE2 3.3Å; V130-Y140 HydrophobicContact CG2-CD2 3.71Å; V130-Y140 HydrophobicContact CG2-CE2 4.27Å; V130-Y140 HydrophobicContact CG2-CG 4.1Å; Y140-P142 VanDerWaalsContact C-CD 3.49Å; Y140-P142 HydrophobicContact CD1-CG 4Å; Y140-P142 HydrophobicContact CE1-CB 4.11Å; Y140-P142 HydrophobicContact CE1-CG 3.55Å; Y140-P142 HydrophobicContact CE2-CB 4.07Å; Y140-P142 HydrophobicContact CE2-CG 4.23Å; Y140-P142 HydrophobicContact CG-CG 4.49Å
141	L	94.1	Very high	94.8	Very high	71 Å²	71	39.2 Å²	39.2	37%	0.372	21%	0.208	S	C	.	.			trans	-125.9	73.1	-176.6	-66	89.7	0	0	0	110.7	L78 Q79 T128 Q139	L78-L141 VanDerWaalsContact O-CA 3.27Å; L78-L141 WeakPolarHBondContact O-CA 3.47Å; Q79-L141 HydrophobicContact CG-CD2 4.44Å; Q79-L141 HydrophobicContact CG-CG 4.41Å; T128-L141 PolarHBondContact OG1-O 2.76Å; Q139-L141 HydrophobicContact CB-CD1 4.11Å
142	P	95.1	Very high	94.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.194	C	C	.	.			trans	-81	131.7	176.4	33.4	-35.3	0	0	0	111.2	L78 M80 T125 F126 Y140	L78-P142 HydrophobicContact CB-CG 4.17Å; L78-P142 PolarHBondContact N-O 3.15Å; L78-P142 VanDerWaalsContact N-O 3.1Å; L78-P142 WeakPolarHBondContact O-CD 3.34Å; M80-P142 HydrophobicContact CE-CG 3.71Å; T125-P142 HydrophobicContact CG2-CB 4.39Å; T125-P142 HydrophobicContact CG2-CG 4.28Å; F126-P142 WeakPolarHBondContact O-CB 3.28Å; Y140-P142 VanDerWaalsContact C-CD 3.49Å; Y140-P142 HydrophobicContact CD1-CG 4Å; Y140-P142 HydrophobicContact CE1-CB 4.11Å; Y140-P142 HydrophobicContact CE1-CG 3.55Å; Y140-P142 HydrophobicContact CE2-CB 4.07Å; Y140-P142 HydrophobicContact CE2-CG 4.23Å; Y140-P142 HydrophobicContact CG-CG 4.49Å
143	P	95.4	Very high	94.2	Very high	38 Å²	38	38.1 Å²	38.1	25%	0.247	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	145.7	167.7	33.5	-32.3	0	0	0	110.1	W77 F126 T128	W77-P143 VanDerWaalsContact CD1-CB 3.43Å; W77-P143 HydrophobicContact CG-CB 4.28Å; W77-P143 VanDerWaalsContact NE1-CB 3.35Å; F126-P143 HydrophobicContact CB-CG 4.08Å; F126-P143 PolarHBondContact N-O 3.45Å; T128-P143 HydrophobicContact CG2-CG 4.4Å
144	G	93.9	Very high	93.8	Very high	5 Å²	5	35.4 Å²	35.4	5%	0.052	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	152.3	178.6	0	0	0	0	0	113	I76 A124	I76-G144 PolarHBondContact N-O 3.44Å; I76-G144 PolarHBondContact O-N 3.34Å; I76-G144 VanDerWaalsContact O-O 3.11Å; A124-G144 VanDerWaalsContact O-CA 3.3Å; A124-G144 WeakPolarHBondContact O-CA 3.29Å
145	I	94.9	Very high	93.5	Very high	93 Å²	93	39.3 Å²	39.3	48%	0.477	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	101.7	172.7	-59.7	174.8	0	0	0	107.4	T73 T74 A124	T73-I145 HydrophobicContact CG2-CG2 3.71Å; T74-I145 CarbonylContact O-C 3.55Å; T74-I145 WeakPolarHBondContact O-CA 3.44Å; A124-I145 VanDerWaalsContact CB-O 3.31Å; A124-I145 WeakPolarHBondContact CB-O 3.37Å; A124-I145 PolarHBondContact O-N 2.86Å
146	F	95.3	Very high	93.2	Very high	8 Å²	8	40.9 Å²	40.9	4%	0.035	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	127.4	-176.7	-66.1	-88.8	0	0	0	110.5	T73 T74 I76 L78 L114 A124 T125 F168	T73-F146 WeakPolarHBondContact CA-O 3.48Å; T74-F146 PolarHBondContact N-O 3.17Å; T74-F146 PolarHBondContact O-N 2.91Å; T74-F146 PolarHBondContact OG1-O 2.9Å; I76-F146 HydrophobicContact CB-CD2 3.77Å; I76-F146 HydrophobicContact CB-CE2 3.98Å; I76-F146 HydrophobicContact CD1-CB 4.48Å; I76-F146 HydrophobicContact CD1-CD2 4.12Å; I76-F146 HydrophobicContact CG1-CD2 4.22Å; I76-F146 HydrophobicContact CG2-CE2 4.49Å; L78-F146 HydrophobicContact CD1-CE1 4.43Å; L78-F146 HydrophobicContact CD1-CE2 4.45Å; L78-F146 HydrophobicContact CD1-CZ 3.67Å; L78-F146 HydrophobicContact CD2-CE2 4.17Å; L78-F146 HydrophobicContact CD2-CZ 4.06Å; L78-F146 HydrophobicContact CG-CE2 4.13Å; L78-F146 HydrophobicContact CG-CZ 3.84Å; L114-F146 HydrophobicContact CB-CD1 4.34Å; L114-F146 HydrophobicContact CD2-CB 4.34Å; L114-F146 HydrophobicContact CD2-CD1 4.16Å; A124-F146 HydrophobicContact CB-CD1 4.1Å; A124-F146 HydrophobicContact CB-CE1 4.21Å; T125-F146 HydrophobicContact CG2-CE1 4.42Å; T125-F146 HydrophobicContact CG2-CZ 3.76Å; F146-F168 HydrophobicContact CD1-CE1 4.19Å; F146-F168 HydrophobicContact CD1-CZ 4.42Å; F146-F168 AromaticContact CE1-CE1 3.89Å; F146-F168 HydrophobicContact CE1-CE1 3.89Å; F146-F168 HydrophobicContact CE1-CZ 4.43Å; F146-F168 HydrophobicContact CZ-CE1 4.33Å
147	K	95.5	Very high	92.8	Very high	72 Å²	72	41.5 Å²	41.5	31%	0.313	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	118.5	166.3	-57.4	-175	-168.4	138.5	0	109.1	V71 L72 T73 S117 A118 D119	V71-K147 HydrophobicContact CG1-CB 4Å; L72-K147 WeakPolarHBondContact O-CA 3.48Å; T73-K147 HydrophobicContact CG2-CG 4.15Å; S117-K147 WeakPolarHBondContact CA-O 3.46Å; A118-K147 PolarHBondContact N-O 2.97Å; D119-K147 HydrophobicContact CB-CB 4.13Å; D119-K147 HydrophobicContact CB-CD 4.2Å; D119-K147 HydrophobicContact CB-CG 4.42Å; D119-K147 IonicContact OD1-NZ 2.66Å; D119-K147 PolarHBondContact OD1-NZ 3.36Å; D119-K147 WeakPolarHBondContact OD2-CD 3.19Å; D119-K147 VanDerWaalsContact OD2-CE 3.27Å; D119-K147 WeakPolarHBondContact OD2-CE 3.43Å; D119-K147 IonicContact OD2-NZ 3.14Å; D119-K147 PolarHBondContact OD2-NZ 3.14Å
148	S	95.6	Very high	92.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	143.3	-177.8	63.8	0	0	0	0	111.1	V71 L72 N116 C150 L166	V71-S148 WeakPolarHBondContact CA-O 3.29Å; L72-S148 PolarHBondContact N-O 3.1Å; L72-S148 PolarHBondContact O-N 2.86Å; L72-S148 PolarHBondContact O-OG 2.85Å; N116-S148 WeakPolarHBondContact O-CA 3.44Å; S148-C150 PolarHBondContact O-N 3.32Å; S148-L166 VanDerWaalsContact CB-CD2 3.41Å; S148-L166 WeakPolarHBondContact OG-CD2 3.26Å
149	S	94.7	Very high	91.8	Very high	66 Å²	66	40.3 Å²	40.3	46%	0.462	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	123	168.8	-58.7	0	0	0	0	109.3	N116	N116-S149 PolarHBondContact ND2-O 2.9Å; N116-S149 VanDerWaalsContact ND2-O 3.16Å; N116-S149 PolarHBondContact O-N 3.28Å
150	C	94	Very high	91.5	Very high	6 Å²	6	36.2 Å²	36.2	4%	0.041	17%	0.173	C	C	.	.			trans	-133.6	125.4	179.5	176.6	0	0	0	0	110.6	Q70 L72 S148 I152 C164	Q70-C150 CarbonylContact C-O 3.6Å; Q70-C150 WeakPolarHBondContact CB-O 3.47Å; Q70-C150 PolarHBondContact O-N 2.8Å; L72-C150 HydrophobicContact CB-CB 4.22Å; S148-C150 PolarHBondContact O-N 3.32Å; C150-I152 PolarHBondContact O-N 2.87Å; C150-C164 HydrophobicContact CB-CB 3.69Å; C150-C164 WeakPolarHBondContact CB-SG 3.41Å; C150-C164 WeakPolarHBondContact SG-CA 3.41Å; C150-C164 WeakPolarHBondContact SG-CB 3.44Å; C150-C164 CovalentContact SG-SG 2.03Å; C150-C164 PolarHBondContact SG-SG 2.76Å
151	Y	90.7	Very high	91.3	Very high	107 Å²	107	37.8 Å²	37.8	42%	0.42	18%	0.183	S	C	.	.			trans	-72.9	120.6	172.6	-179.2	-97.2	0	0	0	110.3	D153 D288	Y151-D153 HydrophobicContact CE1-CB 4.32Å; Y151-D288 WeakPolarHBondContact OH-CB 3.19Å; Y151-D288 PolarHBondContact OH-OD2 2.94Å
152	I	90.2	Very high	91.3	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.01	17%	0.166	C	C	.	.			trans	-100	120.8	179.6	-56.7	-58.7	0	0	0	109.3	V65 E67 C150 V154 Q162 M226	V65-I152 HydrophobicContact CG1-CD1 4.13Å; E67-I152 HydrophobicContact CB-CG2 4.29Å; E67-I152 HydrophobicContact CG-CG2 4.06Å; C150-I152 PolarHBondContact O-N 2.87Å; I152-V154 HydrophobicContact CG2-CG1 4.11Å; I152-Q162 HydrophobicContact CD1-CG 4.33Å; I152-Q162 HydrophobicContact CG2-CG 4.43Å; I152-M226 HydrophobicContact CD1-CE 4.5Å
153	D	88.3	Confident	91.3	Very high	35 Å²	35	39.5 Å²	39.5	19%	0.187	19%	0.189	C	C	.	.			trans	-93	111.5	176.5	-173.7	-6.1	0	0	0	110.4	Y151 R155 Q162	Y151-D153 HydrophobicContact CE1-CB 4.32Å; D153-R155 WeakPolarHBondContact OD1-CB 3.2Å; D153-R155 WeakPolarHBondContact OD1-CD 3.27Å; D153-R155 WeakPolarHBondContact OD1-CG 3.33Å; D153-R155 PolarHBondContact OD1-N 2.77Å; D153-R155 VanDerWaalsContact OD1-N 3.11Å; D153-R155 IonicContact OD1-NE 2.68Å; D153-R155 PolarHBondContact OD1-NE 3.47Å; D153-R155 IonicContact OD2-NE 3.61Å; D153-Q162 PolarHBondContact O-NE2 3.13Å
154	V	87.8	Confident	91.3	Very high	3 Å²	3	37.7 Å²	37.7	2%	0.018	18%	0.178	C	C	.	.			trans	-95.3	5.9	-174.3	-65	0	0	0	0	114.2	I152 W156 F157 P284 P291	I152-V154 HydrophobicContact CG2-CG1 4.11Å; V154-W156 VanDerWaalsContact C-N 3.28Å; V154-W156 PolarHBondContact O-N 2.98Å; V154-F157 WeakPolarHBondContact O-CB 3.41Å; V154-F157 PolarHBondContact O-N 3.29Å; V154-P284 HydrophobicContact CG1-CG 3.87Å; V154-P291 HydrophobicContact CB-CG 4.17Å; V154-P291 HydrophobicContact CG2-CG 3.8Å; V154-P291 WeakPolarHBondContact O-CA 3.27Å
155	R	86.8	Confident	91.4	Very high	109 Å²	109	43.6 Å²	43.6	41%	0.411	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-45.3	-176.9	-75.4	165.2	-164.4	-165	-3.2	113.4	D153 S289 L292	D153-R155 WeakPolarHBondContact OD1-CB 3.2Å; D153-R155 WeakPolarHBondContact OD1-CD 3.27Å; D153-R155 WeakPolarHBondContact OD1-CG 3.33Å; D153-R155 PolarHBondContact OD1-N 2.77Å; D153-R155 VanDerWaalsContact OD1-N 3.11Å; D153-R155 IonicContact OD1-NE 2.68Å; D153-R155 PolarHBondContact OD1-NE 3.47Å; D153-R155 IonicContact OD2-NE 3.61Å; R155-S289 VanDerWaalsContact NE-CB 3.33Å; R155-L292 WeakPolarHBondContact O-CB 3.43Å; R155-L292 PolarHBondContact O-N 2.98Å
156	W	87.1	Confident	91.5	Very high	96 Å²	96	39.2 Å²	39.2	36%	0.364	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	16.4	-173.8	-58.2	-76.6	0	0	0	113.9	V154 F159	V154-W156 VanDerWaalsContact C-N 3.28Å; V154-W156 PolarHBondContact O-N 2.98Å; W156-F159 CarbonylContact O-C 3.44Å; W156-F159 WeakPolarHBondContact O-CA 3.28Å; W156-F159 PolarHBondContact O-N 2.74Å
157	F	85.6	Confident	91.5	Very high	13 Å²	13	40.9 Å²	40.9	6%	0.057	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	134.2	179	-179.7	-86.7	0	0	0	111.8	V154 Y233 L237 I282 M283 I293	V154-F157 WeakPolarHBondContact O-CB 3.41Å; V154-F157 PolarHBondContact O-N 3.29Å; F157-Y233 HydrophobicContact CE1-CD1 4.24Å; F157-Y233 HydrophobicContact CE2-CE1 4.25Å; F157-Y233 AromaticContact CZ-CD1 3.62Å; F157-Y233 HydrophobicContact CZ-CD1 3.62Å; F157-Y233 AromaticContact CZ-CE1 3.63Å; F157-Y233 HydrophobicContact CZ-CE1 3.63Å; F157-Y233 HydrophobicContact CZ-CG 4.24Å; F157-L237 HydrophobicContact CE1-CD1 4.14Å; F157-I282 HydrophobicContact CZ-CD1 4.32Å; F157-M283 HydrophobicContact CD1-SD 4.43Å; F157-I293 HydrophobicContact CD1-CG2 3.85Å
158	P	85.8	Confident	91.5	Very high	7 Å²	7	37.5 Å²	37.5	5%	0.045	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	cis	-92.3	10	1.5	37.6	-37.4	0	0	0	114.6	D160 T230 Y233	P158-D160 VanDerWaalsContact C-OD1 3.22Å; P158-D160 PolarHBondContact O-N 3.16Å; P158-T230 VanDerWaalsContact O-CG2 3.26Å; P158-T230 WeakPolarHBondContact O-CG2 3.49Å; P158-Y233 HydrophobicContact CB-CD2 4.09Å; P158-Y233 HydrophobicContact CB-CG 4Å
159	F	86.1	Confident	91.5	Very high	22 Å²	22	37.5 Å²	37.5	10%	0.096	17%	0.172	C	C	.	.	S	Bend	trans	-90.5	35.7	-178.4	-52.8	-75	0	0	0	112.4	W156 T230 L238 A490 F493 A496	W156-F159 CarbonylContact O-C 3.44Å; W156-F159 WeakPolarHBondContact O-CA 3.28Å; W156-F159 PolarHBondContact O-N 2.74Å; F159-T230 HydrophobicContact CD1-CG2 3.7Å; F159-T230 HydrophobicContact CE1-CG2 4.01Å; F159-L238 HydrophobicContact CZ-CD1 4.31Å; F159-A490 HydrophobicContact CD2-CB 4.14Å; F159-F493 HydrophobicContact CD1-CD2 4.22Å; F159-F493 HydrophobicContact CD2-CD2 4.4Å; F159-F493 AromaticContact CE1-CD2 3.67Å; F159-F493 HydrophobicContact CE1-CD2 3.67Å; F159-F493 HydrophobicContact CE1-CE2 4.09Å; F159-F493 AromaticContact CE2-CD2 3.85Å; F159-F493 HydrophobicContact CE2-CD2 3.85Å; F159-F493 HydrophobicContact CE2-CE2 4.32Å; F159-F493 AromaticContact CZ-CD2 3.47Å; F159-F493 HydrophobicContact CZ-CD2 3.47Å; F159-F493 VanDerWaalsContact CZ-CD2 3.47Å; F159-F493 AromaticContact CZ-CE2 3.69Å; F159-F493 HydrophobicContact CZ-CE2 3.69Å; F159-A496 HydrophobicContact CD1-CB 3.87Å; F159-A496 HydrophobicContact CE1-CB 4.45Å
160	D	88.5	Confident	91.5	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	15%	0.15	C	C	.	.			trans	-89.8	151.5	-171.3	57.2	-56.3	0	0	0	113.5	P158 Q162 R228	P158-D160 VanDerWaalsContact C-OD1 3.22Å; P158-D160 PolarHBondContact O-N 3.16Å; D160-Q162 PolarHBondContact OD2-NE2 2.62Å; D160-R228 PolarHBondContact O-N 2.83Å; D160-R228 IonicContact OD1-NE 3.24Å; D160-R228 PolarHBondContact OD1-NE 3.3Å; D160-R228 IonicContact OD2-CZ 2.81Å; D160-R228 IonicContact OD2-NE 3.22Å; D160-R228 PolarHBondContact OD2-NE 3.03Å; D160-R228 IonicContact OD2-NH2 2.9Å
161	V	91.4	Very high	91.3	Very high	39 Å²	39	41.9 Å²	41.9	24%	0.236	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	120.8	170	179.7	0	0	0	0	107.5	T225 M226 R227	V161-T225 HydrophobicContact CG1-CG2 3.92Å; V161-M226 CarbonylContact C-O 3.54Å; V161-M226 WeakPolarHBondContact CA-O 3.15Å; V161-R227 HydrophobicContact CG2-CB 4.34Å; V161-R227 HydrophobicContact CG2-CG 4.19Å
162	Q	93.9	Very high	91.3	Very high	4 Å²	4	40.6 Å²	40.6	2%	0.019	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	145.1	-175.9	-58.1	-57.7	-21	0	0	111.1	I152 D153 D160 W196 T225 M226	I152-Q162 HydrophobicContact CD1-CG 4.33Å; I152-Q162 HydrophobicContact CG2-CG 4.43Å; D153-Q162 PolarHBondContact O-NE2 3.13Å; D160-Q162 PolarHBondContact OD2-NE2 2.62Å; Q162-W196 HydrophobicContact CB-CZ3 4.3Å; Q162-W196 HydrophobicContact CG-CH2 3.69Å; Q162-W196 HydrophobicContact CG-CZ3 3.73Å; Q162-T225 WeakPolarHBondContact O-CA 3.37Å; Q162-M226 HydrophobicContact CB-CE 3.72Å; Q162-M226 HydrophobicContact CB-CG 3.94Å; Q162-M226 HydrophobicContact CG-CE 4.3Å; Q162-M226 PolarHBondContact N-O 3.2Å; Q162-M226 PolarHBondContact O-N 3.38Å
163	H	95.1	Very high	91.4	Very high	104 Å²	104	43.2 Å²	43.2	48%	0.481	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	92	-177.8	-61.7	84.9	0	0	0	109.7	T223	H163-T223 HydrophobicContact CB-CG2 4.01Å
164	C	96.4	Very high	91.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	122.8	-178.8	-66.7	0	0	0	0	111.4	L72 C150 T223 V224	L72-C164 HydrophobicContact CD2-CB 3.41Å; L72-C164 VanDerWaalsContact CD2-CB 3.41Å; C150-C164 HydrophobicContact CB-CB 3.69Å; C150-C164 WeakPolarHBondContact CB-SG 3.41Å; C150-C164 WeakPolarHBondContact SG-CA 3.41Å; C150-C164 WeakPolarHBondContact SG-CB 3.44Å; C150-C164 CovalentContact SG-SG 2.03Å; C150-C164 PolarHBondContact SG-SG 2.76Å; C164-T223 CarbonylContact O-C 3.58Å; C164-T223 WeakPolarHBondContact O-CA 3.48Å; C164-V224 PolarHBondContact N-O 2.94Å; C164-V224 PolarHBondContact O-N 2.68Å
165	K	96.3	Very high	91.8	Very high	129 Å²	129	42.4 Å²	42.4	56%	0.561	20%	0.195	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	132.9	-178.9	-63.3	176	-173.9	170.3	0	109.8	N116 T221 F222 T223	N116-K165 PolarHBondContact ND2-O 2.96Å; K165-T221 HydrophobicContact CB-CG2 3.95Å; K165-T221 HydrophobicContact CD-CG2 4.46Å; K165-T221 HydrophobicContact CG-CG2 4.26Å; K165-F222 CarbonylContact C-O 3.56Å; K165-F222 WeakPolarHBondContact CA-O 3.5Å; K165-T223 HydrophobicContact CG-CG2 4.26Å
166	L	96	Very high	92.1	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	108.8	170.5	-60.9	174.7	0	0	0	107.5	I76 L114 S148 F168 T221 F222 V224	I76-L166 HydrophobicContact CD1-CD1 3.53Å; L114-L166 HydrophobicContact CD1-CB 4.2Å; L114-L166 HydrophobicContact CD1-CD2 4.31Å; S148-L166 VanDerWaalsContact CB-CD2 3.41Å; S148-L166 WeakPolarHBondContact OG-CD2 3.26Å; L166-F168 HydrophobicContact CB-CD2 4.39Å; L166-F168 HydrophobicContact CB-CE2 3.74Å; L166-F168 HydrophobicContact CB-CZ 4.45Å; L166-T221 WeakPolarHBondContact O-CA 3.27Å; L166-F222 PolarHBondContact N-O 3.4Å; L166-F222 PolarHBondContact O-N 3.33Å; L166-V224 HydrophobicContact CD1-CG2 3.79Å; L166-V224 HydrophobicContact CG-CG2 4.34Å
167	K	95.6	Very high	92.3	Very high	44 Å²	44	42.4 Å²	42.4	19%	0.191	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	108.5	-174.7	-173.8	174.5	-174.4	-178.2	0	110.9	L114 Y115 N116 D219	L114-K167 CarbonylContact C-O 3.58Å; L114-K167 WeakPolarHBondContact CA-O 3.21Å; Y115-K167 HydrophobicContact CD2-CD 3.77Å; Y115-K167 HydrophobicContact CD2-CG 3.92Å; Y115-K167 HydrophobicContact CG-CG 4.46Å; Y115-K167 PolarHBondContact N-O 2.93Å; N116-K167 PolarHBondContact OD1-N 3.01Å; K167-D219 VanDerWaalsContact CE-CB 3.49Å; K167-D219 WeakPolarHBondContact CE-OD1 3.32Å; K167-D219 WeakPolarHBondContact CE-OD2 3.46Å; K167-D219 HydrophobicContact CG-CB 4.47Å; K167-D219 IonicContact NZ-OD1 3.97Å; K167-D219 PolarHBondContact NZ-OD1 2.99Å; K167-D219 IonicContact NZ-OD2 2.8Å
168	F	96	Very high	92.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	143.4	178.1	-64.8	-82.8	0	0	0	111.5	F55 L57 L78 I112 L113 L114 F146 L166 D219 V220 F222	F55-F168 HydrophobicContact CE1-CB 3.61Å; F55-F168 AromaticContact CE1-CD2 3.76Å; F55-F168 HydrophobicContact CE1-CD2 3.76Å; F55-F168 AromaticContact CE1-CG 3.75Å; F55-F168 HydrophobicContact CE1-CG 3.75Å; F55-F168 HydrophobicContact CZ-CB 3.7Å; F55-F168 AromaticContact CZ-CD1 3.92Å; F55-F168 HydrophobicContact CZ-CD1 3.92Å; F55-F168 AromaticContact CZ-CD2 3.76Å; F55-F168 HydrophobicContact CZ-CD2 3.76Å; F55-F168 HydrophobicContact CZ-CE1 4.48Å; F55-F168 HydrophobicContact CZ-CE2 4.33Å; F55-F168 AromaticContact CZ-CG 3.51Å; F55-F168 HydrophobicContact CZ-CG 3.51Å; L57-F168 HydrophobicContact CD2-CE2 3.97Å; L78-F168 HydrophobicContact CD2-CE1 4.04Å; L78-F168 HydrophobicContact CD2-CZ 4.03Å; I112-F168 HydrophobicContact CG2-CB 4.01Å; I112-F168 HydrophobicContact CG2-CD1 4.48Å; L113-F168 WeakPolarHBondContact O-CA 3.26Å; L114-F168 HydrophobicContact CB-CD1 4.27Å; L114-F168 HydrophobicContact CB-CE1 4Å; L114-F168 HydrophobicContact CD1-CD1 4.35Å; L114-F168 HydrophobicContact CD1-CE1 4.02Å; L114-F168 HydrophobicContact CD1-CE2 4.26Å; L114-F168 HydrophobicContact CD1-CZ 3.98Å; F146-F168 HydrophobicContact CD1-CE1 4.19Å; F146-F168 HydrophobicContact CD1-CZ 4.42Å; F146-F168 AromaticContact CE1-CE1 3.89Å; F146-F168 HydrophobicContact CE1-CE1 3.89Å; F146-F168 HydrophobicContact CE1-CZ 4.43Å; F146-F168 HydrophobicContact CZ-CE1 4.33Å; L166-F168 HydrophobicContact CB-CD2 4.39Å; L166-F168 HydrophobicContact CB-CE2 3.74Å; L166-F168 HydrophobicContact CB-CZ 4.45Å; F168-D219 CarbonylContact O-C 3.56Å; F168-D219 WeakPolarHBondContact O-CA 3.32Å; F168-V220 PolarHBondContact N-O 2.81Å; F168-V220 PolarHBondContact O-N 2.68Å; F168-F222 HydrophobicContact CD2-CD2 4.36Å
169	G	94.9	Very high	93.2	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.6	166.5	175	0	0	0	0	0	111.7	I112 L113	I112-G169 WeakPolarHBondContact CA-O 3.43Å; L113-G169 PolarHBondContact N-O 2.99Å; L113-G169 PolarHBondContact O-N 2.88Å; L113-G169 VanDerWaalsContact O-N 3.11Å
170	S	94.4	Very high	93.7	Very high	2 Å²	2	42 Å²	42	1%	0.014	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	142.2	170.4	175.2	0	0	0	0	109.9	D111 Y115 Y173	D111-S170 WeakPolarHBondContact O-CA 3.46Å; D111-S170 PolarHBondContact OD1-OG 2.79Å; Y115-S170 PolarHBondContact OH-O 2.89Å; S170-Y173 WeakPolarHBondContact OG-CB 3.45Å; S170-Y173 PolarHBondContact OG-N 2.97Å; S170-Y173 PolarHBondContact OG-O 2.73Å
171	W	90.3	Very high	94.1	Very high	163 Å²	163	45 Å²	45	62%	0.617	21%	0.214	S	C	*	.	S	Bend	trans	-85.9	-43.8	176.9	-169.9	-102.5	0	0	0	112.2	D111 L113 Y115	D111-W171 PolarHBondContact O-N 2.9Å; D111-W171 PolarHBondContact OD2-N 3.39Å; L113-W171 HydrophobicContact CD1-CB 4.01Å; L113-W171 HydrophobicContact CD1-CG 4.29Å; Y115-W171 HydrophobicContact CD1-CE3 4.23Å; Y115-W171 HydrophobicContact CD1-CZ3 4.3Å; Y115-W171 HydrophobicContact CE1-CE3 4.03Å; Y115-W171 HydrophobicContact CE1-CZ3 4.45Å
172	S	91.1	Very high	94.3	Very high	80 Å²	80	46 Å²	46	56%	0.559	22%	0.217	S	C	*	.	S	Bend	trans	-101.8	-29	-170.3	-42.4	0	0	0	0	113.3	D111	D111-S172 WeakPolarHBondContact OD2-CB 3.47Å; D111-S172 PolarHBondContact OD2-N 3.36Å; D111-S172 PolarHBondContact OD2-OG 3.45Å
173	Y	92.6	Very high	94.3	Very high	57 Å²	57	49.2 Å²	49.2	22%	0.224	23%	0.232	C	C	.	.			trans	-96.5	124.7	-175.6	-60.1	-83.4	0	0	0	111.8	W108 D111 S170 L178	W108-Y173 HydrophobicContact CZ2-CE2 4.13Å; W108-Y173 PolarHBondContact NE1-OH 3.44Å; D111-Y173 WeakPolarHBondContact OD1-CD2 3.45Å; S170-Y173 WeakPolarHBondContact OG-CB 3.45Å; S170-Y173 PolarHBondContact OG-N 2.97Å; S170-Y173 PolarHBondContact OG-O 2.73Å; Y173-L178 HydrophobicContact CD2-CD1 4.23Å; Y173-L178 HydrophobicContact CG-CB 4.39Å; Y173-L178 HydrophobicContact CG-CD1 4.42Å
174	G	92.3	Very high	94.3	Very high	2 Å²	2	52.8 Å²	52.8	2%	0.021	25%	0.249	C	C	.	.			trans	-76.2	170.8	167.4	0	0	0	0	0	113	W176 S177 L178	G174-W176 PolarHBondContact O-N 2.96Å; G174-W176 VanDerWaalsContact O-N 3.12Å; G174-S177 PolarHBondContact O-N 3.43Å; G174-L178 PolarHBondContact O-N 3.46Å
175	G	91.4	Very high	94.1	Very high	19 Å²	19	54 Å²	54	20%	0.196	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-14.2	-175.5	0	0	0	0	0	115.5	L178 P216	G175-L178 WeakPolarHBondContact CA-O 3.43Å; G175-P216 VanDerWaalsContact CA-O 3.26Å; G175-P216 WeakPolarHBondContact CA-O 3.47Å; G175-P216 PolarHBondContact N-O 2.76Å
176	W	92.4	Very high	93.9	Very high	167 Å²	167	51.1 Å²	51.1	63%	0.633	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-23.3	171.2	-60.4	-17.8	0	0	0	112.9	G174 E215	G174-W176 PolarHBondContact O-N 2.96Å; G174-W176 VanDerWaalsContact O-N 3.12Å; W176-E215 HydrophobicContact CD2-CB 4.01Å; W176-E215 HydrophobicContact CE3-CB 4.11Å; W176-E215 HydrophobicContact CH2-CB 4.48Å; W176-E215 HydrophobicContact CZ2-CB 4.38Å; W176-E215 HydrophobicContact CZ3-CB 4.35Å
177	S	92.9	Very high	93.7	Very high	38 Å²	38	54.4 Å²	54.4	27%	0.266	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	-35.6	-177.9	-63.7	0	0	0	0	112.7	R42 P50 L51 G174	R42-S177 WeakPolarHBondContact CD-O 3.34Å; R42-S177 PolarHBondContact NH1-O 3.22Å; P50-S177 WeakPolarHBondContact CA-O 3.29Å; L51-S177 PolarHBondContact N-O 3.4Å; G174-S177 PolarHBondContact O-N 3.43Å
178	L	94.8	Very high	93.5	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	124.4	-177	-172.5	154.6	0	0	0	109.8	L51 V53 W108 P110 Y173 G174 G175 L180	L51-L178 WeakPolarHBondContact O-CA 3.43Å; V53-L178 HydrophobicContact CG2-CD1 4.09Å; V53-L178 HydrophobicContact CG2-CD2 4.31Å; V53-L178 HydrophobicContact CG2-CG 4.05Å; W108-L178 HydrophobicContact CH2-CD1 4.41Å; P110-L178 HydrophobicContact CB-CD1 4.13Å; Y173-L178 HydrophobicContact CD2-CD1 4.23Å; Y173-L178 HydrophobicContact CG-CB 4.39Å; Y173-L178 HydrophobicContact CG-CD1 4.42Å; G174-L178 PolarHBondContact O-N 3.46Å; G175-L178 WeakPolarHBondContact CA-O 3.43Å; L178-L180 HydrophobicContact CD2-CB 4.19Å
179	D	95.3	Very high	93.2	Very high	32 Å²	32	59 Å²	59	17%	0.171	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	114.4	174.1	178.7	31.3	0	0	0	110.1	P50 L51 T52 V53 Q181 R205	P50-D179 HydrophobicContact CB-CB 4.4Å; L51-D179 PolarHBondContact O-N 2.92Å; T52-D179 WeakPolarHBondContact CA-O 3.32Å; V53-D179 PolarHBondContact N-O 2.89Å; D179-Q181 PolarHBondContact OD1-NE2 3.43Å; D179-Q181 PolarHBondContact OD2-NE2 2.03Å; D179-R205 IonicContact OD1-CZ 3.99Å; D179-R205 IonicContact OD1-NE 3.21Å; D179-R205 IonicContact OD1-NH2 2.71Å; D179-R205 PolarHBondContact OD1-NH2 3.03Å
180	L	96.1	Very high	93.2	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	113.2	-178.7	-169.3	63.9	0	0	0	109.8	V53 F55 I112 L178 R205 P218 V220	V53-L180 HydrophobicContact CB-CD1 4.25Å; V53-L180 HydrophobicContact CG1-CD1 4.21Å; F55-L180 HydrophobicContact CB-CD1 3.65Å; F55-L180 HydrophobicContact CB-CG 4.35Å; F55-L180 HydrophobicContact CG-CD1 4.31Å; I112-L180 HydrophobicContact CD1-CD1 3.89Å; I112-L180 HydrophobicContact CD1-CD2 4.44Å; L178-L180 HydrophobicContact CD2-CB 4.19Å; L180-R205 WeakPolarHBondContact O-CD 3.46Å; L180-R205 PolarHBondContact O-NE 3.35Å; L180-P218 HydrophobicContact CB-CB 4.22Å; L180-P218 HydrophobicContact CB-CG 4.28Å; L180-V220 HydrophobicContact CD2-CB 4.29Å; L180-V220 HydrophobicContact CD2-CG2 3.7Å; L180-V220 HydrophobicContact CG-CG2 3.86Å
181	Q	96.1	Very high	93.1	Very high	64 Å²	64	65.6 Å²	65.6	30%	0.299	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	125.8	179.5	-69.5	-64	-22.5	0	0	110.6	T52 V53 Y54 F55 D179	T52-Q181 HydrophobicContact CG2-CB 4.32Å; T52-Q181 HydrophobicContact CG2-CG 3.58Å; V53-Q181 PolarHBondContact O-N 2.91Å; Y54-Q181 CarbonylContact C-O 3.57Å; Y54-Q181 WeakPolarHBondContact CA-O 3.21Å; Y54-Q181 HydrophobicContact CD1-CB 3.72Å; Y54-Q181 HydrophobicContact CE1-CB 4Å; Y54-Q181 HydrophobicContact CE1-CG 4.44Å; Y54-Q181 HydrophobicContact CG-CB 4.47Å; F55-Q181 PolarHBondContact N-O 3.27Å; D179-Q181 PolarHBondContact OD1-NE2 3.43Å; D179-Q181 PolarHBondContact OD2-NE2 2.03Å
182	M	95.8	Very high	93.2	Very high	60 Å²	60	62.2 Å²	62.2	30%	0.296	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	133.7	-178.3	-177.7	-175.6	80.4	0	0	111	G203 K204 R205 V220 F222	M182-G203 WeakPolarHBondContact CE-O 3.05Å; M182-G203 VanDerWaalsContact SD-CA 3.58Å; M182-K204 PolarHBondContact SD-N 3.34Å; M182-R205 HydrophobicContact CB-CB 4.31Å; M182-V220 HydrophobicContact CB-CG1 4Å; M182-V220 HydrophobicContact CB-CG2 3.93Å; M182-V220 HydrophobicContact CG-CG1 3.6Å; M182-V220 HydrophobicContact CG-CG2 4.47Å; M182-V220 HydrophobicContact SD-CG1 3.78Å; M182-F222 HydrophobicContact CG-CZ 4.14Å
183	Q	95.4	Very high	93.1	Very high	73 Å²	73	59.5 Å²	59.5	34%	0.341	33%	0.325	S	S	.	.			trans	-109.9	159.3	163.8	-68.1	179.3	7.6	0	0	109.6	Y54 F55	Y54-Q183 HydrophobicContact CD1-CG 4.5Å; F55-Q183 PolarHBondContact O-N 3.45Å
184	E	94.3	Very high	92.9	Very high	179 Å²	179	60.3 Å²	60.3	84%	0.836	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-62.4	145.7	178.6	-65.9	-177.6	174.1	0	0	111.1	S56	S56-E184 PolarHBondContact OG-O 2.89Å
185	A	93.3	Very high	92.8	Very high	24 Å²	24	63.5 Å²	63.5	20%	0.198	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-73.1	138	177.8	0	0	0	0	0	110.4	L57 I201 F222	L57-A185 HydrophobicContact CD1-CB 3.9Å; L57-A185 HydrophobicContact CG-CB 4.23Å; L57-A185 CarbonylContact O-C 3.58Å; L57-A185 VanDerWaalsContact O-CA 3.29Å; L57-A185 WeakPolarHBondContact O-CA 3.47Å; A185-I201 HydrophobicContact CB-CB 4.19Å; A185-I201 HydrophobicContact CB-CG2 4.19Å; A185-F222 HydrophobicContact CB-CD1 4.02Å; A185-F222 HydrophobicContact CB-CE1 3.8Å
186	D	92	Very high	92.8	Very high	69 Å²	69	62.8 Å²	62.8	37%	0.369	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-93	127.5	176	-174.3	16.1	0	0	0	110.9	L57 S58 L59 S188	L57-D186 PolarHBondContact O-N 3.42Å; S58-D186 VanDerWaalsContact CA-O 3.27Å; S58-D186 WeakPolarHBondContact CA-O 3Å; L59-D186 PolarHBondContact N-O 3.42Å; D186-S188 VanDerWaalsContact CG-OG 3.23Å; D186-S188 WeakPolarHBondContact OD1-CB 3.41Å; D186-S188 PolarHBondContact OD1-N 3.4Å; D186-S188 PolarHBondContact OD1-OG 2.85Å; D186-S188 PolarHBondContact OD2-OG 3.43Å
187	T	90.9	Very high	92.8	Very high	70 Å²	70	56.6 Å²	56.6	43%	0.429	34%	0.335	S	S	.	.			trans	-112.6	8.1	176	61.2	0	0	0	0	112.5	G189 Y190 L198 I201	T187-G189 VanDerWaalsContact C-N 3.26Å; T187-G189 PolarHBondContact O-N 2.87Å; T187-Y190 VanDerWaalsContact O-CB 3.28Å; T187-Y190 WeakPolarHBondContact O-CB 3.38Å; T187-Y190 PolarHBondContact O-N 2.9Å; T187-Y190 VanDerWaalsContact O-N 3.13Å; T187-L198 HydrophobicContact CG2-CD2 4.08Å; T187-I201 HydrophobicContact CG2-CD1 3.97Å; T187-I201 HydrophobicContact CG2-CG1 4.43Å
188	S	90.6	Very high	92.8	Very high	100 Å²	100	56.6 Å²	56.6	70%	0.699	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-34	-176.6	67.5	0	0	0	0	113.3	D186	D186-S188 VanDerWaalsContact CG-OG 3.23Å; D186-S188 WeakPolarHBondContact OD1-CB 3.41Å; D186-S188 PolarHBondContact OD1-N 3.4Å; D186-S188 PolarHBondContact OD1-OG 2.85Å; D186-S188 PolarHBondContact OD2-OG 3.43Å
189	G	90	Very high	92.7	Very high	39 Å²	39	60.6 Å²	60.6	40%	0.402	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	11.2	177.7	0	0	0	0	0	115.2	L60 T187 I191	L60-G189 WeakPolarHBondContact CD2-O 3.31Å; T187-G189 VanDerWaalsContact C-N 3.26Å; T187-G189 PolarHBondContact O-N 2.87Å; G189-I191 PolarHBondContact O-N 2.79Å
190	Y	94.9	Very high	92.6	Very high	42 Å²	42	60.2 Å²	60.2	17%	0.165	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-71.4	125.9	-174.9	179.2	-110.5	0	0	0	112.2	L59 L60 I62 T187 P192 L198	L59-Y190 HydrophobicContact CD2-CD2 4.19Å; L59-Y190 HydrophobicContact CD2-CE2 4.1Å; L59-Y190 HydrophobicContact CG-CD2 4.14Å; L59-Y190 HydrophobicContact CG-CE2 4.36Å; L60-Y190 WeakPolarHBondContact O-CA 3.3Å; I62-Y190 HydrophobicContact CD1-CE2 4.49Å; I62-Y190 HydrophobicContact CG1-CE2 4.2Å; T187-Y190 VanDerWaalsContact O-CB 3.28Å; T187-Y190 WeakPolarHBondContact O-CB 3.38Å; T187-Y190 PolarHBondContact O-N 2.9Å; T187-Y190 VanDerWaalsContact O-N 3.13Å; Y190-P192 HydrophobicContact CE1-CB 4.27Å; Y190-L198 HydrophobicContact CD1-CB 4.24Å; Y190-L198 HydrophobicContact CD1-CD2 3.86Å; Y190-L198 HydrophobicContact CD2-CD2 3.95Å; Y190-L198 HydrophobicContact CE1-CB 3.56Å; Y190-L198 HydrophobicContact CE1-CD2 3.96Å; Y190-L198 HydrophobicContact CE1-CG 4.42Å; Y190-L198 HydrophobicContact CE2-CB 4.41Å; Y190-L198 HydrophobicContact CE2-CD2 4.07Å; Y190-L198 HydrophobicContact CG-CD2 3.85Å
191	I	93.9	Very high	92.6	Very high	99 Å²	99	61.1 Å²	61.1	51%	0.508	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-94.1	117.3	171.9	-57.5	173.6	0	0	0	107.5	L60 G189	L60-I191 PolarHBondContact O-N 2.82Å; G189-I191 PolarHBondContact O-N 2.79Å
192	P	90.8	Very high	92.6	Very high	92 Å²	92	61.6 Å²	61.6	60%	0.597	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-63.8	137.8	-176.9	26	-33.6	0	0	0	111.6	Y190	Y190-P192 HydrophobicContact CE1-CB 4.27Å
193	S	89.8	Confident	92.6	Very high	24 Å²	24	60.2 Å²	60.2	17%	0.168	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-79	150.2	173.5	179.8	0	0	0	0	110.9	E195 W196	S193-E195 VanDerWaalsContact C-N 3.26Å; S193-E195 PolarHBondContact O-N 2.9Å; S193-E195 PolarHBondContact OG-N 2.95Å; S193-W196 WeakPolarHBondContact CB-O 3.46Å
194	G	88.6	Confident	92.7	Very high	73 Å²	73	63.3 Å²	63.3	75%	0.753	39%	0.386	S	S	*	.	S	Bend	trans	-74.5	-15.6	175.4	0	0	0	0	0	113.9	R229	G194-R229 WeakPolarHBondContact O-CD 3.42Å
195	E	89	Confident	92.7	Very high	69 Å²	69	58.4 Å²	58.4	32%	0.322	36%	0.36	S	S	.	.	S	Bend	trans	-111.9	-31.6	-176.9	-171.6	-178	161.8	0	0	113	S193 R228 R229 Y233	S193-E195 VanDerWaalsContact C-N 3.26Å; S193-E195 PolarHBondContact O-N 2.9Å; S193-E195 PolarHBondContact OG-N 2.95Å; E195-R228 IonicContact OE1-NH1 2.79Å; E195-R228 PolarHBondContact OE1-NH1 3.05Å; E195-R228 VanDerWaalsContact OE1-NH1 3.09Å; E195-R229 WeakPolarHBondContact O-CB 3.25Å; E195-R229 PolarHBondContact O-N 2.82Å; E195-Y233 PolarHBondContact OE1-OH 2.77Å
196	W	92.4	Very high	92.8	Very high	4 Å²	4	59.1 Å²	59.1	2%	0.015	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	130.2	-172.9	-65.8	93.4	0	0	0	111.9	V65 Q162 S193 M226 R227 R228	V65-W196 HydrophobicContact CB-CZ2 4.14Å; V65-W196 HydrophobicContact CG1-CZ2 4Å; V65-W196 HydrophobicContact CG2-CD2 4.41Å; V65-W196 HydrophobicContact CG2-CG 4.43Å; V65-W196 HydrophobicContact CG2-CZ2 4.36Å; Q162-W196 HydrophobicContact CB-CZ3 4.3Å; Q162-W196 HydrophobicContact CG-CH2 3.69Å; Q162-W196 HydrophobicContact CG-CZ3 3.73Å; S193-W196 WeakPolarHBondContact CB-O 3.46Å; W196-M226 HydrophobicContact CD2-CG 4.37Å; W196-M226 HydrophobicContact CD2-SD 4.25Å; W196-M226 HydrophobicContact CE3-CB 4.06Å; W196-M226 HydrophobicContact CE3-CE 4.33Å; W196-M226 HydrophobicContact CE3-CG 3.67Å; W196-M226 HydrophobicContact CE3-SD 4.12Å; W196-M226 HydrophobicContact CH2-CE 4.32Å; W196-M226 HydrophobicContact CZ3-CE 4.24Å; W196-M226 HydrophobicContact CZ3-CG 4Å; W196-R227 CarbonylContact C-O 3.56Å; W196-R227 WeakPolarHBondContact CA-O 3.34Å; W196-R228 HydrophobicContact CE3-CB 4.2Å; W196-R228 HydrophobicContact CH2-CB 4.27Å; W196-R228 VanDerWaalsContact CH2-NH2 3.25Å; W196-R228 VanDerWaalsContact CZ2-CZ 3.41Å; W196-R228 VanDerWaalsContact CZ2-NH2 3.26Å; W196-R228 HydrophobicContact CZ3-CB 3.9Å
197	D	92.1	Very high	92.9	Very high	38 Å²	38	60.7 Å²	60.7	20%	0.203	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	124.3	170.1	-72.5	-31.8	0	0	0	110.7	V199 M226 R227 R229	D197-V199 PolarHBondContact O-N 2.9Å; D197-M226 CarbonylContact O-C 3.46Å; D197-M226 VanDerWaalsContact O-CA 3.32Å; D197-M226 WeakPolarHBondContact O-CA 3.1Å; D197-R227 HydrophobicContact CB-CB 4.43Å; D197-R227 PolarHBondContact N-O 3.11Å; D197-R227 PolarHBondContact O-N 2.95Å; D197-R229 IonicContact OD1-CZ 3.97Å; D197-R229 IonicContact OD1-NE 3.09Å; D197-R229 PolarHBondContact OD1-NE 3.23Å; D197-R229 IonicContact OD1-NH2 2.88Å; D197-R229 PolarHBondContact OD1-NH2 3.18Å; D197-R229 IonicContact OD2-CZ 2.74Å; D197-R229 IonicContact OD2-NE 3.24Å; D197-R229 IonicContact OD2-NH2 2.79Å
198	L	93.8	Very high	92.9	Very high	38 Å²	38	62.3 Å²	62.3	20%	0.199	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	116	172.4	-177.7	67.1	0	0	0	109.9	L59 I62 T187 Y190 I201 V224	L59-L198 HydrophobicContact CD2-CD1 4.01Å; L59-L198 HydrophobicContact CD2-CD2 4.06Å; I62-L198 HydrophobicContact CD1-CD1 4.5Å; T187-L198 HydrophobicContact CG2-CD2 4.08Å; Y190-L198 HydrophobicContact CD1-CB 4.24Å; Y190-L198 HydrophobicContact CD1-CD2 3.86Å; Y190-L198 HydrophobicContact CD2-CD2 3.95Å; Y190-L198 HydrophobicContact CE1-CB 3.56Å; Y190-L198 HydrophobicContact CE1-CD2 3.96Å; Y190-L198 HydrophobicContact CE1-CG 4.42Å; Y190-L198 HydrophobicContact CE2-CB 4.41Å; Y190-L198 HydrophobicContact CE2-CD2 4.07Å; Y190-L198 HydrophobicContact CG-CD2 3.85Å; L198-I201 HydrophobicContact CD1-CD1 4.39Å; L198-I201 HydrophobicContact CD1-CG1 3.96Å; L198-I201 HydrophobicContact CD2-CD1 4.4Å; L198-V224 HydrophobicContact CD1-CG1 3.98Å
199	V	92.4	Very high	93	Very high	84 Å²	84	63.9 Å²	63.9	51%	0.509	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-41.2	175.4	-177.9	0	0	0	0	110.5	D197 T225 R227	D197-V199 PolarHBondContact O-N 2.9Å; V199-T225 HydrophobicContact CB-CG2 4.07Å; V199-T225 WeakPolarHBondContact CB-O 3.33Å; V199-T225 HydrophobicContact CG1-CG2 4.45Å; V199-T225 PolarHBondContact N-O 3.38Å; V199-R227 HydrophobicContact CG2-CB 3.98Å
200	G	93.4	Very high	93	Very high	23 Å²	23	65.2 Å²	65.2	24%	0.237	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.5	171.7	178.2	0	0	0	0	0	113.3	T225	G200-T225 PolarHBondContact N-O 3.35Å; G200-T225 WeakPolarHBondContact O-CB 3.43Å; G200-T225 PolarHBondContact O-N 3.31Å
201	I	96.1	Very high	92.8	Very high	20 Å²	20	73.2 Å²	73.2	10%	0.103	40%	0.396	C	S	.	.			trans	-130.4	73.8	-178.3	-46.6	174.9	0	0	0	110.2	L57 L59 A185 T187 L198 G203 F222 T223 V224	L57-I201 HydrophobicContact CD1-CD1 4.4Å; L59-I201 HydrophobicContact CB-CD1 3.56Å; L59-I201 HydrophobicContact CD2-CD1 3.58Å; L59-I201 HydrophobicContact CD2-CG1 4.5Å; L59-I201 HydrophobicContact CG-CD1 4.2Å; A185-I201 HydrophobicContact CB-CB 4.19Å; A185-I201 HydrophobicContact CB-CG2 4.19Å; T187-I201 HydrophobicContact CG2-CD1 3.97Å; T187-I201 HydrophobicContact CG2-CG1 4.43Å; L198-I201 HydrophobicContact CD1-CD1 4.39Å; L198-I201 HydrophobicContact CD1-CG1 3.96Å; L198-I201 HydrophobicContact CD2-CD1 4.4Å; I201-G203 PolarHBondContact O-N 3.4Å; I201-F222 HydrophobicContact CG2-CB 3.88Å; I201-F222 HydrophobicContact CG2-CD1 4.04Å; I201-F222 HydrophobicContact CG2-CG 4.38Å; I201-T223 WeakPolarHBondContact CA-O 3.16Å; I201-V224 HydrophobicContact CG2-CG2 4.36Å
202	P	96.2	Very high	92.5	Very high	74 Å²	74	73.7 Å²	73.7	48%	0.481	41%	0.407	S	S	.	.			trans	-61.1	129.2	172.9	23.3	-34.5	0	0	0	111.5	T223	P202-T223 WeakPolarHBondContact CD-O 3.46Å; P202-T223 PolarHBondContact O-N 3.43Å
203	G	95.6	Very high	92.2	Very high	30 Å²	30	71.1 Å²	71.1	31%	0.309	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	144.4	173.2	0	0	0	0	0	112	M182 I201 T221	M182-G203 WeakPolarHBondContact CE-O 3.05Å; M182-G203 VanDerWaalsContact SD-CA 3.58Å; I201-G203 PolarHBondContact O-N 3.4Å; G203-T221 CarbonylContact C-O 3.59Å
204	K	95.9	Very high	92.2	Very high	139 Å²	139	79 Å²	79	60%	0.604	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.9	123.6	171.7	-177.7	179.1	176.6	-179.6	0	110.9	M182 T221	M182-K204 PolarHBondContact SD-N 3.34Å; K204-T221 PolarHBondContact N-O 2.77Å; K204-T221 PolarHBondContact O-N 2.83Å
205	R	95.7	Very high	92.3	Very high	75 Å²	75	77.8 Å²	77.8	28%	0.283	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	133.5	166.4	-174.5	-178.8	178.1	-80.3	2.1	109.9	D179 L180 M182 E207 D219	D179-R205 IonicContact OD1-CZ 3.99Å; D179-R205 IonicContact OD1-NE 3.21Å; D179-R205 IonicContact OD1-NH2 2.71Å; D179-R205 PolarHBondContact OD1-NH2 3.03Å; L180-R205 WeakPolarHBondContact O-CD 3.46Å; L180-R205 PolarHBondContact O-NE 3.35Å; M182-R205 HydrophobicContact CB-CB 4.31Å; R205-E207 IonicContact CZ-OE1 2.68Å; R205-E207 IonicContact NH1-OE1 3.38Å; R205-E207 PolarHBondContact NH1-OE1 3.24Å; R205-E207 IonicContact NH2-OE1 2.82Å; R205-E207 PolarHBondContact NH2-OE1 3.4Å; R205-D219 WeakPolarHBondContact CA-O 3.5Å
206	S	94.6	Very high	92.6	Very high	39 Å²	39	75.3 Å²	75.3	27%	0.273	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	154.5	175.9	-54	0	0	0	0	110.2	D219	S206-D219 PolarHBondContact N-O 3.33Å; S206-D219 PolarHBondContact O-N 3.47Å; S206-D219 VanDerWaalsContact O-O 3.09Å
207	E	93.8	Very high	92.6	Very high	102 Å²	102	76.4 Å²	76.4	48%	0.477	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.6	171.7	-71.3	176.5	-165.5	0	0	108.2	R205 P216 P218	R205-E207 IonicContact CZ-OE1 2.68Å; R205-E207 IonicContact NH1-OE1 3.38Å; R205-E207 PolarHBondContact NH1-OE1 3.24Å; R205-E207 IonicContact NH2-OE1 2.82Å; R205-E207 PolarHBondContact NH2-OE1 3.4Å; E207-P216 HydrophobicContact CB-CB 4.44Å; E207-P218 HydrophobicContact CG-CB 4.31Å
208	K	91.4	Very high	92.8	Very high	105 Å²	105	74.8 Å²	74.8	46%	0.457	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	134.5	-178.6	-171	175.1	177.7	-175.3	0	110.6	Y210 Y217	K208-Y210 HydrophobicContact CD-CD1 4.41Å; K208-Y210 HydrophobicContact CD-CE1 3.87Å; K208-Y217 PolarHBondContact N-O 3.37Å; K208-Y217 PolarHBondContact O-N 3.02Å
209	F	93.5	Very high	92.9	Very high	132 Å²	132	73.1 Å²	73.1	58%	0.579	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.3	122	166.7	-67.1	-91.4	0	0	0	108.4	K214 P216	F209-K214 WeakPolarHBondContact CE1-O 3.32Å; F209-P216 HydrophobicContact CD1-CB 4.34Å; F209-P216 HydrophobicContact CE1-CB 3.83Å; F209-P216 HydrophobicContact CE1-CG 4.22Å; F209-P216 HydrophobicContact CE2-CB 4.09Å; F209-P216 HydrophobicContact CZ-CB 3.69Å; F209-P216 HydrophobicContact CZ-CG 4.17Å
210	Y	89.5	Confident	93.1	Very high	67 Å²	67	69.1 Å²	69.1	26%	0.263	35%	0.35	S	S	.	.			trans	-92.8	151.1	175	-69.9	-78.7	0	0	0	110.1	K208 C212 C213 Y217	K208-Y210 HydrophobicContact CD-CD1 4.41Å; K208-Y210 HydrophobicContact CD-CE1 3.87Å; Y210-C212 PolarHBondContact O-N 3.15Å; Y210-C213 PolarHBondContact O-N 3.44Å; Y210-Y217 AromaticContact CD2-CD2 3.68Å; Y210-Y217 HydrophobicContact CD2-CD2 3.68Å; Y210-Y217 HydrophobicContact CD2-CE2 4.37Å; Y210-Y217 AromaticContact CD2-CG 3.89Å; Y210-Y217 HydrophobicContact CD2-CG 3.89Å; Y210-Y217 HydrophobicContact CE2-CD2 4.21Å; Y210-Y217 AromaticContact CE2-CG 3.94Å; Y210-Y217 HydrophobicContact CE2-CG 3.94Å
211	E	89.5	Confident	93.2	Very high	210 Å²	210	69 Å²	69	98%	0.981	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-24.9	-177.9	-65.1	-180	178.6	0	0	113.2
212	C	87.8	Confident	93.3	Very high	109 Å²	109	68 Å²	68	74%	0.736	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-29.3	178	53.3	0	0	0	0	113.9	Y210	Y210-C212 PolarHBondContact O-N 3.15Å
213	C	85.3	Confident	93.3	Very high	39 Å²	39	65.8 Å²	65.8	26%	0.264	33%	0.325	S	S	.	.			trans	-133	142.2	-164.9	-63.7	0	0	0	0	112.1	Y210 E215 Y217	Y210-C213 PolarHBondContact O-N 3.44Å; C213-E215 HydrophobicContact CB-CG 4.23Å; C213-Y217 HydrophobicContact CB-CE2 3.76Å
214	K	89.1	Confident	93.3	Very high	188 Å²	188	64.4 Å²	64.4	82%	0.817	31%	0.31	S	S	*	.	S	Bend	trans	-80	-19.6	177.2	-65.3	-178.7	-178.8	177.2	0	113.4	F209	F209-K214 WeakPolarHBondContact CE1-O 3.32Å
215	E	91.4	Very high	93.3	Very high	49 Å²	49	58.6 Å²	58.6	23%	0.229	29%	0.286	C	S	.	.	S	Bend	trans	-83.1	144.8	-179.6	63.1	-156.3	162.9	0	0	111.4	W176 C213 Y217	W176-E215 HydrophobicContact CD2-CB 4.01Å; W176-E215 HydrophobicContact CE3-CB 4.11Å; W176-E215 HydrophobicContact CH2-CB 4.48Å; W176-E215 HydrophobicContact CZ2-CB 4.38Å; W176-E215 HydrophobicContact CZ3-CB 4.35Å; C213-E215 HydrophobicContact CB-CG 4.23Å; E215-Y217 HydrophobicContact CG-CD2 4.48Å; E215-Y217 HydrophobicContact CG-CE2 3.85Å
216	P	94.3	Very high	93.2	Very high	16 Å²	16	55 Å²	55	10%	0.104	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	140.4	174.7	29.1	-31.4	0	0	0	109.8	G175 E207 F209	G175-P216 VanDerWaalsContact CA-O 3.26Å; G175-P216 WeakPolarHBondContact CA-O 3.47Å; G175-P216 PolarHBondContact N-O 2.76Å; E207-P216 HydrophobicContact CB-CB 4.44Å; F209-P216 HydrophobicContact CD1-CB 4.34Å; F209-P216 HydrophobicContact CE1-CB 3.83Å; F209-P216 HydrophobicContact CE1-CG 4.22Å; F209-P216 HydrophobicContact CE2-CB 4.09Å; F209-P216 HydrophobicContact CZ-CB 3.69Å; F209-P216 HydrophobicContact CZ-CG 4.17Å
217	Y	94.1	Very high	93.1	Very high	27 Å²	27	54.8 Å²	54.8	11%	0.106	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	113.7	170.4	-77.9	-102.3	0	0	0	108.9	K208 Y210 C213 E215	K208-Y217 PolarHBondContact N-O 3.37Å; K208-Y217 PolarHBondContact O-N 3.02Å; Y210-Y217 AromaticContact CD2-CD2 3.68Å; Y210-Y217 HydrophobicContact CD2-CD2 3.68Å; Y210-Y217 HydrophobicContact CD2-CE2 4.37Å; Y210-Y217 AromaticContact CD2-CG 3.89Å; Y210-Y217 HydrophobicContact CD2-CG 3.89Å; Y210-Y217 HydrophobicContact CE2-CD2 4.21Å; Y210-Y217 AromaticContact CE2-CG 3.94Å; Y210-Y217 HydrophobicContact CE2-CG 3.94Å; C213-Y217 HydrophobicContact CB-CE2 3.76Å; E215-Y217 HydrophobicContact CG-CD2 4.48Å; E215-Y217 HydrophobicContact CG-CE2 3.85Å
218	P	95.1	Very high	92.9	Very high	4 Å²	4	50.2 Å²	50.2	3%	0.026	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	131.9	175.3	30.1	-32.2	0	0	0	110	L180 E207	L180-P218 HydrophobicContact CB-CB 4.22Å; L180-P218 HydrophobicContact CB-CG 4.28Å; E207-P218 HydrophobicContact CG-CB 4.31Å
219	D	95.6	Very high	92.9	Very high	4 Å²	4	49.9 Å²	49.9	2%	0.021	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	150.7	176.5	69.4	-120.8	0	0	0	111.3	Y115 K167 F168 R205 S206 T221	Y115-D219 HydrophobicContact CE2-CB 4.29Å; K167-D219 VanDerWaalsContact CE-CB 3.49Å; K167-D219 WeakPolarHBondContact CE-OD1 3.32Å; K167-D219 WeakPolarHBondContact CE-OD2 3.46Å; K167-D219 HydrophobicContact CG-CB 4.47Å; K167-D219 IonicContact NZ-OD1 3.97Å; K167-D219 PolarHBondContact NZ-OD1 2.99Å; K167-D219 IonicContact NZ-OD2 2.8Å; F168-D219 CarbonylContact O-C 3.56Å; F168-D219 WeakPolarHBondContact O-CA 3.32Å; R205-D219 WeakPolarHBondContact CA-O 3.5Å; S206-D219 PolarHBondContact N-O 3.33Å; S206-D219 PolarHBondContact O-N 3.47Å; S206-D219 VanDerWaalsContact O-O 3.09Å; D219-T221 PolarHBondContact OD2-OG1 2.82Å
220	V	96.6	Very high	92.5	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	120.4	175.6	177.1	0	0	0	0	108.1	F55 F168 L180 M182 F222	F55-V220 HydrophobicContact CD1-CB 4.11Å; F55-V220 HydrophobicContact CD1-CG1 4.11Å; F55-V220 HydrophobicContact CD1-CG2 4.45Å; F55-V220 HydrophobicContact CE1-CB 4.47Å; F55-V220 HydrophobicContact CE1-CG1 4.44Å; F168-V220 PolarHBondContact N-O 2.81Å; F168-V220 PolarHBondContact O-N 2.68Å; L180-V220 HydrophobicContact CD2-CB 4.29Å; L180-V220 HydrophobicContact CD2-CG2 3.7Å; L180-V220 HydrophobicContact CG-CG2 3.86Å; M182-V220 HydrophobicContact CB-CG1 4Å; M182-V220 HydrophobicContact CB-CG2 3.93Å; M182-V220 HydrophobicContact CG-CG1 3.6Å; M182-V220 HydrophobicContact CG-CG2 4.47Å; M182-V220 HydrophobicContact SD-CG1 3.78Å; V220-F222 HydrophobicContact CG1-CD2 3.91Å; V220-F222 HydrophobicContact CG1-CE2 3.44Å; V220-F222 VanDerWaalsContact CG1-CE2 3.44Å; V220-F222 HydrophobicContact CG1-CZ 3.93Å
221	T	96.9	Very high	92.3	Very high	20 Å²	20	44.8 Å²	44.8	12%	0.123	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	117.6	179.1	-57.7	0	0	0	0	109.9	K165 L166 G203 K204 D219	K165-T221 HydrophobicContact CB-CG2 3.95Å; K165-T221 HydrophobicContact CD-CG2 4.46Å; K165-T221 HydrophobicContact CG-CG2 4.26Å; L166-T221 WeakPolarHBondContact O-CA 3.27Å; G203-T221 CarbonylContact C-O 3.59Å; K204-T221 PolarHBondContact N-O 2.77Å; K204-T221 PolarHBondContact O-N 2.83Å; D219-T221 PolarHBondContact OD2-OG1 2.82Å
222	F	97.1	Very high	92.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	129.3	170.4	-72	-80.4	0	0	0	109.6	F55 L57 K165 L166 F168 M182 A185 I201 V220	F55-F222 AromaticContact CD1-CE2 3.98Å; F55-F222 HydrophobicContact CD1-CE2 3.98Å; F55-F222 HydrophobicContact CE1-CD2 4.32Å; F55-F222 AromaticContact CE1-CE2 3.68Å; F55-F222 HydrophobicContact CE1-CE2 3.68Å; L57-F222 HydrophobicContact CD2-CB 3.74Å; L57-F222 HydrophobicContact CD2-CD1 4.16Å; L57-F222 HydrophobicContact CD2-CD2 3.22Å; L57-F222 HydrophobicContact CD2-CE2 3.75Å; L57-F222 HydrophobicContact CD2-CG 3.44Å; L57-F222 VanDerWaalsContact CD2-CG 3.44Å; L57-F222 HydrophobicContact CD2-CZ 4.42Å; L57-F222 HydrophobicContact CG-CD1 4.28Å; L57-F222 HydrophobicContact CG-CD2 3.91Å; L57-F222 HydrophobicContact CG-CE1 4.37Å; L57-F222 HydrophobicContact CG-CE2 3.97Å; L57-F222 HydrophobicContact CG-CG 4.04Å; L57-F222 HydrophobicContact CG-CZ 4.22Å; K165-F222 CarbonylContact C-O 3.56Å; K165-F222 WeakPolarHBondContact CA-O 3.5Å; L166-F222 PolarHBondContact N-O 3.4Å; L166-F222 PolarHBondContact O-N 3.33Å; F168-F222 HydrophobicContact CD2-CD2 4.36Å; M182-F222 HydrophobicContact CG-CZ 4.14Å; A185-F222 HydrophobicContact CB-CD1 4.02Å; A185-F222 HydrophobicContact CB-CE1 3.8Å; I201-F222 HydrophobicContact CG2-CB 3.88Å; I201-F222 HydrophobicContact CG2-CD1 4.04Å; I201-F222 HydrophobicContact CG2-CG 4.38Å; V220-F222 HydrophobicContact CG1-CD2 3.91Å; V220-F222 HydrophobicContact CG1-CE2 3.44Å; V220-F222 VanDerWaalsContact CG1-CE2 3.44Å; V220-F222 HydrophobicContact CG1-CZ 3.93Å
223	T	96.8	Very high	92.1	Very high	27 Å²	27	38.6 Å²	38.6	17%	0.166	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	103.4	178.2	-51.9	0	0	0	0	109.5	H163 C164 K165 I201 P202 T225	H163-T223 HydrophobicContact CB-CG2 4.01Å; C164-T223 CarbonylContact O-C 3.58Å; C164-T223 WeakPolarHBondContact O-CA 3.48Å; K165-T223 HydrophobicContact CG-CG2 4.26Å; I201-T223 WeakPolarHBondContact CA-O 3.16Å; P202-T223 WeakPolarHBondContact CD-O 3.46Å; P202-T223 PolarHBondContact O-N 3.43Å; T223-T225 PolarHBondContact O-N 3.4Å; T223-T225 VanDerWaalsContact O-N 3.17Å
224	V	96.4	Very high	91.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	109.5	172.8	-176.6	0	0	0	0	108	L59 I62 L72 C164 L166 L198 I201	L59-V224 HydrophobicContact CD2-CG1 4.37Å; I62-V224 HydrophobicContact CD1-CG1 4.36Å; L72-V224 HydrophobicContact CD2-CB 4.47Å; C164-V224 PolarHBondContact N-O 2.94Å; C164-V224 PolarHBondContact O-N 2.68Å; L166-V224 HydrophobicContact CD1-CG2 3.79Å; L166-V224 HydrophobicContact CG-CG2 4.34Å; L198-V224 HydrophobicContact CD1-CG1 3.98Å; I201-V224 HydrophobicContact CG2-CG2 4.36Å
225	T	95.3	Very high	91.7	Very high	17 Å²	17	33 Å²	33	10%	0.104	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	113.5	177.2	-51.2	0	0	0	0	108.3	V161 Q162 V199 G200 T223	V161-T225 HydrophobicContact CG1-CG2 3.92Å; Q162-T225 WeakPolarHBondContact O-CA 3.37Å; V199-T225 HydrophobicContact CB-CG2 4.07Å; V199-T225 WeakPolarHBondContact CB-O 3.33Å; V199-T225 HydrophobicContact CG1-CG2 4.45Å; V199-T225 PolarHBondContact N-O 3.38Å; G200-T225 PolarHBondContact N-O 3.35Å; G200-T225 WeakPolarHBondContact O-CB 3.43Å; G200-T225 PolarHBondContact O-N 3.31Å; T223-T225 PolarHBondContact O-N 3.4Å; T223-T225 VanDerWaalsContact O-N 3.17Å
226	M	93.4	Very high	91.3	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	145	-174.8	63	-168.6	-172.8	0	0	111.2	I62 V65 L72 I152 V161 Q162 W196 D197	I62-M226 HydrophobicContact CD1-CB 4.31Å; I62-M226 HydrophobicContact CD1-SD 4.3Å; V65-M226 HydrophobicContact CB-CE 4.36Å; V65-M226 HydrophobicContact CG1-CE 3.69Å; V65-M226 HydrophobicContact CG2-CE 3.69Å; V65-M226 HydrophobicContact CG2-SD 3.99Å; L72-M226 HydrophobicContact CD1-CE 4.42Å; L72-M226 HydrophobicContact CD1-SD 4.31Å; I152-M226 HydrophobicContact CD1-CE 4.5Å; V161-M226 CarbonylContact C-O 3.54Å; V161-M226 WeakPolarHBondContact CA-O 3.15Å; Q162-M226 HydrophobicContact CB-CE 3.72Å; Q162-M226 HydrophobicContact CB-CG 3.94Å; Q162-M226 HydrophobicContact CG-CE 4.3Å; Q162-M226 PolarHBondContact N-O 3.2Å; Q162-M226 PolarHBondContact O-N 3.38Å; W196-M226 HydrophobicContact CD2-CG 4.37Å; W196-M226 HydrophobicContact CD2-SD 4.25Å; W196-M226 HydrophobicContact CE3-CB 4.06Å; W196-M226 HydrophobicContact CE3-CE 4.33Å; W196-M226 HydrophobicContact CE3-CG 3.67Å; W196-M226 HydrophobicContact CE3-SD 4.12Å; W196-M226 HydrophobicContact CH2-CE 4.32Å; W196-M226 HydrophobicContact CZ3-CE 4.24Å; W196-M226 HydrophobicContact CZ3-CG 4Å; D197-M226 CarbonylContact O-C 3.46Å; D197-M226 VanDerWaalsContact O-CA 3.32Å; D197-M226 WeakPolarHBondContact O-CA 3.1Å
227	R	92	Very high	90.8	Very high	35 Å²	35	34.4 Å²	34.4	13%	0.132	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	137.3	-179.6	179.7	-174.8	-63.1	-178.1	-3.6	109.4	V161 W196 D197 V199 E495	V161-R227 HydrophobicContact CG2-CB 4.34Å; V161-R227 HydrophobicContact CG2-CG 4.19Å; W196-R227 CarbonylContact C-O 3.56Å; W196-R227 WeakPolarHBondContact CA-O 3.34Å; D197-R227 HydrophobicContact CB-CB 4.43Å; D197-R227 PolarHBondContact N-O 3.11Å; D197-R227 PolarHBondContact O-N 2.95Å; V199-R227 HydrophobicContact CG2-CB 3.98Å; R227-E495 IonicContact CZ-OE1 3.64Å; R227-E495 IonicContact NH1-OE1 3.03Å; R227-E495 PolarHBondContact NH1-OE1 3.08Å; R227-E495 IonicContact NH2-OE1 3.3Å; R227-E495 PolarHBondContact NH2-OE1 3.23Å; R227-E495 IonicContact NH2-OE2 2.94Å
228	R	90.9	Very high	90.2	Very high	6 Å²	6	35 Å²	35	2%	0.023	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	140.6	178.7	-169.5	179.8	-61	-91.6	4.2	111.6	E67 D160 E195 W196 Y233	E67-R228 IonicContact OE1-CZ 3.3Å; E67-R228 VanDerWaalsContact OE1-CZ 3.24Å; E67-R228 IonicContact OE1-NH1 3.22Å; E67-R228 PolarHBondContact OE1-NH1 2.81Å; E67-R228 IonicContact OE1-NH2 3.62Å; E67-R228 PolarHBondContact OE1-NH2 2.85Å; D160-R228 PolarHBondContact O-N 2.83Å; D160-R228 IonicContact OD1-NE 3.24Å; D160-R228 PolarHBondContact OD1-NE 3.3Å; D160-R228 IonicContact OD2-CZ 2.81Å; D160-R228 IonicContact OD2-NE 3.22Å; D160-R228 PolarHBondContact OD2-NE 3.03Å; D160-R228 IonicContact OD2-NH2 2.9Å; E195-R228 IonicContact OE1-NH1 2.79Å; E195-R228 PolarHBondContact OE1-NH1 3.05Å; E195-R228 VanDerWaalsContact OE1-NH1 3.09Å; W196-R228 HydrophobicContact CE3-CB 4.2Å; W196-R228 HydrophobicContact CH2-CB 4.27Å; W196-R228 VanDerWaalsContact CH2-NH2 3.25Å; W196-R228 VanDerWaalsContact CZ2-CZ 3.41Å; W196-R228 VanDerWaalsContact CZ2-NH2 3.26Å; W196-R228 HydrophobicContact CZ3-CB 3.9Å; R228-Y233 HydrophobicContact CG-CE2 4.15Å; R228-Y233 PolarHBondContact NH1-OH 2.84Å
229	R	89.6	Confident	89.7	Confident	98 Å²	98	38.9 Å²	38.9	37%	0.37	19%	0.19	S	C	.	.			trans	-80.1	121.6	168.5	-70.7	174.4	168.4	-98.9	-4.7	109.7	G194 E195 D197	G194-R229 WeakPolarHBondContact O-CD 3.42Å; E195-R229 WeakPolarHBondContact O-CB 3.25Å; E195-R229 PolarHBondContact O-N 2.82Å; D197-R229 IonicContact OD1-CZ 3.97Å; D197-R229 IonicContact OD1-NE 3.09Å; D197-R229 PolarHBondContact OD1-NE 3.23Å; D197-R229 IonicContact OD1-NH2 2.88Å; D197-R229 PolarHBondContact OD1-NH2 3.18Å; D197-R229 IonicContact OD2-CZ 2.74Å; D197-R229 IonicContact OD2-NE 3.24Å; D197-R229 IonicContact OD2-NH2 2.79Å
230	T	86.5	Confident	89.2	Confident	10 Å²	10	40.1 Å²	40.1	6%	0.061	20%	0.198	C	C	.	.			trans	-95.3	-16.1	-161.9	71.1	0	0	0	0	114.4	P158 F159 Y232 Y233 G234 A496 D500	P158-T230 VanDerWaalsContact O-CG2 3.26Å; P158-T230 WeakPolarHBondContact O-CG2 3.49Å; F159-T230 HydrophobicContact CD1-CG2 3.7Å; F159-T230 HydrophobicContact CE1-CG2 4.01Å; T230-Y232 PolarHBondContact O-N 3.11Å; T230-Y233 PolarHBondContact O-N 3.05Å; T230-G234 PolarHBondContact O-N 2.74Å; T230-A496 HydrophobicContact CG2-CB 4.21Å; T230-D500 PolarHBondContact N-OD2 2.89Å; T230-D500 PolarHBondContact OG1-OD2 3.11Å
231	L	84.5	Confident	88.5	Confident	81 Å²	81	40.2 Å²	40.2	42%	0.424	20%	0.199	S	C	.	.	H	α-helix	trans	-54.8	-45.7	-172.8	-172.8	68.7	0	0	0	113.8	Y233 G234 L235 F501	L231-Y233 PolarHBondContact O-N 3.28Å; L231-G234 PolarHBondContact O-N 3.5Å; L231-L235 HydrophobicContact CD1-CD1 4.41Å; L231-L235 HydrophobicContact CD1-CG 4.5Å; L231-L235 HydrophobicContact CG-CD1 4.3Å; L231-L235 WeakPolarHBondContact O-CG 3.45Å; L231-L235 PolarHBondContact O-N 2.65Å; L231-F501 HydrophobicContact CD1-CE1 4.43Å; L231-F501 HydrophobicContact CD1-CZ 4.12Å
232	Y	86.9	Confident	87.8	Confident	158 Å²	158	43.1 Å²	43.1	62%	0.62	22%	0.216	S	C	*	.	H	α-helix	trans	-60.2	-47.4	-179.5	177.1	-92.7	0	0	0	111.7	T230 L235 N236	T230-Y232 PolarHBondContact O-N 3.11Å; Y232-L235 PolarHBondContact O-N 3.03Å; Y232-N236 VanDerWaalsContact CD2-ND2 3.3Å; Y232-N236 WeakPolarHBondContact CD2-ND2 3.46Å; Y232-N236 WeakPolarHBondContact CE2-ND2 3.38Å; Y232-N236 VanDerWaalsContact CZ-ND2 3.31Å; Y232-N236 WeakPolarHBondContact O-CB 3.34Å; Y232-N236 PolarHBondContact O-N 3.29Å; Y232-N236 PolarHBondContact O-ND2 2.74Å
233	Y	85.4	Confident	87.3	Confident	32 Å²	32	48.1 Å²	48.1	13%	0.125	24%	0.243	C	C	.	.	H	α-helix	trans	-70.9	-33.4	178.8	-58.8	-80.3	0	0	0	111.7	F157 P158 E195 R228 T230 L231 L237 L238	F157-Y233 HydrophobicContact CE1-CD1 4.24Å; F157-Y233 HydrophobicContact CE2-CE1 4.25Å; F157-Y233 AromaticContact CZ-CD1 3.62Å; F157-Y233 HydrophobicContact CZ-CD1 3.62Å; F157-Y233 AromaticContact CZ-CE1 3.63Å; F157-Y233 HydrophobicContact CZ-CE1 3.63Å; F157-Y233 HydrophobicContact CZ-CG 4.24Å; P158-Y233 HydrophobicContact CB-CD2 4.09Å; P158-Y233 HydrophobicContact CB-CG 4Å; E195-Y233 PolarHBondContact OE1-OH 2.77Å; R228-Y233 HydrophobicContact CG-CE2 4.15Å; R228-Y233 PolarHBondContact NH1-OH 2.84Å; T230-Y233 PolarHBondContact O-N 3.05Å; L231-Y233 PolarHBondContact O-N 3.28Å; Y233-L237 HydrophobicContact CD1-CD1 3.79Å; Y233-L237 WeakPolarHBondContact O-CA 3.36Å; Y233-L237 VanDerWaalsContact O-CB 3.23Å; Y233-L237 WeakPolarHBondContact O-CB 3.47Å; Y233-L237 PolarHBondContact O-N 3.29Å; Y233-L238 PolarHBondContact O-N 2.91Å
234	G	82.6	Confident	86.8	Confident	19 Å²	19	47.5 Å²	47.5	20%	0.196	24%	0.238	C	C	.	.	I	π-helix	trans	-59.2	-49.8	172.5	0	0	0	0	0	112.3	T230 L231 L238 I239	T230-G234 PolarHBondContact O-N 2.74Å; L231-G234 PolarHBondContact O-N 3.5Å; G234-L238 WeakPolarHBondContact O-CB 3.27Å; G234-L238 PolarHBondContact O-N 3.36Å; G234-I239 PolarHBondContact O-N 2.84Å; G234-I239 VanDerWaalsContact O-N 3.12Å
235	L	84.4	Confident	86.1	Confident	90 Å²	90	47.9 Å²	47.9	47%	0.471	24%	0.241	S	C	.	.	I	π-helix	trans	-72	-40.3	-178.8	-64.9	178.1	0	0	0	112.8	L231 Y232 I239 P240	L231-L235 HydrophobicContact CD1-CD1 4.41Å; L231-L235 HydrophobicContact CD1-CG 4.5Å; L231-L235 HydrophobicContact CG-CD1 4.3Å; L231-L235 WeakPolarHBondContact O-CG 3.45Å; L231-L235 PolarHBondContact O-N 2.65Å; Y232-L235 PolarHBondContact O-N 3.03Å; L235-I239 HydrophobicContact CD2-CD1 3.47Å; L235-I239 VanDerWaalsContact CD2-CD1 3.47Å; L235-P240 WeakPolarHBondContact O-CD 3.27Å
236	N	84	Confident	85.6	Confident	78 Å²	78	49.7 Å²	49.7	42%	0.417	26%	0.257	S	S	.	.	I	π-helix	trans	-93.8	-21.3	-171.7	-65.6	-36.7	0	0	0	114.5	Y232 P240	Y232-N236 VanDerWaalsContact CD2-ND2 3.3Å; Y232-N236 WeakPolarHBondContact CD2-ND2 3.46Å; Y232-N236 WeakPolarHBondContact CE2-ND2 3.38Å; Y232-N236 VanDerWaalsContact CZ-ND2 3.31Å; Y232-N236 WeakPolarHBondContact O-CB 3.34Å; Y232-N236 PolarHBondContact O-N 3.29Å; Y232-N236 PolarHBondContact O-ND2 2.74Å; N236-P240 WeakPolarHBondContact O-CG 3.42Å
237	L	83.1	Confident	85.3	Confident	17 Å²	17	53.4 Å²	53.4	9%	0.089	28%	0.277	C	S	.	.	I	π-helix	trans	-112.9	-48.5	179.2	-56.8	179.8	0	0	0	112.6	F157 Y233 C241 V279 I282	F157-L237 HydrophobicContact CE1-CD1 4.14Å; Y233-L237 HydrophobicContact CD1-CD1 3.79Å; Y233-L237 WeakPolarHBondContact O-CA 3.36Å; Y233-L237 VanDerWaalsContact O-CB 3.23Å; Y233-L237 WeakPolarHBondContact O-CB 3.47Å; Y233-L237 PolarHBondContact O-N 3.29Å; L237-C241 WeakPolarHBondContact O-CB 3.22Å; L237-C241 PolarHBondContact O-N 2.95Å; L237-V279 HydrophobicContact CD2-CG2 4.02Å; L237-I282 HydrophobicContact CD1-CD1 4.01Å
238	L	81.3	Confident	84.9	Confident	40 Å²	40	52.2 Å²	52.2	21%	0.209	28%	0.275	C	S	.	.	I	π-helix	trans	-73	-47.2	-175.9	-82.5	167	0	0	0	112.7	F159 Y233 G234 C241 V242 I293	F159-L238 HydrophobicContact CZ-CD1 4.31Å; Y233-L238 PolarHBondContact O-N 2.91Å; G234-L238 WeakPolarHBondContact O-CB 3.27Å; G234-L238 PolarHBondContact O-N 3.36Å; L238-C241 WeakPolarHBondContact O-CB 3.42Å; L238-C241 PolarHBondContact O-N 3.38Å; L238-V242 WeakPolarHBondContact O-CG2 3.26Å; L238-V242 PolarHBondContact O-N 2.97Å; L238-I293 HydrophobicContact CD2-CD1 4.17Å
239	I	84.4	Confident	84.6	Confident	84 Å²	84	54.1 Å²	54.1	43%	0.431	29%	0.285	S	S	.	.	H	α-helix	trans	-59.6	-50.4	-177.8	-69	-178.9	0	0	0	112.4	G234 L235 C241 V242 L243	G234-I239 PolarHBondContact O-N 2.84Å; G234-I239 VanDerWaalsContact O-N 3.12Å; L235-I239 HydrophobicContact CD2-CD1 3.47Å; L235-I239 VanDerWaalsContact CD2-CD1 3.47Å; I239-C241 VanDerWaalsContact C-N 3.26Å; I239-C241 PolarHBondContact O-N 3.37Å; I239-V242 PolarHBondContact O-N 3.28Å; I239-L243 HydrophobicContact CG2-CD1 3.71Å; I239-L243 HydrophobicContact CG2-CG 4.45Å; I239-L243 WeakPolarHBondContact O-CG 3.4Å; I239-L243 PolarHBondContact O-N 3.48Å
240	P	86	Confident	84.5	Confident	30 Å²	30	53.4 Å²	53.4	20%	0.195	29%	0.288	C	S	.	.	H	α-helix	trans	-58.1	-38.1	176.1	-27.2	37.1	0	0	0	112.6	L235 N236 L243 I244 F275	L235-P240 WeakPolarHBondContact O-CD 3.27Å; N236-P240 WeakPolarHBondContact O-CG 3.42Å; P240-L243 PolarHBondContact O-N 3.26Å; P240-I244 WeakPolarHBondContact O-CB 3.19Å; P240-I244 WeakPolarHBondContact O-CD1 3.29Å; P240-I244 WeakPolarHBondContact O-CG1 3.29Å; P240-I244 PolarHBondContact O-N 3.31Å; P240-F275 HydrophobicContact CB-CE1 3.98Å; P240-F275 HydrophobicContact CB-CZ 3.92Å
241	C	81.4	Confident	84.6	Confident	2 Å²	2	53 Å²	53	1%	0.014	29%	0.285	C	S	.	.	H	α-helix	trans	-66.3	-42.8	179	-169.7	0	0	0	0	112.8	L237 L238 I239 L243 I244 S245 Y296 F297	L237-C241 WeakPolarHBondContact O-CB 3.22Å; L237-C241 PolarHBondContact O-N 2.95Å; L238-C241 WeakPolarHBondContact O-CB 3.42Å; L238-C241 PolarHBondContact O-N 3.38Å; I239-C241 VanDerWaalsContact C-N 3.26Å; I239-C241 PolarHBondContact O-N 3.37Å; C241-L243 VanDerWaalsContact C-N 3.34Å; C241-I244 PolarHBondContact O-N 2.7Å; C241-S245 WeakPolarHBondContact O-CB 3.39Å; C241-S245 PolarHBondContact O-N 2.85Å; C241-S245 PolarHBondContact O-OG 3.14Å; C241-Y296 HydrophobicContact CB-CE1 4.27Å; C241-Y296 WeakPolarHBondContact SG-CE1 3.44Å; C241-F297 HydrophobicContact CB-CE1 3.73Å; C241-F297 HydrophobicContact CB-CZ 3.68Å; C241-F297 WeakPolarHBondContact SG-CE1 3.23Å
242	V	82.4	Confident	84.7	Confident	81 Å²	81	49.2 Å²	49.2	49%	0.491	27%	0.265	S	S	.	.	H	α-helix	trans	-63.3	-42.3	175.6	173.1	0	0	0	0	110.6	L238 I239 S245 A246	L238-V242 WeakPolarHBondContact O-CG2 3.26Å; L238-V242 PolarHBondContact O-N 2.97Å; I239-V242 PolarHBondContact O-N 3.28Å; V242-S245 PolarHBondContact O-N 3.38Å; V242-A246 PolarHBondContact O-N 3.43Å
243	L	86.1	Confident	84.6	Confident	106 Å²	106	45.8 Å²	45.8	56%	0.555	26%	0.257	S	S	*	.	H	α-helix	trans	-61.1	-47.1	175.6	-75.4	162.3	0	0	0	111.9	I239 P240 C241 S245 A246 L247	I239-L243 HydrophobicContact CG2-CD1 3.71Å; I239-L243 HydrophobicContact CG2-CG 4.45Å; I239-L243 WeakPolarHBondContact O-CG 3.4Å; I239-L243 PolarHBondContact O-N 3.48Å; P240-L243 PolarHBondContact O-N 3.26Å; C241-L243 VanDerWaalsContact C-N 3.34Å; L243-S245 VanDerWaalsContact C-N 3.33Å; L243-S245 PolarHBondContact O-N 2.98Å; L243-A246 WeakPolarHBondContact O-CB 3.48Å; L243-A246 PolarHBondContact O-N 3.25Å; L243-L247 WeakPolarHBondContact O-CG 3.5Å; L243-L247 PolarHBondContact O-N 2.86Å
244	I	85.2	Confident	84.7	Confident	13 Å²	13	46.6 Å²	46.6	7%	0.067	26%	0.264	C	S	.	.	H	α-helix	trans	-63.8	-40	178.2	-68.9	166	0	0	0	111	P240 C241 A246 L247 A248 V268 L272 F275	P240-I244 WeakPolarHBondContact O-CB 3.19Å; P240-I244 WeakPolarHBondContact O-CD1 3.29Å; P240-I244 WeakPolarHBondContact O-CG1 3.29Å; P240-I244 PolarHBondContact O-N 3.31Å; C241-I244 PolarHBondContact O-N 2.7Å; I244-A246 VanDerWaalsContact C-N 3.31Å; I244-A246 PolarHBondContact O-N 2.85Å; I244-L247 PolarHBondContact O-N 2.87Å; I244-A248 PolarHBondContact O-N 2.82Å; I244-V268 HydrophobicContact CG2-CG1 3.97Å; I244-L272 HydrophobicContact CG2-CB 4.27Å; I244-L272 HydrophobicContact CG2-CD1 4.17Å; I244-F275 HydrophobicContact CD1-CD2 3.39Å; I244-F275 HydrophobicContact CD1-CE2 3.46Å; I244-F275 VanDerWaalsContact CD1-CE2 3.46Å; I244-F275 HydrophobicContact CD1-CG 4.35Å; I244-F275 HydrophobicContact CD1-CZ 4.43Å
245	S	82.1	Confident	84.9	Confident	9 Å²	9	48.9 Å²	48.9	6%	0.063	28%	0.275	C	S	.	.	H	α-helix	trans	-64.4	-36.7	175.8	-57.1	0	0	0	0	111.8	C241 V242 L243 A248 L249	C241-S245 WeakPolarHBondContact O-CB 3.39Å; C241-S245 PolarHBondContact O-N 2.85Å; C241-S245 PolarHBondContact O-OG 3.14Å; V242-S245 PolarHBondContact O-N 3.38Å; L243-S245 VanDerWaalsContact C-N 3.33Å; L243-S245 PolarHBondContact O-N 2.98Å; S245-A248 WeakPolarHBondContact O-CB 3.42Å; S245-A248 PolarHBondContact O-N 3.26Å; S245-L249 PolarHBondContact O-N 3.03Å
246	A	84.8	Confident	84.9	Confident	54 Å²	54	45.2 Å²	45.2	45%	0.446	26%	0.257	S	S	.	.	H	α-helix	trans	-67.7	-40	173.1	0	0	0	0	0	112.2	V242 L243 I244 A248 L249 L250	V242-A246 PolarHBondContact O-N 3.43Å; L243-A246 WeakPolarHBondContact O-CB 3.48Å; L243-A246 PolarHBondContact O-N 3.25Å; I244-A246 VanDerWaalsContact C-N 3.31Å; I244-A246 PolarHBondContact O-N 2.85Å; A246-A248 VanDerWaalsContact C-N 3.28Å; A246-A248 PolarHBondContact O-N 2.95Å; A246-L249 PolarHBondContact O-N 3.47Å; A246-L250 PolarHBondContact O-N 2.79Å; A246-L250 VanDerWaalsContact O-N 3.11Å
247	L	86.8	Confident	84.9	Confident	78 Å²	78	47.3 Å²	47.3	41%	0.408	27%	0.269	S	S	.	.	H	α-helix	trans	-62.3	-35.5	174.1	-69.4	174.3	0	0	0	112	L243 I244 L249 L250 V251 V268	L243-L247 WeakPolarHBondContact O-CG 3.5Å; L243-L247 PolarHBondContact O-N 2.86Å; I244-L247 PolarHBondContact O-N 2.87Å; L247-L249 VanDerWaalsContact C-N 3.31Å; L247-L249 PolarHBondContact O-N 3.37Å; L247-L250 HydrophobicContact CD2-CD2 4.25Å; L247-L250 WeakPolarHBondContact O-CB 3.24Å; L247-L250 PolarHBondContact O-N 3.21Å; L247-L250 VanDerWaalsContact O-N 3.17Å; L247-V251 PolarHBondContact O-N 3.44Å; L247-V268 HydrophobicContact CB-CG2 3.99Å
248	A	83.5	Confident	84.9	Confident	11 Å²	11	49.5 Å²	49.5	9%	0.091	29%	0.286	C	S	.	.	H	α-helix	trans	-61.9	-37.4	174.2	0	0	0	0	0	112.7	I244 S245 A246 V251 V268 V304	I244-A248 PolarHBondContact O-N 2.82Å; S245-A248 WeakPolarHBondContact O-CB 3.42Å; S245-A248 PolarHBondContact O-N 3.26Å; A246-A248 VanDerWaalsContact C-N 3.28Å; A246-A248 PolarHBondContact O-N 2.95Å; A248-V251 WeakPolarHBondContact O-CB 3.35Å; A248-V251 PolarHBondContact O-N 3.31Å; A248-V268 HydrophobicContact CB-CG1 3.98Å; A248-V304 HydrophobicContact CB-CG2 3.8Å
249	L	86.6	Confident	85.1	Confident	45 Å²	45	50.2 Å²	50.2	24%	0.236	30%	0.302	C	S	.	.	H	α-helix	trans	-70.6	-33.2	174.7	-64.6	176.2	0	0	0	112	S245 A246 L247 V251 F252 F475	S245-L249 PolarHBondContact O-N 3.03Å; A246-L249 PolarHBondContact O-N 3.47Å; L247-L249 VanDerWaalsContact C-N 3.31Å; L247-L249 PolarHBondContact O-N 3.37Å; L249-V251 PolarHBondContact O-N 2.95Å; L249-F252 PolarHBondContact O-N 3.09Å; L249-F475 HydrophobicContact CD2-CB 4.19Å
250	L	86.9	Confident	85.2	Confident	83 Å²	83	51.8 Å²	51.8	44%	0.435	31%	0.308	S	S	.	.	H	α-helix	trans	-62.4	-27.4	177.4	-170.2	65.7	0	0	0	112.5	A246 L247 F252 L253 L254	A246-L250 PolarHBondContact O-N 2.79Å; A246-L250 VanDerWaalsContact O-N 3.11Å; L247-L250 HydrophobicContact CD2-CD2 4.25Å; L247-L250 WeakPolarHBondContact O-CB 3.24Å; L247-L250 PolarHBondContact O-N 3.21Å; L247-L250 VanDerWaalsContact O-N 3.17Å; L250-F252 PolarHBondContact O-N 2.9Å; L250-L253 HydrophobicContact CD1-CB 4.25Å; L250-L253 HydrophobicContact CD1-CD1 4.01Å; L250-L253 WeakPolarHBondContact O-CB 3.3Å; L250-L253 PolarHBondContact O-N 2.93Å; L250-L254 PolarHBondContact O-N 3.43Å
251	V	87.9	Confident	85.3	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.006	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-38	174.9	-179.9	0	0	0	0	112	L247 A248 L249 L253 K261 L264 T311	L247-V251 PolarHBondContact O-N 3.44Å; A248-V251 WeakPolarHBondContact O-CB 3.35Å; A248-V251 PolarHBondContact O-N 3.31Å; L249-V251 PolarHBondContact O-N 2.95Å; V251-L253 VanDerWaalsContact C-N 3.32Å; V251-K261 HydrophobicContact CG1-CG 4Å; V251-K261 VanDerWaalsContact O-CE 3.24Å; V251-K261 WeakPolarHBondContact O-CE 3.27Å; V251-L264 HydrophobicContact CG2-CB 4.41Å; V251-L264 HydrophobicContact CG2-CD2 3.89Å; V251-L264 HydrophobicContact CG2-CG 3.87Å; V251-T311 HydrophobicContact CG1-CG2 3.75Å
252	F	86.8	Confident	85.7	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.009	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-5.4	178.2	-63.2	-74.1	0	0	0	113.9	L249 L250 V310 T311 D468 C471 L472 F475	L249-F252 PolarHBondContact O-N 3.09Å; L250-F252 PolarHBondContact O-N 2.9Å; F252-V310 HydrophobicContact CE1-CG1 4.32Å; F252-T311 HydrophobicContact CD1-CG2 4.17Å; F252-T311 HydrophobicContact CE1-CG2 3.67Å; F252-T311 HydrophobicContact CZ-CG2 4.16Å; F252-D468 WeakPolarHBondContact CD1-OD1 3.35Å; F252-C471 HydrophobicContact CD1-CB 4.16Å; F252-C471 HydrophobicContact CE1-CB 3.86Å; F252-C471 HydrophobicContact CZ-CB 4.35Å; F252-L472 HydrophobicContact CB-CB 3.81Å; F252-L472 HydrophobicContact CB-CD1 3.92Å; F252-L472 HydrophobicContact CB-CG 4.27Å; F252-L472 HydrophobicContact CG-CB 4.46Å; F252-F475 HydrophobicContact CD2-CD2 4.2Å; F252-F475 HydrophobicContact CE1-CD2 4.26Å; F252-F475 HydrophobicContact CE1-CE2 4.12Å; F252-F475 AromaticContact CE2-CD2 3.32Å; F252-F475 HydrophobicContact CE2-CD2 3.32Å; F252-F475 AromaticContact CE2-CE2 3.78Å; F252-F475 HydrophobicContact CE2-CE2 3.78Å; F252-F475 HydrophobicContact CE2-CG 4.2Å; F252-F475 AromaticContact CZ-CD2 3.37Å; F252-F475 HydrophobicContact CZ-CD2 3.37Å; F252-F475 AromaticContact CZ-CE2 3.3Å; F252-F475 HydrophobicContact CZ-CE2 3.3Å; F252-F475 HydrophobicContact CZ-CZ 4.43Å
253	L	85.6	Confident	86	Confident	86 Å²	86	52.5 Å²	52.5	45%	0.45	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-22.9	171.2	-71.3	172.5	0	0	0	111.9	L250 V251 L472	L250-L253 HydrophobicContact CD1-CB 4.25Å; L250-L253 HydrophobicContact CD1-CD1 4.01Å; L250-L253 WeakPolarHBondContact O-CB 3.3Å; L250-L253 PolarHBondContact O-N 2.93Å; V251-L253 VanDerWaalsContact C-N 3.32Å; L253-L472 HydrophobicContact CD2-CD1 3.41Å; L253-L472 VanDerWaalsContact CD2-CD1 3.41Å; L253-L472 HydrophobicContact CG-CD1 3.57Å
254	L	87.8	Confident	86.2	Confident	50 Å²	50	49.7 Å²	49.7	26%	0.262	30%	0.296	S	S	.	.	S	Bend	trans	-74.1	127.8	-178	-163.4	73.5	0	0	0	110.8	L250 E260 K261	L250-L254 PolarHBondContact O-N 3.43Å; L254-E260 HydrophobicContact CD2-CB 4.24Å; L254-K261 HydrophobicContact CD2-CB 4.31Å; L254-K261 PolarHBondContact O-NZ 2.91Å
255	P	86.6	Confident	86.3	Confident	67 Å²	67	49.1 Å²	49.1	44%	0.435	29%	0.294	S	S	.	.			trans	-64.6	144.5	177.5	27.3	-33.6	0	0	0	111	D257 S258	P255-D257 PolarHBondContact O-N 2.88Å; P255-S258 PolarHBondContact O-N 3.29Å
256	A	83.8	Confident	86.7	Confident	12 Å²	12	53 Å²	53	10%	0.099	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-64.8	-23.5	-179.8	0	0	0	0	0	113.3	S258 G259 L315 H318	A256-S258 PolarHBondContact O-N 3.28Å; A256-G259 PolarHBondContact O-N 2.86Å; A256-L315 HydrophobicContact CB-CD2 3.79Å; A256-H318 HydrophobicContact CB-CB 4.16Å
257	D	83.3	Confident	87	Confident	122 Å²	122	54 Å²	54	65%	0.652	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-64.5	-22.8	179.5	-62.9	-46.5	0	0	0	113.4	P255 G259 H318	P255-D257 PolarHBondContact O-N 2.88Å; D257-G259 VanDerWaalsContact C-N 3.32Å; D257-G259 PolarHBondContact O-N 3.47Å; D257-H318 IonicContact OD1-CE1 3.94Å; D257-H318 PolarHBondContact OD1-CE1 2.92Å; D257-H318 IonicContact OD1-NE2 3.99Å
258	S	84.4	Confident	87.1	Confident	64 Å²	64	50.7 Å²	50.7	45%	0.448	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-76	-15.5	-177.7	-60.9	0	0	0	0	114.1	P255 A256 E260	P255-S258 PolarHBondContact O-N 3.29Å; A256-S258 PolarHBondContact O-N 3.28Å; S258-E260 PolarHBondContact O-N 3.19Å
259	G	84.1	Confident	87.4	Confident	54 Å²	54	52.5 Å²	52.5	56%	0.557	30%	0.304	S	S	*	.	S	Bend	trans	70.1	-24.9	-178.2	0	0	0	0	0	115.9	A256 D257 K261	A256-G259 PolarHBondContact O-N 2.86Å; D257-G259 VanDerWaalsContact C-N 3.32Å; D257-G259 PolarHBondContact O-N 3.47Å; G259-K261 PolarHBondContact O-N 2.7Å
260	E	87.4	Confident	87.6	Confident	117 Å²	117	55.9 Å²	55.9	55%	0.547	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-3.7	-176.9	-65.8	-54.5	137.1	0	0	115.1	L254 S258 I262 S263 L264	L254-E260 HydrophobicContact CD2-CB 4.24Å; S258-E260 PolarHBondContact O-N 3.19Å; E260-I262 PolarHBondContact O-N 3.16Å; E260-S263 PolarHBondContact O-N 3.28Å; E260-L264 PolarHBondContact O-N 2.98Å
261	K	88.1	Confident	87.7	Confident	1 Å²	1	54.1 Å²	54.1	0%	0.004	32%	0.317	C	S	.	.	H	α-helix	trans	-61.2	-41.3	-174.9	-174	169.3	-174.5	150.2	0	113.5	V251 L254 G259 G265 D468	V251-K261 HydrophobicContact CG1-CG 4Å; V251-K261 VanDerWaalsContact O-CE 3.24Å; V251-K261 WeakPolarHBondContact O-CE 3.27Å; L254-K261 HydrophobicContact CD2-CB 4.31Å; L254-K261 PolarHBondContact O-NZ 2.91Å; G259-K261 PolarHBondContact O-N 2.7Å; K261-G265 PolarHBondContact O-N 3.32Å; K261-D468 IonicContact NZ-OD1 3.69Å; K261-D468 PolarHBondContact NZ-OD1 2.94Å; K261-D468 IonicContact NZ-OD2 2.68Å; K261-D468 PolarHBondContact NZ-OD2 3.47Å
262	I	88.7	Confident	87.7	Confident	66 Å²	66	54 Å²	54	34%	0.338	32%	0.316	S	S	.	.	H	α-helix	trans	-70.5	-43.7	178.1	-59.7	-179	0	0	0	110.4	E260 L264 G265 I266 L315	E260-I262 PolarHBondContact O-N 3.16Å; I262-L264 VanDerWaalsContact C-N 3.34Å; I262-L264 PolarHBondContact O-N 3.29Å; I262-G265 PolarHBondContact O-N 2.87Å; I262-G265 VanDerWaalsContact O-N 3.16Å; I262-I266 HydrophobicContact CG2-CD1 3.64Å; I262-I266 HydrophobicContact CG2-CG1 4.22Å; I262-I266 WeakPolarHBondContact O-CG1 3.26Å; I262-I266 PolarHBondContact O-N 3.45Å; I262-L315 HydrophobicContact CD1-CD1 3.5Å; I262-L315 VanDerWaalsContact CD1-CD1 3.5Å; I262-L315 HydrophobicContact CG1-CD1 3.23Å
263	S	89.7	Confident	87.7	Confident	61 Å²	61	56.1 Å²	56.1	43%	0.427	33%	0.329	S	S	.	.	H	α-helix	trans	-58	-46.4	179.4	-173.8	0	0	0	0	111.2	E260 G265 I266 T267	E260-S263 PolarHBondContact O-N 3.28Å; S263-G265 PolarHBondContact O-N 3.38Å; S263-I266 PolarHBondContact O-N 3.45Å; S263-T267 WeakPolarHBondContact O-CB 3.26Å; S263-T267 VanDerWaalsContact O-CG2 3.24Å; S263-T267 WeakPolarHBondContact O-CG2 3.4Å; S263-T267 PolarHBondContact O-N 3.43Å; S263-T267 PolarHBondContact O-OG1 3.48Å
264	L	89.8	Confident	87.9	Confident	47 Å²	47	56.3 Å²	56.3	25%	0.246	33%	0.334	C	S	.	.	H	α-helix	trans	-63	-41.5	175.6	-174.1	65.5	0	0	0	112.2	V251 E260 I262 T267 V268	V251-L264 HydrophobicContact CG2-CB 4.41Å; V251-L264 HydrophobicContact CG2-CD2 3.89Å; V251-L264 HydrophobicContact CG2-CG 3.87Å; E260-L264 PolarHBondContact O-N 2.98Å; I262-L264 VanDerWaalsContact C-N 3.34Å; I262-L264 PolarHBondContact O-N 3.29Å; L264-T267 WeakPolarHBondContact CA-OG1 3.35Å; L264-T267 PolarHBondContact O-OG1 3.33Å; L264-V268 WeakPolarHBondContact O-CB 3.43Å; L264-V268 VanDerWaalsContact O-CG2 3.23Å; L264-V268 WeakPolarHBondContact O-CG2 3.36Å; L264-V268 PolarHBondContact O-N 3.38Å; L264-V268 VanDerWaalsContact O-N 3.15Å
265	G	87.6	Confident	87.8	Confident	1 Å²	1	56.6 Å²	56.6	1%	0.01	33%	0.333	C	S	.	.	H	α-helix	trans	-63.4	-45.5	178.4	0	0	0	0	0	113.5	K261 I262 S263 L269	K261-G265 PolarHBondContact O-N 3.32Å; I262-G265 PolarHBondContact O-N 2.87Å; I262-G265 VanDerWaalsContact O-N 3.16Å; S263-G265 PolarHBondContact O-N 3.38Å; G265-L269 PolarHBondContact O-N 3.26Å; G265-L269 VanDerWaalsContact O-N 3.16Å
266	I	90.3	Very high	87.7	Confident	92 Å²	92	56.5 Å²	56.5	47%	0.472	33%	0.328	S	S	.	.	H	α-helix	trans	-67.8	-42	179.8	-65.7	173	0	0	0	111.1	I262 S263 V268 L269 L270 V308	I262-I266 HydrophobicContact CG2-CD1 3.64Å; I262-I266 HydrophobicContact CG2-CG1 4.22Å; I262-I266 WeakPolarHBondContact O-CG1 3.26Å; I262-I266 PolarHBondContact O-N 3.45Å; S263-I266 PolarHBondContact O-N 3.45Å; I266-V268 PolarHBondContact O-N 3.44Å; I266-L269 PolarHBondContact O-N 2.74Å; I266-L270 PolarHBondContact O-N 3.08Å; I266-V308 HydrophobicContact CG1-CG1 4.47Å
267	T	91.4	Very high	87.8	Confident	75 Å²	75	60.7 Å²	60.7	46%	0.46	35%	0.348	S	S	.	.	H	α-helix	trans	-64.2	-39.1	179.9	50.1	0	0	0	0	112.2	S263 L264 S271	S263-T267 WeakPolarHBondContact O-CB 3.26Å; S263-T267 VanDerWaalsContact O-CG2 3.24Å; S263-T267 WeakPolarHBondContact O-CG2 3.4Å; S263-T267 PolarHBondContact O-N 3.43Å; S263-T267 PolarHBondContact O-OG1 3.48Å; L264-T267 WeakPolarHBondContact CA-OG1 3.35Å; L264-T267 PolarHBondContact O-OG1 3.33Å; T267-S271 WeakPolarHBondContact O-CB 3.27Å; T267-S271 PolarHBondContact O-N 2.9Å
268	V	89.6	Confident	87.9	Confident	8 Å²	8	58.9 Å²	58.9	5%	0.048	34%	0.338	C	S	.	.	H	α-helix	trans	-63.4	-44	173.4	170.2	0	0	0	0	111.5	I244 L247 A248 L264 I266 S271 L272 V304	I244-V268 HydrophobicContact CG2-CG1 3.97Å; L247-V268 HydrophobicContact CB-CG2 3.99Å; A248-V268 HydrophobicContact CB-CG1 3.98Å; L264-V268 WeakPolarHBondContact O-CB 3.43Å; L264-V268 VanDerWaalsContact O-CG2 3.23Å; L264-V268 WeakPolarHBondContact O-CG2 3.36Å; L264-V268 PolarHBondContact O-N 3.38Å; L264-V268 VanDerWaalsContact O-N 3.15Å; I266-V268 PolarHBondContact O-N 3.44Å; V268-S271 PolarHBondContact O-N 3.42Å; V268-L272 WeakPolarHBondContact O-CB 3.47Å; V268-L272 PolarHBondContact O-N 2.96Å; V268-V304 HydrophobicContact CG1-CG1 4.1Å
269	L	88.1	Confident	87.8	Confident	48 Å²	48	56 Å²	56	25%	0.251	32%	0.317	S	S	.	.	H	α-helix	trans	-63.2	-44.1	177.8	-178	64.9	0	0	0	112.3	G265 I266 L272 T273 M301 V304	G265-L269 PolarHBondContact O-N 3.26Å; G265-L269 VanDerWaalsContact O-N 3.16Å; I266-L269 PolarHBondContact O-N 2.74Å; L269-L272 PolarHBondContact O-N 3.31Å; L269-T273 PolarHBondContact O-N 3.34Å; L269-T273 PolarHBondContact O-OG1 2.89Å; L269-M301 HydrophobicContact CD1-CG 4.37Å; L269-V304 HydrophobicContact CB-CG1 4Å; L269-V304 HydrophobicContact CD1-CB 4.36Å; L269-V304 HydrophobicContact CD1-CG1 3.97Å
270	L	90.9	Very high	87.6	Confident	117 Å²	117	56 Å²	56	61%	0.613	31%	0.312	S	S	*	.	H	α-helix	trans	-64.4	-46	178.1	-175.9	67.6	0	0	0	111.1	I266 L272 T273 V274	I266-L270 PolarHBondContact O-N 3.08Å; L270-L272 VanDerWaalsContact C-N 3.34Å; L270-L272 PolarHBondContact O-N 3.5Å; L270-T273 WeakPolarHBondContact O-CB 3.13Å; L270-T273 PolarHBondContact O-N 3.05Å; L270-T273 VanDerWaalsContact O-N 3.15Å; L270-V274 WeakPolarHBondContact O-CG2 3.34Å; L270-V274 PolarHBondContact O-N 2.84Å
271	S	90.3	Very high	87.5	Confident	45 Å²	45	57.6 Å²	57.6	32%	0.315	32%	0.319	S	S	.	.	H	α-helix	trans	-57.6	-47	177.2	-179.5	0	0	0	0	111.4	T267 V268 T273 V274 F275	T267-S271 WeakPolarHBondContact O-CB 3.27Å; T267-S271 PolarHBondContact O-N 2.9Å; V268-S271 PolarHBondContact O-N 3.42Å; S271-T273 VanDerWaalsContact C-N 3.28Å; S271-T273 PolarHBondContact O-N 2.91Å; S271-V274 PolarHBondContact O-N 3.27Å; S271-F275 VanDerWaalsContact O-CD2 3.28Å; S271-F275 WeakPolarHBondContact O-CD2 3.45Å; S271-F275 PolarHBondContact O-N 3.27Å
272	L	86.5	Confident	87	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-60.6	-37.4	177.4	-172.6	69.4	0	0	0	112.6	I244 V268 L269 L270 F275 M276 F297 T300 M301 V304	I244-L272 HydrophobicContact CG2-CB 4.27Å; I244-L272 HydrophobicContact CG2-CD1 4.17Å; V268-L272 WeakPolarHBondContact O-CB 3.47Å; V268-L272 PolarHBondContact O-N 2.96Å; L269-L272 PolarHBondContact O-N 3.31Å; L270-L272 VanDerWaalsContact C-N 3.34Å; L270-L272 PolarHBondContact O-N 3.5Å; L272-F275 PolarHBondContact O-N 3.4Å; L272-M276 PolarHBondContact O-N 2.98Å; L272-F297 HydrophobicContact CD1-CD1 3.75Å; L272-F297 HydrophobicContact CD1-CE1 4.06Å; L272-T300 HydrophobicContact CD1-CG2 4.18Å; L272-T300 HydrophobicContact CD2-CG2 3.81Å; L272-M301 VanDerWaalsContact CD2-CA 3.48Å; L272-M301 HydrophobicContact CD2-CB 3.92Å; L272-V304 HydrophobicContact CD2-CB 4.4Å; L272-V304 HydrophobicContact CD2-CG2 4.22Å
273	T	87.6	Confident	86.6	Confident	46 Å²	46	59.1 Å²	59.1	28%	0.282	33%	0.327	S	S	.	.	H	α-helix	trans	-66.2	-42.7	177	-53.8	0	0	0	0	111.7	L269 L270 S271 M276 L277 M301	L269-T273 PolarHBondContact O-N 3.34Å; L269-T273 PolarHBondContact O-OG1 2.89Å; L270-T273 WeakPolarHBondContact O-CB 3.13Å; L270-T273 PolarHBondContact O-N 3.05Å; L270-T273 VanDerWaalsContact O-N 3.15Å; S271-T273 VanDerWaalsContact C-N 3.28Å; S271-T273 PolarHBondContact O-N 2.91Å; T273-M276 PolarHBondContact O-N 3.43Å; T273-L277 WeakPolarHBondContact O-CG 3.48Å; T273-L277 PolarHBondContact O-N 3.31Å; T273-M301 HydrophobicContact CG2-CE 4.37Å
274	V	90.1	Very high	85.9	Confident	90 Å²	90	56.9 Å²	56.9	55%	0.545	31%	0.311	S	S	.	.	H	α-helix	trans	-63.3	-44	175.8	173.6	0	0	0	0	111.2	L270 S271 M276 L277 L278	L270-V274 WeakPolarHBondContact O-CG2 3.34Å; L270-V274 PolarHBondContact O-N 2.84Å; S271-V274 PolarHBondContact O-N 3.27Å; V274-M276 VanDerWaalsContact C-N 3.3Å; V274-M276 PolarHBondContact O-N 3.12Å; V274-L277 PolarHBondContact O-N 2.97Å; V274-L278 PolarHBondContact O-N 3.02Å
275	F	85.7	Confident	85.1	Confident	56 Å²	56	60 Å²	60	25%	0.246	34%	0.344	C	S	.	.	H	α-helix	trans	-61.9	-37.3	175.6	-85.8	-73.1	0	0	0	112.5	P240 I244 S271 L272 L278 V279 F297	P240-F275 HydrophobicContact CB-CE1 3.98Å; P240-F275 HydrophobicContact CB-CZ 3.92Å; I244-F275 HydrophobicContact CD1-CD2 3.39Å; I244-F275 HydrophobicContact CD1-CE2 3.46Å; I244-F275 VanDerWaalsContact CD1-CE2 3.46Å; I244-F275 HydrophobicContact CD1-CG 4.35Å; I244-F275 HydrophobicContact CD1-CZ 4.43Å; S271-F275 VanDerWaalsContact O-CD2 3.28Å; S271-F275 WeakPolarHBondContact O-CD2 3.45Å; S271-F275 PolarHBondContact O-N 3.27Å; L272-F275 PolarHBondContact O-N 3.4Å; F275-L278 PolarHBondContact O-N 3.45Å; F275-V279 WeakPolarHBondContact O-CG2 3.36Å; F275-V279 PolarHBondContact O-N 2.87Å; F275-V279 VanDerWaalsContact O-N 3.12Å; F275-F297 HydrophobicContact CB-CE1 4.35Å
276	M	83.7	Confident	84.3	Confident	65 Å²	65	61.8 Å²	61.8	32%	0.32	36%	0.355	S	S	.	.	H	α-helix	trans	-65.2	-41.7	175.4	-171.5	-84.1	-84.9	0	0	112	L272 T273 V274 L278 V279 A280 F297 M301	L272-M276 PolarHBondContact O-N 2.98Å; T273-M276 PolarHBondContact O-N 3.43Å; V274-M276 VanDerWaalsContact C-N 3.3Å; V274-M276 PolarHBondContact O-N 3.12Å; M276-L278 PolarHBondContact O-N 3.28Å; M276-V279 PolarHBondContact O-N 2.99Å; M276-A280 PolarHBondContact O-N 3.46Å; M276-F297 HydrophobicContact CG-CB 4.38Å; M276-M301 HydrophobicContact CB-CE 3.83Å; M276-M301 HydrophobicContact CE-CE 3.87Å; M276-M301 HydrophobicContact CE-SD 4.44Å; M276-M301 HydrophobicContact CG-CE 4.1Å
277	L	85.8	Confident	83.5	Confident	99 Å²	99	63 Å²	63	52%	0.518	37%	0.372	S	S	.	.	H	α-helix	trans	-62.1	-42.6	175.7	-70.4	173.5	0	0	0	112	T273 V274 V279 A280 E281	T273-L277 WeakPolarHBondContact O-CG 3.48Å; T273-L277 PolarHBondContact O-N 3.31Å; V274-L277 PolarHBondContact O-N 2.97Å; L277-V279 VanDerWaalsContact C-N 3.29Å; L277-V279 PolarHBondContact O-N 3.25Å; L277-A280 WeakPolarHBondContact O-CB 3.21Å; L277-A280 PolarHBondContact O-N 3.43Å; L277-A280 VanDerWaalsContact O-N 3.14Å; L277-E281 PolarHBondContact O-N 3.03Å; L277-E281 VanDerWaalsContact O-N 3.12Å
278	L	85.6	Confident	82.6	Confident	85 Å²	85	64.4 Å²	64.4	45%	0.445	38%	0.376	S	S	.	.	H	α-helix	trans	-57.7	-43.2	174.4	-178.9	71.2	0	0	0	111.7	V274 F275 M276 A280 E281	V274-L278 PolarHBondContact O-N 3.02Å; F275-L278 PolarHBondContact O-N 3.45Å; M276-L278 PolarHBondContact O-N 3.28Å; L278-A280 VanDerWaalsContact C-N 3.34Å; L278-E281 PolarHBondContact O-N 3.24Å
279	V	82.9	Confident	82	Confident	3 Å²	3	64.6 Å²	64.6	2%	0.018	38%	0.378	C	S	.	.	H	α-helix	trans	-67	-35.5	177.8	169.1	0	0	0	0	111.5	L237 F275 M276 L277 E281 I282 M283 I293 F297	L237-V279 HydrophobicContact CD2-CG2 4.02Å; F275-V279 WeakPolarHBondContact O-CG2 3.36Å; F275-V279 PolarHBondContact O-N 2.87Å; F275-V279 VanDerWaalsContact O-N 3.12Å; M276-V279 PolarHBondContact O-N 2.99Å; L277-V279 VanDerWaalsContact C-N 3.29Å; L277-V279 PolarHBondContact O-N 3.25Å; V279-E281 VanDerWaalsContact C-N 3.3Å; V279-E281 PolarHBondContact O-N 3.38Å; V279-I282 WeakPolarHBondContact O-CG1 3.39Å; V279-I282 PolarHBondContact O-N 3.29Å; V279-M283 HydrophobicContact CG1-CE 3.36Å; V279-M283 HydrophobicContact CG1-SD 3.99Å; V279-M283 WeakPolarHBondContact O-CE 3.25Å; V279-M283 WeakPolarHBondContact O-CG 3.39Å; V279-M283 PolarHBondContact O-N 2.85Å; V279-I293 HydrophobicContact CG1-CG2 4.41Å; V279-F297 HydrophobicContact CG2-CE2 4.05Å
280	A	80.6	Confident	81.6	Confident	54 Å²	54	66.4 Å²	66.4	45%	0.446	39%	0.391	S	S	.	.	H	α-helix	trans	-68.2	-27	176.1	0	0	0	0	0	113.3	M276 L277 L278	M276-A280 PolarHBondContact O-N 3.46Å; L277-A280 WeakPolarHBondContact O-CB 3.21Å; L277-A280 PolarHBondContact O-N 3.43Å; L277-A280 VanDerWaalsContact O-N 3.14Å; L278-A280 VanDerWaalsContact C-N 3.34Å
281	E	83.4	Confident	81.4	Confident	150 Å²	150	61.5 Å²	61.5	70%	0.701	37%	0.366	S	S	*	.	H	α-helix	trans	-74	-32.9	177.3	-72.8	-173.3	167.5	0	0	113.4	L277 L278 V279	L277-E281 PolarHBondContact O-N 3.03Å; L277-E281 VanDerWaalsContact O-N 3.12Å; L278-E281 PolarHBondContact O-N 3.24Å; V279-E281 VanDerWaalsContact C-N 3.3Å; V279-E281 PolarHBondContact O-N 3.38Å
282	I	79.4	Confident	81	Confident	76 Å²	76	60.7 Å²	60.7	39%	0.39	36%	0.358	S	S	.	.	H	α-helix	trans	-82.7	-19.9	-178.8	61.5	169.7	0	0	0	113.3	F157 L237 V279	F157-I282 HydrophobicContact CZ-CD1 4.32Å; L237-I282 HydrophobicContact CD1-CD1 4.01Å; V279-I282 WeakPolarHBondContact O-CG1 3.39Å; V279-I282 PolarHBondContact O-N 3.29Å
283	M	79.2	Confident	80.8	Confident	24 Å²	24	61.3 Å²	61.3	12%	0.118	36%	0.361	C	S	.	.	S	Bend	trans	-98.9	142.8	-177.1	-63.1	-175.8	-53.2	0	0	111.4	F157 V279 P291 I293 A294	F157-M283 HydrophobicContact CD1-SD 4.43Å; V279-M283 HydrophobicContact CG1-CE 3.36Å; V279-M283 HydrophobicContact CG1-SD 3.99Å; V279-M283 WeakPolarHBondContact O-CE 3.25Å; V279-M283 WeakPolarHBondContact O-CG 3.39Å; V279-M283 PolarHBondContact O-N 2.85Å; M283-P291 HydrophobicContact CE-CB 4.32Å; M283-P291 HydrophobicContact CE-CG 3.88Å; M283-P291 HydrophobicContact SD-CB 3.76Å; M283-P291 HydrophobicContact SD-CG 3.51Å; M283-P291 VanDerWaalsContact SD-CG 3.51Å; M283-I293 HydrophobicContact SD-CG2 4.08Å; M283-A294 HydrophobicContact CE-CB 4.15Å
284	P	76.2	Confident	80.6	Confident	13 Å²	13	60.3 Å²	60.3	8%	0.084	36%	0.357	C	S	.	.			trans	-59.9	140.2	174	21.1	-30.6	0	0	0	111.8	E67 V154 T286	E67-P284 HydrophobicContact CB-CG 4.45Å; E67-P284 VanDerWaalsContact O-CB 3.29Å; E67-P284 WeakPolarHBondContact O-CB 3.42Å; E67-P284 WeakPolarHBondContact O-CG 3.43Å; V154-P284 HydrophobicContact CG1-CG 3.87Å; P284-T286 HydrophobicContact CB-CG2 4.1Å; P284-T286 PolarHBondContact O-N 3.22Å
285	A	71.7	Confident	80.3	Confident	114 Å²	114	60.8 Å²	60.8	94%	0.942	35%	0.354	S	S	*	.			trans	-73.8	74.1	171.3	0	0	0	0	0	110.5
286	T	71.4	Confident	80.2	Confident	38 Å²	38	58.7 Å²	58.7	23%	0.233	34%	0.344	C	S	.	.			trans	-111.3	133.4	176.9	51.3	0	0	0	0	110.2	P284	P284-T286 HydrophobicContact CB-CG2 4.1Å; P284-T286 PolarHBondContact O-N 3.22Å
287	S	72.6	Confident	80.3	Confident	118 Å²	118	55.6 Å²	55.6	83%	0.825	33%	0.329	S	S	*	.	S	Bend	trans	-89.8	-10.4	178	54.5	0	0	0	0	113.8	S289	S287-S289 PolarHBondContact O-N 3.5Å
288	D	73.1	Confident	80.2	Confident	103 Å²	103	53.1 Å²	53.1	55%	0.551	32%	0.322	S	S	*	.	S	Bend	trans	-68.9	-23.6	-174.4	-64	-19.4	0	0	0	112.8	Y151	Y151-D288 WeakPolarHBondContact OH-CB 3.19Å; Y151-D288 PolarHBondContact OH-OD2 2.94Å
289	S	76.7	Confident	80.2	Confident	13 Å²	13	50.5 Å²	50.5	9%	0.091	31%	0.311	C	S	.	.			trans	-161.2	135.4	177	50.6	0	0	0	0	113	R155 S287	R155-S289 VanDerWaalsContact NE-CB 3.33Å; S287-S289 PolarHBondContact O-N 3.5Å
290	V	81.1	Confident	80.3	Confident	86 Å²	86	50.7 Å²	50.7	52%	0.521	31%	0.313	S	S	.	.			trans	-89.5	125.8	175.1	-175.2	0	0	0	0	109.5	A294 Q295	V290-A294 HydrophobicContact CG1-CB 4.22Å; V290-Q295 HydrophobicContact CB-CG 4.31Å; V290-Q295 HydrophobicContact CG1-CG 3.72Å; V290-Q295 PolarHBondContact O-NE2 3.12Å
291	P	85.5	Confident	80.6	Confident	13 Å²	13	50.1 Å²	50.1	8%	0.084	30%	0.301	C	S	.	.			trans	-57.8	139.9	177	-24.5	33.3	0	0	0	112.5	V154 M283 I293 A294 Q295	V154-P291 HydrophobicContact CB-CG 4.17Å; V154-P291 HydrophobicContact CG2-CG 3.8Å; V154-P291 WeakPolarHBondContact O-CA 3.27Å; M283-P291 HydrophobicContact CE-CB 4.32Å; M283-P291 HydrophobicContact CE-CG 3.88Å; M283-P291 HydrophobicContact SD-CB 3.76Å; M283-P291 HydrophobicContact SD-CG 3.51Å; M283-P291 VanDerWaalsContact SD-CG 3.51Å; P291-I293 HydrophobicContact CB-CG2 4Å; P291-I293 PolarHBondContact O-N 3.12Å; P291-A294 HydrophobicContact CB-CB 4.09Å; P291-A294 HydrophobicContact CG-CB 4.37Å; P291-A294 WeakPolarHBondContact O-CB 3.43Å; P291-A294 PolarHBondContact O-N 3.31Å; P291-Q295 PolarHBondContact O-N 3.14Å
292	L	82.7	Confident	80.8	Confident	29 Å²	29	48.5 Å²	48.5	15%	0.152	30%	0.296	C	S	.	.	H	α-helix	trans	-56.4	-39.6	177.5	-164.1	85.3	0	0	0	112	R155 A294 Q295 Y296 I486	R155-L292 WeakPolarHBondContact O-CB 3.43Å; R155-L292 PolarHBondContact O-N 2.98Å; L292-A294 VanDerWaalsContact C-N 3.32Å; L292-A294 PolarHBondContact O-N 2.81Å; L292-Q295 PolarHBondContact O-N 3.4Å; L292-Y296 PolarHBondContact O-N 3.38Å; L292-I486 HydrophobicContact CD2-CG2 3.72Å; L292-I486 WeakPolarHBondContact CD2-O 3.36Å; L292-I486 HydrophobicContact CG-CG2 3.92Å
293	I	82.3	Confident	81.2	Confident	12 Å²	12	45.5 Å²	45.5	6%	0.062	28%	0.281	C	S	.	.	H	α-helix	trans	-63.2	-37.5	176	-167.9	60.7	0	0	0	112	F157 L238 V279 M283 P291 Y296 F297	F157-I293 HydrophobicContact CD1-CG2 3.85Å; L238-I293 HydrophobicContact CD2-CD1 4.17Å; V279-I293 HydrophobicContact CG1-CG2 4.41Å; M283-I293 HydrophobicContact SD-CG2 4.08Å; P291-I293 HydrophobicContact CB-CG2 4Å; P291-I293 PolarHBondContact O-N 3.12Å; I293-Y296 HydrophobicContact CD1-CD1 4.23Å; I293-Y296 WeakPolarHBondContact O-CB 3.22Å; I293-Y296 PolarHBondContact O-N 3.44Å; I293-F297 HydrophobicContact CD1-CD2 4.11Å; I293-F297 HydrophobicContact CD1-CE2 3.74Å; I293-F297 HydrophobicContact CG1-CD2 3.85Å; I293-F297 HydrophobicContact CG1-CE2 3.65Å; I293-F297 WeakPolarHBondContact O-CD2 3.33Å; I293-F297 PolarHBondContact O-N 3.39Å
294	A	83.3	Confident	81.5	Confident	25 Å²	25	44.6 Å²	44.6	21%	0.207	28%	0.277	C	S	.	.	H	α-helix	trans	-69.7	-40	178.1	0	0	0	0	0	110.9	M283 V290 P291 L292 Y296 F297 A298	M283-A294 HydrophobicContact CE-CB 4.15Å; V290-A294 HydrophobicContact CG1-CB 4.22Å; P291-A294 HydrophobicContact CB-CB 4.09Å; P291-A294 HydrophobicContact CG-CB 4.37Å; P291-A294 WeakPolarHBondContact O-CB 3.43Å; P291-A294 PolarHBondContact O-N 3.31Å; L292-A294 VanDerWaalsContact C-N 3.32Å; L292-A294 PolarHBondContact O-N 2.81Å; A294-Y296 VanDerWaalsContact C-N 3.29Å; A294-Y296 PolarHBondContact O-N 2.96Å; A294-F297 PolarHBondContact O-N 2.85Å; A294-A298 VanDerWaalsContact O-CB 3.27Å; A294-A298 WeakPolarHBondContact O-CB 3.4Å; A294-A298 PolarHBondContact O-N 3.3Å
295	Q	84.1	Confident	82.1	Confident	101 Å²	101	45.1 Å²	45.1	47%	0.472	28%	0.284	S	S	.	.	H	α-helix	trans	-61	-40.6	172.7	-63.3	-178.5	11.3	0	0	111.4	V290 P291 L292 S299	V290-Q295 HydrophobicContact CB-CG 4.31Å; V290-Q295 HydrophobicContact CG1-CG 3.72Å; V290-Q295 PolarHBondContact O-NE2 3.12Å; P291-Q295 PolarHBondContact O-N 3.14Å; L292-Q295 PolarHBondContact O-N 3.4Å; Q295-S299 WeakPolarHBondContact O-CB 3.44Å; Q295-S299 PolarHBondContact O-N 2.9Å; Q295-S299 PolarHBondContact O-OG 3Å
296	Y	83.9	Confident	82.9	Confident	11 Å²	11	44.4 Å²	44.4	4%	0.043	26%	0.264	C	S	.	.	H	α-helix	trans	-58.8	-56.9	173.7	-178.6	-127	0	0	0	111.4	C241 L292 I293 A294 A298 S299 T300 I486	C241-Y296 HydrophobicContact CB-CE1 4.27Å; C241-Y296 WeakPolarHBondContact SG-CE1 3.44Å; L292-Y296 PolarHBondContact O-N 3.38Å; I293-Y296 HydrophobicContact CD1-CD1 4.23Å; I293-Y296 WeakPolarHBondContact O-CB 3.22Å; I293-Y296 PolarHBondContact O-N 3.44Å; A294-Y296 VanDerWaalsContact C-N 3.29Å; A294-Y296 PolarHBondContact O-N 2.96Å; Y296-A298 VanDerWaalsContact C-N 3.32Å; Y296-A298 PolarHBondContact O-N 3.47Å; Y296-S299 PolarHBondContact O-N 3.32Å; Y296-S299 VanDerWaalsContact O-N 3.16Å; Y296-S299 PolarHBondContact O-OG 3.02Å; Y296-T300 PolarHBondContact O-N 3.03Å; Y296-T300 PolarHBondContact O-OG1 2.89Å; Y296-T300 VanDerWaalsContact O-OG1 3.08Å; Y296-I486 HydrophobicContact CD2-CD1 3.46Å; Y296-I486 VanDerWaalsContact CD2-CD1 3.46Å; Y296-I486 HydrophobicContact CE2-CD1 4.47Å; Y296-I486 HydrophobicContact CG-CD1 4.01Å
297	F	83.9	Confident	83.7	Confident	1 Å²	1	42.8 Å²	42.8	0%	0.004	25%	0.254	C	S	.	.	H	α-helix	trans	-58.5	-41.2	179.5	-83.1	-70.6	0	0	0	112.9	C241 L272 F275 M276 V279 I293 A294 T300 M301	C241-F297 HydrophobicContact CB-CE1 3.73Å; C241-F297 HydrophobicContact CB-CZ 3.68Å; C241-F297 WeakPolarHBondContact SG-CE1 3.23Å; L272-F297 HydrophobicContact CD1-CD1 3.75Å; L272-F297 HydrophobicContact CD1-CE1 4.06Å; F275-F297 HydrophobicContact CB-CE1 4.35Å; M276-F297 HydrophobicContact CG-CB 4.38Å; V279-F297 HydrophobicContact CG2-CE2 4.05Å; I293-F297 HydrophobicContact CD1-CD2 4.11Å; I293-F297 HydrophobicContact CD1-CE2 3.74Å; I293-F297 HydrophobicContact CG1-CD2 3.85Å; I293-F297 HydrophobicContact CG1-CE2 3.65Å; I293-F297 WeakPolarHBondContact O-CD2 3.33Å; I293-F297 PolarHBondContact O-N 3.39Å; A294-F297 PolarHBondContact O-N 2.85Å; F297-T300 PolarHBondContact O-N 3.01Å; F297-M301 VanDerWaalsContact O-CB 3.28Å; F297-M301 WeakPolarHBondContact O-CB 3.35Å; F297-M301 PolarHBondContact O-N 3.05Å
298	A	84.9	Confident	84.5	Confident	46 Å²	46	38.1 Å²	38.1	38%	0.38	22%	0.221	S	C	.	.	H	α-helix	trans	-63.6	-44.3	176.8	0	0	0	0	0	111.7	A294 Y296 M301 I302	A294-A298 VanDerWaalsContact O-CB 3.27Å; A294-A298 WeakPolarHBondContact O-CB 3.4Å; A294-A298 PolarHBondContact O-N 3.3Å; Y296-A298 VanDerWaalsContact C-N 3.32Å; Y296-A298 PolarHBondContact O-N 3.47Å; A298-M301 PolarHBondContact O-N 3.38Å; A298-I302 WeakPolarHBondContact O-CG1 3.35Å; A298-I302 PolarHBondContact O-N 2.91Å
299	S	85	Confident	85.3	Confident	30 Å²	30	37.3 Å²	37.3	21%	0.21	22%	0.22	C	C	.	.	H	α-helix	trans	-62.8	-45.5	176.1	72.7	0	0	0	0	111.7	Q295 Y296 M301 I302 I303	Q295-S299 WeakPolarHBondContact O-CB 3.44Å; Q295-S299 PolarHBondContact O-N 2.9Å; Q295-S299 PolarHBondContact O-OG 3Å; Y296-S299 PolarHBondContact O-N 3.32Å; Y296-S299 VanDerWaalsContact O-N 3.16Å; Y296-S299 PolarHBondContact O-OG 3.02Å; S299-M301 VanDerWaalsContact C-N 3.3Å; S299-M301 PolarHBondContact O-N 2.74Å; S299-I302 PolarHBondContact O-N 2.92Å; S299-I303 WeakPolarHBondContact O-CD1 3.45Å; S299-I303 WeakPolarHBondContact O-CG1 3.33Å; S299-I303 PolarHBondContact O-N 3.4Å
300	T	84.2	Confident	85.9	Confident	8 Å²	8	38.2 Å²	38.2	5%	0.049	22%	0.224	C	C	.	.	H	α-helix	trans	-59.9	-40.5	175.1	-55.6	0	0	0	0	111.5	L272 Y296 F297 I303 V304	L272-T300 HydrophobicContact CD1-CG2 4.18Å; L272-T300 HydrophobicContact CD2-CG2 3.81Å; Y296-T300 PolarHBondContact O-N 3.03Å; Y296-T300 PolarHBondContact O-OG1 2.89Å; Y296-T300 VanDerWaalsContact O-OG1 3.08Å; F297-T300 PolarHBondContact O-N 3.01Å; T300-I303 PolarHBondContact O-N 3.38Å; T300-V304 HydrophobicContact CG2-CG2 4.2Å; T300-V304 WeakPolarHBondContact O-CB 3.05Å; T300-V304 VanDerWaalsContact O-CG2 3.23Å; T300-V304 WeakPolarHBondContact O-CG2 3.3Å; T300-V304 PolarHBondContact O-N 3.27Å
301	M	87.4	Confident	86.2	Confident	42 Å²	42	34.1 Å²	34.1	21%	0.207	20%	0.2	C	C	.	.	H	α-helix	trans	-64.8	-41.7	178.3	-174	-179.7	-65.7	0	0	112.2	L269 L272 T273 M276 F297 A298 S299 G305	L269-M301 HydrophobicContact CD1-CG 4.37Å; L272-M301 VanDerWaalsContact CD2-CA 3.48Å; L272-M301 HydrophobicContact CD2-CB 3.92Å; T273-M301 HydrophobicContact CG2-CE 4.37Å; M276-M301 HydrophobicContact CB-CE 3.83Å; M276-M301 HydrophobicContact CE-CE 3.87Å; M276-M301 HydrophobicContact CE-SD 4.44Å; M276-M301 HydrophobicContact CG-CE 4.1Å; F297-M301 VanDerWaalsContact O-CB 3.28Å; F297-M301 WeakPolarHBondContact O-CB 3.35Å; F297-M301 PolarHBondContact O-N 3.05Å; A298-M301 PolarHBondContact O-N 3.38Å; S299-M301 VanDerWaalsContact C-N 3.3Å; S299-M301 PolarHBondContact O-N 2.74Å; M301-G305 PolarHBondContact O-N 3.37Å
302	I	88.6	Confident	86.4	Confident	115 Å²	115	37 Å²	37	59%	0.59	22%	0.216	S	C	*	.	H	α-helix	trans	-63.8	-45.4	174.9	-66.8	165.7	0	0	0	110.3	A298 S299 G305 L306	A298-I302 WeakPolarHBondContact O-CG1 3.35Å; A298-I302 PolarHBondContact O-N 2.91Å; S299-I302 PolarHBondContact O-N 2.92Å; I302-G305 PolarHBondContact O-N 2.78Å; I302-L306 HydrophobicContact CG2-CD1 4.12Å; I302-L306 WeakPolarHBondContact O-CG 3.21Å; I302-L306 PolarHBondContact O-N 3.19Å
303	I	86.5	Confident	86.7	Confident	14 Å²	14	38.9 Å²	38.9	7%	0.072	23%	0.226	C	C	.	.	H	α-helix	trans	-60.8	-48.9	178.5	-62.2	157.8	0	0	0	110.9	S299 T300 G305 L306 S307 F475 F478	S299-I303 WeakPolarHBondContact O-CD1 3.45Å; S299-I303 WeakPolarHBondContact O-CG1 3.33Å; S299-I303 PolarHBondContact O-N 3.4Å; T300-I303 PolarHBondContact O-N 3.38Å; I303-G305 VanDerWaalsContact C-N 3.33Å; I303-G305 PolarHBondContact O-N 2.9Å; I303-L306 PolarHBondContact O-N 3.49Å; I303-S307 WeakPolarHBondContact O-CB 3.28Å; I303-S307 PolarHBondContact O-N 3.16Å; I303-F475 HydrophobicContact CG2-CD1 3.58Å; I303-F475 HydrophobicContact CG2-CE1 3.99Å; I303-F475 HydrophobicContact CG2-CG 4.44Å; I303-F478 HydrophobicContact CD1-CD1 3.3Å; I303-F478 HydrophobicContact CD1-CE1 3.31Å; I303-F478 HydrophobicContact CG1-CD1 3.54Å; I303-F478 HydrophobicContact CG1-CE1 3.39Å
304	V	86.4	Confident	86.9	Confident	5 Å²	5	38.5 Å²	38.5	3%	0.03	22%	0.224	C	C	.	.	H	α-helix	trans	-66.2	-36.8	-179.9	175	0	0	0	0	110.8	A248 V268 L269 L272 T300 S307 V308	A248-V304 HydrophobicContact CB-CG2 3.8Å; V268-V304 HydrophobicContact CG1-CG1 4.1Å; L269-V304 HydrophobicContact CB-CG1 4Å; L269-V304 HydrophobicContact CD1-CB 4.36Å; L269-V304 HydrophobicContact CD1-CG1 3.97Å; L272-V304 HydrophobicContact CD2-CB 4.4Å; L272-V304 HydrophobicContact CD2-CG2 4.22Å; T300-V304 HydrophobicContact CG2-CG2 4.2Å; T300-V304 WeakPolarHBondContact O-CB 3.05Å; T300-V304 VanDerWaalsContact O-CG2 3.23Å; T300-V304 WeakPolarHBondContact O-CG2 3.3Å; T300-V304 PolarHBondContact O-N 3.27Å; V304-S307 WeakPolarHBondContact CA-OG 3.5Å; V304-S307 PolarHBondContact O-N 2.94Å; V304-S307 PolarHBondContact O-OG 2.89Å; V304-V308 WeakPolarHBondContact O-CG2 3.43Å; V304-V308 PolarHBondContact O-N 3.46Å
305	G	88.9	Confident	87.1	Confident	24 Å²	24	38.3 Å²	38.3	25%	0.247	22%	0.22	C	C	.	.	H	α-helix	trans	-60.2	-48	172.3	0	0	0	0	0	112.1	M301 I302 I303 S307 V308 V309	M301-G305 PolarHBondContact O-N 3.37Å; I302-G305 PolarHBondContact O-N 2.78Å; I303-G305 VanDerWaalsContact C-N 3.33Å; I303-G305 PolarHBondContact O-N 2.9Å; G305-S307 VanDerWaalsContact C-N 3.29Å; G305-S307 PolarHBondContact O-N 3.39Å; G305-V308 PolarHBondContact O-N 3.3Å; G305-V309 PolarHBondContact O-N 2.95Å
306	L	89	Confident	87.3	Confident	98 Å²	98	40 Å²	40	51%	0.513	23%	0.228	S	C	.	.	H	α-helix	trans	-63.6	-35.6	175.2	-69.9	172.6	0	0	0	112	I302 I303 V309 V310	I302-L306 HydrophobicContact CG2-CD1 4.12Å; I302-L306 WeakPolarHBondContact O-CG 3.21Å; I302-L306 PolarHBondContact O-N 3.19Å; I303-L306 PolarHBondContact O-N 3.49Å; L306-V309 PolarHBondContact O-N 3.14Å; L306-V310 WeakPolarHBondContact O-CG2 3.41Å; L306-V310 PolarHBondContact O-N 3.11Å
307	S	87.3	Confident	87.3	Confident	4 Å²	4	42.7 Å²	42.7	3%	0.028	24%	0.238	C	C	.	.	H	α-helix	trans	-63.2	-43.2	179	88.8	0	0	0	0	111.5	I303 V304 G305 V310 T311	I303-S307 WeakPolarHBondContact O-CB 3.28Å; I303-S307 PolarHBondContact O-N 3.16Å; V304-S307 WeakPolarHBondContact CA-OG 3.5Å; V304-S307 PolarHBondContact O-N 2.94Å; V304-S307 PolarHBondContact O-OG 2.89Å; G305-S307 VanDerWaalsContact C-N 3.29Å; G305-S307 PolarHBondContact O-N 3.39Å; S307-V310 PolarHBondContact O-N 3.32Å; S307-T311 VanDerWaalsContact O-CG2 3.29Å; S307-T311 WeakPolarHBondContact O-CG2 3.37Å; S307-T311 PolarHBondContact O-N 2.85Å; S307-T311 PolarHBondContact O-OG1 3.2Å
308	V	88.9	Confident	87.4	Confident	21 Å²	21	43.6 Å²	43.6	13%	0.127	24%	0.242	C	C	.	.	H	α-helix	trans	-64.1	-40.5	175.7	175.2	0	0	0	0	111.8	I266 V304 G305 V310 T311 V312	I266-V308 HydrophobicContact CG1-CG1 4.47Å; V304-V308 WeakPolarHBondContact O-CG2 3.43Å; V304-V308 PolarHBondContact O-N 3.46Å; G305-V308 PolarHBondContact O-N 3.3Å; V308-V310 VanDerWaalsContact C-N 3.32Å; V308-V310 PolarHBondContact O-N 2.93Å; V308-T311 WeakPolarHBondContact CA-OG1 3.3Å; V308-T311 PolarHBondContact O-N 3.37Å; V308-T311 PolarHBondContact O-OG1 3.01Å; V308-V312 WeakPolarHBondContact O-CG2 3.42Å; V308-V312 PolarHBondContact O-N 3.27Å
309	V	90.7	Very high	87.4	Confident	86 Å²	86	47.2 Å²	47.2	52%	0.521	25%	0.251	S	S	.	.	H	α-helix	trans	-62.2	-43.5	175.6	174.7	0	0	0	0	110.8	G305 L306 V312 I313	G305-V309 PolarHBondContact O-N 2.95Å; L306-V309 PolarHBondContact O-N 3.14Å; V309-V312 PolarHBondContact O-N 3.48Å; V309-I313 HydrophobicContact CG1-CD1 4.42Å; V309-I313 WeakPolarHBondContact O-CG1 3.4Å; V309-I313 PolarHBondContact O-N 3.01Å
310	V	88.4	Confident	87.2	Confident	32 Å²	32	48.2 Å²	48.2	19%	0.194	25%	0.252	C	S	.	.	H	α-helix	trans	-67.1	-37.1	178.5	171.1	0	0	0	0	111.9	F252 L306 S307 V308 V312 I313 V314 C471	F252-V310 HydrophobicContact CE1-CG1 4.32Å; L306-V310 WeakPolarHBondContact O-CG2 3.41Å; L306-V310 PolarHBondContact O-N 3.11Å; S307-V310 PolarHBondContact O-N 3.32Å; V308-V310 VanDerWaalsContact C-N 3.32Å; V308-V310 PolarHBondContact O-N 2.93Å; V310-V312 VanDerWaalsContact C-N 3.31Å; V310-V312 PolarHBondContact O-N 3.29Å; V310-I313 WeakPolarHBondContact O-CB 3.23Å; V310-I313 PolarHBondContact O-N 3.27Å; V310-I313 VanDerWaalsContact O-N 3.14Å; V310-V314 HydrophobicContact CG1-CG2 4.32Å; V310-V314 WeakPolarHBondContact O-CG2 3.07Å; V310-V314 PolarHBondContact O-N 3.34Å; V310-C471 HydrophobicContact CG1-CB 4.14Å; V310-C471 WeakPolarHBondContact CG1-SG 3.47Å
311	T	88.4	Confident	86.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-66.5	-33.9	177.4	58.2	0	0	0	0	112.2	V251 F252 S307 V308 I313 V314 L315	V251-T311 HydrophobicContact CG1-CG2 3.75Å; F252-T311 HydrophobicContact CD1-CG2 4.17Å; F252-T311 HydrophobicContact CE1-CG2 3.67Å; F252-T311 HydrophobicContact CZ-CG2 4.16Å; S307-T311 VanDerWaalsContact O-CG2 3.29Å; S307-T311 WeakPolarHBondContact O-CG2 3.37Å; S307-T311 PolarHBondContact O-N 2.85Å; S307-T311 PolarHBondContact O-OG1 3.2Å; V308-T311 WeakPolarHBondContact CA-OG1 3.3Å; V308-T311 PolarHBondContact O-N 3.37Å; V308-T311 PolarHBondContact O-OG1 3.01Å; T311-I313 VanDerWaalsContact C-N 3.35Å; T311-V314 PolarHBondContact O-N 3.16Å; T311-L315 WeakPolarHBondContact O-CB 3.44Å; T311-L315 WeakPolarHBondContact O-CG 3.35Å; T311-L315 PolarHBondContact O-N 3.24Å
312	V	89.4	Confident	85.7	Confident	72 Å²	72	55 Å²	55	44%	0.436	29%	0.294	S	S	.	.	H	α-helix	trans	-61.5	-44.2	170.2	173.6	0	0	0	0	110.7	V308 V309 V310 L315 Q316	V308-V312 WeakPolarHBondContact O-CG2 3.42Å; V308-V312 PolarHBondContact O-N 3.27Å; V309-V312 PolarHBondContact O-N 3.48Å; V310-V312 VanDerWaalsContact C-N 3.31Å; V310-V312 PolarHBondContact O-N 3.29Å; V312-L315 PolarHBondContact O-N 3.5Å; V312-Q316 PolarHBondContact O-N 2.84Å
313	I	88.2	Confident	84.5	Confident	70 Å²	70	57.2 Å²	57.2	36%	0.359	31%	0.306	S	S	.	.	H	α-helix	trans	-61.6	-48.4	175.1	-64.3	169	0	0	0	110.2	V309 V310 T311 L315 Q316 Y317	V309-I313 HydrophobicContact CG1-CD1 4.42Å; V309-I313 WeakPolarHBondContact O-CG1 3.4Å; V309-I313 PolarHBondContact O-N 3.01Å; V310-I313 WeakPolarHBondContact O-CB 3.23Å; V310-I313 PolarHBondContact O-N 3.27Å; V310-I313 VanDerWaalsContact O-N 3.14Å; T311-I313 VanDerWaalsContact C-N 3.35Å; I313-L315 VanDerWaalsContact C-N 3.27Å; I313-L315 PolarHBondContact O-N 3.23Å; I313-Q316 WeakPolarHBondContact O-CA 3.43Å; I313-Q316 WeakPolarHBondContact O-CB 3.21Å; I313-Q316 PolarHBondContact O-N 3.42Å; I313-Q316 VanDerWaalsContact O-N 3.07Å; I313-Y317 HydrophobicContact CG2-CD2 3.71Å; I313-Y317 HydrophobicContact CG2-CE2 3.65Å; I313-Y317 VanDerWaalsContact O-CD2 3.31Å; I313-Y317 WeakPolarHBondContact O-CD2 3.46Å; I313-Y317 PolarHBondContact O-N 2.87Å
314	V	88	Confident	83.4	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.018	33%	0.325	C	S	.	.	H	α-helix	trans	-57	-41.6	177.9	169.8	0	0	0	0	111.4	V310 T311 Y317 H318 A464 V467 D468	V310-V314 HydrophobicContact CG1-CG2 4.32Å; V310-V314 WeakPolarHBondContact O-CG2 3.07Å; V310-V314 PolarHBondContact O-N 3.34Å; T311-V314 PolarHBondContact O-N 3.16Å; V314-Y317 PolarHBondContact O-N 3.2Å; V314-H318 WeakPolarHBondContact O-CB 3.29Å; V314-H318 PolarHBondContact O-N 3.17Å; V314-A464 HydrophobicContact CG1-CB 4.34Å; V314-V467 HydrophobicContact CG2-CB 4.21Å; V314-V467 HydrophobicContact CG2-CG1 3.67Å; V314-D468 HydrophobicContact CG1-CB 4.1Å; V314-D468 HydrophobicContact CG2-CB 4.46Å
315	L	87.4	Confident	82.5	Confident	21 Å²	21	60.7 Å²	60.7	11%	0.11	35%	0.347	C	S	.	.	H	α-helix	trans	-67.6	-36.2	177	-77.8	164	0	0	0	112.7	A256 I262 T311 V312 I313 H318 H319	A256-L315 HydrophobicContact CB-CD2 3.79Å; I262-L315 HydrophobicContact CD1-CD1 3.5Å; I262-L315 VanDerWaalsContact CD1-CD1 3.5Å; I262-L315 HydrophobicContact CG1-CD1 3.23Å; T311-L315 WeakPolarHBondContact O-CB 3.44Å; T311-L315 WeakPolarHBondContact O-CG 3.35Å; T311-L315 PolarHBondContact O-N 3.24Å; V312-L315 PolarHBondContact O-N 3.5Å; I313-L315 VanDerWaalsContact C-N 3.27Å; I313-L315 PolarHBondContact O-N 3.23Å; L315-H318 PolarHBondContact O-N 3.2Å; L315-H319 PolarHBondContact O-N 3.24Å; L315-H319 PolarHBondContact O-ND1 3.31Å
316	Q	87.1	Confident	81.5	Confident	138 Å²	138	68.6 Å²	68.6	65%	0.645	37%	0.374	S	S	*	.	H	α-helix	trans	-63.7	-41	172.4	-172.5	-179	5.6	0	0	111.6	V312 I313 H318 H320	V312-Q316 PolarHBondContact O-N 2.84Å; I313-Q316 WeakPolarHBondContact O-CA 3.43Å; I313-Q316 WeakPolarHBondContact O-CB 3.21Å; I313-Q316 PolarHBondContact O-N 3.42Å; I313-Q316 VanDerWaalsContact O-N 3.07Å; Q316-H318 VanDerWaalsContact C-N 3.35Å; Q316-H320 PolarHBondContact O-N 2.81Å
317	Y	84.3	Confident	80.9	Confident	66 Å²	66	64.3 Å²	64.3	26%	0.259	35%	0.352	S	S	.	.	H	α-helix	trans	-67.4	-34.6	173.4	-86.3	-97.6	0	0	0	112.3	I313 V314 T331 W460	I313-Y317 HydrophobicContact CG2-CD2 3.71Å; I313-Y317 HydrophobicContact CG2-CE2 3.65Å; I313-Y317 VanDerWaalsContact O-CD2 3.31Å; I313-Y317 WeakPolarHBondContact O-CD2 3.46Å; I313-Y317 PolarHBondContact O-N 2.87Å; V314-Y317 PolarHBondContact O-N 3.2Å; Y317-T331 HydrophobicContact CE1-CG2 4.43Å; Y317-W460 AromaticContact CD1-CE3 3.57Å; Y317-W460 HydrophobicContact CD1-CE3 3.57Å; Y317-W460 AromaticContact CD1-CZ3 3.4Å; Y317-W460 HydrophobicContact CD1-CZ3 3.4Å; Y317-W460 VanDerWaalsContact CD1-CZ3 3.4Å; Y317-W460 HydrophobicContact CE1-CE3 4.07Å; Y317-W460 HydrophobicContact CE1-CH2 4.47Å; Y317-W460 AromaticContact CE1-CZ3 3.44Å; Y317-W460 HydrophobicContact CE1-CZ3 3.44Å; Y317-W460 VanDerWaalsContact CE1-CZ3 3.44Å; Y317-W460 HydrophobicContact CG-CE3 4.49Å; Y317-W460 HydrophobicContact CG-CZ3 4.42Å
318	H	85.9	Confident	80.5	Confident	20 Å²	20	67.8 Å²	67.8	9%	0.093	37%	0.374	C	S	.	.	H	α-helix	trans	-71	-41.7	-178.9	-174.7	-93.2	0	0	0	113.2	A256 D257 V314 L315 Q316 A464	A256-H318 HydrophobicContact CB-CB 4.16Å; D257-H318 IonicContact OD1-CE1 3.94Å; D257-H318 PolarHBondContact OD1-CE1 2.92Å; D257-H318 IonicContact OD1-NE2 3.99Å; V314-H318 WeakPolarHBondContact O-CB 3.29Å; V314-H318 PolarHBondContact O-N 3.17Å; L315-H318 PolarHBondContact O-N 3.2Å; Q316-H318 VanDerWaalsContact C-N 3.35Å; H318-A464 HydrophobicContact CB-CB 4.02Å
319	H	85.1	Confident	80	Confident	123 Å²	123	74.9 Å²	74.9	57%	0.569	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	27	179.6	-63.6	106.3	0	0	0	112.9	L315 D321	L315-H319 PolarHBondContact O-N 3.24Å; L315-H319 PolarHBondContact O-ND1 3.31Å; H319-D321 PolarHBondContact O-N 3.26Å
320	H	81.6	Confident	79.5	Confident	50 Å²	50	80.4 Å²	80.4	23%	0.231	42%	0.415	C	S	.	.			trans	-63.3	130.2	-179.2	-173.7	-71.3	0	0	0	111.6	Q316 G324 W460	Q316-H320 PolarHBondContact O-N 2.81Å; H320-G324 PolarHBondContact CE1-O 3.07Å; H320-G324 PolarHBondContact NE2-O 3.15Å; H320-W460 HydrophobicContact CB-CB 4.48Å; H320-W460 HydrophobicContact CB-CD2 4.2Å; H320-W460 HydrophobicContact CB-CE3 4.29Å; H320-W460 HydrophobicContact CB-CG 4.28Å; H320-W460 AromaticContact CD2-CE3 3.98Å; H320-W460 AromaticContact CD2-CH2 3.69Å; H320-W460 AromaticContact CD2-CZ2 3.81Å; H320-W460 AromaticContact CD2-CZ3 3.75Å; H320-W460 AromaticContact CE1-CE2 3.89Å; H320-W460 AromaticContact CE1-CZ2 3.73Å; H320-W460 AromaticContact CG-CD2 3.95Å; H320-W460 AromaticContact CG-CE2 3.98Å; H320-W460 AromaticContact ND1-CE2 3.9Å; H320-W460 AromaticContact ND1-NE1 3.9Å; H320-W460 AromaticContact NE2-CE2 3.96Å; H320-W460 AromaticContact NE2-CH2 3.6Å; H320-W460 AromaticContact NE2-CZ2 3.47Å; H320-W460 WeakPolarHBondContact NE2-CZ2 3.45Å
321	D	74.8	Confident	79	Confident	121 Å²	121	80.3 Å²	80.3	65%	0.647	42%	0.415	S	S	*	.			trans	-62.6	132	178.3	-75.2	-50.5	0	0	0	111.5	H319 D323 G324	H319-D321 PolarHBondContact O-N 3.26Å; D321-D323 PolarHBondContact O-N 2.82Å; D321-G324 PolarHBondContact O-N 3.07Å
322	P	64.3	Low	78.6	Confident	73 Å²	73	82.9 Å²	82.9	47%	0.474	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-23	178.9	23.9	-31.5	0	0	0	113.2
323	D	64.3	Low	78	Confident	160 Å²	160	83.6 Å²	83.6	86%	0.856	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-11.9	175.8	-61.4	-39.4	0	0	0	113	D321 G325	D321-D323 PolarHBondContact O-N 2.82Å; D323-G325 PolarHBondContact O-N 3.34Å
324	G	63.9	Low	77.7	Confident	45 Å²	45	82.9 Å²	82.9	46%	0.464	43%	0.425	S	S	.	.	S	Bend	trans	-76.4	41.8	-175.4	0	0	0	0	0	115	H320 D321	H320-G324 PolarHBondContact CE1-O 3.07Å; H320-G324 PolarHBondContact NE2-O 3.15Å; D321-G324 PolarHBondContact O-N 3.07Å
325	G	66.6	Low	77.1	Confident	48 Å²	48	83.6 Å²	83.6	50%	0.495	43%	0.428	S	S	.	.			trans	72.1	154.6	176.3	0	0	0	0	0	115.6	D323	D323-G325 PolarHBondContact O-N 3.34Å
326	K	68.8	Low	76.3	Confident	189 Å²	189	83.1 Å²	83.1	82%	0.822	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-78.9	139.6	-177.5	-66.7	178.1	179.4	175.8	0	110.7
327	M	74.6	Confident	75.6	Confident	9 Å²	9	81.9 Å²	81.9	4%	0.044	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-50.5	128	177.6	-172.5	152.3	62.4	0	0	111.4	K329 T331 R332 L336 W460 A463	M327-K329 PolarHBondContact O-N 3.46Å; M327-T331 HydrophobicContact CG-CG2 4.07Å; M327-T331 HydrophobicContact SD-CG2 3.93Å; M327-R332 HydrophobicContact CE-CB 4.33Å; M327-L336 HydrophobicContact CE-CD1 3.49Å; M327-L336 VanDerWaalsContact CE-CD1 3.49Å; M327-L336 HydrophobicContact CE-CG 4.21Å; M327-W460 VanDerWaalsContact CA-CZ2 3.44Å; M327-W460 HydrophobicContact CB-CH2 3.94Å; M327-W460 HydrophobicContact CB-CZ2 3.48Å; M327-W460 VanDerWaalsContact CB-CZ2 3.48Å; M327-W460 HydrophobicContact CG-CH2 3.92Å; M327-W460 HydrophobicContact CG-CZ2 4Å; M327-W460 HydrophobicContact CG-CZ3 4.32Å; M327-W460 HydrophobicContact SD-CD2 4.26Å; M327-W460 HydrophobicContact SD-CE3 4.02Å; M327-W460 HydrophobicContact SD-CH2 4.19Å; M327-W460 HydrophobicContact SD-CZ2 4.44Å; M327-W460 HydrophobicContact SD-CZ3 3.99Å; M327-A463 HydrophobicContact CE-CB 4.23Å; M327-A463 HydrophobicContact SD-CB 4.23Å
328	P	80.6	Confident	75.3	Confident	76 Å²	76	86.6 Å²	86.6	49%	0.494	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-53.3	141.1	-179.4	-25.5	32.3	0	0	0	111.6	W330 T331 R332	P328-W330 PolarHBondContact O-N 3Å; P328-W330 VanDerWaalsContact O-N 3.15Å; P328-T331 PolarHBondContact O-N 3.47Å; P328-T331 VanDerWaalsContact O-N 3.13Å; P328-R332 PolarHBondContact O-N 3.45Å
329	K	77.6	Confident	74.8	Confident	170 Å²	170	85.7 Å²	85.7	74%	0.739	44%	0.437	S	S	*	.	H	α-helix	trans	-57.1	-34.8	-176.3	-67.1	-179.3	-177.3	173.4	0	112	M327 V333	M327-K329 PolarHBondContact O-N 3.46Å; K329-V333 WeakPolarHBondContact O-CG2 3.49Å; K329-V333 PolarHBondContact O-N 3.48Å
330	W	80.8	Confident	74.2	Confident	203 Å²	203	80.2 Å²	80.2	77%	0.769	41%	0.413	S	S	*	.	H	α-helix	trans	-69.7	-46.2	178.1	-167.1	36.9	0	0	0	112.3	P328 R332 V333 I334	P328-W330 PolarHBondContact O-N 3Å; P328-W330 VanDerWaalsContact O-N 3.15Å; W330-R332 VanDerWaalsContact C-N 3.29Å; W330-R332 PolarHBondContact O-N 3.01Å; W330-V333 PolarHBondContact O-N 2.94Å; W330-V333 VanDerWaalsContact O-N 3.11Å; W330-I334 HydrophobicContact CD2-CD1 3.8Å; W330-I334 VanDerWaalsContact CE2-CD1 3.41Å; W330-I334 HydrophobicContact CG-CD1 3.99Å; W330-I334 HydrophobicContact CZ2-CD1 3.87Å; W330-I334 WeakPolarHBondContact O-CG1 3.46Å; W330-I334 PolarHBondContact O-N 3.42Å
331	T	78.4	Confident	74	Confident	30 Å²	30	87.3 Å²	87.3	18%	0.184	44%	0.438	C	S	.	.	H	α-helix	trans	-58.8	-40.6	175.2	-47.5	0	0	0	0	111.9	Y317 M327 P328 V333 I334 L335	Y317-T331 HydrophobicContact CE1-CG2 4.43Å; M327-T331 HydrophobicContact CG-CG2 4.07Å; M327-T331 HydrophobicContact SD-CG2 3.93Å; P328-T331 PolarHBondContact O-N 3.47Å; P328-T331 VanDerWaalsContact O-N 3.13Å; T331-V333 PolarHBondContact O-N 3.43Å; T331-I334 PolarHBondContact O-N 2.92Å; T331-L335 HydrophobicContact CG2-CD1 3.64Å; T331-L335 HydrophobicContact CG2-CG 4.2Å; T331-L335 WeakPolarHBondContact O-CB 3.36Å; T331-L335 PolarHBondContact O-N 3.43Å
332	R	78.9	Confident	74.2	Confident	54 Å²	54	87.5 Å²	87.5	20%	0.204	43%	0.433	C	S	.	.	H	α-helix	trans	-60.1	-43.7	174.7	176.8	-178.6	-69.5	-109.9	-2.1	111.8	M327 P328 W330 L336 E459	M327-R332 HydrophobicContact CE-CB 4.33Å; P328-R332 PolarHBondContact O-N 3.45Å; W330-R332 VanDerWaalsContact C-N 3.29Å; W330-R332 PolarHBondContact O-N 3.01Å; R332-L336 HydrophobicContact CB-CD1 4.32Å; R332-L336 HydrophobicContact CG-CD1 3.73Å; R332-L336 WeakPolarHBondContact O-CB 3.49Å; R332-L336 PolarHBondContact O-N 3.22Å; R332-L336 VanDerWaalsContact O-N 3.07Å; R332-E459 IonicContact CZ-OE1 3.69Å; R332-E459 IonicContact CZ-OE2 3.13Å; R332-E459 VanDerWaalsContact CZ-OE2 3.24Å; R332-E459 IonicContact NH1-OE1 2.73Å; R332-E459 PolarHBondContact NH1-OE1 3.03Å; R332-E459 IonicContact NH1-OE2 3.46Å; R332-E459 PolarHBondContact NH1-OE2 3.16Å; R332-E459 IonicContact NH2-OE1 3.78Å; R332-E459 IonicContact NH2-OE2 2.72Å; R332-E459 PolarHBondContact NH2-OE2 3.14Å
333	V	77.1	Confident	74.7	Confident	86 Å²	86	85.5 Å²	85.5	52%	0.521	42%	0.419	S	S	.	.	H	α-helix	trans	-71.6	-42.8	179.9	174.4	0	0	0	0	111.5	K329 W330 T331 N337 W338	K329-V333 WeakPolarHBondContact O-CG2 3.49Å; K329-V333 PolarHBondContact O-N 3.48Å; W330-V333 PolarHBondContact O-N 2.94Å; W330-V333 VanDerWaalsContact O-N 3.11Å; T331-V333 PolarHBondContact O-N 3.43Å; V333-N337 WeakPolarHBondContact O-CB 3.39Å; V333-N337 PolarHBondContact O-N 3.08Å; V333-W338 PolarHBondContact O-N 3.17Å; V333-W338 VanDerWaalsContact O-N 3.17Å
334	I	81.1	Confident	75.2	Confident	56 Å²	56	89 Å²	89	29%	0.287	42%	0.42	S	S	.	.	I	π-helix	trans	-65.7	-55.5	-179.7	-67.8	167.1	0	0	0	110.6	W330 T331 W338 C339	W330-I334 HydrophobicContact CD2-CD1 3.8Å; W330-I334 VanDerWaalsContact CE2-CD1 3.41Å; W330-I334 HydrophobicContact CG-CD1 3.99Å; W330-I334 HydrophobicContact CZ2-CD1 3.87Å; W330-I334 WeakPolarHBondContact O-CG1 3.46Å; W330-I334 PolarHBondContact O-N 3.42Å; T331-I334 PolarHBondContact O-N 2.92Å; I334-W338 WeakPolarHBondContact O-CB 3.5Å; I334-W338 PolarHBondContact O-N 3.48Å; I334-C339 PolarHBondContact O-N 3.42Å; I334-C339 PolarHBondContact O-SG 3.22Å
335	L	76.4	Confident	75.7	Confident	17 Å²	17	89.5 Å²	89.5	9%	0.089	41%	0.41	C	S	.	.	I	π-helix	trans	-74.9	-47.2	-173	-63.7	-179	0	0	0	112.2	T331 A340 A463 V467	T331-L335 HydrophobicContact CG2-CD1 3.64Å; T331-L335 HydrophobicContact CG2-CG 4.2Å; T331-L335 WeakPolarHBondContact O-CB 3.36Å; T331-L335 PolarHBondContact O-N 3.43Å; L335-A340 PolarHBondContact O-N 3.47Å; L335-A463 HydrophobicContact CD1-CB 4.06Å; L335-V467 HydrophobicContact CD1-CG2 3.87Å; L335-V467 HydrophobicContact CD2-CG2 3.6Å; L335-V467 HydrophobicContact CG-CG2 4.4Å
336	L	70.4	Confident	75.6	Confident	11 Å²	11	93.3 Å²	93.3	6%	0.058	41%	0.414	C	S	.	.	I	π-helix	trans	-86	-17.7	-170.5	-58.9	165.4	0	0	0	114	M327 R332 A340 F462	M327-L336 HydrophobicContact CE-CD1 3.49Å; M327-L336 VanDerWaalsContact CE-CD1 3.49Å; M327-L336 HydrophobicContact CE-CG 4.21Å; R332-L336 HydrophobicContact CB-CD1 4.32Å; R332-L336 HydrophobicContact CG-CD1 3.73Å; R332-L336 WeakPolarHBondContact O-CB 3.49Å; R332-L336 PolarHBondContact O-N 3.22Å; R332-L336 VanDerWaalsContact O-N 3.07Å; L336-A340 WeakPolarHBondContact O-CB 3.43Å; L336-F462 HydrophobicContact CD2-CD1 3.31Å; L336-F462 HydrophobicContact CD2-CE1 3.7Å
337	N	72.3	Confident	75.2	Confident	113 Å²	113	90 Å²	90	60%	0.604	40%	0.396	S	S	*	.	I	π-helix	trans	-112.5	-56.9	180	-156.3	25.7	0	0	0	111.1	V333 W341	V333-N337 WeakPolarHBondContact O-CB 3.39Å; V333-N337 PolarHBondContact O-N 3.08Å; N337-W341 WeakPolarHBondContact O-CB 3.47Å; N337-W341 PolarHBondContact O-N 3.42Å; N337-W341 VanDerWaalsContact O-N 3.16Å
338	W	77.2	Confident	74.2	Confident	164 Å²	164	93.4 Å²	93.4	62%	0.621	42%	0.418	S	S	*	.	I	π-helix	trans	-75.3	-52.7	-174.5	-169.7	81.2	0	0	0	112.8	V333 I334 W341 F342	V333-W338 PolarHBondContact O-N 3.17Å; V333-W338 VanDerWaalsContact O-N 3.17Å; I334-W338 WeakPolarHBondContact O-CB 3.5Å; I334-W338 PolarHBondContact O-N 3.48Å; W338-W341 PolarHBondContact O-N 2.96Å; W338-F342 WeakPolarHBondContact O-CB 3.46Å; W338-F342 PolarHBondContact O-N 3.42Å
339	C	75.9	Confident	72.9	Confident	2 Å²	2	92.1 Å²	92.1	1%	0.014	42%	0.419	C	S	.	.	I	π-helix	trans	-68.4	-41.2	179.4	-63.2	0	0	0	0	112.4	I334 W341 F342 L343 V466	I334-C339 PolarHBondContact O-N 3.42Å; I334-C339 PolarHBondContact O-SG 3.22Å; C339-W341 VanDerWaalsContact C-N 3.34Å; C339-W341 PolarHBondContact O-N 3.45Å; C339-F342 PolarHBondContact O-N 3.05Å; C339-L343 WeakPolarHBondContact O-CB 3.33Å; C339-L343 WeakPolarHBondContact O-CG 3.34Å; C339-L343 PolarHBondContact O-N 3.17Å; C339-V466 HydrophobicContact CB-CG1 3.53Å
340	A	73.6	Confident	71.6	Confident	7 Å²	7	90.9 Å²	90.9	6%	0.058	42%	0.416	C	S	.	.	H	α-helix	trans	-64.6	-36.9	177.8	0	0	0	0	0	112.6	L335 L336 R344 M345 F462 V466	L335-A340 PolarHBondContact O-N 3.47Å; L336-A340 WeakPolarHBondContact O-CB 3.43Å; A340-R344 PolarHBondContact O-N 3.35Å; A340-R344 VanDerWaalsContact O-N 3.11Å; A340-M345 PolarHBondContact O-N 3.2Å; A340-F462 HydrophobicContact CB-CE1 4.37Å; A340-F462 HydrophobicContact CB-CZ 4.42Å; A340-V466 HydrophobicContact CB-CG2 4.48Å
341	W	76.9	Confident	69.7	Low	200 Å²	200	87.3 Å²	87.3	76%	0.758	41%	0.412	S	S	*	.	H	α-helix	trans	-65.5	-46.9	171.9	178.9	84.2	0	0	0	111.5	N337 W338 C339 L343 R344	N337-W341 WeakPolarHBondContact O-CB 3.47Å; N337-W341 PolarHBondContact O-N 3.42Å; N337-W341 VanDerWaalsContact O-N 3.16Å; W338-W341 PolarHBondContact O-N 2.96Å; C339-W341 VanDerWaalsContact C-N 3.34Å; C339-W341 PolarHBondContact O-N 3.45Å; W341-L343 VanDerWaalsContact C-N 3.32Å; W341-L343 PolarHBondContact O-N 3.11Å; W341-R344 PolarHBondContact O-N 2.93Å; W341-R344 VanDerWaalsContact O-N 3.14Å
342	F	78.4	Confident	68.2	Low	124 Å²	124	95.1 Å²	95.1	54%	0.544	44%	0.443	S	S	.	.	H	α-helix	trans	-59.7	-40.6	177.7	-179	-102.1	0	0	0	112.6	W338 C339 R344 L470	W338-F342 WeakPolarHBondContact O-CB 3.46Å; W338-F342 PolarHBondContact O-N 3.42Å; C339-F342 PolarHBondContact O-N 3.05Å; F342-R344 VanDerWaalsContact C-N 3.32Å; F342-R344 PolarHBondContact O-N 3.11Å; F342-L470 HydrophobicContact CD1-CD1 4.25Å; F342-L470 HydrophobicContact CE1-CD1 4.44Å
343	L	74.6	Confident	66.5	Low	32 Å²	32	98.6 Å²	98.6	17%	0.168	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	0.3	179.2	-67.7	165.1	0	0	0	113.9	C339 W341 M345 V466 R469 L470 M473	C339-L343 WeakPolarHBondContact O-CB 3.33Å; C339-L343 WeakPolarHBondContact O-CG 3.34Å; C339-L343 PolarHBondContact O-N 3.17Å; W341-L343 VanDerWaalsContact C-N 3.32Å; W341-L343 PolarHBondContact O-N 3.11Å; L343-M345 HydrophobicContact CB-CG 3.95Å; L343-M345 HydrophobicContact CB-SD 4.49Å; L343-M345 PolarHBondContact O-N 3.28Å; L343-M345 VanDerWaalsContact O-N 3.16Å; L343-V466 HydrophobicContact CD1-CG1 4.06Å; L343-V466 WeakPolarHBondContact CD1-O 3.38Å; L343-R469 HydrophobicContact CD1-CB 4.08Å; L343-R469 HydrophobicContact CD2-CB 4.49Å; L343-L470 HydrophobicContact CD1-CB 4.07Å; L343-M473 HydrophobicContact CD2-CG 3.94Å
344	R	75.2	Confident	64.2	Low	234 Å²	234	105.3 Å²	105.3	88%	0.883	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.6	37.3	-173.8	-62.9	177.3	88.4	169.5	6.5	113.4	A340 W341 F342	A340-R344 PolarHBondContact O-N 3.35Å; A340-R344 VanDerWaalsContact O-N 3.11Å; W341-R344 PolarHBondContact O-N 2.93Å; W341-R344 VanDerWaalsContact O-N 3.14Å; F342-R344 VanDerWaalsContact C-N 3.32Å; F342-R344 PolarHBondContact O-N 3.11Å
345	M	73.6	Confident	62.1	Low	54 Å²	54	107.7 Å²	107.7	27%	0.266	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-83.6	126.4	176.3	-66.8	-167.7	126.8	0	0	110	A340 L343 R347 F462 V466 R469	A340-M345 PolarHBondContact O-N 3.2Å; L343-M345 HydrophobicContact CB-CG 3.95Å; L343-M345 HydrophobicContact CB-SD 4.49Å; L343-M345 PolarHBondContact O-N 3.28Å; L343-M345 VanDerWaalsContact O-N 3.16Å; M345-R347 PolarHBondContact O-N 3.49Å; M345-F462 HydrophobicContact CB-CE2 4.45Å; M345-F462 HydrophobicContact CB-CZ 4.26Å; M345-V466 HydrophobicContact SD-CG2 4.1Å; M345-R469 HydrophobicContact CE-CB 4.16Å; M345-R469 HydrophobicContact CE-CG 3.53Å; M345-R469 HydrophobicContact SD-CB 4.39Å; M345-R469 HydrophobicContact SD-CG 4.3Å
346	K	64.3	Low	60.3	Low	129 Å²	129	111.9 Å²	111.9	56%	0.561	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-69.2	127.2	175.5	-159.3	-176.7	-177.7	-161	0	108.8	D351	K346-D351 IonicContact NZ-OD1 3.83Å; K346-D351 PolarHBondContact NZ-OD1 3.15Å; K346-D351 VanDerWaalsContact NZ-OD1 3.14Å; K346-D351 IonicContact NZ-OD2 3.51Å; K346-D351 PolarHBondContact NZ-OD2 3.13Å
347	R	60.5	Low	58.9	Low	120 Å²	120	116.9 Å²	116.9	45%	0.453	58%	0.577	S	S	.	*	P	Polyproline II helix	trans	-68.1	130	-178.9	-168.7	173.6	-178.1	-175	-2	109.7	M345 G349 E459	M345-R347 PolarHBondContact O-N 3.49Å; R347-G349 PolarHBondContact O-N 3.36Å; R347-G349 VanDerWaalsContact O-N 3.08Å; R347-E459 IonicContact NH2-OE1 3.74Å
348	P	53.7	Low	56.9	Low	79 Å²	79	119.9 Å²	119.9	51%	0.513	59%	0.588	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.8	113.8	172.2	23.3	-29.3	0	0	0	108.4	F462	P348-F462 HydrophobicContact CG-CB 4.02Å; P348-F462 HydrophobicContact CG-CD1 4.41Å; P348-F462 HydrophobicContact CG-CD2 3.61Å; P348-F462 HydrophobicContact CG-CE2 4.17Å; P348-F462 HydrophobicContact CG-CG 3.75Å
349	G	54.4	Low	54.8	Low	50 Å²	50	120.7 Å²	120.7	52%	0.515	60%	0.598	S	S	.	*	T	Hydrogen-bonded Turn	trans	132.4	-12.5	176.7	0	0	0	0	0	116.7	R347 D351 K352	R347-G349 PolarHBondContact O-N 3.36Å; R347-G349 VanDerWaalsContact O-N 3.08Å; G349-D351 PolarHBondContact O-N 2.99Å; G349-K352 PolarHBondContact O-N 2.92Å
350	E	49.1	Very low	52.6	Low	143 Å²	143	129.4 Å²	129.4	67%	0.668	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-21.4	178.1	-98	-176.5	146.8	0	0	113.9
351	D	42.5	Very low	50.5	Low	128 Å²	128	137.3 Å²	137.3	68%	0.684	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-0.6	-179.6	-61.4	-44.7	0	0	0	113.6	K346 G349	K346-D351 IonicContact NZ-OD1 3.83Å; K346-D351 PolarHBondContact NZ-OD1 3.15Å; K346-D351 VanDerWaalsContact NZ-OD1 3.14Å; K346-D351 IonicContact NZ-OD2 3.51Å; K346-D351 PolarHBondContact NZ-OD2 3.13Å; G349-D351 PolarHBondContact O-N 2.99Å
352	K	45.1	Very low	48.1	Very low	194 Å²	194	138.9 Å²	138.9	84%	0.843	68%	0.677	S	S	*	*	S	Bend	trans	-96.2	7.3	-176.8	-93.4	-172	179.1	-176.9	0	115.7	G349	G349-K352 PolarHBondContact O-N 2.92Å
353	V	43.7	Very low	45.6	Very low	127 Å²	127	144.6 Å²	144.6	77%	0.77	70%	0.695	S	S	*	*			trans	-110.8	68.5	166.5	-167.5	0	0	0	0	109.9
354	R	30.1	Very low	43.3	Very low	227 Å²	227	148.3 Å²	148.3	86%	0.857	72%	0.723	S	S	*	*			trans	-77.3	118.4	144.7	-80.8	-175.3	171.4	176.6	-1.3	105.8	A356	R354-A356 PolarHBondContact O-N 3.28Å
355	P	35.9	Very low	41	Very low	106 Å²	106	143.1 Å²	143.1	69%	0.688	72%	0.722	S	S	*	*			trans	-57.3	116.9	169.9	22.1	-29.5	0	0	0	107.4	C357	P355-C357 PolarHBondContact O-N 3.46Å
356	A	38.4	Very low	38.9	Very low	105 Å²	105	148.6 Å²	148.6	87%	0.868	75%	0.751	S	S	*	*	S	Bend	trans	-71.2	60.2	172.5	0	0	0	0	0	109.5	R354	R354-A356 PolarHBondContact O-N 3.28Å
357	C	42	Very low	37.2	Very low	116 Å²	116	146.3 Å²	146.3	78%	0.784	76%	0.757	S	S	*	*			trans	-151.3	59.9	170.8	-90	0	0	0	0	109.3	P355	P355-C357 PolarHBondContact O-N 3.46Å
358	Q	30.6	Very low	35.5	Very low	177 Å²	177	146.3 Å²	146.3	83%	0.827	78%	0.775	S	S	*	*			trans	-132.5	76.1	148.6	-74.8	-165.3	-0.8	0	0	108	K360	Q358-K360 PolarHBondContact O-N 3.37Å
359	H	31.7	Very low	34.3	Very low	180 Å²	180	149 Å²	149	83%	0.833	79%	0.79	S	S	*	*			trans	-71.8	68.8	160.5	-163.3	-67.4	0	0	0	108.2	Q361	H359-Q361 PolarHBondContact O-N 3.19Å; H359-Q361 VanDerWaalsContact O-N 3.13Å
360	K	31	Very low	33	Very low	186 Å²	186	155.4 Å²	155.4	81%	0.809	81%	0.806	S	S	*	*			trans	-75.4	102.1	169	-156.7	175.7	-171.4	179.7	0	106.5	Q358 R362	Q358-K360 PolarHBondContact O-N 3.37Å; K360-R362 PolarHBondContact O-N 3.25Å
361	Q	28.7	Very low	31.8	Very low	173 Å²	173	157.2 Å²	157.2	81%	0.808	82%	0.817	S	S	*	*			trans	4.5	106.7	161	-119.9	157.7	-21.1	0	0	115	H359 R363	H359-Q361 PolarHBondContact O-N 3.19Å; H359-Q361 VanDerWaalsContact O-N 3.13Å; Q361-R363 PolarHBondContact O-N 2.85Å
362	R	26.2	Very low	31	Very low	232 Å²	232	155.5 Å²	155.5	88%	0.875	82%	0.815	S	S	*	*			trans	-47.8	100.3	165.4	-147.1	176.6	-171.4	-176.8	1.5	108.9	K360 C364	K360-R362 PolarHBondContact O-N 3.25Å; R362-C364 PolarHBondContact O-N 3.17Å
363	R	25.6	Very low	30.1	Very low	245 Å²	245	152.3 Å²	152.3	93%	0.925	81%	0.812	S	S	*	*			trans	-81	107.2	162.3	-102.1	-177.2	-178.9	174	0.1	106.7	Q361 S365	Q361-R363 PolarHBondContact O-N 2.85Å; R363-S365 PolarHBondContact O-N 3.34Å
364	C	27.4	Very low	29.4	Very low	110 Å²	110	153.1 Å²	153.1	74%	0.743	82%	0.817	S	S	*	*			trans	-57.4	131	167.2	-67.8	0	0	0	0	109.7	R362	R362-C364 PolarHBondContact O-N 3.17Å
365	S	25.7	Very low	29.1	Very low	124 Å²	124	146.2 Å²	146.2	87%	0.867	81%	0.808	S	S	*	*			trans	-62.3	128.1	159.1	-55.3	0	0	0	0	108.6	R363	R363-S365 PolarHBondContact O-N 3.34Å
366	L	30.6	Very low	29.1	Very low	169 Å²	169	146.9 Å²	146.9	89%	0.885	81%	0.813	S	S	*	*			trans	-134.8	126.9	157.8	-138.7	130.2	0	0	0	108
367	A	27.3	Very low	29.2	Very low	82 Å²	82	147.3 Å²	147.3	68%	0.678	81%	0.807	S	S	*	*			trans	-56.4	146	179.6	0	0	0	0	0	111.2	V369	A367-V369 PolarHBondContact O-N 3.39Å
368	S	26	Very low	29.3	Very low	119 Å²	119	147.5 Å²	147.5	83%	0.832	81%	0.806	S	S	*	*			trans	-52.2	115.7	165.8	49.5	0	0	0	0	111.6
369	V	28.4	Very low	29	Very low	136 Å²	136	143.9 Å²	143.9	82%	0.824	81%	0.806	S	S	*	*			trans	-144.7	133.2	149.5	-177.7	0	0	0	0	107.2	A367	A367-V369 PolarHBondContact O-N 3.39Å
370	E	26.9	Very low	28.9	Very low	184 Å²	184	140.2 Å²	140.2	86%	0.86	80%	0.801	S	S	*	*			trans	-52.1	150.2	-179.5	-65.6	163	127.5	0	0	114
371	M	24.7	Very low	28.8	Very low	182 Å²	182	139.3 Å²	139.3	90%	0.897	81%	0.805	S	S	*	*				178.1	144	122.6	-168.5	58.2	165.1	0	0	111.6
372	S	25.7	Very low	29	Very low	91 Å²	91	134.7 Å²	134.7	64%	0.636	80%	0.804	S	S	*	*			trans	-67.7	144.7	-173.2	-51.3	0	0	0	0	116.6
373	T	24.9	Very low	29.2	Very low	127 Å²	127	132 Å²	132	78%	0.779	81%	0.807	S	S	*	*			trans	43.1	136.7	139.6	61.1	0	0	0	0	123.5
374	V	28.8	Very low	29.4	Very low	144 Å²	144	128.4 Å²	128.4	87%	0.873	81%	0.805	S	S	*	*			trans	106	130.4	149.6	-167.3	0	0	0	0	117.4
375	A	24.1	Very low	29.5	Very low	83 Å²	83	131.2 Å²	131.2	69%	0.686	81%	0.812	S	S	*	*			trans	-106.2	-171.1	177.1	0	0	0	0	0	111.6
376	P	37.3	Very low	29.6	Very low	120 Å²	120	135.3 Å²	135.3	78%	0.779	81%	0.81	S	S	*	*				-111.1	-152.3	-77.1	41.4	-25.7	0	0	0	110.4
377	P	40.7	Very low	29.7	Very low	114 Å²	114	134.6 Å²	134.6	74%	0.74	81%	0.806	S	S	*	*			cis	-132.2	-142.7	-14.3	35.6	-10.4	0	0	0	112.3
378	P	42.1	Very low	29.7	Very low	120 Å²	120	133.4 Å²	133.4	78%	0.779	80%	0.801	S	S	*	*				-122.4	177.4	-69.5	32.2	-12.7	0	0	0	115.3
379	A	26	Very low	29.8	Very low	100 Å²	100	137.5 Å²	137.5	83%	0.826	80%	0.804	S	S	*	*			trans	125.7	144.1	137.5	0	0	0	0	0	119.1
380	S	28.9	Very low	29.8	Very low	104 Å²	104	142.1 Å²	142.1	73%	0.727	81%	0.807	S	S	*	*			trans	104.6	91	154.3	-175.3	0	0	0	0	120.1
381	N	29.4	Very low	29.8	Very low	167 Å²	167	137 Å²	137	89%	0.893	80%	0.804	S	S	*	*				55.1	114.7	128	-62.8	-9.3	0	0	0	122
382	G	31.7	Very low	30.1	Very low	76 Å²	76	136.9 Å²	136.9	78%	0.784	81%	0.806	S	S	*	*			trans	-173.1	111.4	155.7	0	0	0	0	0	111.9
383	N	31.6	Very low	30.2	Very low	176 Å²	176	140.7 Å²	140.7	94%	0.941	82%	0.819	S	S	*	*			trans	-65.3	127.5	-178.3	-77.8	-18.8	0	0	0	112.8
384	L	30	Very low	30.2	Very low	169 Å²	169	138.2 Å²	138.2	89%	0.885	82%	0.819	S	S	*	*			trans	-137.1	116.1	161.1	-168.9	75.4	0	0	0	109.3	Y386	L384-Y386 PolarHBondContact O-N 3.42Å
385	L	28.6	Very low	30	Very low	168 Å²	168	140 Å²	140	88%	0.88	82%	0.82	S	S	*	*			trans	-72.7	114.2	179.8	-108.8	144.2	0	0	0	110.2
386	Y	27.7	Very low	30	Very low	210 Å²	210	144.6 Å²	144.6	82%	0.824	83%	0.827	S	S	*	*			trans	-108.1	115.3	168.9	-173.1	-95.1	0	0	0	109.1	L384 G388	L384-Y386 PolarHBondContact O-N 3.42Å; Y386-G388 PolarHBondContact O-N 3.13Å
387	I	32.3	Very low	29.3	Very low	155 Å²	155	145.3 Å²	145.3	80%	0.795	83%	0.833	S	S	*	*			trans	-79	103	171.7	-69.3	168.3	0	0	0	107.4
388	G	28.1	Very low	28.4	Very low	56 Å²	56	146.2 Å²	146.2	58%	0.577	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-101.6	118	170.5	0	0	0	0	0	110.6	Y386	Y386-G388 PolarHBondContact O-N 3.13Å
389	F	28.7	Very low	28.2	Very low	205 Å²	205	146.2 Å²	146.2	90%	0.899	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-86.2	122	173.2	-153	-96.4	0	0	0	109.5
390	R	28.4	Very low	28.1	Very low	233 Å²	233	148.3 Å²	148.3	88%	0.879	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-68	147	178.8	-92.2	-179.8	167.4	174.8	-3.9	111.7
391	G	25.5	Very low	28.6	Very low	78 Å²	78	148.6 Å²	148.6	80%	0.804	84%	0.839	S	S	*	*	P	Polyproline II helix	trans	-69.8	167	178.7	0	0	0	0	0	115.5
392	L	31	Very low	28.3	Very low	179 Å²	179	147.7 Å²	147.7	94%	0.937	83%	0.834	S	S	*	*			trans	-124.3	132.5	159.1	-147.2	85.4	0	0	0	107.6
393	D	28.2	Very low	28.1	Very low	170 Å²	170	150 Å²	150	91%	0.909	84%	0.838	S	S	*	*			trans	-68.2	164.6	-170.2	-85.4	-50	0	0	0	115
394	G	25.7	Very low	27.9	Very low	75 Å²	75	145.1 Å²	145.1	77%	0.773	83%	0.829	S	S	*	*			trans	-70.9	166.7	-169.6	0	0	0	0	0	117.3
395	M	23.9	Very low	28.4	Very low	182 Å²	182	144.1 Å²	144.1	90%	0.897	83%	0.83	S	S	*	*			trans	-132.2	124.2	156.2	-160.7	80.6	79.3	0	0	108.3
396	H	23.4	Very low	28.3	Very low	180 Å²	180	142.4 Å²	142.4	83%	0.833	83%	0.826	S	S	*	*			trans	-68.7	148.8	178.9	-85.4	-10.5	0	0	0	113.1
397	C	23.2	Very low	28.4	Very low	135 Å²	135	138.5 Å²	138.5	91%	0.912	83%	0.828	S	S	*	*			trans	-121.8	117.9	158.3	-71.7	0	0	0	0	109.7
398	T	22.6	Very low	28.1	Very low	133 Å²	133	134.2 Å²	134.2	82%	0.816	82%	0.822	S	S	*	*			trans	-83.2	153.7	167.5	46.1	0	0	0	0	111.1
399	P	37.3	Very low	28.2	Very low	120 Å²	120	140.3 Å²	140.3	78%	0.779	83%	0.828	S	S	*	*			trans	-98.2	145.7	-172.6	36.7	-30	0	0	0	112.9
400	T	23.3	Very low	28	Very low	143 Å²	143	139.4 Å²	139.4	88%	0.877	83%	0.829	S	S	*	*			trans	-155.6	156.2	155	37.4	0	0	0	0	111.3
401	P	39.7	Very low	27.9	Very low	110 Å²	110	132.4 Å²	132.4	71%	0.714	82%	0.82	S	S	*	*			trans	-103.1	175	-145.8	39.5	-33.4	0	0	0	114.9
402	D	23.4	Very low	28	Very low	149 Å²	149	134.4 Å²	134.4	80%	0.797	82%	0.821	S	S	*	*			trans	96.7	125.7	160.4	-68.5	-17.2	0	0	0	120.3
403	S	28	Very low	27.8	Very low	124 Å²	124	130.3 Å²	130.3	87%	0.867	81%	0.807	S	S	*	*			trans	79.9	117.1	152	-60	0	0	0	0	119.3
404	G	26.7	Very low	28.2	Very low	74 Å²	74	128.3 Å²	128.3	76%	0.763	80%	0.803	S	S	*	*			trans	111.4	99.2	137.5	0	0	0	0	0	115.6	V406	G404-V406 PolarHBondContact O-N 3.27Å; G404-V406 VanDerWaalsContact O-N 3.16Å
405	V	40	Very low	28.7	Very low	148 Å²	148	130.3 Å²	130.3	90%	0.897	80%	0.801	S	S	*	*			trans	-35.7	111.1	157.9	176.8	0	0	0	0	112.5
406	V	27.7	Very low	29.1	Very low	132 Å²	132	130.3 Å²	130.3	80%	0.8	80%	0.798	S	S	*	*			trans	-148.1	97.6	148.9	-177.6	0	0	0	0	108.5	G404 G408	G404-V406 PolarHBondContact O-N 3.27Å; G404-V406 VanDerWaalsContact O-N 3.16Å; V406-G408 PolarHBondContact O-N 3.07Å
407	C	30.1	Very low	29.4	Very low	127 Å²	127	129.9 Å²	129.9	86%	0.858	80%	0.802	S	S	*	*			trans	-79.1	101.7	164.1	-169.6	0	0	0	0	107.4	R409	C407-R409 PolarHBondContact O-N 2.98Å; C407-R409 VanDerWaalsContact O-N 3.13Å
408	G	26	Very low	30	Very low	66 Å²	66	132.4 Å²	132.4	68%	0.68	80%	0.801	S	S	*	*			trans	-65.1	106.8	177.5	0	0	0	0	0	111.1	V406 M410	V406-G408 PolarHBondContact O-N 3.07Å; G408-M410 PolarHBondContact O-N 3.27Å
409	R	28.4	Very low	30.5	Very low	184 Å²	184	134.6 Å²	134.6	69%	0.694	80%	0.801	S	S	*	*			trans	-65	111.3	157.9	-84.3	174.7	162.8	173.1	-7.6	108.2	C407 A411	C407-R409 PolarHBondContact O-N 2.98Å; C407-R409 VanDerWaalsContact O-N 3.13Å; R409-A411 PolarHBondContact O-N 3.49Å; R409-A411 VanDerWaalsContact O-N 3.14Å
410	M	25.8	Very low	30.4	Very low	186 Å²	186	137 Å²	137	92%	0.916	81%	0.806	S	S	*	*			trans	-70.2	101.9	154.9	-90.4	178.9	172.7	0	0	107.4	G408	G408-M410 PolarHBondContact O-N 3.27Å
411	A	27	Very low	31	Very low	85 Å²	85	138.6 Å²	138.6	70%	0.702	81%	0.809	S	S	*	*			trans	-87.3	104.9	162.8	0	0	0	0	0	107.1	R409 S413	R409-A411 PolarHBondContact O-N 3.49Å; R409-A411 VanDerWaalsContact O-N 3.14Å; A411-S413 PolarHBondContact O-N 2.91Å
412	C	27	Very low	30.9	Very low	120 Å²	120	143.4 Å²	143.4	81%	0.811	82%	0.821	S	S	*	*			trans	-85.7	103.7	163	-68.6	0	0	0	0	107.7
413	S	26	Very low	31.6	Very low	94 Å²	94	140.2 Å²	140.2	66%	0.657	82%	0.824	S	S	*	*			trans	-75.1	139.2	162.7	-62	0	0	0	0	108.6	A411 T415	A411-S413 PolarHBondContact O-N 2.91Å; S413-T415 VanDerWaalsContact C-N 3.28Å; S413-T415 PolarHBondContact O-N 3.44Å; S413-T415 VanDerWaalsContact O-N 3.07Å
414	P	37.6	Very low	31.8	Very low	127 Å²	127	137.8 Å²	137.8	83%	0.825	82%	0.818	S	S	*	*	S	Bend	trans	-88.5	62	-178	36.9	-33.1	0	0	0	110.2
415	T	36.5	Very low	32.2	Very low	118 Å²	118	143.3 Å²	143.3	72%	0.724	82%	0.824	S	S	*	*	S	Bend	trans	-169.4	75.9	171	39.1	0	0	0	0	110	S413	S413-T415 VanDerWaalsContact C-N 3.28Å; S413-T415 PolarHBondContact O-N 3.44Å; S413-T415 VanDerWaalsContact O-N 3.07Å
416	H	31.7	Very low	32.2	Very low	182 Å²	182	141.7 Å²	141.7	84%	0.843	82%	0.816	S	S	*	*	S	Bend	trans	156.2	77.4	153.9	-97.9	-79.1	0	0	0	108.6
417	D	29.6	Very low	33	Very low	170 Å²	170	141 Å²	141	91%	0.909	82%	0.815	S	S	*	*			trans	-154.1	51.1	159.5	-93.7	-34.7	0	0	0	108.5
418	E	35.5	Very low	34	Very low	189 Å²	189	145 Å²	145	88%	0.883	82%	0.821	S	S	*	*	S	Bend	trans	-114.3	16.1	173.9	-135.3	-170.3	136.5	0	0	113
419	H	32.6	Very low	35.3	Very low	179 Å²	179	144.3 Å²	144.3	83%	0.829	81%	0.813	S	S	*	*	S	Bend	trans	-144.3	93.2	171.2	-97	-86.4	0	0	0	107.8
420	L	36.4	Very low	37	Very low	169 Å²	169	140.6 Å²	140.6	89%	0.885	81%	0.807	S	S	*	*	S	Bend	trans	170.8	48.2	146.5	-90.6	170	0	0	0	112.5
421	L	34.6	Very low	39.2	Very low	177 Å²	177	136.3 Å²	136.3	93%	0.927	79%	0.793	S	S	*	*			trans	-150.6	72.4	159.5	-80.1	-177.4	0	0	0	110.6
422	H	38.2	Very low	41.3	Very low	211 Å²	211	137.4 Å²	137.4	98%	0.977	79%	0.787	S	S	*	*			trans	-111.8	100.5	158.8	-108.3	-41	0	0	0	108.4
423	G	37.4	Very low	43.7	Very low	83 Å²	83	137.1 Å²	137.1	86%	0.856	78%	0.777	S	S	*	*			trans	166.8	58.2	178.6	0	0	0	0	0	113.4
424	G	32.3	Very low	46.1	Very low	72 Å²	72	135.5 Å²	135.5	74%	0.742	77%	0.769	S	S	*	*			trans	-177.7	119.7	171.2	0	0	0	0	0	110.9
425	Q	35.3	Very low	48.1	Very low	191 Å²	191	136 Å²	136	89%	0.893	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-50.6	145.5	178.8	-86.6	152.9	-77.3	0	0	113
426	P	40.3	Very low	50.4	Low	113 Å²	113	135.3 Å²	135.3	73%	0.734	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-72.8	138.6	171	31.8	-30.3	0	0	0	109
427	P	44.8	Very low	52.8	Low	118 Å²	118	130.7 Å²	130.7	77%	0.766	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-68.8	135.9	157.8	29.6	-27.3	0	0	0	107.2	G429	P427-G429 PolarHBondContact O-N 2.83Å
428	E	50.3	Low	55.3	Low	212 Å²	212	129 Å²	129	99%	0.991	72%	0.717	S	S	*	*			trans	-59.3	88.6	165	-78.1	178.5	134.5	0	0	108.3
429	G	54.2	Low	57.7	Low	50 Å²	50	125 Å²	125	52%	0.515	70%	0.699	S	S	.	*			trans	-103.5	134	170.6	0	0	0	0	0	108.7	P427	P427-G429 PolarHBondContact O-N 2.83Å
430	D	63.5	Low	60.4	Low	107 Å²	107	120.4 Å²	120.4	57%	0.572	68%	0.683	S	S	*	*			trans	-42.1	125.4	178	-140.1	-17	0	0	0	111.2	D432 L433 A434	D430-D432 PolarHBondContact O-N 3.16Å; D430-D432 VanDerWaalsContact O-N 3.11Å; D430-L433 HydrophobicContact CB-CB 4.02Å; D430-L433 WeakPolarHBondContact O-CA 3.18Å; D430-L433 WeakPolarHBondContact O-CB 3.38Å; D430-L433 PolarHBondContact O-N 3.27Å; D430-A434 PolarHBondContact O-N 2.97Å
431	P	71.4	Confident	62.7	Low	96 Å²	96	120.4 Å²	120.4	62%	0.623	67%	0.671	S	S	*	*	H	α-helix	trans	-57.8	-28.3	-178.6	21.8	-33.6	0	0	0	112.4	A434 K435	P431-A434 PolarHBondContact O-N 3.49Å; P431-K435 PolarHBondContact O-N 3.47Å; P431-K435 VanDerWaalsContact O-N 3.14Å
432	D	72.3	Confident	65.4	Low	107 Å²	107	118.7 Å²	118.7	57%	0.572	65%	0.653	S	S	*	*	H	α-helix	trans	-69.1	-35.1	174.6	-71.8	-18.2	0	0	0	112.3	D430 K435 I436	D430-D432 PolarHBondContact O-N 3.16Å; D430-D432 VanDerWaalsContact O-N 3.11Å; D432-K435 PolarHBondContact O-N 3.33Å; D432-I436 WeakPolarHBondContact O-CD1 3Å; D432-I436 VanDerWaalsContact O-CG1 3.23Å; D432-I436 WeakPolarHBondContact O-CG1 3.4Å; D432-I436 PolarHBondContact O-N 3.46Å
433	L	77.2	Confident	67.8	Low	114 Å²	114	112.7 Å²	112.7	60%	0.597	63%	0.628	S	S	*	*	H	α-helix	trans	-71.1	-37.5	176.2	-175.3	65.1	0	0	0	111.7	D430 K435 I436 L437	D430-L433 HydrophobicContact CB-CB 4.02Å; D430-L433 WeakPolarHBondContact O-CA 3.18Å; D430-L433 WeakPolarHBondContact O-CB 3.38Å; D430-L433 PolarHBondContact O-N 3.27Å; L433-K435 VanDerWaalsContact C-N 3.32Å; L433-I436 PolarHBondContact O-N 3.45Å; L433-L437 WeakPolarHBondContact O-CB 3.48Å; L433-L437 PolarHBondContact O-N 3.24Å
434	A	75.8	Confident	70.3	Confident	60 Å²	60	111.4 Å²	111.4	50%	0.496	61%	0.609	S	S	.	*	H	α-helix	trans	-62.9	-40.8	174.1	0	0	0	0	0	111.5	D430 P431 L437 E438	D430-A434 PolarHBondContact O-N 2.97Å; P431-A434 PolarHBondContact O-N 3.49Å; A434-L437 PolarHBondContact O-N 2.95Å; A434-E438 PolarHBondContact O-N 3.46Å
435	K	80	Confident	72.9	Confident	137 Å²	137	112 Å²	112	60%	0.596	60%	0.595	S	S	*	*	H	α-helix	trans	-67.2	-41.3	177.1	-161.8	172.4	-173.3	176.6	0	112.6	P431 D432 L433 L437 E438 E439	P431-K435 PolarHBondContact O-N 3.47Å; P431-K435 VanDerWaalsContact O-N 3.14Å; D432-K435 PolarHBondContact O-N 3.33Å; L433-K435 VanDerWaalsContact C-N 3.32Å; K435-L437 VanDerWaalsContact C-N 3.35Å; K435-E438 PolarHBondContact O-N 2.88Å; K435-E439 WeakPolarHBondContact O-CG 3.45Å; K435-E439 PolarHBondContact O-N 2.9Å; K435-E439 VanDerWaalsContact O-N 3.08Å
436	I	84.7	Confident	75.4	Confident	105 Å²	105	110.3 Å²	110.3	54%	0.538	58%	0.581	S	S	.	*	H	α-helix	trans	-64	-40.7	174	-67.9	163.2	0	0	0	111	D432 L433 E438 E439 V440	D432-I436 WeakPolarHBondContact O-CD1 3Å; D432-I436 VanDerWaalsContact O-CG1 3.23Å; D432-I436 WeakPolarHBondContact O-CG1 3.4Å; D432-I436 PolarHBondContact O-N 3.46Å; L433-I436 PolarHBondContact O-N 3.45Å; I436-E438 VanDerWaalsContact C-N 3.3Å; I436-E438 PolarHBondContact O-N 2.94Å; I436-E439 PolarHBondContact O-N 3.33Å; I436-V440 HydrophobicContact CG2-CG2 4.42Å; I436-V440 VanDerWaalsContact O-CG2 3.31Å; I436-V440 WeakPolarHBondContact O-CG2 3.41Å; I436-V440 PolarHBondContact O-N 3.27Å
437	L	81.8	Confident	77.7	Confident	85 Å²	85	110.7 Å²	110.7	45%	0.445	57%	0.571	S	S	.	*	H	α-helix	trans	-64.3	-36.2	177.4	-172.3	69.8	0	0	0	111.9	L433 A434 K435 R441	L433-L437 WeakPolarHBondContact O-CB 3.48Å; L433-L437 PolarHBondContact O-N 3.24Å; A434-L437 PolarHBondContact O-N 2.95Å; K435-L437 VanDerWaalsContact C-N 3.35Å; L437-R441 WeakPolarHBondContact O-CB 3.28Å; L437-R441 VanDerWaalsContact O-CG 3.22Å; L437-R441 WeakPolarHBondContact O-CG 3.39Å; L437-R441 PolarHBondContact O-N 3.01Å
438	E	83.3	Confident	79.7	Confident	134 Å²	134	111.4 Å²	111.4	63%	0.626	56%	0.558	S	S	*	*	H	α-helix	trans	-65.7	-45.6	174.9	-171.2	172.9	-170	0	0	111.9	A434 K435 I436 V440 R441 Y442	A434-E438 PolarHBondContact O-N 3.46Å; K435-E438 PolarHBondContact O-N 2.88Å; I436-E438 VanDerWaalsContact C-N 3.3Å; I436-E438 PolarHBondContact O-N 2.94Å; E438-V440 PolarHBondContact O-N 2.66Å; E438-R441 WeakPolarHBondContact O-CB 3.41Å; E438-R441 PolarHBondContact O-N 3.18Å; E438-Y442 WeakPolarHBondContact O-CB 3.38Å; E438-Y442 PolarHBondContact O-N 3.19Å
439	E	86.1	Confident	81.2	Confident	105 Å²	105	104.5 Å²	104.5	49%	0.491	53%	0.533	S	S	.	.	H	α-helix	trans	-62.9	-41.8	175.4	-68.8	-62	157.2	0	0	112.2	K435 I436 R441 Y442 I443	K435-E439 WeakPolarHBondContact O-CG 3.45Å; K435-E439 PolarHBondContact O-N 2.9Å; K435-E439 VanDerWaalsContact O-N 3.08Å; I436-E439 PolarHBondContact O-N 3.33Å; E439-R441 PolarHBondContact O-N 3.15Å; E439-Y442 PolarHBondContact O-N 2.93Å; E439-I443 WeakPolarHBondContact O-CB 3.37Å; E439-I443 VanDerWaalsContact O-CG1 3.23Å; E439-I443 WeakPolarHBondContact O-CG1 3.42Å; E439-I443 PolarHBondContact O-N 3.08Å
440	V	88.6	Confident	82.6	Confident	83 Å²	83	106.1 Å²	106.1	50%	0.503	53%	0.527	S	S	.	.	H	α-helix	trans	-65.7	-39	175.5	172.9	0	0	0	0	111.2	I436 E438 I443 A444	I436-V440 HydrophobicContact CG2-CG2 4.42Å; I436-V440 VanDerWaalsContact O-CG2 3.31Å; I436-V440 WeakPolarHBondContact O-CG2 3.41Å; I436-V440 PolarHBondContact O-N 3.27Å; E438-V440 PolarHBondContact O-N 2.66Å; V440-I443 PolarHBondContact O-N 3.23Å; V440-A444 VanDerWaalsContact O-CB 3.25Å; V440-A444 WeakPolarHBondContact O-CB 3.45Å; V440-A444 PolarHBondContact O-N 2.98Å
441	R	85.1	Confident	83.6	Confident	169 Å²	169	105.8 Å²	105.8	64%	0.638	53%	0.525	S	S	*	.	H	α-helix	trans	-64.2	-40.3	173.4	-79	173	179.8	172	0.7	111.6	L437 E438 E439 A444 N445	L437-R441 WeakPolarHBondContact O-CB 3.28Å; L437-R441 VanDerWaalsContact O-CG 3.22Å; L437-R441 WeakPolarHBondContact O-CG 3.39Å; L437-R441 PolarHBondContact O-N 3.01Å; E438-R441 WeakPolarHBondContact O-CB 3.41Å; E438-R441 PolarHBondContact O-N 3.18Å; E439-R441 PolarHBondContact O-N 3.15Å; R441-A444 PolarHBondContact O-N 3.47Å; R441-N445 VanDerWaalsContact O-CB 3.28Å; R441-N445 WeakPolarHBondContact O-CB 3.45Å; R441-N445 PolarHBondContact O-N 3.14Å
442	Y	90	Very high	84	Confident	140 Å²	140	106 Å²	106	55%	0.549	52%	0.518	S	S	.	.	H	α-helix	trans	-63.6	-46.5	175.7	177.2	-105.2	0	0	0	111.5	E438 E439 N445 R446	E438-Y442 WeakPolarHBondContact O-CB 3.38Å; E438-Y442 PolarHBondContact O-N 3.19Å; E439-Y442 PolarHBondContact O-N 2.93Å; Y442-N445 PolarHBondContact O-N 2.81Å; Y442-R446 WeakPolarHBondContact O-CB 3.43Å; Y442-R446 PolarHBondContact O-N 3.14Å
443	I	89.8	Confident	84.3	Confident	85 Å²	85	103.4 Å²	103.4	44%	0.436	51%	0.508	S	S	.	.	H	α-helix	trans	-60.5	-48.3	175.2	-68.3	165.1	0	0	0	110.5	E439 V440 N445 R446 F447	E439-I443 WeakPolarHBondContact O-CB 3.37Å; E439-I443 VanDerWaalsContact O-CG1 3.23Å; E439-I443 WeakPolarHBondContact O-CG1 3.42Å; E439-I443 PolarHBondContact O-N 3.08Å; V440-I443 PolarHBondContact O-N 3.23Å; I443-N445 PolarHBondContact O-N 3.48Å; I443-R446 PolarHBondContact O-N 2.94Å; I443-F447 HydrophobicContact CG2-CD2 3.57Å; I443-F447 HydrophobicContact CG2-CE2 3.52Å; I443-F447 VanDerWaalsContact O-CD2 3.24Å; I443-F447 WeakPolarHBondContact O-CD2 3.45Å; I443-F447 PolarHBondContact O-N 3.32Å
444	A	88.8	Confident	84.4	Confident	57 Å²	57	103 Å²	103	47%	0.471	50%	0.503	S	S	.	.	H	α-helix	trans	-61.7	-41	178.7	0	0	0	0	0	112.3	V440 R441 R448	V440-A444 VanDerWaalsContact O-CB 3.25Å; V440-A444 WeakPolarHBondContact O-CB 3.45Å; V440-A444 PolarHBondContact O-N 2.98Å; R441-A444 PolarHBondContact O-N 3.47Å; A444-R448 WeakPolarHBondContact O-CB 3.19Å; A444-R448 PolarHBondContact O-N 3.32Å
445	N	87.2	Confident	84.6	Confident	83 Å²	83	102.5 Å²	102.5	44%	0.444	50%	0.499	S	S	.	.	H	α-helix	trans	-71.2	-35.4	178.1	-155.4	26	0	0	0	111.5	R441 Y442 I443 R448 C449	R441-N445 VanDerWaalsContact O-CB 3.28Å; R441-N445 WeakPolarHBondContact O-CB 3.45Å; R441-N445 PolarHBondContact O-N 3.14Å; Y442-N445 PolarHBondContact O-N 2.81Å; I443-N445 PolarHBondContact O-N 3.48Å; N445-R448 PolarHBondContact O-N 2.9Å; N445-R448 PolarHBondContact OD1-NE 2.93Å; N445-R448 PolarHBondContact OD1-NH2 3.29Å; N445-C449 WeakPolarHBondContact O-CB 3.44Å; N445-C449 PolarHBondContact O-N 2.92Å; N445-C449 PolarHBondContact O-SG 3.36Å
446	R	89.3	Confident	84.6	Confident	157 Å²	157	97.9 Å²	97.9	59%	0.592	48%	0.482	S	S	*	.	H	α-helix	trans	-63.8	-46.6	172.8	-179.4	177.5	178.2	134.2	-0.4	112	Y442 I443 R448 C449 Q450	Y442-R446 WeakPolarHBondContact O-CB 3.43Å; Y442-R446 PolarHBondContact O-N 3.14Å; I443-R446 PolarHBondContact O-N 2.94Å; R446-R448 VanDerWaalsContact C-N 3.31Å; R446-R448 PolarHBondContact O-N 3.22Å; R446-C449 PolarHBondContact O-N 2.89Å; R446-Q450 WeakPolarHBondContact O-CB 3.36Å; R446-Q450 PolarHBondContact O-N 3.05Å
447	F	87.8	Confident	84.4	Confident	121 Å²	121	94.8 Å²	94.8	53%	0.531	47%	0.469	S	S	.	.	H	α-helix	trans	-60.7	-41.7	174	-85.6	-69.5	0	0	0	111.3	I443 Q450 D451	I443-F447 HydrophobicContact CG2-CD2 3.57Å; I443-F447 HydrophobicContact CG2-CE2 3.52Å; I443-F447 VanDerWaalsContact O-CD2 3.24Å; I443-F447 WeakPolarHBondContact O-CD2 3.45Å; I443-F447 PolarHBondContact O-N 3.32Å; F447-Q450 PolarHBondContact O-N 2.96Å; F447-D451 PolarHBondContact O-N 3.44Å
448	R	86	Confident	84.3	Confident	133 Å²	133	93.5 Å²	93.5	50%	0.502	47%	0.467	S	S	.	.	H	α-helix	trans	-64.1	-43.4	176.6	-165.3	180	70.8	93	-1.1	112.7	A444 N445 R446 Q450 D451 E452	A444-R448 WeakPolarHBondContact O-CB 3.19Å; A444-R448 PolarHBondContact O-N 3.32Å; N445-R448 PolarHBondContact O-N 2.9Å; N445-R448 PolarHBondContact OD1-NE 2.93Å; N445-R448 PolarHBondContact OD1-NH2 3.29Å; R446-R448 VanDerWaalsContact C-N 3.31Å; R446-R448 PolarHBondContact O-N 3.22Å; R448-Q450 VanDerWaalsContact C-N 3.31Å; R448-Q450 PolarHBondContact O-N 2.68Å; R448-D451 PolarHBondContact O-N 3.3Å; R448-E452 IonicContact CZ-OE1 3.63Å; R448-E452 IonicContact NH1-OE1 2.82Å; R448-E452 PolarHBondContact NH1-OE1 3.07Å; R448-E452 WeakPolarHBondContact O-CB 3.47Å; R448-E452 WeakPolarHBondContact O-CG 3.43Å; R448-E452 PolarHBondContact O-N 3.16Å
449	C	83.3	Confident	84.3	Confident	66 Å²	66	89.2 Å²	89.2	45%	0.446	45%	0.447	S	S	.	.	H	α-helix	trans	-64	-36.8	174.9	-71.8	0	0	0	0	112	N445 R446 E452 S453	N445-C449 WeakPolarHBondContact O-CB 3.44Å; N445-C449 PolarHBondContact O-N 2.92Å; N445-C449 PolarHBondContact O-SG 3.36Å; R446-C449 PolarHBondContact O-N 2.89Å; C449-E452 PolarHBondContact O-N 2.91Å; C449-S453 PolarHBondContact O-N 3.28Å; C449-S453 PolarHBondContact O-OG 3.42Å
450	Q	83.3	Confident	84.2	Confident	84 Å²	84	85.1 Å²	85.1	39%	0.393	43%	0.427	S	S	.	.	H	α-helix	trans	-67.4	-43.9	174.8	-176.1	175	-13.2	0	0	111.8	R446 F447 R448 E452 S453 E454	R446-Q450 WeakPolarHBondContact O-CB 3.36Å; R446-Q450 PolarHBondContact O-N 3.05Å; F447-Q450 PolarHBondContact O-N 2.96Å; R448-Q450 VanDerWaalsContact C-N 3.31Å; R448-Q450 PolarHBondContact O-N 2.68Å; Q450-E452 VanDerWaalsContact C-N 3.3Å; Q450-E452 PolarHBondContact O-N 3.19Å; Q450-S453 PolarHBondContact O-N 2.95Å; Q450-S453 PolarHBondContact O-OG 2.85Å; Q450-E454 PolarHBondContact NE2-OE1 3.49Å; Q450-E454 WeakPolarHBondContact O-CB 3.39Å; Q450-E454 WeakPolarHBondContact O-CG 3.39Å; Q450-E454 PolarHBondContact O-N 3.43Å
451	D	83.7	Confident	84	Confident	101 Å²	101	85.4 Å²	85.4	54%	0.54	42%	0.422	S	S	.	.	H	α-helix	trans	-62	-38.8	174.7	-76.7	-13.8	0	0	0	111.5	F447 R448 A455	F447-D451 PolarHBondContact O-N 3.44Å; R448-D451 PolarHBondContact O-N 3.3Å; D451-A455 VanDerWaalsContact O-CB 3.3Å; D451-A455 WeakPolarHBondContact O-CB 3.17Å; D451-A455 PolarHBondContact O-N 2.95Å
452	E	81.1	Confident	83.9	Confident	101 Å²	101	78.6 Å²	78.6	47%	0.472	40%	0.397	S	S	.	.	H	α-helix	trans	-66.3	-41.1	176.1	-76.9	-179.6	-168	0	0	112.3	R448 C449 Q450 A455 V456	R448-E452 IonicContact CZ-OE1 3.63Å; R448-E452 IonicContact NH1-OE1 2.82Å; R448-E452 PolarHBondContact NH1-OE1 3.07Å; R448-E452 WeakPolarHBondContact O-CB 3.47Å; R448-E452 WeakPolarHBondContact O-CG 3.43Å; R448-E452 PolarHBondContact O-N 3.16Å; C449-E452 PolarHBondContact O-N 2.91Å; Q450-E452 VanDerWaalsContact C-N 3.3Å; Q450-E452 PolarHBondContact O-N 3.19Å; E452-A455 PolarHBondContact O-N 3.38Å; E452-V456 WeakPolarHBondContact O-CG2 3.36Å; E452-V456 PolarHBondContact O-N 3.28Å
453	S	78.3	Confident	83.7	Confident	51 Å²	51	72 Å²	72	36%	0.357	37%	0.371	S	S	.	.	H	α-helix	trans	-70.7	-38.7	177.6	67.5	0	0	0	0	112.2	C449 Q450 A455 V456 C457	C449-S453 PolarHBondContact O-N 3.28Å; C449-S453 PolarHBondContact O-OG 3.42Å; Q450-S453 PolarHBondContact O-N 2.95Å; Q450-S453 PolarHBondContact O-OG 2.85Å; S453-A455 VanDerWaalsContact C-N 3.34Å; S453-V456 PolarHBondContact O-N 2.86Å; S453-C457 WeakPolarHBondContact O-CB 3.39Å; S453-C457 PolarHBondContact O-N 3.24Å
454	E	79.5	Confident	83.5	Confident	106 Å²	106	68 Å²	68	50%	0.495	35%	0.351	S	S	.	.	H	α-helix	trans	-62.3	-40.7	171.8	-75.8	-177.7	-163.2	0	0	111.6	Q450 C457 S458	Q450-E454 PolarHBondContact NE2-OE1 3.49Å; Q450-E454 WeakPolarHBondContact O-CB 3.39Å; Q450-E454 WeakPolarHBondContact O-CG 3.39Å; Q450-E454 PolarHBondContact O-N 3.43Å; E454-C457 PolarHBondContact O-N 3.14Å; E454-S458 WeakPolarHBondContact O-CB 3.44Å; E454-S458 PolarHBondContact O-N 3.12Å
455	A	79.3	Confident	83.3	Confident	49 Å²	49	67.8 Å²	67.8	41%	0.405	35%	0.345	S	S	.	.	H	α-helix	trans	-62.6	-45.3	175.2	0	0	0	0	0	111.8	D451 E452 S453 S458 E459	D451-A455 VanDerWaalsContact O-CB 3.3Å; D451-A455 WeakPolarHBondContact O-CB 3.17Å; D451-A455 PolarHBondContact O-N 2.95Å; E452-A455 PolarHBondContact O-N 3.38Å; S453-A455 VanDerWaalsContact C-N 3.34Å; A455-S458 PolarHBondContact O-N 3.19Å; A455-S458 PolarHBondContact O-OG 3.17Å; A455-E459 PolarHBondContact O-N 2.98Å
456	V	79.8	Confident	83.3	Confident	41 Å²	41	63.9 Å²	63.9	25%	0.248	32%	0.324	C	S	.	.	H	α-helix	trans	-63	-44.6	176.6	172	0	0	0	0	111.1	E452 S453 S458 E459 W460	E452-V456 WeakPolarHBondContact O-CG2 3.36Å; E452-V456 PolarHBondContact O-N 3.28Å; S453-V456 PolarHBondContact O-N 2.86Å; V456-S458 VanDerWaalsContact C-N 3.3Å; V456-S458 PolarHBondContact O-N 3.35Å; V456-E459 PolarHBondContact O-N 3.27Å; V456-E459 VanDerWaalsContact O-N 3.17Å; V456-W460 PolarHBondContact O-N 3.28Å; V456-W460 VanDerWaalsContact O-N 3.14Å
457	C	79.6	Confident	83.1	Confident	39 Å²	39	57.5 Å²	57.5	26%	0.264	30%	0.303	S	S	.	.	H	α-helix	trans	-59.3	-41.9	175.7	-174.5	0	0	0	0	111.5	S453 E454 E459 W460 K461	S453-C457 WeakPolarHBondContact O-CB 3.39Å; S453-C457 PolarHBondContact O-N 3.24Å; E454-C457 PolarHBondContact O-N 3.14Å; C457-E459 VanDerWaalsContact C-N 3.34Å; C457-E459 PolarHBondContact O-N 3.39Å; C457-W460 PolarHBondContact O-N 3.37Å; C457-K461 WeakPolarHBondContact O-CG 3.29Å; C457-K461 PolarHBondContact O-N 3.36Å
458	S	80.4	Confident	83.2	Confident	58 Å²	58	52.4 Å²	52.4	41%	0.406	28%	0.281	S	S	.	.	H	α-helix	trans	-64.2	-35.7	176.8	79.6	0	0	0	0	113.1	E454 A455 V456 F462	E454-S458 WeakPolarHBondContact O-CB 3.44Å; E454-S458 PolarHBondContact O-N 3.12Å; A455-S458 PolarHBondContact O-N 3.19Å; A455-S458 PolarHBondContact O-OG 3.17Å; V456-S458 VanDerWaalsContact C-N 3.3Å; V456-S458 PolarHBondContact O-N 3.35Å; S458-F462 WeakPolarHBondContact O-CB 3.49Å; S458-F462 PolarHBondContact O-N 3.46Å
459	E	82.6	Confident	83.3	Confident	44 Å²	44	50.3 Å²	50.3	21%	0.206	27%	0.273	C	S	.	.	H	α-helix	trans	-64.9	-41.5	175.1	-73.3	-169.9	145.4	0	0	111.5	R332 R347 A455 V456 C457 A463	R332-E459 IonicContact CZ-OE1 3.69Å; R332-E459 IonicContact CZ-OE2 3.13Å; R332-E459 VanDerWaalsContact CZ-OE2 3.24Å; R332-E459 IonicContact NH1-OE1 2.73Å; R332-E459 PolarHBondContact NH1-OE1 3.03Å; R332-E459 IonicContact NH1-OE2 3.46Å; R332-E459 PolarHBondContact NH1-OE2 3.16Å; R332-E459 IonicContact NH2-OE1 3.78Å; R332-E459 IonicContact NH2-OE2 2.72Å; R332-E459 PolarHBondContact NH2-OE2 3.14Å; R347-E459 IonicContact NH2-OE1 3.74Å; A455-E459 PolarHBondContact O-N 2.98Å; V456-E459 PolarHBondContact O-N 3.27Å; V456-E459 VanDerWaalsContact O-N 3.17Å; C457-E459 VanDerWaalsContact C-N 3.34Å; C457-E459 PolarHBondContact O-N 3.39Å; E459-A463 WeakPolarHBondContact O-CB 3.31Å; E459-A463 PolarHBondContact O-N 2.69Å
460	W	84	Confident	83.5	Confident	19 Å²	19	49.6 Å²	49.6	7%	0.072	26%	0.264	C	S	.	.	H	α-helix	trans	-68.4	-43.7	176.8	-77.5	107.9	0	0	0	112.6	Y317 H320 M327 V456 C457 F462 A463 A464	Y317-W460 AromaticContact CD1-CE3 3.57Å; Y317-W460 HydrophobicContact CD1-CE3 3.57Å; Y317-W460 AromaticContact CD1-CZ3 3.4Å; Y317-W460 HydrophobicContact CD1-CZ3 3.4Å; Y317-W460 VanDerWaalsContact CD1-CZ3 3.4Å; Y317-W460 HydrophobicContact CE1-CE3 4.07Å; Y317-W460 HydrophobicContact CE1-CH2 4.47Å; Y317-W460 AromaticContact CE1-CZ3 3.44Å; Y317-W460 HydrophobicContact CE1-CZ3 3.44Å; Y317-W460 VanDerWaalsContact CE1-CZ3 3.44Å; Y317-W460 HydrophobicContact CG-CE3 4.49Å; Y317-W460 HydrophobicContact CG-CZ3 4.42Å; H320-W460 HydrophobicContact CB-CB 4.48Å; H320-W460 HydrophobicContact CB-CD2 4.2Å; H320-W460 HydrophobicContact CB-CE3 4.29Å; H320-W460 HydrophobicContact CB-CG 4.28Å; H320-W460 AromaticContact CD2-CE3 3.98Å; H320-W460 AromaticContact CD2-CH2 3.69Å; H320-W460 AromaticContact CD2-CZ2 3.81Å; H320-W460 AromaticContact CD2-CZ3 3.75Å; H320-W460 AromaticContact CE1-CE2 3.89Å; H320-W460 AromaticContact CE1-CZ2 3.73Å; H320-W460 AromaticContact CG-CD2 3.95Å; H320-W460 AromaticContact CG-CE2 3.98Å; H320-W460 AromaticContact ND1-CE2 3.9Å; H320-W460 AromaticContact ND1-NE1 3.9Å; H320-W460 AromaticContact NE2-CE2 3.96Å; H320-W460 AromaticContact NE2-CH2 3.6Å; H320-W460 AromaticContact NE2-CZ2 3.47Å; H320-W460 WeakPolarHBondContact NE2-CZ2 3.45Å; M327-W460 VanDerWaalsContact CA-CZ2 3.44Å; M327-W460 HydrophobicContact CB-CH2 3.94Å; M327-W460 HydrophobicContact CB-CZ2 3.48Å; M327-W460 VanDerWaalsContact CB-CZ2 3.48Å; M327-W460 HydrophobicContact CG-CH2 3.92Å; M327-W460 HydrophobicContact CG-CZ2 4Å; M327-W460 HydrophobicContact CG-CZ3 4.32Å; M327-W460 HydrophobicContact SD-CD2 4.26Å; M327-W460 HydrophobicContact SD-CE3 4.02Å; M327-W460 HydrophobicContact SD-CH2 4.19Å; M327-W460 HydrophobicContact SD-CZ2 4.44Å; M327-W460 HydrophobicContact SD-CZ3 3.99Å; V456-W460 PolarHBondContact O-N 3.28Å; V456-W460 VanDerWaalsContact O-N 3.14Å; C457-W460 PolarHBondContact O-N 3.37Å; W460-F462 VanDerWaalsContact C-N 3.31Å; W460-F462 PolarHBondContact O-N 3.01Å; W460-A463 WeakPolarHBondContact O-CB 3.18Å; W460-A463 PolarHBondContact O-N 3.03Å; W460-A464 PolarHBondContact O-N 3.43Å
461	K	84.8	Confident	83.6	Confident	90 Å²	90	46.5 Å²	46.5	39%	0.391	25%	0.252	S	S	.	.	H	α-helix	trans	-61	-40.8	174.4	-73.1	-178.2	176.3	-174.8	0	112.1	C457 A464 C465	C457-K461 WeakPolarHBondContact O-CG 3.29Å; C457-K461 PolarHBondContact O-N 3.36Å; K461-A464 PolarHBondContact O-N 2.9Å; K461-C465 PolarHBondContact O-N 3.4Å
462	F	84.4	Confident	83.9	Confident	26 Å²	26	43 Å²	43	11%	0.114	23%	0.233	C	C	.	.	H	α-helix	trans	-67.6	-40.6	174.9	-178.3	-101.9	0	0	0	111.6	L336 A340 M345 P348 S458 W460 A464 C465 V466	L336-F462 HydrophobicContact CD2-CD1 3.31Å; L336-F462 HydrophobicContact CD2-CE1 3.7Å; A340-F462 HydrophobicContact CB-CE1 4.37Å; A340-F462 HydrophobicContact CB-CZ 4.42Å; M345-F462 HydrophobicContact CB-CE2 4.45Å; M345-F462 HydrophobicContact CB-CZ 4.26Å; P348-F462 HydrophobicContact CG-CB 4.02Å; P348-F462 HydrophobicContact CG-CD1 4.41Å; P348-F462 HydrophobicContact CG-CD2 3.61Å; P348-F462 HydrophobicContact CG-CE2 4.17Å; P348-F462 HydrophobicContact CG-CG 3.75Å; S458-F462 WeakPolarHBondContact O-CB 3.49Å; S458-F462 PolarHBondContact O-N 3.46Å; W460-F462 VanDerWaalsContact C-N 3.31Å; W460-F462 PolarHBondContact O-N 3.01Å; F462-A464 VanDerWaalsContact C-N 3.34Å; F462-A464 PolarHBondContact O-N 3.28Å; F462-C465 PolarHBondContact O-N 2.92Å; F462-V466 HydrophobicContact CD1-CG2 4.09Å; F462-V466 HydrophobicContact CE1-CG2 3.69Å; F462-V466 HydrophobicContact CE2-CG2 4.28Å; F462-V466 HydrophobicContact CZ-CG2 3.8Å; F462-V466 VanDerWaalsContact O-CG2 3.31Å; F462-V466 WeakPolarHBondContact O-CG2 3.24Å; F462-V466 PolarHBondContact O-N 3.4Å
463	A	84.1	Confident	84.3	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.8	-43.1	173.4	0	0	0	0	0	112.1	M327 L335 E459 W460 C465 V466 V467	M327-A463 HydrophobicContact CE-CB 4.23Å; M327-A463 HydrophobicContact SD-CB 4.23Å; L335-A463 HydrophobicContact CD1-CB 4.06Å; E459-A463 WeakPolarHBondContact O-CB 3.31Å; E459-A463 PolarHBondContact O-N 2.69Å; W460-A463 WeakPolarHBondContact O-CB 3.18Å; W460-A463 PolarHBondContact O-N 3.03Å; A463-C465 PolarHBondContact O-N 3.34Å; A463-V466 PolarHBondContact O-N 3.03Å; A463-V467 WeakPolarHBondContact O-CG2 3.23Å; A463-V467 PolarHBondContact O-N 3.27Å
464	A	85.8	Confident	84.8	Confident	2 Å²	2	43.2 Å²	43.2	2%	0.017	24%	0.24	C	C	.	.	H	α-helix	trans	-59.6	-45.2	174.4	0	0	0	0	0	111.8	V314 H318 W460 K461 F462 V466 V467 D468	V314-A464 HydrophobicContact CG1-CB 4.34Å; H318-A464 HydrophobicContact CB-CB 4.02Å; W460-A464 PolarHBondContact O-N 3.43Å; K461-A464 PolarHBondContact O-N 2.9Å; F462-A464 VanDerWaalsContact C-N 3.34Å; F462-A464 PolarHBondContact O-N 3.28Å; A464-V466 PolarHBondContact O-N 3.26Å; A464-V467 PolarHBondContact O-N 2.78Å; A464-D468 WeakPolarHBondContact O-CB 3.49Å; A464-D468 PolarHBondContact O-N 3.37Å
465	C	85.2	Confident	85.2	Confident	53 Å²	53	39.7 Å²	39.7	36%	0.358	22%	0.223	S	C	.	.	H	α-helix	trans	-62.9	-39	176.5	-171.5	0	0	0	0	112.6	K461 F462 A463 D468 R469	K461-C465 PolarHBondContact O-N 3.4Å; F462-C465 PolarHBondContact O-N 2.92Å; A463-C465 PolarHBondContact O-N 3.34Å; C465-D468 PolarHBondContact O-N 3.13Å; C465-R469 WeakPolarHBondContact O-CB 3.48Å; C465-R469 WeakPolarHBondContact O-CG 3.4Å; C465-R469 PolarHBondContact O-N 2.92Å; C465-R469 VanDerWaalsContact O-N 3.08Å
466	V	86.3	Confident	85.7	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64.9	-44.3	175.8	169.1	0	0	0	0	111.3	C339 A340 L343 M345 F462 A463 A464 R469 L470	C339-V466 HydrophobicContact CB-CG1 3.53Å; A340-V466 HydrophobicContact CB-CG2 4.48Å; L343-V466 HydrophobicContact CD1-CG1 4.06Å; L343-V466 WeakPolarHBondContact CD1-O 3.38Å; M345-V466 HydrophobicContact SD-CG2 4.1Å; F462-V466 HydrophobicContact CD1-CG2 4.09Å; F462-V466 HydrophobicContact CE1-CG2 3.69Å; F462-V466 HydrophobicContact CE2-CG2 4.28Å; F462-V466 HydrophobicContact CZ-CG2 3.8Å; F462-V466 VanDerWaalsContact O-CG2 3.31Å; F462-V466 WeakPolarHBondContact O-CG2 3.24Å; F462-V466 PolarHBondContact O-N 3.4Å; A463-V466 PolarHBondContact O-N 3.03Å; A464-V466 PolarHBondContact O-N 3.26Å; V466-R469 PolarHBondContact O-N 2.87Å; V466-L470 WeakPolarHBondContact O-CB 3.31Å; V466-L470 PolarHBondContact O-N 3.45Å
467	V	86.3	Confident	86.1	Confident	23 Å²	23	40.3 Å²	40.3	14%	0.139	22%	0.222	C	C	.	.	H	α-helix	trans	-61.9	-46.4	176.1	174.6	0	0	0	0	110.4	V314 L335 A463 A464 R469 L470 C471	V314-V467 HydrophobicContact CG2-CB 4.21Å; V314-V467 HydrophobicContact CG2-CG1 3.67Å; L335-V467 HydrophobicContact CD1-CG2 3.87Å; L335-V467 HydrophobicContact CD2-CG2 3.6Å; L335-V467 HydrophobicContact CG-CG2 4.4Å; A463-V467 WeakPolarHBondContact O-CG2 3.23Å; A463-V467 PolarHBondContact O-N 3.27Å; A464-V467 PolarHBondContact O-N 2.78Å; V467-R469 VanDerWaalsContact C-N 3.29Å; V467-R469 PolarHBondContact O-N 3Å; V467-L470 PolarHBondContact O-N 2.86Å; V467-C471 WeakPolarHBondContact O-CB 3.38Å; V467-C471 PolarHBondContact O-N 3.13Å; V467-C471 PolarHBondContact O-SG 3.23Å
468	D	88.6	Confident	86.5	Confident	14 Å²	14	43.4 Å²	43.4	8%	0.075	23%	0.231	C	C	.	.	H	α-helix	trans	-56.1	-43.7	179.3	-158.6	47.8	0	0	0	112.4	F252 K261 V314 A464 C465 C471 L472	F252-D468 WeakPolarHBondContact CD1-OD1 3.35Å; K261-D468 IonicContact NZ-OD1 3.69Å; K261-D468 PolarHBondContact NZ-OD1 2.94Å; K261-D468 IonicContact NZ-OD2 2.68Å; K261-D468 PolarHBondContact NZ-OD2 3.47Å; V314-D468 HydrophobicContact CG1-CB 4.1Å; V314-D468 HydrophobicContact CG2-CB 4.46Å; A464-D468 WeakPolarHBondContact O-CB 3.49Å; A464-D468 PolarHBondContact O-N 3.37Å; C465-D468 PolarHBondContact O-N 3.13Å; D468-C471 PolarHBondContact O-N 3.03Å; D468-L472 PolarHBondContact O-N 3.4Å
469	R	88.1	Confident	86.8	Confident	90 Å²	90	41.7 Å²	41.7	34%	0.34	22%	0.219	S	C	.	.	H	α-helix	trans	-74.9	-35.7	-179.8	-68	-84.1	-177.6	-166.8	-3	112.9	L343 M345 C465 V466 V467 C471 L472 M473	L343-R469 HydrophobicContact CD1-CB 4.08Å; L343-R469 HydrophobicContact CD2-CB 4.49Å; M345-R469 HydrophobicContact CE-CB 4.16Å; M345-R469 HydrophobicContact CE-CG 3.53Å; M345-R469 HydrophobicContact SD-CB 4.39Å; M345-R469 HydrophobicContact SD-CG 4.3Å; C465-R469 WeakPolarHBondContact O-CB 3.48Å; C465-R469 WeakPolarHBondContact O-CG 3.4Å; C465-R469 PolarHBondContact O-N 2.92Å; C465-R469 VanDerWaalsContact O-N 3.08Å; V466-R469 PolarHBondContact O-N 2.87Å; V467-R469 VanDerWaalsContact C-N 3.29Å; V467-R469 PolarHBondContact O-N 3Å; R469-C471 VanDerWaalsContact C-N 3.32Å; R469-L472 PolarHBondContact O-N 2.72Å; R469-M473 WeakPolarHBondContact O-CG 3.37Å; R469-M473 PolarHBondContact O-N 2.95Å
470	L	87.5	Confident	87	Confident	50 Å²	50	44.2 Å²	44.2	26%	0.262	23%	0.233	S	C	.	.	H	α-helix	trans	-61	-46.4	172.1	-175.4	68.5	0	0	0	110.2	F342 L343 V466 V467 M473 A474	F342-L470 HydrophobicContact CD1-CD1 4.25Å; F342-L470 HydrophobicContact CE1-CD1 4.44Å; L343-L470 HydrophobicContact CD1-CB 4.07Å; V466-L470 WeakPolarHBondContact O-CB 3.31Å; V466-L470 PolarHBondContact O-N 3.45Å; V467-L470 PolarHBondContact O-N 2.86Å; L470-M473 PolarHBondContact O-N 3.41Å; L470-A474 WeakPolarHBondContact O-CB 3.44Å; L470-A474 PolarHBondContact O-N 2.93Å
471	C	87.1	Confident	87.1	Confident	20 Å²	20	48.4 Å²	48.4	14%	0.135	26%	0.255	C	S	.	.	H	α-helix	trans	-64.4	-42.2	178	-67.5	0	0	0	0	111.5	F252 V310 V467 D468 R469 M473 A474 F475	F252-C471 HydrophobicContact CD1-CB 4.16Å; F252-C471 HydrophobicContact CE1-CB 3.86Å; F252-C471 HydrophobicContact CZ-CB 4.35Å; V310-C471 HydrophobicContact CG1-CB 4.14Å; V310-C471 WeakPolarHBondContact CG1-SG 3.47Å; V467-C471 WeakPolarHBondContact O-CB 3.38Å; V467-C471 PolarHBondContact O-N 3.13Å; V467-C471 PolarHBondContact O-SG 3.23Å; D468-C471 PolarHBondContact O-N 3.03Å; R469-C471 VanDerWaalsContact C-N 3.32Å; C471-M473 VanDerWaalsContact C-N 3.32Å; C471-M473 PolarHBondContact O-N 3.48Å; C471-A474 PolarHBondContact O-N 2.91Å; C471-F475 HydrophobicContact CB-CD2 3.98Å; C471-F475 HydrophobicContact CB-CE2 3.86Å; C471-F475 VanDerWaalsContact O-CB 3.3Å; C471-F475 WeakPolarHBondContact O-CB 3.43Å; C471-F475 WeakPolarHBondContact O-CD2 3.39Å; C471-F475 WeakPolarHBondContact O-CG 3.32Å; C471-F475 PolarHBondContact O-N 3Å
472	L	89.8	Confident	87.1	Confident	27 Å²	27	45.3 Å²	45.3	14%	0.141	25%	0.245	C	C	.	.	H	α-helix	trans	-55.2	-46.6	172.5	-177.8	145.5	0	0	0	112.2	F252 L253 D468 R469 S476	F252-L472 HydrophobicContact CB-CB 3.81Å; F252-L472 HydrophobicContact CB-CD1 3.92Å; F252-L472 HydrophobicContact CB-CG 4.27Å; F252-L472 HydrophobicContact CG-CB 4.46Å; L253-L472 HydrophobicContact CD2-CD1 3.41Å; L253-L472 VanDerWaalsContact CD2-CD1 3.41Å; L253-L472 HydrophobicContact CG-CD1 3.57Å; D468-L472 PolarHBondContact O-N 3.4Å; R469-L472 PolarHBondContact O-N 2.72Å; L472-S476 WeakPolarHBondContact O-CB 3.24Å; L472-S476 PolarHBondContact O-N 3.47Å; L472-S476 PolarHBondContact O-OG 3.33Å
473	M	88.8	Confident	87	Confident	98 Å²	98	46 Å²	46	48%	0.483	25%	0.251	S	S	.	.	H	α-helix	trans	-68.5	-43.2	-179.9	-66	-63.6	-92.9	0	0	111.6	L343 R469 L470 C471 S476 V477	L343-M473 HydrophobicContact CD2-CG 3.94Å; R469-M473 WeakPolarHBondContact O-CG 3.37Å; R469-M473 PolarHBondContact O-N 2.95Å; L470-M473 PolarHBondContact O-N 3.41Å; C471-M473 VanDerWaalsContact C-N 3.32Å; C471-M473 PolarHBondContact O-N 3.48Å; M473-S476 WeakPolarHBondContact CA-OG 3.39Å; M473-S476 PolarHBondContact O-OG 3.42Å; M473-V477 WeakPolarHBondContact O-CB 3.5Å; M473-V477 VanDerWaalsContact O-CG2 3.25Å; M473-V477 WeakPolarHBondContact O-CG2 3.36Å; M473-V477 PolarHBondContact O-N 3.26Å
474	A	87.9	Confident	86.9	Confident	58 Å²	58	50.7 Å²	50.7	48%	0.479	28%	0.275	S	S	.	.	H	α-helix	trans	-62.7	-48.3	177.1	0	0	0	0	0	112	L470 C471 F478	L470-A474 WeakPolarHBondContact O-CB 3.44Å; L470-A474 PolarHBondContact O-N 2.93Å; C471-A474 PolarHBondContact O-N 2.91Å; A474-F478 WeakPolarHBondContact O-CB 3.3Å; A474-F478 PolarHBondContact O-N 3.29Å
475	F	88.8	Confident	86.7	Confident	33 Å²	33	52.3 Å²	52.3	15%	0.145	29%	0.292	C	S	.	.	H	α-helix	trans	-68.8	-39.1	-180	-70.2	-53.9	0	0	0	112.3	L249 F252 I303 C471 F478 T479	L249-F475 HydrophobicContact CD2-CB 4.19Å; F252-F475 HydrophobicContact CD2-CD2 4.2Å; F252-F475 HydrophobicContact CE1-CD2 4.26Å; F252-F475 HydrophobicContact CE1-CE2 4.12Å; F252-F475 AromaticContact CE2-CD2 3.32Å; F252-F475 HydrophobicContact CE2-CD2 3.32Å; F252-F475 AromaticContact CE2-CE2 3.78Å; F252-F475 HydrophobicContact CE2-CE2 3.78Å; F252-F475 HydrophobicContact CE2-CG 4.2Å; F252-F475 AromaticContact CZ-CD2 3.37Å; F252-F475 HydrophobicContact CZ-CD2 3.37Å; F252-F475 AromaticContact CZ-CE2 3.3Å; F252-F475 HydrophobicContact CZ-CE2 3.3Å; F252-F475 HydrophobicContact CZ-CZ 4.43Å; I303-F475 HydrophobicContact CG2-CD1 3.58Å; I303-F475 HydrophobicContact CG2-CE1 3.99Å; I303-F475 HydrophobicContact CG2-CG 4.44Å; C471-F475 HydrophobicContact CB-CD2 3.98Å; C471-F475 HydrophobicContact CB-CE2 3.86Å; C471-F475 VanDerWaalsContact O-CB 3.3Å; C471-F475 WeakPolarHBondContact O-CB 3.43Å; C471-F475 WeakPolarHBondContact O-CD2 3.39Å; C471-F475 WeakPolarHBondContact O-CG 3.32Å; C471-F475 PolarHBondContact O-N 3Å; F475-F478 PolarHBondContact O-N 3.37Å; F475-T479 WeakPolarHBondContact O-CB 3.42Å; F475-T479 PolarHBondContact O-N 3.48Å; F475-T479 PolarHBondContact O-OG1 3.44Å
476	S	88.9	Confident	86.3	Confident	23 Å²	23	51.4 Å²	51.4	16%	0.161	28%	0.283	C	S	.	.	H	α-helix	trans	-64.6	-44.6	175.9	56.3	0	0	0	0	112.3	L472 M473 F478 T479 I480	L472-S476 WeakPolarHBondContact O-CB 3.24Å; L472-S476 PolarHBondContact O-N 3.47Å; L472-S476 PolarHBondContact O-OG 3.33Å; M473-S476 WeakPolarHBondContact CA-OG 3.39Å; M473-S476 PolarHBondContact O-OG 3.42Å; S476-F478 PolarHBondContact O-N 2.86Å; S476-T479 PolarHBondContact O-N 3.27Å; S476-I480 WeakPolarHBondContact O-CB 3.46Å; S476-I480 WeakPolarHBondContact O-CD1 3.36Å; S476-I480 WeakPolarHBondContact O-CG1 3.47Å; S476-I480 PolarHBondContact O-N 3.07Å
477	V	89.4	Confident	85.7	Confident	80 Å²	80	54.6 Å²	54.6	49%	0.485	30%	0.3	S	S	.	.	H	α-helix	trans	-61.9	-45.3	175.5	170.7	0	0	0	0	110.6	M473 I480 I481	M473-V477 WeakPolarHBondContact O-CB 3.5Å; M473-V477 VanDerWaalsContact O-CG2 3.25Å; M473-V477 WeakPolarHBondContact O-CG2 3.36Å; M473-V477 PolarHBondContact O-N 3.26Å; V477-I480 PolarHBondContact O-N 3.49Å; V477-I481 HydrophobicContact CG1-CD1 3.64Å; V477-I481 HydrophobicContact CG1-CG1 4.38Å; V477-I481 WeakPolarHBondContact O-CB 3.43Å; V477-I481 VanDerWaalsContact O-CG1 3.27Å; V477-I481 WeakPolarHBondContact O-CG1 3.37Å; V477-I481 PolarHBondContact O-N 2.93Å
478	F	88.1	Confident	85.1	Confident	103 Å²	103	60.6 Å²	60.6	45%	0.452	33%	0.328	S	S	.	.	H	α-helix	trans	-62.5	-46.9	178.4	-169.4	-100.5	0	0	0	111.8	I303 A474 F475 S476 I480 I481 C482	I303-F478 HydrophobicContact CD1-CD1 3.3Å; I303-F478 HydrophobicContact CD1-CE1 3.31Å; I303-F478 HydrophobicContact CG1-CD1 3.54Å; I303-F478 HydrophobicContact CG1-CE1 3.39Å; A474-F478 WeakPolarHBondContact O-CB 3.3Å; A474-F478 PolarHBondContact O-N 3.29Å; F475-F478 PolarHBondContact O-N 3.37Å; S476-F478 PolarHBondContact O-N 2.86Å; F478-I480 VanDerWaalsContact C-N 3.34Å; F478-I480 PolarHBondContact O-N 3.38Å; F478-I481 PolarHBondContact O-N 3.49Å; F478-C482 WeakPolarHBondContact CE1-SG 3.42Å; F478-C482 WeakPolarHBondContact O-CB 3.48Å; F478-C482 PolarHBondContact O-N 2.84Å; F478-C482 PolarHBondContact O-SG 2.86Å; F478-C482 VanDerWaalsContact O-SG 3.38Å
479	T	85.8	Confident	84.5	Confident	23 Å²	23	63 Å²	63	14%	0.141	35%	0.346	C	S	.	.	H	α-helix	trans	-59	-44.4	175.8	-61.6	0	0	0	0	111.3	F475 S476 C482 T483	F475-T479 WeakPolarHBondContact O-CB 3.42Å; F475-T479 PolarHBondContact O-N 3.48Å; F475-T479 PolarHBondContact O-OG1 3.44Å; S476-T479 PolarHBondContact O-N 3.27Å; T479-C482 PolarHBondContact O-N 2.91Å; T479-T483 WeakPolarHBondContact O-CB 3.43Å; T479-T483 PolarHBondContact O-N 3.43Å; T479-T483 PolarHBondContact O-OG1 3.35Å
480	I	86.8	Confident	83.7	Confident	97 Å²	97	59.1 Å²	59.1	50%	0.497	33%	0.333	S	S	.	.	H	α-helix	trans	-62.8	-45.9	177.9	-69.3	164.5	0	0	0	111	S476 V477 F478 T483 I484	S476-I480 WeakPolarHBondContact O-CB 3.46Å; S476-I480 WeakPolarHBondContact O-CD1 3.36Å; S476-I480 WeakPolarHBondContact O-CG1 3.47Å; S476-I480 PolarHBondContact O-N 3.07Å; V477-I480 PolarHBondContact O-N 3.49Å; F478-I480 VanDerWaalsContact C-N 3.34Å; F478-I480 PolarHBondContact O-N 3.38Å; I480-T483 PolarHBondContact O-N 2.93Å; I480-I484 HydrophobicContact CG2-CD1 3.6Å; I480-I484 HydrophobicContact CG2-CG1 4.35Å; I480-I484 WeakPolarHBondContact O-CB 3.37Å; I480-I484 VanDerWaalsContact O-CG1 3.26Å; I480-I484 WeakPolarHBondContact O-CG1 3.42Å; I480-I484 PolarHBondContact O-N 3.36Å
481	I	87.8	Confident	82.7	Confident	107 Å²	107	61.2 Å²	61.2	55%	0.549	35%	0.35	S	S	.	.	H	α-helix	trans	-63.1	-45.4	178.9	-68.8	168.8	0	0	0	110.8	V477 F478 G485	V477-I481 HydrophobicContact CG1-CD1 3.64Å; V477-I481 HydrophobicContact CG1-CG1 4.38Å; V477-I481 WeakPolarHBondContact O-CB 3.43Å; V477-I481 VanDerWaalsContact O-CG1 3.27Å; V477-I481 WeakPolarHBondContact O-CG1 3.37Å; V477-I481 PolarHBondContact O-N 2.93Å; F478-I481 PolarHBondContact O-N 3.49Å; I481-G485 PolarHBondContact O-N 3.38Å
482	C	83.7	Confident	81.6	Confident	25 Å²	25	62.6 Å²	62.6	17%	0.169	36%	0.356	C	S	.	.	H	α-helix	trans	-60.7	-49.3	176.6	-74.6	0	0	0	0	111.3	F478 T479 I484 G485 I486	F478-C482 WeakPolarHBondContact CE1-SG 3.42Å; F478-C482 WeakPolarHBondContact O-CB 3.48Å; F478-C482 PolarHBondContact O-N 2.84Å; F478-C482 PolarHBondContact O-SG 2.86Å; F478-C482 VanDerWaalsContact O-SG 3.38Å; T479-C482 PolarHBondContact O-N 2.91Å; C482-I484 PolarHBondContact O-N 3.26Å; C482-G485 PolarHBondContact O-N 3.23Å; C482-I486 VanDerWaalsContact O-CB 3.3Å; C482-I486 WeakPolarHBondContact O-CB 3.38Å; C482-I486 WeakPolarHBondContact O-CD1 3.33Å; C482-I486 VanDerWaalsContact O-CG1 3.24Å; C482-I486 WeakPolarHBondContact O-CG1 3.28Å; C482-I486 PolarHBondContact O-N 3.46Å
483	T	82.2	Confident	80.6	Confident	39 Å²	39	64.1 Å²	64.1	24%	0.239	36%	0.361	C	S	.	.	H	α-helix	trans	-61.3	-45.4	179.4	-58.4	0	0	0	0	111.7	T479 I480 L487	T479-T483 WeakPolarHBondContact O-CB 3.43Å; T479-T483 PolarHBondContact O-N 3.43Å; T479-T483 PolarHBondContact O-OG1 3.35Å; I480-T483 PolarHBondContact O-N 2.93Å; T483-L487 HydrophobicContact CG2-CD1 3.96Å; T483-L487 HydrophobicContact CG2-CG 4.5Å; T483-L487 WeakPolarHBondContact O-CB 3.25Å; T483-L487 VanDerWaalsContact O-CG 3.26Å; T483-L487 WeakPolarHBondContact O-CG 3.24Å; T483-L487 PolarHBondContact O-N 3.27Å
484	I	82.3	Confident	79.5	Confident	99 Å²	99	64.9 Å²	64.9	51%	0.508	37%	0.371	S	S	.	.	H	α-helix	trans	-66	-46.9	177.6	-68	171.3	0	0	0	110.8	I480 C482 I486 L487 M488	I480-I484 HydrophobicContact CG2-CD1 3.6Å; I480-I484 HydrophobicContact CG2-CG1 4.35Å; I480-I484 WeakPolarHBondContact O-CB 3.37Å; I480-I484 VanDerWaalsContact O-CG1 3.26Å; I480-I484 WeakPolarHBondContact O-CG1 3.42Å; I480-I484 PolarHBondContact O-N 3.36Å; C482-I484 PolarHBondContact O-N 3.26Å; I484-I486 PolarHBondContact O-N 2.9Å; I484-L487 PolarHBondContact O-N 2.85Å; I484-M488 HydrophobicContact CG2-CG 4.1Å; I484-M488 VanDerWaalsContact O-CB 3.27Å; I484-M488 WeakPolarHBondContact O-CB 3.22Å; I484-M488 VanDerWaalsContact O-CG 3.22Å; I484-M488 WeakPolarHBondContact O-CG 3.35Å; I484-M488 PolarHBondContact O-N 3.31Å
485	G	81.6	Confident	78.6	Confident	36 Å²	36	66 Å²	66	37%	0.371	37%	0.367	S	S	.	.	H	α-helix	trans	-58.8	-38.8	-179.7	0	0	0	0	0	112.1	I481 C482 S489	I481-G485 PolarHBondContact O-N 3.38Å; C482-G485 PolarHBondContact O-N 3.23Å; G485-S489 WeakPolarHBondContact O-CB 3.49Å; G485-S489 PolarHBondContact O-N 2.93Å; G485-S489 VanDerWaalsContact O-N 3.11Å; G485-S489 PolarHBondContact O-OG 3.27Å
486	I	77.5	Confident	77.4	Confident	35 Å²	35	64.8 Å²	64.8	18%	0.179	36%	0.363	C	S	.	.	H	α-helix	trans	-73.9	-47.7	179	-72.2	164.1	0	0	0	111	L292 Y296 C482 I484 M488 S489	L292-I486 HydrophobicContact CD2-CG2 3.72Å; L292-I486 WeakPolarHBondContact CD2-O 3.36Å; L292-I486 HydrophobicContact CG-CG2 3.92Å; Y296-I486 HydrophobicContact CD2-CD1 3.46Å; Y296-I486 VanDerWaalsContact CD2-CD1 3.46Å; Y296-I486 HydrophobicContact CE2-CD1 4.47Å; Y296-I486 HydrophobicContact CG-CD1 4.01Å; C482-I486 VanDerWaalsContact O-CB 3.3Å; C482-I486 WeakPolarHBondContact O-CB 3.38Å; C482-I486 WeakPolarHBondContact O-CD1 3.33Å; C482-I486 VanDerWaalsContact O-CG1 3.24Å; C482-I486 WeakPolarHBondContact O-CG1 3.28Å; C482-I486 PolarHBondContact O-N 3.46Å; I484-I486 PolarHBondContact O-N 2.9Å; I486-M488 VanDerWaalsContact C-N 3.25Å; I486-M488 PolarHBondContact O-N 2.86Å; I486-S489 WeakPolarHBondContact O-CB 3.45Å; I486-S489 PolarHBondContact O-N 2.82Å
487	L	73.1	Confident	76.3	Confident	67 Å²	67	66 Å²	66	35%	0.351	37%	0.369	S	S	.	.	H	α-helix	trans	-59.7	-36.8	176.3	-71.3	173.3	0	0	0	112.4	T483 I484 S489 F493	T483-L487 HydrophobicContact CG2-CD1 3.96Å; T483-L487 HydrophobicContact CG2-CG 4.5Å; T483-L487 WeakPolarHBondContact O-CB 3.25Å; T483-L487 VanDerWaalsContact O-CG 3.26Å; T483-L487 WeakPolarHBondContact O-CG 3.24Å; T483-L487 PolarHBondContact O-N 3.27Å; I484-L487 PolarHBondContact O-N 2.85Å; L487-S489 VanDerWaalsContact C-N 3.34Å; L487-F493 HydrophobicContact CD2-CD2 4.49Å; L487-F493 HydrophobicContact CD2-CE2 3.97Å; L487-F493 HydrophobicContact CD2-CZ 4.11Å
488	M	74.4	Confident	75.2	Confident	149 Å²	149	65.4 Å²	65.4	73%	0.734	37%	0.369	S	S	*	.	H	α-helix	trans	-75.9	-19	177.1	-71.5	-64.1	-54.5	0	0	113.9	I484 I486 A490	I484-M488 HydrophobicContact CG2-CG 4.1Å; I484-M488 VanDerWaalsContact O-CB 3.27Å; I484-M488 WeakPolarHBondContact O-CB 3.22Å; I484-M488 VanDerWaalsContact O-CG 3.22Å; I484-M488 WeakPolarHBondContact O-CG 3.35Å; I484-M488 PolarHBondContact O-N 3.31Å; I486-M488 VanDerWaalsContact C-N 3.25Å; I486-M488 PolarHBondContact O-N 2.86Å; M488-A490 VanDerWaalsContact C-N 3.29Å
489	S	74.9	Confident	74.1	Confident	65 Å²	65	66 Å²	66	46%	0.455	37%	0.371	S	S	.	.	H	α-helix	trans	-76.9	-16.2	179.4	-66.5	0	0	0	0	113	G485 I486 L487 P491	G485-S489 WeakPolarHBondContact O-CB 3.49Å; G485-S489 PolarHBondContact O-N 2.93Å; G485-S489 VanDerWaalsContact O-N 3.11Å; G485-S489 PolarHBondContact O-OG 3.27Å; I486-S489 WeakPolarHBondContact O-CB 3.45Å; I486-S489 PolarHBondContact O-N 2.82Å; L487-S489 VanDerWaalsContact C-N 3.34Å; S489-P491 VanDerWaalsContact O-CD 3.25Å; S489-P491 WeakPolarHBondContact O-CD 3.23Å
490	A	71.2	Confident	73	Confident	7 Å²	7	66.9 Å²	66.9	6%	0.058	38%	0.375	C	S	.	.			trans	-86.9	105.7	176.5	0	0	0	0	0	110.2	F159 M488 N492 F493	F159-A490 HydrophobicContact CD2-CB 4.14Å; M488-A490 VanDerWaalsContact C-N 3.29Å; A490-N492 PolarHBondContact O-N 3.23Å; A490-F493 HydrophobicContact CB-CB 4.02Å; A490-F493 WeakPolarHBondContact O-CB 3.31Å; A490-F493 PolarHBondContact O-N 2.87Å
491	P	65.8	Low	71.6	Confident	94 Å²	94	69.8 Å²	69.8	61%	0.61	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-27.2	-173.4	25.1	-34	0	0	0	113.2	S489	S489-P491 VanDerWaalsContact O-CD 3.25Å; S489-P491 WeakPolarHBondContact O-CD 3.23Å
492	N	65.8	Low	69.7	Low	49 Å²	49	71.2 Å²	71.2	26%	0.262	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	7.1	-176.2	-60.2	-35.6	0	0	0	113.5	A490 V494 E495 A496	A490-N492 PolarHBondContact O-N 3.23Å; N492-V494 PolarHBondContact O-N 3.5Å; N492-E495 PolarHBondContact O-N 3.48Å; N492-A496 VanDerWaalsContact O-CB 3.32Å; N492-A496 WeakPolarHBondContact O-CB 3.47Å; N492-A496 PolarHBondContact O-N 3.45Å
493	F	69	Low	69	Low	60 Å²	60	73.6 Å²	73.6	26%	0.263	42%	0.424	S	S	.	.	H	α-helix	trans	-57.3	-48.8	-175.7	176.7	-104.1	0	0	0	112.2	F159 L487 A490 E495 A496 V497	F159-F493 HydrophobicContact CD1-CD2 4.22Å; F159-F493 HydrophobicContact CD2-CD2 4.4Å; F159-F493 AromaticContact CE1-CD2 3.67Å; F159-F493 HydrophobicContact CE1-CD2 3.67Å; F159-F493 HydrophobicContact CE1-CE2 4.09Å; F159-F493 AromaticContact CE2-CD2 3.85Å; F159-F493 HydrophobicContact CE2-CD2 3.85Å; F159-F493 HydrophobicContact CE2-CE2 4.32Å; F159-F493 AromaticContact CZ-CD2 3.47Å; F159-F493 HydrophobicContact CZ-CD2 3.47Å; F159-F493 VanDerWaalsContact CZ-CD2 3.47Å; F159-F493 AromaticContact CZ-CE2 3.69Å; F159-F493 HydrophobicContact CZ-CE2 3.69Å; L487-F493 HydrophobicContact CD2-CD2 4.49Å; L487-F493 HydrophobicContact CD2-CE2 3.97Å; L487-F493 HydrophobicContact CD2-CZ 4.11Å; A490-F493 HydrophobicContact CB-CB 4.02Å; A490-F493 WeakPolarHBondContact O-CB 3.31Å; A490-F493 PolarHBondContact O-N 2.87Å; F493-E495 PolarHBondContact O-N 2.76Å; F493-A496 PolarHBondContact O-N 3.14Å; F493-V497 HydrophobicContact CD2-CG2 4.25Å; F493-V497 HydrophobicContact CE1-CG2 4.32Å; F493-V497 HydrophobicContact CE2-CG2 3.89Å; F493-V497 HydrophobicContact CZ-CG2 3.93Å; F493-V497 WeakPolarHBondContact O-CB 3.47Å; F493-V497 VanDerWaalsContact O-CG2 3.27Å; F493-V497 WeakPolarHBondContact O-CG2 3.39Å; F493-V497 PolarHBondContact O-N 3.17Å
494	V	65.7	Low	68.3	Low	114 Å²	114	75.4 Å²	75.4	69%	0.691	43%	0.434	S	S	*	.	H	α-helix	trans	-66	-40	-177.8	-178.5	0	0	0	0	111.3	N492 S498	N492-V494 PolarHBondContact O-N 3.5Å; V494-S498 WeakPolarHBondContact O-CB 3.38Å; V494-S498 PolarHBondContact O-N 2.96Å; V494-S498 PolarHBondContact O-OG 3.43Å
495	E	68.7	Low	67.6	Low	81 Å²	81	74.1 Å²	74.1	38%	0.379	43%	0.43	S	S	.	.	H	α-helix	trans	-69.3	-41.9	179.4	-162.6	-169.3	145.6	0	0	111.6	R227 N492 F493 S498 K499	R227-E495 IonicContact CZ-OE1 3.64Å; R227-E495 IonicContact NH1-OE1 3.03Å; R227-E495 PolarHBondContact NH1-OE1 3.08Å; R227-E495 IonicContact NH2-OE1 3.3Å; R227-E495 PolarHBondContact NH2-OE1 3.23Å; R227-E495 IonicContact NH2-OE2 2.94Å; N492-E495 PolarHBondContact O-N 3.48Å; F493-E495 PolarHBondContact O-N 2.76Å; E495-S498 WeakPolarHBondContact CA-OG 3.49Å; E495-S498 PolarHBondContact O-N 3.32Å; E495-S498 PolarHBondContact O-OG 3.03Å; E495-K499 PolarHBondContact O-N 3.45Å; E495-K499 VanDerWaalsContact O-N 3.15Å
496	A	62.9	Low	66.7	Low	8 Å²	8	76.3 Å²	76.3	7%	0.066	43%	0.433	C	S	.	.	H	α-helix	trans	-62.8	-49	177.6	0	0	0	0	0	111.6	F159 T230 N492 F493 S498 K499 D500	F159-A496 HydrophobicContact CD1-CB 3.87Å; F159-A496 HydrophobicContact CE1-CB 4.45Å; T230-A496 HydrophobicContact CG2-CB 4.21Å; N492-A496 VanDerWaalsContact O-CB 3.32Å; N492-A496 WeakPolarHBondContact O-CB 3.47Å; N492-A496 PolarHBondContact O-N 3.45Å; F493-A496 PolarHBondContact O-N 3.14Å; A496-S498 VanDerWaalsContact C-N 3.32Å; A496-S498 PolarHBondContact O-N 3.43Å; A496-K499 PolarHBondContact O-N 3.36Å; A496-D500 PolarHBondContact O-N 3.37Å
497	V	65.1	Low	66.1	Low	48 Å²	48	78.9 Å²	78.9	29%	0.291	45%	0.449	S	S	.	.	H	α-helix	trans	-62.3	-40.4	177	174.9	0	0	0	0	110.8	F493 K499 D500 F501	F493-V497 HydrophobicContact CD2-CG2 4.25Å; F493-V497 HydrophobicContact CE1-CG2 4.32Å; F493-V497 HydrophobicContact CE2-CG2 3.89Å; F493-V497 HydrophobicContact CZ-CG2 3.93Å; F493-V497 WeakPolarHBondContact O-CB 3.47Å; F493-V497 VanDerWaalsContact O-CG2 3.27Å; F493-V497 WeakPolarHBondContact O-CG2 3.39Å; F493-V497 PolarHBondContact O-N 3.17Å; V497-K499 VanDerWaalsContact C-N 3.29Å; V497-K499 PolarHBondContact O-N 3Å; V497-D500 PolarHBondContact O-N 3.5Å; V497-F501 HydrophobicContact CG1-CD2 3.72Å; V497-F501 HydrophobicContact CG1-CE2 4Å; V497-F501 VanDerWaalsContact O-CD2 3.29Å; V497-F501 WeakPolarHBondContact O-CD2 3.23Å; V497-F501 PolarHBondContact O-N 2.97Å
498	S	66.1	Low	65.6	Low	68 Å²	68	79.7 Å²	79.7	48%	0.476	46%	0.456	S	S	.	.	H	α-helix	trans	-64.2	-31.9	179.1	72.1	0	0	0	0	113.9	V494 E495 A496 A502	V494-S498 WeakPolarHBondContact O-CB 3.38Å; V494-S498 PolarHBondContact O-N 2.96Å; V494-S498 PolarHBondContact O-OG 3.43Å; E495-S498 WeakPolarHBondContact CA-OG 3.49Å; E495-S498 PolarHBondContact O-N 3.32Å; E495-S498 PolarHBondContact O-OG 3.03Å; A496-S498 VanDerWaalsContact C-N 3.32Å; A496-S498 PolarHBondContact O-N 3.43Å; S498-A502 WeakPolarHBondContact O-CB 3.43Å; S498-A502 PolarHBondContact O-N 3.45Å
499	K	66	Low	65	Low	116 Å²	116	74.7 Å²	74.7	50%	0.504	44%	0.436	S	S	.	.	H	α-helix	trans	-83.3	-33.1	178.6	-89.4	-176.1	174.8	176.5	0	113.3	E495 A496 V497 F501	E495-K499 PolarHBondContact O-N 3.45Å; E495-K499 VanDerWaalsContact O-N 3.15Å; A496-K499 PolarHBondContact O-N 3.36Å; V497-K499 VanDerWaalsContact C-N 3.29Å; V497-K499 PolarHBondContact O-N 3Å; K499-F501 VanDerWaalsContact C-N 3.31Å
500	D	62.4	Low	64.2	Low	41 Å²	41	75.5 Å²	75.5	22%	0.219	43%	0.434	C	S	.	.	H	α-helix	trans	-75.8	-21	-179.3	-74.7	-22.5	0	0	0	112.3	T230 A496 V497	T230-D500 PolarHBondContact N-OD2 2.89Å; T230-D500 PolarHBondContact OG1-OD2 3.11Å; A496-D500 PolarHBondContact O-N 3.37Å; V497-D500 PolarHBondContact O-N 3.5Å
501	F	58.4	Low	63.6	Low	157 Å²	157	81.2 Å²	81.2	69%	0.689	47%	0.466	S	S	*	.			trans	-113.2	2.6	-178.8	-68.9	-75.1	0	0	0	115.2	L231 V497 K499	L231-F501 HydrophobicContact CD1-CE1 4.43Å; L231-F501 HydrophobicContact CD1-CZ 4.12Å; V497-F501 HydrophobicContact CG1-CD2 3.72Å; V497-F501 HydrophobicContact CG1-CE2 4Å; V497-F501 VanDerWaalsContact O-CD2 3.29Å; V497-F501 WeakPolarHBondContact O-CD2 3.23Å; V497-F501 PolarHBondContact O-N 2.97Å; K499-F501 VanDerWaalsContact C-N 3.31Å
502	A	47.5	Very low	63.4	Low	138 Å²	138	80 Å²	80	100%	1.141	45%	0.453	S	S	*	.			trans	-100.3	0	171.1	0	0	0	0	0	110.1	S498	S498-A502 WeakPolarHBondContact O-CB 3.43Å; S498-A502 PolarHBondContact O-N 3.45Å

Retrieved 502 of 502 residues in 450.6 ms (Link to these results)

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