A0A087X9W6_POEFO Loading...

Protein associated with LIN7 2, MAGUK p55 family member a

AlphaFold DB , UniProt , Accession A0A087X9W6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 552 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	28.9	Very low	40.5	Very low	240 Å²	240	110.5 Å²	110.5	100%	1.182	68%	0.677	S	S	*	*				0	131.6	0	-86.3	177.9	-173.2	0	0	108.3
2	T	33.9	Very low	42.5	Very low	140 Å²	140	105 Å²	105	86%	0.859	64%	0.639	S	S	*	*			trans	-58.7	128.8	-175.2	41.3	0	0	0	0	113.9
3	V	29.3	Very low	44.2	Very low	143 Å²	143	103.6 Å²	103.6	87%	0.867	62%	0.621	S	S	*	*			trans	-132.6	96.3	157.3	-171.6	0	0	0	0	110
4	A	30.9	Very low	45.7	Very low	88 Å²	88	103.8 Å²	103.8	73%	0.727	61%	0.612	S	S	*	*			trans	35.4	87	145.4	0	0	0	0	0	118.7	A6	A4-A6 PolarHBondContact O-N 2.83Å
5	N	37.6	Very low	47.1	Very low	171 Å²	171	101.5 Å²	101.5	91%	0.914	60%	0.6	S	S	*	*			trans	-73.7	97.8	149.7	-163	14	0	0	0	108.4
6	A	34.5	Very low	48.3	Very low	74 Å²	74	95.6 Å²	95.6	61%	0.612	56%	0.564	S	S	*	*			trans	-158.5	137.9	171.3	0	0	0	0	0	111.8	A4	A4-A6 PolarHBondContact O-N 2.83Å
7	K	40.9	Very low	49.5	Very low	172 Å²	172	93.4 Å²	93.4	75%	0.748	55%	0.549	S	S	*	.			trans	108.5	66.4	150.3	-58.9	-174.6	-178	-178.3	0	118.9	S10	K7-S10 VanDerWaalsContact CB-CB 3.45Å
8	S	46.8	Very low	50.6	Low	60 Å²	60	94 Å²	94	42%	0.42	55%	0.55	S	S	.	.	S	Bend	trans	-111.2	-28.9	147.7	64.5	0	0	0	0	112.8	S10 A11 E53	S8-S10 PolarHBondContact O-N 3Å; S8-A11 WeakPolarHBondContact O-CB 3.42Å; S8-A11 PolarHBondContact O-N 2.96Å; S8-E53 PolarHBondContact OG-OE1 2.73Å
9	G	46.6	Very low	51.4	Low	50 Å²	50	91.1 Å²	91.1	52%	0.515	53%	0.532	S	S	.	.	H	α-helix	trans	-58.2	-16.7	161.1	0	0	0	0	0	113.6	Q13 E53	G9-Q13 WeakPolarHBondContact O-CB 3.06Å; G9-E53 WeakPolarHBondContact CA-OE1 3.25Å; G9-E53 PolarHBondContact N-OE1 3.15Å; G9-E53 VanDerWaalsContact N-OE1 3.12Å
10	S	55.8	Low	52	Low	29 Å²	29	92.6 Å²	92.6	20%	0.203	53%	0.531	C	S	.	.	H	α-helix	trans	-72.4	-32.8	169.7	-178.4	0	0	0	0	113.1	K7 S8 Q14	K7-S10 VanDerWaalsContact CB-CB 3.45Å; S8-S10 PolarHBondContact O-N 3Å; S10-Q14 WeakPolarHBondContact O-CA 3.29Å; S10-Q14 WeakPolarHBondContact O-CB 3.18Å; S10-Q14 VanDerWaalsContact O-CG 3.23Å; S10-Q14 WeakPolarHBondContact O-CG 3.24Å; S10-Q14 PolarHBondContact O-N 2.91Å; S10-Q14 PolarHBondContact O-OE1 2.89Å; S10-Q14 PolarHBondContact OG-OE1 2.86Å; S10-Q14 VanDerWaalsContact OG-OE1 3.06Å
11	A	60.7	Low	52.6	Low	49 Å²	49	94.5 Å²	94.5	41%	0.405	54%	0.54	S	S	.	.	H	α-helix	trans	-73.8	-45.4	-169.9	0	0	0	0	0	111.5	S8 Q13 Q14 V15	S8-A11 WeakPolarHBondContact O-CB 3.42Å; S8-A11 PolarHBondContact O-N 2.96Å; A11-Q13 VanDerWaalsContact C-N 3.34Å; A11-Q14 PolarHBondContact O-N 2.79Å; A11-V15 VanDerWaalsContact O-CG2 3.28Å; A11-V15 WeakPolarHBondContact O-CG2 3.48Å; A11-V15 PolarHBondContact O-N 3.11Å
12	M	63.8	Low	54.1	Low	44 Å²	44	87.4 Å²	87.4	22%	0.217	51%	0.505	C	S	.	.	H	α-helix	trans	-68.3	-37	175.8	-162.7	-162.2	-71.4	0	0	111.6	V15 L16 M40 V45 R46 A49	M12-V15 PolarHBondContact O-N 3.32Å; M12-L16 WeakPolarHBondContact O-CB 3.01Å; M12-L16 PolarHBondContact O-N 2.63Å; M12-M40 HydrophobicContact CE-CE 4.42Å; M12-M40 HydrophobicContact CG-CE 3.57Å; M12-M40 HydrophobicContact CG-SD 4.43Å; M12-M40 HydrophobicContact SD-CE 4.01Å; M12-V45 HydrophobicContact CE-CG1 4.43Å; M12-R46 HydrophobicContact SD-CG 4.38Å; M12-A49 HydrophobicContact CE-CB 3.09Å
13	Q	64.8	Low	55.2	Low	87 Å²	87	85 Å²	85	41%	0.407	49%	0.492	S	S	.	.	H	α-helix	trans	-68.4	-38.6	175.2	-168	58.5	46.6	0	0	111.3	G9 A11 L16 D17	G9-Q13 WeakPolarHBondContact O-CB 3.06Å; A11-Q13 VanDerWaalsContact C-N 3.34Å; Q13-L16 PolarHBondContact O-N 2.75Å; Q13-D17 PolarHBondContact NE2-OD1 2.83Å; Q13-D17 PolarHBondContact NE2-OD2 2.84Å; Q13-D17 WeakPolarHBondContact O-CB 3.38Å; Q13-D17 PolarHBondContact O-N 3.4Å; Q13-D17 VanDerWaalsContact O-OD2 3.13Å
14	Q	65.7	Low	56.4	Low	106 Å²	106	84.3 Å²	84.3	50%	0.495	49%	0.493	S	S	.	.	H	α-helix	trans	-63.6	-40.9	171.4	-89.3	173.7	-55.8	0	0	111.9	S10 A11 L16 D17 N18	S10-Q14 WeakPolarHBondContact O-CA 3.29Å; S10-Q14 WeakPolarHBondContact O-CB 3.18Å; S10-Q14 VanDerWaalsContact O-CG 3.23Å; S10-Q14 WeakPolarHBondContact O-CG 3.24Å; S10-Q14 PolarHBondContact O-N 2.91Å; S10-Q14 PolarHBondContact O-OE1 2.89Å; S10-Q14 PolarHBondContact OG-OE1 2.86Å; S10-Q14 VanDerWaalsContact OG-OE1 3.06Å; A11-Q14 PolarHBondContact O-N 2.79Å; Q14-L16 VanDerWaalsContact C-N 3.34Å; Q14-D17 PolarHBondContact O-N 2.8Å; Q14-N18 WeakPolarHBondContact O-CB 3.18Å; Q14-N18 PolarHBondContact O-N 3.33Å; Q14-N18 PolarHBondContact O-ND2 3.31Å
15	V	66.3	Low	57.6	Low	70 Å²	70	83.7 Å²	83.7	42%	0.424	50%	0.495	S	S	.	.	H	α-helix	trans	-64.7	-41.6	175.3	171.6	0	0	0	0	110.4	A11 M12 L19 M40	A11-V15 VanDerWaalsContact O-CG2 3.28Å; A11-V15 WeakPolarHBondContact O-CG2 3.48Å; A11-V15 PolarHBondContact O-N 3.11Å; M12-V15 PolarHBondContact O-N 3.32Å; V15-L19 HydrophobicContact CG1-CD1 3.96Å; V15-L19 VanDerWaalsContact O-CB 3.3Å; V15-L19 WeakPolarHBondContact O-CB 3.34Å; V15-L19 WeakPolarHBondContact O-CD1 3.44Å; V15-L19 WeakPolarHBondContact O-CG 3.35Å; V15-L19 PolarHBondContact O-N 3.42Å; V15-M40 HydrophobicContact CG1-SD 3.84Å
16	L	66.9	Low	58.5	Low	7 Å²	7	78 Å²	78	4%	0.037	47%	0.467	C	S	.	.	H	α-helix	trans	-65.3	-38.3	174.8	-82.3	167.2	0	0	0	113.3	M12 Q13 Q14 K20 K37 M40 E41	M12-L16 WeakPolarHBondContact O-CB 3.01Å; M12-L16 PolarHBondContact O-N 2.63Å; Q13-L16 PolarHBondContact O-N 2.75Å; Q14-L16 VanDerWaalsContact C-N 3.34Å; L16-K20 WeakPolarHBondContact O-CG 3.41Å; L16-K20 PolarHBondContact O-N 2.78Å; L16-K37 HydrophobicContact CD2-CG 4.47Å; L16-M40 HydrophobicContact CD2-CB 3.73Å; L16-M40 HydrophobicContact CG-CB 4.21Å; L16-E41 HydrophobicContact CD2-CG 4.05Å
17	D	68	Low	59.6	Low	58 Å²	58	78.9 Å²	78.9	31%	0.31	48%	0.483	S	S	.	.	H	α-helix	trans	-77	-38.1	179.5	-66.6	-28.9	0	0	0	110.8	Q13 Q14 L19 K20 D21	Q13-D17 PolarHBondContact NE2-OD1 2.83Å; Q13-D17 PolarHBondContact NE2-OD2 2.84Å; Q13-D17 WeakPolarHBondContact O-CB 3.38Å; Q13-D17 PolarHBondContact O-N 3.4Å; Q13-D17 VanDerWaalsContact O-OD2 3.13Å; Q14-D17 PolarHBondContact O-N 2.8Å; D17-L19 VanDerWaalsContact C-N 3.29Å; D17-L19 PolarHBondContact O-N 2.8Å; D17-K20 WeakPolarHBondContact O-CB 3.42Å; D17-K20 PolarHBondContact O-N 3.13Å; D17-K20 IonicContact OD1-NZ 3.66Å; D17-K20 PolarHBondContact OD1-NZ 3.25Å; D17-D21 PolarHBondContact O-N 2.78Å
18	N	68.7	Low	60.6	Low	104 Å²	104	73.1 Å²	73.1	56%	0.556	47%	0.467	S	S	*	.	H	α-helix	trans	-62	-36	169.5	-70.2	-19.8	0	0	0	111.8	Q14 K20 D21 M22	Q14-N18 WeakPolarHBondContact O-CB 3.18Å; Q14-N18 PolarHBondContact O-N 3.33Å; Q14-N18 PolarHBondContact O-ND2 3.31Å; N18-K20 VanDerWaalsContact C-N 3.26Å; N18-K20 PolarHBondContact O-N 2.92Å; N18-D21 PolarHBondContact O-N 2.76Å; N18-M22 VanDerWaalsContact O-CG 3.32Å; N18-M22 WeakPolarHBondContact O-CG 3.44Å; N18-M22 PolarHBondContact O-N 2.89Å
19	L	66.4	Low	61.6	Low	39 Å²	39	77.5 Å²	77.5	20%	0.204	48%	0.479	C	S	.	.	H	α-helix	trans	-66.9	-24.1	174.1	-82.7	162.4	0	0	0	113.1	V15 D17 L33 L36	V15-L19 HydrophobicContact CG1-CD1 3.96Å; V15-L19 VanDerWaalsContact O-CB 3.3Å; V15-L19 WeakPolarHBondContact O-CB 3.34Å; V15-L19 WeakPolarHBondContact O-CD1 3.44Å; V15-L19 WeakPolarHBondContact O-CG 3.35Å; V15-L19 PolarHBondContact O-N 3.42Å; D17-L19 VanDerWaalsContact C-N 3.29Å; D17-L19 PolarHBondContact O-N 2.8Å; L19-L33 HydrophobicContact CD2-CD2 3.69Å; L19-L36 HydrophobicContact CD1-CD2 4.31Å; L19-L36 HydrophobicContact CD2-CD2 4.08Å
20	K	64.3	Low	62.5	Low	120 Å²	120	80.8 Å²	80.8	52%	0.522	49%	0.485	S	S	.	.	H	α-helix	trans	-79.8	-30.6	174.4	-69.5	169.5	-169.4	157.5	0	112.4	L16 D17 N18	L16-K20 WeakPolarHBondContact O-CG 3.41Å; L16-K20 PolarHBondContact O-N 2.78Å; D17-K20 WeakPolarHBondContact O-CB 3.42Å; D17-K20 PolarHBondContact O-N 3.13Å; D17-K20 IonicContact OD1-NZ 3.66Å; D17-K20 PolarHBondContact OD1-NZ 3.25Å; N18-K20 VanDerWaalsContact C-N 3.26Å; N18-K20 PolarHBondContact O-N 2.92Å
21	D	63.1	Low	63.1	Low	133 Å²	133	85.5 Å²	85.5	71%	0.711	51%	0.506	S	S	*	.	S	Bend	trans	-92.8	5.2	-175.8	-69.9	-19.4	0	0	0	113.6	D17 N18 P23	D17-D21 PolarHBondContact O-N 2.78Å; N18-D21 PolarHBondContact O-N 2.76Å; D21-P23 WeakPolarHBondContact O-CD 3.15Å
22	M	60.4	Low	63.6	Low	91 Å²	91	87.5 Å²	87.5	45%	0.448	51%	0.51	S	S	.	.			trans	-68.2	121.9	177.3	-77.9	-81.8	-84.5	0	0	110.9	N18 T26	N18-M22 VanDerWaalsContact O-CG 3.32Å; N18-M22 WeakPolarHBondContact O-CG 3.44Å; N18-M22 PolarHBondContact O-N 2.89Å; M22-T26 HydrophobicContact CE-CG2 3.63Å; M22-T26 WeakPolarHBondContact CE-OG1 3.46Å; M22-T26 HydrophobicContact SD-CG2 4.19Å
23	P	57.8	Low	63.8	Low	90 Å²	90	87.2 Å²	87.2	58%	0.584	51%	0.509	S	S	*	.			trans	-66.5	143.5	174.7	25.6	-31	0	0	0	110.2	D21 G25 T26	D21-P23 WeakPolarHBondContact O-CD 3.15Å; P23-G25 PolarHBondContact O-N 2.8Å; P23-T26 PolarHBondContact O-N 3.18Å; P23-T26 PolarHBondContact O-OG1 3.35Å
24	S	55.4	Low	64.1	Low	129 Å²	129	88.8 Å²	88.8	90%	0.902	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	13.7	-178.7	17.3	0	0	0	0	115.4
25	G	56	Low	64.5	Low	74 Å²	74	90.5 Å²	90.5	76%	0.763	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.5	5.3	175.4	0	0	0	0	0	114.6	P23 G27	P23-G25 PolarHBondContact O-N 2.8Å; G25-G27 PolarHBondContact O-N 3Å
26	T	55.6	Low	64.8	Low	52 Å²	52	91.1 Å²	91.1	32%	0.319	53%	0.526	S	S	.	.	S	Bend	trans	-78.9	119.5	171.1	50.3	0	0	0	0	107.7	M22 P23 A28	M22-T26 HydrophobicContact CE-CG2 3.63Å; M22-T26 WeakPolarHBondContact CE-OG1 3.46Å; M22-T26 HydrophobicContact SD-CG2 4.19Å; P23-T26 PolarHBondContact O-N 3.18Å; P23-T26 PolarHBondContact O-OG1 3.35Å; T26-A28 PolarHBondContact O-N 2.82Å
27	G	58.9	Low	65	Low	93 Å²	93	94.7 Å²	94.7	96%	0.959	54%	0.541	S	S	*	.	S	Bend	trans	-62.4	22.2	-171.5	0	0	0	0	0	117.2	G25	G25-G27 PolarHBondContact O-N 3Å
28	A	61.2	Low	65.4	Low	50 Å²	50	94 Å²	94	41%	0.413	55%	0.548	S	S	.	.	S	Bend	trans	-80.5	138.8	166.7	0	0	0	0	0	109.8	T26 L33	T26-A28 PolarHBondContact O-N 2.82Å; A28-L33 HydrophobicContact CB-CD1 3.95Å; A28-L33 HydrophobicContact CB-CG 4.41Å
29	K	67.8	Low	65.8	Low	153 Å²	153	92.4 Å²	92.4	67%	0.665	54%	0.539	S	S	*	.			trans	-69.6	136.8	175.7	-62.8	175.3	-179	174.7	0	108.6	I31 D32 L33	K29-I31 PolarHBondContact O-N 2.84Å; K29-D32 WeakPolarHBondContact O-CB 3.34Å; K29-D32 PolarHBondContact O-N 3.02Å; K29-L33 PolarHBondContact O-N 2.8Å
30	D	64.2	Low	66	Low	119 Å²	119	92.2 Å²	92.2	64%	0.636	54%	0.537	S	S	*	.	H	α-helix	trans	-51	-31.5	179.7	-72.5	-32.7	0	0	0	113.2	D32 L33 I34	D30-D32 VanDerWaalsContact C-N 3.35Å; D30-D32 PolarHBondContact O-N 2.94Å; D30-L33 PolarHBondContact O-N 3.41Å; D30-I34 WeakPolarHBondContact O-CD1 3.4Å; D30-I34 WeakPolarHBondContact O-CG1 3.38Å; D30-I34 PolarHBondContact O-N 2.89Å
31	I	68.9	Low	66.5	Low	127 Å²	127	90.2 Å²	90.2	65%	0.651	53%	0.53	S	S	*	.	H	α-helix	trans	-63.3	-39.6	177.7	-58.5	169.3	0	0	0	111.6	K29 I34 F35	K29-I31 PolarHBondContact O-N 2.84Å; I31-I34 PolarHBondContact O-N 3.16Å; I31-F35 WeakPolarHBondContact O-CB 3Å; I31-F35 PolarHBondContact O-N 3.48Å
32	D	70.7	Confident	67.3	Low	91 Å²	91	85.3 Å²	85.3	49%	0.487	51%	0.506	S	S	.	.	H	α-helix	trans	-72.6	-35.5	-179	-61.1	-35.2	0	0	0	110.9	K29 D30 F35 L36	K29-D32 WeakPolarHBondContact O-CB 3.34Å; K29-D32 PolarHBondContact O-N 3.02Å; D30-D32 VanDerWaalsContact C-N 3.35Å; D30-D32 PolarHBondContact O-N 2.94Å; D32-F35 PolarHBondContact O-N 2.71Å; D32-L36 VanDerWaalsContact O-CB 3.31Å; D32-L36 WeakPolarHBondContact O-CB 3.38Å; D32-L36 PolarHBondContact O-N 3.23Å
33	L	69.5	Low	67.9	Low	38 Å²	38	85.8 Å²	85.8	20%	0.199	52%	0.516	C	S	.	.	H	α-helix	trans	-66.1	-43.2	173.2	-84.8	147.5	0	0	0	111.9	L19 A28 K29 D30 L36 K37	L19-L33 HydrophobicContact CD2-CD2 3.69Å; A28-L33 HydrophobicContact CB-CD1 3.95Å; A28-L33 HydrophobicContact CB-CG 4.41Å; K29-L33 PolarHBondContact O-N 2.8Å; D30-L33 PolarHBondContact O-N 3.41Å; L33-L36 PolarHBondContact O-N 3.46Å; L33-K37 WeakPolarHBondContact O-CB 3.49Å; L33-K37 PolarHBondContact O-N 3.41Å
34	I	69.9	Low	68.7	Low	121 Å²	121	87.3 Å²	87.3	62%	0.621	52%	0.518	S	S	*	.	H	α-helix	trans	-64.2	-42.6	175	-68.3	164.5	0	0	0	110.6	D30 I31 K37 G38	D30-I34 WeakPolarHBondContact O-CD1 3.4Å; D30-I34 WeakPolarHBondContact O-CG1 3.38Å; D30-I34 PolarHBondContact O-N 2.89Å; I31-I34 PolarHBondContact O-N 3.16Å; I34-K37 PolarHBondContact O-N 3.34Å; I34-G38 PolarHBondContact O-N 3.32Å
35	F	74.9	Confident	69.6	Low	141 Å²	141	83.3 Å²	83.3	62%	0.618	49%	0.488	S	S	*	.	H	α-helix	trans	-62.6	-47.3	177.2	178.2	-106.3	0	0	0	112	I31 D32 K37 G38 I39	I31-F35 WeakPolarHBondContact O-CB 3Å; I31-F35 PolarHBondContact O-N 3.48Å; D32-F35 PolarHBondContact O-N 2.71Å; F35-K37 VanDerWaalsContact C-N 3.32Å; F35-K37 PolarHBondContact O-N 3.2Å; F35-G38 PolarHBondContact O-N 3.39Å; F35-G38 VanDerWaalsContact O-N 3.13Å; F35-I39 HydrophobicContact CD1-CD1 3.81Å; F35-I39 HydrophobicContact CE1-CD1 3.25Å; F35-I39 HydrophobicContact CE1-CG1 4.31Å; F35-I39 HydrophobicContact CE2-CD1 4.19Å; F35-I39 HydrophobicContact CG-CD1 4.49Å; F35-I39 HydrophobicContact CZ-CD1 3.48Å; F35-I39 VanDerWaalsContact CZ-CD1 3.48Å; F35-I39 HydrophobicContact CZ-CG1 4.26Å; F35-I39 PolarHBondContact O-N 2.92Å
36	L	72.8	Confident	70.5	Confident	83 Å²	83	84.8 Å²	84.8	44%	0.435	47%	0.47	S	S	.	.	H	α-helix	trans	-62	-41.4	178	-170.7	67.8	0	0	0	111.5	L19 D32 L33 G38 I39 M40	L19-L36 HydrophobicContact CD1-CD2 4.31Å; L19-L36 HydrophobicContact CD2-CD2 4.08Å; D32-L36 VanDerWaalsContact O-CB 3.31Å; D32-L36 WeakPolarHBondContact O-CB 3.38Å; D32-L36 PolarHBondContact O-N 3.23Å; L33-L36 PolarHBondContact O-N 3.46Å; L36-G38 VanDerWaalsContact C-N 3.35Å; L36-I39 PolarHBondContact O-N 3.02Å; L36-M40 WeakPolarHBondContact O-CG 3.35Å; L36-M40 PolarHBondContact O-N 3.4Å
37	K	71.4	Confident	71.3	Confident	82 Å²	82	86 Å²	86	36%	0.357	48%	0.48	S	S	.	.	H	α-helix	trans	-61.4	-43.1	173.2	-171.4	176.3	178.7	-178.8	0	111.6	L16 L33 I34 F35 I39 M40 E41	L16-K37 HydrophobicContact CD2-CG 4.47Å; L33-K37 WeakPolarHBondContact O-CB 3.49Å; L33-K37 PolarHBondContact O-N 3.41Å; I34-K37 PolarHBondContact O-N 3.34Å; F35-K37 VanDerWaalsContact C-N 3.32Å; F35-K37 PolarHBondContact O-N 3.2Å; K37-I39 VanDerWaalsContact C-N 3.33Å; K37-I39 PolarHBondContact O-N 3.14Å; K37-M40 PolarHBondContact O-N 3.46Å; K37-E41 WeakPolarHBondContact CE-OE1 3.32Å; K37-E41 HydrophobicContact CG-CG 4.35Å; K37-E41 WeakPolarHBondContact O-CB 3.39Å; K37-E41 WeakPolarHBondContact O-CG 3.27Å; K37-E41 PolarHBondContact O-N 3.38Å
38	G	75.2	Confident	71.9	Confident	45 Å²	45	87.5 Å²	87.5	46%	0.464	47%	0.466	S	S	.	.	H	α-helix	trans	-61.2	-38.1	175.5	0	0	0	0	0	113.5	I34 F35 L36 S42	I34-G38 PolarHBondContact O-N 3.32Å; F35-G38 PolarHBondContact O-N 3.39Å; F35-G38 VanDerWaalsContact O-N 3.13Å; L36-G38 VanDerWaalsContact C-N 3.35Å; G38-S42 PolarHBondContact O-N 2.9Å
39	I	78.1	Confident	72.2	Confident	70 Å²	70	86.5 Å²	86.5	36%	0.359	46%	0.458	S	S	.	.	H	α-helix	trans	-66.7	-47.6	173.4	-69.3	173.1	0	0	0	110.7	F35 L36 K37 E41 S42 V45	F35-I39 HydrophobicContact CD1-CD1 3.81Å; F35-I39 HydrophobicContact CE1-CD1 3.25Å; F35-I39 HydrophobicContact CE1-CG1 4.31Å; F35-I39 HydrophobicContact CE2-CD1 4.19Å; F35-I39 HydrophobicContact CG-CD1 4.49Å; F35-I39 HydrophobicContact CZ-CD1 3.48Å; F35-I39 VanDerWaalsContact CZ-CD1 3.48Å; F35-I39 HydrophobicContact CZ-CG1 4.26Å; F35-I39 PolarHBondContact O-N 2.92Å; L36-I39 PolarHBondContact O-N 3.02Å; K37-I39 VanDerWaalsContact C-N 3.33Å; K37-I39 PolarHBondContact O-N 3.14Å; I39-E41 VanDerWaalsContact C-N 3.33Å; I39-E41 PolarHBondContact O-N 2.87Å; I39-S42 WeakPolarHBondContact O-CB 3.35Å; I39-S42 PolarHBondContact O-N 3.14Å; I39-S42 VanDerWaalsContact O-N 3.17Å; I39-V45 HydrophobicContact CG2-CG2 4.06Å; I39-V45 WeakPolarHBondContact O-CB 3.33Å; I39-V45 VanDerWaalsContact O-CG2 3.28Å; I39-V45 WeakPolarHBondContact O-CG2 3.16Å
40	M	70.9	Confident	72.2	Confident	35 Å²	35	85.9 Å²	85.9	17%	0.172	46%	0.455	C	S	.	.	H	α-helix	trans	-66.5	-33.2	-177.9	-67.3	-109.5	69.3	0	0	112.7	M12 V15 L16 L36 K37 S42 V45	M12-M40 HydrophobicContact CE-CE 4.42Å; M12-M40 HydrophobicContact CG-CE 3.57Å; M12-M40 HydrophobicContact CG-SD 4.43Å; M12-M40 HydrophobicContact SD-CE 4.01Å; V15-M40 HydrophobicContact CG1-SD 3.84Å; L16-M40 HydrophobicContact CD2-CB 3.73Å; L16-M40 HydrophobicContact CG-CB 4.21Å; L36-M40 WeakPolarHBondContact O-CG 3.35Å; L36-M40 PolarHBondContact O-N 3.4Å; K37-M40 PolarHBondContact O-N 3.46Å; M40-S42 VanDerWaalsContact C-N 3.31Å; M40-V45 HydrophobicContact CE-CG1 4.45Å
41	E	74.3	Confident	72.3	Confident	78 Å²	78	82.4 Å²	82.4	36%	0.364	44%	0.443	S	S	.	.	H	α-helix	trans	-81.7	-10.6	176.6	-68.3	-180	171.5	0	0	113.2	L16 K37 I39 R46	L16-E41 HydrophobicContact CD2-CG 4.05Å; K37-E41 WeakPolarHBondContact CE-OE1 3.32Å; K37-E41 HydrophobicContact CG-CG 4.35Å; K37-E41 WeakPolarHBondContact O-CB 3.39Å; K37-E41 WeakPolarHBondContact O-CG 3.27Å; K37-E41 PolarHBondContact O-N 3.38Å; I39-E41 VanDerWaalsContact C-N 3.33Å; I39-E41 PolarHBondContact O-N 2.87Å; E41-R46 PolarHBondContact O-NH1 3.46Å
42	S	79.7	Confident	72.1	Confident	30 Å²	30	81.8 Å²	81.8	21%	0.21	44%	0.437	C	S	.	.			trans	-56	131.2	-179.2	179.4	0	0	0	0	111.9	G38 I39 M40 I44 V45 R46	G38-S42 PolarHBondContact O-N 2.9Å; I39-S42 WeakPolarHBondContact O-CB 3.35Å; I39-S42 PolarHBondContact O-N 3.14Å; I39-S42 VanDerWaalsContact O-N 3.17Å; M40-S42 VanDerWaalsContact C-N 3.31Å; S42-I44 PolarHBondContact O-N 3.39Å; S42-I44 VanDerWaalsContact O-N 3.11Å; S42-I44 PolarHBondContact OG-N 2.67Å; S42-V45 PolarHBondContact O-N 2.91Å; S42-V45 VanDerWaalsContact O-N 3.14Å; S42-R46 PolarHBondContact O-N 3.32Å
43	P	73.1	Confident	71.7	Confident	101 Å²	101	80.4 Å²	80.4	66%	0.656	43%	0.427	S	S	*	.	H	α-helix	trans	-56.8	-29.1	176.4	-22.8	31.9	0	0	0	113	S47	P43-S47 WeakPolarHBondContact O-CB 3.46Å; P43-S47 PolarHBondContact O-N 3.43Å; P43-S47 PolarHBondContact O-OG 2.91Å
44	I	73.8	Confident	71.3	Confident	122 Å²	122	88 Å²	88	63%	0.626	45%	0.453	S	S	*	.	H	α-helix	trans	-70.2	-50.4	178.8	-62.1	172.7	0	0	0	109.8	S42 S47 L48	S42-I44 PolarHBondContact O-N 3.39Å; S42-I44 VanDerWaalsContact O-N 3.11Å; S42-I44 PolarHBondContact OG-N 2.67Å; I44-S47 PolarHBondContact O-N 2.81Å; I44-L48 WeakPolarHBondContact O-CB 3.36Å; I44-L48 PolarHBondContact O-N 2.84Å
45	V	75.6	Confident	70.7	Confident	44 Å²	44	88.5 Å²	88.5	27%	0.267	46%	0.457	S	S	.	.	H	α-helix	trans	-65.2	-41.9	-178.9	176.4	0	0	0	0	111	M12 I39 M40 S42 S47 L48 A49	M12-V45 HydrophobicContact CE-CG1 4.43Å; I39-V45 HydrophobicContact CG2-CG2 4.06Å; I39-V45 WeakPolarHBondContact O-CB 3.33Å; I39-V45 VanDerWaalsContact O-CG2 3.28Å; I39-V45 WeakPolarHBondContact O-CG2 3.16Å; M40-V45 HydrophobicContact CE-CG1 4.45Å; S42-V45 PolarHBondContact O-N 2.91Å; S42-V45 VanDerWaalsContact O-N 3.14Å; V45-S47 VanDerWaalsContact C-N 3.31Å; V45-S47 PolarHBondContact O-N 3.38Å; V45-L48 PolarHBondContact O-N 2.86Å; V45-A49 PolarHBondContact O-N 3.15Å
46	R	73.8	Confident	69.8	Low	106 Å²	106	87.2 Å²	87.2	40%	0.4	45%	0.453	S	S	.	.	H	α-helix	trans	-62.3	-38.8	173.4	-74.3	-176.9	175.1	144.6	-9.6	112.7	M12 E41 S42 K50	M12-R46 HydrophobicContact SD-CG 4.38Å; E41-R46 PolarHBondContact O-NH1 3.46Å; S42-R46 PolarHBondContact O-N 3.32Å; R46-K50 WeakPolarHBondContact O-CB 3.19Å; R46-K50 WeakPolarHBondContact O-CG 3.17Å; R46-K50 PolarHBondContact O-N 3.34Å
47	S	71.8	Confident	68.9	Low	76 Å²	76	90.9 Å²	90.9	53%	0.531	47%	0.468	S	S	.	.	H	α-helix	trans	-70.8	-34.9	177.2	-64.4	0	0	0	0	111.7	P43 I44 V45 A51	P43-S47 WeakPolarHBondContact O-CB 3.46Å; P43-S47 PolarHBondContact O-N 3.43Å; P43-S47 PolarHBondContact O-OG 2.91Å; I44-S47 PolarHBondContact O-N 2.81Å; V45-S47 VanDerWaalsContact C-N 3.31Å; V45-S47 PolarHBondContact O-N 3.38Å; S47-A51 WeakPolarHBondContact O-CB 3.41Å; S47-A51 PolarHBondContact O-N 3.31Å
48	L	72.7	Confident	68.1	Low	126 Å²	126	91.8 Å²	91.8	66%	0.66	48%	0.48	S	S	*	.	H	α-helix	trans	-68.4	-43.2	176.1	-139.5	112.4	0	0	0	111.5	I44 V45 A51 H52	I44-L48 WeakPolarHBondContact O-CB 3.36Å; I44-L48 PolarHBondContact O-N 2.84Å; V45-L48 PolarHBondContact O-N 2.86Å; L48-A51 WeakPolarHBondContact O-CB 3.48Å; L48-A51 PolarHBondContact O-N 2.93Å; L48-H52 PolarHBondContact O-N 3.43Å
49	A	68	Low	67.2	Low	28 Å²	28	97.9 Å²	97.9	23%	0.231	49%	0.493	C	S	.	.	H	α-helix	trans	-64.7	-43.8	174.8	0	0	0	0	0	112.1	M12 V45 A51 H52 E53	M12-A49 HydrophobicContact CE-CB 3.09Å; V45-A49 PolarHBondContact O-N 3.15Å; A49-A51 PolarHBondContact O-N 3.45Å; A49-H52 WeakPolarHBondContact O-CB 2.93Å; A49-H52 PolarHBondContact O-N 3.4Å; A49-H52 VanDerWaalsContact O-N 3.14Å; A49-E53 WeakPolarHBondContact O-CG 3.33Å; A49-E53 PolarHBondContact O-N 3.29Å
50	K	66.6	Low	66.3	Low	140 Å²	140	102.1 Å²	102.1	61%	0.609	52%	0.516	S	S	*	.	H	α-helix	trans	-61.7	-31.6	172.1	-77	-179.1	178	-178.1	0	113	R46 R54	R46-K50 WeakPolarHBondContact O-CB 3.19Å; R46-K50 WeakPolarHBondContact O-CG 3.17Å; R46-K50 PolarHBondContact O-N 3.34Å; K50-R54 WeakPolarHBondContact O-CB 3.17Å; K50-R54 WeakPolarHBondContact O-CG 3.41Å; K50-R54 PolarHBondContact O-N 2.9Å; K50-R54 VanDerWaalsContact O-N 3.16Å
51	A	66	Low	66.2	Low	46 Å²	46	108.1 Å²	108.1	38%	0.38	54%	0.544	S	S	.	.	H	α-helix	trans	-73.1	-37.9	175	0	0	0	0	0	111.6	S47 L48 A49 R54 L55	S47-A51 WeakPolarHBondContact O-CB 3.41Å; S47-A51 PolarHBondContact O-N 3.31Å; L48-A51 WeakPolarHBondContact O-CB 3.48Å; L48-A51 PolarHBondContact O-N 2.93Å; A49-A51 PolarHBondContact O-N 3.45Å; A51-R54 PolarHBondContact O-N 3.16Å; A51-L55 WeakPolarHBondContact O-CD1 3.44Å; A51-L55 VanDerWaalsContact O-CG 3.25Å; A51-L55 WeakPolarHBondContact O-CG 3.45Å; A51-L55 PolarHBondContact O-N 3.28Å; A51-L55 VanDerWaalsContact O-N 3.08Å
52	H	66.2	Low	66	Low	114 Å²	114	107 Å²	107	53%	0.528	55%	0.548	S	S	.	.	H	α-helix	trans	-63.8	-47	173.6	-169.5	61.3	0	0	0	111.4	L48 A49 R54 L55 E56	L48-H52 PolarHBondContact O-N 3.43Å; A49-H52 WeakPolarHBondContact O-CB 2.93Å; A49-H52 PolarHBondContact O-N 3.4Å; A49-H52 VanDerWaalsContact O-N 3.14Å; H52-R54 VanDerWaalsContact C-N 3.31Å; H52-R54 PolarHBondContact O-N 3.08Å; H52-L55 WeakPolarHBondContact O-CA 3.39Å; H52-L55 WeakPolarHBondContact O-CB 3.37Å; H52-L55 PolarHBondContact O-N 3.31Å; H52-E56 IonicContact NE2-OE1 2.96Å; H52-E56 PolarHBondContact O-N 3.19Å
53	E	62.4	Low	65.8	Low	62 Å²	62	113 Å²	113	29%	0.29	58%	0.583	S	S	.	*	H	α-helix	trans	-57.4	-42.6	174.4	-72.9	175.6	168.2	0	0	112	S8 G9 A49 L55 E56 E57	S8-E53 PolarHBondContact OG-OE1 2.73Å; G9-E53 WeakPolarHBondContact CA-OE1 3.25Å; G9-E53 PolarHBondContact N-OE1 3.15Å; G9-E53 VanDerWaalsContact N-OE1 3.12Å; A49-E53 WeakPolarHBondContact O-CG 3.33Å; A49-E53 PolarHBondContact O-N 3.29Å; E53-L55 VanDerWaalsContact C-N 3.25Å; E53-L55 PolarHBondContact O-N 2.98Å; E53-E56 PolarHBondContact O-N 2.66Å; E53-E57 PolarHBondContact O-N 3.47Å
54	R	59.5	Low	66	Low	197 Å²	197	109.3 Å²	109.3	74%	0.743	56%	0.563	S	S	*	*	H	α-helix	trans	-69	-20.6	175.8	-81.5	-179.1	166.9	177.3	-1.2	114.4	K50 A51 H52	K50-R54 WeakPolarHBondContact O-CB 3.17Å; K50-R54 WeakPolarHBondContact O-CG 3.41Å; K50-R54 PolarHBondContact O-N 2.9Å; K50-R54 VanDerWaalsContact O-N 3.16Å; A51-R54 PolarHBondContact O-N 3.16Å; H52-R54 VanDerWaalsContact C-N 3.31Å; H52-R54 PolarHBondContact O-N 3.08Å
55	L	57.8	Low	66.4	Low	133 Å²	133	108.5 Å²	108.5	70%	0.696	56%	0.56	S	S	*	*	H	α-helix	trans	-86.8	-28.7	175.4	-73.9	165.7	0	0	0	111.1	A51 H52 E53 E57	A51-L55 WeakPolarHBondContact O-CD1 3.44Å; A51-L55 VanDerWaalsContact O-CG 3.25Å; A51-L55 WeakPolarHBondContact O-CG 3.45Å; A51-L55 PolarHBondContact O-N 3.28Å; A51-L55 VanDerWaalsContact O-N 3.08Å; H52-L55 WeakPolarHBondContact O-CA 3.39Å; H52-L55 WeakPolarHBondContact O-CB 3.37Å; H52-L55 PolarHBondContact O-N 3.31Å; E53-L55 VanDerWaalsContact C-N 3.25Å; E53-L55 PolarHBondContact O-N 2.98Å; L55-E57 VanDerWaalsContact C-N 3.34Å
56	E	56.3	Low	66.8	Low	113 Å²	113	110.7 Å²	110.7	53%	0.528	57%	0.57	S	S	.	*	H	α-helix	trans	-71.3	-24.6	172.7	-74.2	-170.9	141.7	0	0	113.5	H52 E53 V58	H52-E56 IonicContact NE2-OE1 2.96Å; H52-E56 PolarHBondContact O-N 3.19Å; E53-E56 PolarHBondContact O-N 2.66Å; E56-V58 PolarHBondContact O-N 2.68Å
57	E	53.2	Low	67.4	Low	160 Å²	160	107.8 Å²	107.8	75%	0.748	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	-12.8	-179.5	-82.7	-174.5	163.4	0	0	114.8	E53 L55	E53-E57 PolarHBondContact O-N 3.47Å; L55-E57 VanDerWaalsContact C-N 3.34Å
58	V	54.9	Low	68.2	Low	101 Å²	101	106.6 Å²	106.6	61%	0.612	55%	0.552	S	S	*	*			trans	-104	70.3	175.6	-165	0	0	0	0	109.6	E56 L60	E56-V58 PolarHBondContact O-N 2.68Å; V58-L60 HydrophobicContact CG1-CD2 3.97Å; V58-L60 HydrophobicContact CG1-CG 4.11Å; V58-L60 PolarHBondContact O-N 2.95Å
59	K	56.4	Low	68.8	Low	173 Å²	173	105.4 Å²	105.4	75%	0.752	54%	0.543	S	S	*	.			trans	-68	101.1	158.9	-80	-176.2	177.7	178.7	0	107.6	E61	K59-E61 PolarHBondContact O-N 3.08Å
60	L	59.8	Low	69.7	Low	160 Å²	160	108.2 Å²	108.2	84%	0.838	55%	0.554	S	S	*	*			trans	-70.9	107	165.4	-66.1	170.9	0	0	0	106.6	V58	V58-L60 HydrophobicContact CG1-CD2 3.97Å; V58-L60 HydrophobicContact CG1-CG 4.11Å; V58-L60 PolarHBondContact O-N 2.95Å
61	E	67.4	Low	70.7	Confident	161 Å²	161	102.8 Å²	102.8	75%	0.752	53%	0.531	S	S	*	.			trans	-94.2	140	170.9	-66.7	-179.1	174.1	0	0	108.2	K59	K59-E61 PolarHBondContact O-N 3.08Å
62	A	70.9	Confident	71.6	Confident	55 Å²	55	104.1 Å²	104.1	46%	0.455	54%	0.535	S	S	.	.			trans	-64.8	139.2	175.4	0	0	0	0	0	109.1	G64 A111	A62-G64 PolarHBondContact O-N 2.89Å; A62-A111 HydrophobicContact CB-CB 3.47Å; A62-A111 VanDerWaalsContact CB-CB 3.47Å
63	V	76.1	Confident	72.5	Confident	154 Å²	154	103.4 Å²	103.4	93%	0.933	53%	0.532	S	S	*	.	S	Bend	trans	-69.2	-24.3	178.1	-178.9	0	0	0	0	110.9
64	G	77.8	Confident	73.6	Confident	24 Å²	24	103.4 Å²	103.4	25%	0.247	53%	0.534	C	S	.	.			trans	-173.7	164.2	171.5	0	0	0	0	0	109.8	A62 N67 H107	A62-G64 PolarHBondContact O-N 2.89Å; G64-N67 PolarHBondContact O-ND2 3.25Å; G64-H107 PolarHBondContact O-CE1 3.05Å; G64-H107 VanDerWaalsContact O-CE1 3.26Å
65	D	80.2	Confident	74.8	Confident	106 Å²	106	94.9 Å²	94.9	57%	0.567	50%	0.504	S	S	*	.	S	Bend	trans	-126.1	5.4	-176	55.6	-12.4	0	0	0	113.8	D108 A111	D65-D108 WeakPolarHBondContact O-CB 3.45Å; D65-D108 VanDerWaalsContact O-CG 3.26Å; D65-A111 HydrophobicContact CB-CB 3.89Å
66	D	85	Confident	76.1	Confident	89 Å²	89	93 Å²	93	48%	0.476	50%	0.495	S	S	.	.			trans	-129	39.8	-174.8	-154.1	9.9	0	0	0	112.3	Q69 L70	D66-Q69 WeakPolarHBondContact OD1-CB 3.26Å; D66-Q69 PolarHBondContact OD2-OE1 3.47Å; D66-L70 PolarHBondContact O-N 2.88Å
67	N	87.3	Confident	77.3	Confident	45 Å²	45	91.2 Å²	91.2	24%	0.241	49%	0.494	C	S	.	.	H	α-helix	trans	-76.5	-25.2	-177.3	-58.5	-71.1	0	0	0	112.1	G64 L70 L71 I104 H107 D108	G64-N67 PolarHBondContact O-ND2 3.25Å; N67-L70 PolarHBondContact O-N 3.06Å; N67-L71 WeakPolarHBondContact O-CB 3.37Å; N67-L71 WeakPolarHBondContact O-CG 3.13Å; N67-L71 PolarHBondContact O-N 3.17Å; N67-I104 HydrophobicContact CB-CG2 3.64Å; N67-H107 PolarHBondContact ND2-CE1 3.05Å; N67-H107 PolarHBondContact ND2-ND1 3.2Å; N67-H107 VanDerWaalsContact ND2-ND1 3.18Å; N67-D108 WeakPolarHBondContact CA-OD2 3.22Å; N67-D108 WeakPolarHBondContact CB-OD1 3.37Å; N67-D108 PolarHBondContact N-OD1 3.5Å; N67-D108 PolarHBondContact N-OD2 3.27Å; N67-D108 PolarHBondContact ND2-OD1 3.17Å
68	V	87.2	Confident	78.7	Confident	52 Å²	52	84.4 Å²	84.4	32%	0.315	46%	0.463	S	S	.	.	H	α-helix	trans	-63.4	-43.3	171.7	174.4	0	0	0	0	110.8	L71 T72 I104 E105 D108	V68-L71 PolarHBondContact O-N 3.07Å; V68-T72 PolarHBondContact O-N 2.9Å; V68-T72 VanDerWaalsContact O-N 3.14Å; V68-T72 PolarHBondContact O-OG1 2.99Å; V68-I104 HydrophobicContact CG2-CG2 3.93Å; V68-E105 HydrophobicContact CG2-CB 4.39Å; V68-E105 HydrophobicContact CG2-CG 3.86Å; V68-D108 WeakPolarHBondContact CG2-OD2 3.26Å; V68-D108 PolarHBondContact N-OD2 3.3Å
69	Q	85.9	Confident	79.7	Confident	100 Å²	100	83.3 Å²	83.3	47%	0.467	45%	0.454	S	S	.	.	H	α-helix	trans	-66.4	-44.3	176.5	-174.1	168	-25.2	0	0	110.9	D66 L71 T72 E73	D66-Q69 WeakPolarHBondContact OD1-CB 3.26Å; D66-Q69 PolarHBondContact OD2-OE1 3.47Å; Q69-L71 VanDerWaalsContact C-N 3.29Å; Q69-L71 PolarHBondContact O-N 2.92Å; Q69-T72 WeakPolarHBondContact O-CA 3.37Å; Q69-T72 WeakPolarHBondContact O-CB 3.05Å; Q69-T72 PolarHBondContact O-N 3.29Å; Q69-E73 PolarHBondContact O-N 2.82Å
70	L	86.6	Confident	80.6	Confident	87 Å²	87	81.6 Å²	81.6	46%	0.455	45%	0.453	S	S	.	.	H	α-helix	trans	-56.8	-41.6	175.2	-176.1	67.2	0	0	0	112.5	D66 N67 T72 E73 I74	D66-L70 PolarHBondContact O-N 2.88Å; N67-L70 PolarHBondContact O-N 3.06Å; L70-T72 VanDerWaalsContact C-N 3.28Å; L70-T72 PolarHBondContact O-N 2.78Å; L70-E73 PolarHBondContact O-N 3.46Å; L70-I74 HydrophobicContact CD1-CD1 4.31Å; L70-I74 HydrophobicContact CD2-CD1 4.47Å; L70-I74 HydrophobicContact CG-CD1 3.9Å; L70-I74 WeakPolarHBondContact O-CB 3.25Å; L70-I74 VanDerWaalsContact O-CG1 3.25Å; L70-I74 WeakPolarHBondContact O-CG1 3.46Å; L70-I74 PolarHBondContact O-N 3.48Å
71	L	86.9	Confident	81.2	Confident	26 Å²	26	78 Å²	78	14%	0.136	43%	0.434	C	S	.	.	H	α-helix	trans	-65.4	-33	176.3	-80.3	176.8	0	0	0	113.2	N67 V68 Q69 S75 L95 F100 I104	N67-L71 WeakPolarHBondContact O-CB 3.37Å; N67-L71 WeakPolarHBondContact O-CG 3.13Å; N67-L71 PolarHBondContact O-N 3.17Å; V68-L71 PolarHBondContact O-N 3.07Å; Q69-L71 VanDerWaalsContact C-N 3.29Å; Q69-L71 PolarHBondContact O-N 2.92Å; L71-S75 VanDerWaalsContact O-CB 3.28Å; L71-S75 WeakPolarHBondContact O-CB 3.3Å; L71-S75 PolarHBondContact O-N 3.35Å; L71-S75 PolarHBondContact O-OG 2.74Å; L71-L95 HydrophobicContact CD2-CD1 4.03Å; L71-L95 HydrophobicContact CD2-CD2 3.61Å; L71-L95 HydrophobicContact CD2-CG 4.23Å; L71-F100 HydrophobicContact CD1-CD1 4.37Å; L71-F100 HydrophobicContact CD1-CE1 3.88Å; L71-F100 HydrophobicContact CD2-CE1 4.03Å; L71-I104 HydrophobicContact CD1-CB 3.8Å; L71-I104 HydrophobicContact CD1-CD1 4.26Å; L71-I104 HydrophobicContact CD1-CG1 3.62Å; L71-I104 HydrophobicContact CD1-CG2 3.64Å
72	T	84.9	Confident	81	Confident	75 Å²	75	73.9 Å²	73.9	46%	0.46	42%	0.415	S	S	.	.	H	α-helix	trans	-67.5	-46.4	175.7	-51.5	0	0	0	0	109.8	V68 Q69 L70 I74 S75 D76	V68-T72 PolarHBondContact O-N 2.9Å; V68-T72 VanDerWaalsContact O-N 3.14Å; V68-T72 PolarHBondContact O-OG1 2.99Å; Q69-T72 WeakPolarHBondContact O-CA 3.37Å; Q69-T72 WeakPolarHBondContact O-CB 3.05Å; Q69-T72 PolarHBondContact O-N 3.29Å; L70-T72 VanDerWaalsContact C-N 3.28Å; L70-T72 PolarHBondContact O-N 2.78Å; T72-I74 PolarHBondContact O-N 2.9Å; T72-S75 PolarHBondContact O-N 3.06Å; T72-D76 PolarHBondContact O-N 3.08Å
73	E	86.3	Confident	80.8	Confident	98 Å²	98	80.6 Å²	80.6	46%	0.458	44%	0.437	S	S	.	.	H	α-helix	trans	-62.6	-40.3	176.8	-67.3	176.3	-169	0	0	112.9	Q69 L70 S77	Q69-E73 PolarHBondContact O-N 2.82Å; L70-E73 PolarHBondContact O-N 3.46Å; E73-S77 WeakPolarHBondContact O-CB 3.26Å; E73-S77 PolarHBondContact O-N 2.76Å; E73-S77 PolarHBondContact O-OG 2.92Å
74	I	85.9	Confident	80.6	Confident	63 Å²	63	81.2 Å²	81.2	32%	0.323	43%	0.43	S	S	.	.	H	α-helix	trans	-66.1	-42.9	174.9	-69	168.2	0	0	0	110.3	L70 T72 S77 L78 L95	L70-I74 HydrophobicContact CD1-CD1 4.31Å; L70-I74 HydrophobicContact CD2-CD1 4.47Å; L70-I74 HydrophobicContact CG-CD1 3.9Å; L70-I74 WeakPolarHBondContact O-CB 3.25Å; L70-I74 VanDerWaalsContact O-CG1 3.25Å; L70-I74 WeakPolarHBondContact O-CG1 3.46Å; L70-I74 PolarHBondContact O-N 3.48Å; T72-I74 PolarHBondContact O-N 2.9Å; I74-S77 PolarHBondContact O-N 3.21Å; I74-L78 HydrophobicContact CG2-CD1 3.67Å; I74-L78 HydrophobicContact CG2-CG 4.19Å; I74-L78 WeakPolarHBondContact O-CB 3.37Å; I74-L78 VanDerWaalsContact O-CG 3.23Å; I74-L78 WeakPolarHBondContact O-CG 3.46Å; I74-L78 PolarHBondContact O-N 2.84Å; I74-L95 HydrophobicContact CG2-CD1 3.66Å
75	S	84.9	Confident	80.8	Confident	18 Å²	18	83.9 Å²	83.9	13%	0.126	44%	0.438	C	S	.	.	H	α-helix	trans	-62.9	-42.7	178	-60.1	0	0	0	0	111.5	L71 T72 S77 L78 N79	L71-S75 VanDerWaalsContact O-CB 3.28Å; L71-S75 WeakPolarHBondContact O-CB 3.3Å; L71-S75 PolarHBondContact O-N 3.35Å; L71-S75 PolarHBondContact O-OG 2.74Å; T72-S75 PolarHBondContact O-N 3.06Å; S75-S77 VanDerWaalsContact C-N 3.3Å; S75-S77 PolarHBondContact O-N 2.65Å; S75-L78 PolarHBondContact O-N 3.15Å; S75-N79 VanDerWaalsContact O-CG 3.22Å; S75-N79 PolarHBondContact O-N 3.32Å; S75-N79 PolarHBondContact O-ND2 2.79Å; S75-N79 PolarHBondContact O-OD1 2.85Å
76	D	83.7	Confident	80.9	Confident	94 Å²	94	84 Å²	84	50%	0.503	45%	0.445	S	S	.	.	H	α-helix	trans	-64.2	-36.1	176.4	-72	-19.7	0	0	0	112.1	T72 N80	T72-D76 PolarHBondContact O-N 3.08Å; D76-N80 PolarHBondContact O-ND2 2.98Å
77	S	83.1	Confident	80.8	Confident	74 Å²	74	82.5 Å²	82.5	52%	0.517	45%	0.445	S	S	.	.	H	α-helix	trans	-70.3	-36.3	175	-59.7	0	0	0	0	112.3	E73 I74 S75	E73-S77 WeakPolarHBondContact O-CB 3.26Å; E73-S77 PolarHBondContact O-N 2.76Å; E73-S77 PolarHBondContact O-OG 2.92Å; I74-S77 PolarHBondContact O-N 3.21Å; S75-S77 VanDerWaalsContact C-N 3.3Å; S75-S77 PolarHBondContact O-N 2.65Å
78	L	80.9	Confident	80.6	Confident	18 Å²	18	80.9 Å²	80.9	9%	0.094	44%	0.437	C	S	.	.	H	α-helix	trans	-74.4	-32.4	179.5	-73.3	170.8	0	0	0	112.9	I74 S75 N80 L81 E82 A88 L91 A92 L95	I74-L78 HydrophobicContact CG2-CD1 3.67Å; I74-L78 HydrophobicContact CG2-CG 4.19Å; I74-L78 WeakPolarHBondContact O-CB 3.37Å; I74-L78 VanDerWaalsContact O-CG 3.23Å; I74-L78 WeakPolarHBondContact O-CG 3.46Å; I74-L78 PolarHBondContact O-N 2.84Å; S75-L78 PolarHBondContact O-N 3.15Å; L78-N80 PolarHBondContact O-N 2.99Å; L78-L81 WeakPolarHBondContact O-CA 3.36Å; L78-L81 PolarHBondContact O-N 3.27Å; L78-E82 WeakPolarHBondContact O-CG 3.43Å; L78-E82 PolarHBondContact O-N 3.05Å; L78-E82 VanDerWaalsContact O-N 3.09Å; L78-A88 HydrophobicContact CD2-CB 4.09Å; L78-L91 HydrophobicContact CD1-CB 4.43Å; L78-L91 HydrophobicContact CD1-CD2 3.86Å; L78-L91 HydrophobicContact CD1-CG 3.88Å; L78-L91 HydrophobicContact CD2-CD2 4.24Å; L78-A92 HydrophobicContact CB-CB 4.42Å; L78-A92 HydrophobicContact CD1-CB 4.47Å; L78-L95 HydrophobicContact CD1-CD1 3.93Å
79	N	76.4	Confident	80.3	Confident	78 Å²	78	80.2 Å²	80.2	42%	0.417	44%	0.437	S	S	.	.	H	α-helix	trans	-53.9	-29.2	176.9	-74.7	-21.9	0	0	0	112.8	S75 L81	S75-N79 VanDerWaalsContact O-CG 3.22Å; S75-N79 PolarHBondContact O-N 3.32Å; S75-N79 PolarHBondContact O-ND2 2.79Å; S75-N79 PolarHBondContact O-OD1 2.85Å; N79-L81 VanDerWaalsContact C-N 3.31Å
80	N	75.1	Confident	80.3	Confident	136 Å²	136	81 Å²	81	73%	0.727	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-9.5	177.4	-63.8	-53.8	0	0	0	114	D76 L78	D76-N80 PolarHBondContact O-ND2 2.98Å; L78-N80 PolarHBondContact O-N 2.99Å
81	L	73.1	Confident	80.2	Confident	85 Å²	85	80.6 Å²	80.6	45%	0.445	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-11.5	-173.7	-66	168.6	0	0	0	113.3	L78 N79 E83 Q84 D85 A88	L78-L81 WeakPolarHBondContact O-CA 3.36Å; L78-L81 PolarHBondContact O-N 3.27Å; N79-L81 VanDerWaalsContact C-N 3.31Å; L81-E83 PolarHBondContact O-N 2.96Å; L81-Q84 PolarHBondContact O-N 2.96Å; L81-D85 PolarHBondContact O-N 3.36Å; L81-A88 HydrophobicContact CB-CB 4.16Å
82	E	63.7	Low	80.1	Confident	74 Å²	74	79.3 Å²	79.3	35%	0.346	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-31.8	-178	-74.2	-171.9	163.6	0	0	113.6	L78 A92	L78-E82 WeakPolarHBondContact O-CG 3.43Å; L78-E82 PolarHBondContact O-N 3.05Å; L78-E82 VanDerWaalsContact O-N 3.09Å; E82-A92 HydrophobicContact CG-CB 4.23Å; E82-A92 WeakPolarHBondContact OE1-CB 3.48Å
83	E	66.5	Low	80.1	Confident	197 Å²	197	82.3 Å²	82.3	92%	0.921	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-17.1	179.5	-67.6	-169.3	164.9	0	0	113.8	L81	L81-E83 PolarHBondContact O-N 2.96Å
84	Q	71.3	Confident	80.2	Confident	167 Å²	167	80.4 Å²	80.4	78%	0.78	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	-26.1	-171.3	-64.7	-174.7	10.9	0	0	113.9	L81	L81-Q84 PolarHBondContact O-N 2.96Å
85	D	82.3	Confident	80.2	Confident	80 Å²	80	78.1 Å²	78.1	43%	0.428	42%	0.416	S	S	.	.			trans	-132	116.5	-177	-171	-15.4	0	0	0	112.1	L81 A87 A88 A89	L81-D85 PolarHBondContact O-N 3.36Å; D85-A87 PolarHBondContact O-N 2.88Å; D85-A87 WeakPolarHBondContact OD1-CB 3.37Å; D85-A87 PolarHBondContact OD1-N 3.03Å; D85-A88 HydrophobicContact CB-CB 3.91Å; D85-A88 WeakPolarHBondContact O-CB 3.43Å; D85-A88 PolarHBondContact O-N 2.69Å; D85-A88 VanDerWaalsContact O-N 3.09Å; D85-A89 PolarHBondContact O-N 2.62Å; D85-A89 VanDerWaalsContact O-N 3.13Å
86	P	81.3	Confident	80.2	Confident	109 Å²	109	81.4 Å²	81.4	71%	0.708	43%	0.429	S	S	*	.	H	α-helix	trans	-62	-26.9	177.1	25.9	-34.3	0	0	0	113.4	E90	P86-E90 PolarHBondContact O-N 3.06Å
87	A	83.4	Confident	80.4	Confident	57 Å²	57	80.5 Å²	80.5	47%	0.471	42%	0.422	S	S	.	.	H	α-helix	trans	-72.9	-33.7	175.4	0	0	0	0	0	111.8	D85 E90 L91	D85-A87 PolarHBondContact O-N 2.88Å; D85-A87 WeakPolarHBondContact OD1-CB 3.37Å; D85-A87 PolarHBondContact OD1-N 3.03Å; A87-E90 PolarHBondContact O-N 3.2Å; A87-L91 WeakPolarHBondContact O-CB 3.1Å; A87-L91 PolarHBondContact O-N 2.84Å
88	A	83.1	Confident	80.6	Confident	10 Å²	10	81.4 Å²	81.4	8%	0.083	43%	0.426	C	S	.	.	H	α-helix	trans	-67.4	-40.9	173.7	0	0	0	0	0	111.2	L78 L81 D85 L91 A92	L78-A88 HydrophobicContact CD2-CB 4.09Å; L81-A88 HydrophobicContact CB-CB 4.16Å; D85-A88 HydrophobicContact CB-CB 3.91Å; D85-A88 WeakPolarHBondContact O-CB 3.43Å; D85-A88 PolarHBondContact O-N 2.69Å; D85-A88 VanDerWaalsContact O-N 3.09Å; A88-L91 PolarHBondContact O-N 3.09Å; A88-A92 WeakPolarHBondContact O-CB 3.37Å; A88-A92 PolarHBondContact O-N 3.1Å
89	A	80.8	Confident	80.9	Confident	38 Å²	38	88 Å²	88	31%	0.314	46%	0.456	S	S	.	.	H	α-helix	trans	-64.5	-40	174.4	0	0	0	0	0	112.5	D85 R93	D85-A89 PolarHBondContact O-N 2.62Å; D85-A89 VanDerWaalsContact O-N 3.13Å; A89-R93 WeakPolarHBondContact O-CB 3.45Å; A89-R93 PolarHBondContact O-N 3.3Å
90	E	85.3	Confident	81.3	Confident	117 Å²	117	87.4 Å²	87.4	55%	0.547	45%	0.45	S	S	.	.	H	α-helix	trans	-63.7	-44.3	174.3	-175.7	177.6	-168.4	0	0	111.7	P86 A87 R93 I94	P86-E90 PolarHBondContact O-N 3.06Å; A87-E90 PolarHBondContact O-N 3.2Å; E90-R93 WeakPolarHBondContact O-CB 3.48Å; E90-R93 PolarHBondContact O-N 3.41Å; E90-I94 HydrophobicContact CG-CD1 4.12Å; E90-I94 WeakPolarHBondContact O-CG1 3.2Å; E90-I94 PolarHBondContact O-N 2.79Å
91	L	85.8	Confident	81.9	Confident	78 Å²	78	85.4 Å²	85.4	41%	0.408	44%	0.435	S	S	.	.	H	α-helix	trans	-62.2	-47.5	177.4	-179.1	59.7	0	0	0	111.1	L78 A87 A88 R93 I94 L95	L78-L91 HydrophobicContact CD1-CB 4.43Å; L78-L91 HydrophobicContact CD1-CD2 3.86Å; L78-L91 HydrophobicContact CD1-CG 3.88Å; L78-L91 HydrophobicContact CD2-CD2 4.24Å; A87-L91 WeakPolarHBondContact O-CB 3.1Å; A87-L91 PolarHBondContact O-N 2.84Å; A88-L91 PolarHBondContact O-N 3.09Å; L91-R93 VanDerWaalsContact C-N 3.28Å; L91-R93 PolarHBondContact O-N 2.76Å; L91-I94 PolarHBondContact O-N 3.45Å; L91-I94 VanDerWaalsContact O-N 3.13Å; L91-L95 HydrophobicContact CD1-CD1 4.3Å; L91-L95 HydrophobicContact CD1-CD2 4.27Å; L91-L95 HydrophobicContact CD1-CG 4.1Å; L91-L95 HydrophobicContact CG-CD1 4.18Å; L91-L95 HydrophobicContact CG-CG 4.33Å; L91-L95 WeakPolarHBondContact O-CG 3.35Å; L91-L95 PolarHBondContact O-N 2.92Å
92	A	84.8	Confident	82.5	Confident	0 Å²	0	84.6 Å²	84.6	0%	0	44%	0.436	C	S	.	.	H	α-helix	trans	-58	-42.2	177.1	0	0	0	0	0	111.7	L78 E82 A88 I94 L95 Q96	L78-A92 HydrophobicContact CB-CB 4.42Å; L78-A92 HydrophobicContact CD1-CB 4.47Å; E82-A92 HydrophobicContact CG-CB 4.23Å; E82-A92 WeakPolarHBondContact OE1-CB 3.48Å; A88-A92 WeakPolarHBondContact O-CB 3.37Å; A88-A92 PolarHBondContact O-N 3.1Å; A92-I94 PolarHBondContact O-N 3.25Å; A92-L95 PolarHBondContact O-N 2.85Å; A92-Q96 WeakPolarHBondContact O-CB 3.43Å; A92-Q96 VanDerWaalsContact O-CG 3.22Å; A92-Q96 WeakPolarHBondContact O-CG 3.34Å; A92-Q96 PolarHBondContact O-N 3.13Å
93	R	85.3	Confident	83.7	Confident	137 Å²	137	86.4 Å²	86.4	52%	0.517	45%	0.447	S	S	.	.	H	α-helix	trans	-58.4	-46.6	174.9	-167.6	-173.8	69.4	73.8	5.1	111.9	A89 E90 L91 Q96 E97	A89-R93 WeakPolarHBondContact O-CB 3.45Å; A89-R93 PolarHBondContact O-N 3.3Å; E90-R93 WeakPolarHBondContact O-CB 3.48Å; E90-R93 PolarHBondContact O-N 3.41Å; L91-R93 VanDerWaalsContact C-N 3.28Å; L91-R93 PolarHBondContact O-N 2.76Å; R93-Q96 PolarHBondContact O-N 2.81Å; R93-E97 IonicContact CZ-OE1 2.71Å; R93-E97 IonicContact NH1-OE1 2.56Å; R93-E97 PolarHBondContact NH1-OE1 2.79Å; R93-E97 IonicContact NH2-OE1 3.48Å; R93-E97 PolarHBondContact O-N 2.86Å
94	I	87.1	Confident	84.8	Confident	58 Å²	58	78.5 Å²	78.5	30%	0.297	41%	0.411	S	S	.	.	H	α-helix	trans	-64.3	-45.5	179.7	-67.1	166	0	0	0	111	E90 L91 A92 Q96 E97	E90-I94 HydrophobicContact CG-CD1 4.12Å; E90-I94 WeakPolarHBondContact O-CG1 3.2Å; E90-I94 PolarHBondContact O-N 2.79Å; L91-I94 PolarHBondContact O-N 3.45Å; L91-I94 VanDerWaalsContact O-N 3.13Å; A92-I94 PolarHBondContact O-N 3.25Å; I94-Q96 PolarHBondContact O-N 2.92Å; I94-E97 WeakPolarHBondContact O-CB 3.43Å; I94-E97 PolarHBondContact O-N 2.93Å
95	L	86.3	Confident	85.5	Confident	15 Å²	15	74.6 Å²	74.6	8%	0.079	39%	0.393	C	S	.	.	H	α-helix	trans	-66.1	-25.6	179.7	-61.9	-173.7	0	0	0	112.4	L71 I74 L78 L91 A92 F100	L71-L95 HydrophobicContact CD2-CD1 4.03Å; L71-L95 HydrophobicContact CD2-CD2 3.61Å; L71-L95 HydrophobicContact CD2-CG 4.23Å; I74-L95 HydrophobicContact CG2-CD1 3.66Å; L78-L95 HydrophobicContact CD1-CD1 3.93Å; L91-L95 HydrophobicContact CD1-CD1 4.3Å; L91-L95 HydrophobicContact CD1-CD2 4.27Å; L91-L95 HydrophobicContact CD1-CG 4.1Å; L91-L95 HydrophobicContact CG-CD1 4.18Å; L91-L95 HydrophobicContact CG-CG 4.33Å; L91-L95 WeakPolarHBondContact O-CG 3.35Å; L91-L95 PolarHBondContact O-N 2.92Å; A92-L95 PolarHBondContact O-N 2.85Å; L95-F100 HydrophobicContact CD2-CD1 4.15Å; L95-F100 HydrophobicContact CD2-CE1 3.48Å; L95-F100 VanDerWaalsContact CD2-CE1 3.48Å; L95-F100 HydrophobicContact CD2-CZ 3.93Å
96	Q	84.3	Confident	85.6	Confident	87 Å²	87	73 Å²	73	41%	0.407	39%	0.391	S	S	.	.	H	α-helix	trans	-84.8	-11.5	176.9	-69.8	179.2	27.9	0	0	114.3	A92 R93 I94	A92-Q96 WeakPolarHBondContact O-CB 3.43Å; A92-Q96 VanDerWaalsContact O-CG 3.22Å; A92-Q96 WeakPolarHBondContact O-CG 3.34Å; A92-Q96 PolarHBondContact O-N 3.13Å; R93-Q96 PolarHBondContact O-N 2.81Å; I94-Q96 PolarHBondContact O-N 2.92Å
97	E	89.1	Confident	86	Confident	75 Å²	75	71.6 Å²	71.6	35%	0.35	38%	0.375	S	S	.	.			trans	-61.3	134.5	-178.9	-77.7	-173.4	-176.6	0	0	111.5	R93 I94 H99 F100 K101	R93-E97 IonicContact CZ-OE1 2.71Å; R93-E97 IonicContact NH1-OE1 2.56Å; R93-E97 PolarHBondContact NH1-OE1 2.79Å; R93-E97 IonicContact NH2-OE1 3.48Å; R93-E97 PolarHBondContact O-N 2.86Å; I94-E97 WeakPolarHBondContact O-CB 3.43Å; I94-E97 PolarHBondContact O-N 2.93Å; E97-H99 VanDerWaalsContact C-N 3.27Å; E97-H99 PolarHBondContact O-N 2.98Å; E97-F100 HydrophobicContact CB-CB 4.32Å; E97-F100 PolarHBondContact O-N 2.78Å; E97-K101 PolarHBondContact O-N 2.99Å
98	P	86.3	Confident	86.2	Confident	93 Å²	93	69.6 Å²	69.6	60%	0.604	36%	0.357	S	S	*	.	H	α-helix	trans	-56.5	-40.4	-175.2	-24.5	32	0	0	0	113.1	F100 K101 S102	P98-F100 PolarHBondContact O-N 2.86Å; P98-K101 PolarHBondContact O-N 3.22Å; P98-S102 WeakPolarHBondContact O-CB 3.47Å; P98-S102 PolarHBondContact O-N 3.23Å; P98-S102 PolarHBondContact O-OG 3.44Å
99	H	86.9	Confident	86.2	Confident	157 Å²	157	74.7 Å²	74.7	73%	0.727	38%	0.377	S	S	*	.	H	α-helix	trans	-67.5	-36.2	180	-63	-57.3	0	0	0	112.5	E97 L103	E97-H99 VanDerWaalsContact C-N 3.27Å; E97-H99 PolarHBondContact O-N 2.98Å; H99-L103 VanDerWaalsContact O-CB 3.32Å; H99-L103 WeakPolarHBondContact O-CB 3.21Å; H99-L103 PolarHBondContact O-N 3.09Å
100	F	86.7	Confident	86.3	Confident	66 Å²	66	77.1 Å²	77.1	29%	0.289	39%	0.387	S	S	.	.	H	α-helix	trans	-69.5	-44.5	177.7	-168.6	-92.3	0	0	0	110.8	L71 L95 E97 P98 L103 I104	L71-F100 HydrophobicContact CD1-CD1 4.37Å; L71-F100 HydrophobicContact CD1-CE1 3.88Å; L71-F100 HydrophobicContact CD2-CE1 4.03Å; L95-F100 HydrophobicContact CD2-CD1 4.15Å; L95-F100 HydrophobicContact CD2-CE1 3.48Å; L95-F100 VanDerWaalsContact CD2-CE1 3.48Å; L95-F100 HydrophobicContact CD2-CZ 3.93Å; E97-F100 HydrophobicContact CB-CB 4.32Å; E97-F100 PolarHBondContact O-N 2.78Å; P98-F100 PolarHBondContact O-N 2.86Å; F100-L103 WeakPolarHBondContact O-CB 3.48Å; F100-L103 PolarHBondContact O-N 2.95Å; F100-I104 HydrophobicContact CD1-CG1 4.3Å; F100-I104 HydrophobicContact CE1-CD1 4.37Å; F100-I104 HydrophobicContact CE1-CG1 4.01Å; F100-I104 HydrophobicContact CZ-CD1 4.35Å; F100-I104 HydrophobicContact CZ-CG1 4.41Å; F100-I104 VanDerWaalsContact O-CG1 3.29Å; F100-I104 WeakPolarHBondContact O-CG1 3.29Å; F100-I104 PolarHBondContact O-N 2.96Å; F100-I104 VanDerWaalsContact O-N 3.16Å
101	K	86.6	Confident	86.2	Confident	94 Å²	94	72.5 Å²	72.5	41%	0.409	37%	0.369	S	S	.	.	H	α-helix	trans	-59.7	-49.5	173.9	-74.3	177.3	169	163.7	0	112.3	E97 P98 L103 I104 E105	E97-K101 PolarHBondContact O-N 2.99Å; P98-K101 PolarHBondContact O-N 3.22Å; K101-L103 VanDerWaalsContact C-N 3.26Å; K101-L103 PolarHBondContact O-N 2.95Å; K101-I104 PolarHBondContact O-N 2.86Å; K101-I104 VanDerWaalsContact O-N 3.12Å; K101-E105 WeakPolarHBondContact O-CG 3.1Å; K101-E105 PolarHBondContact O-N 3.34Å
102	S	85.6	Confident	86	Confident	68 Å²	68	71.7 Å²	71.7	48%	0.476	37%	0.374	S	S	.	.	H	α-helix	trans	-61.2	-34.4	177.8	-62.7	0	0	0	0	112.9	P98 A106	P98-S102 WeakPolarHBondContact O-CB 3.47Å; P98-S102 PolarHBondContact O-N 3.23Å; P98-S102 PolarHBondContact O-OG 3.44Å; S102-A106 VanDerWaalsContact O-CB 3.27Å; S102-A106 WeakPolarHBondContact O-CB 3.39Å; S102-A106 PolarHBondContact O-N 2.82Å
103	L	89	Confident	85.6	Confident	111 Å²	111	79.3 Å²	79.3	58%	0.581	41%	0.407	S	S	*	.	H	α-helix	trans	-63.7	-42	175.7	179.3	65.4	0	0	0	111.6	H99 F100 K101 A106 H107	H99-L103 VanDerWaalsContact O-CB 3.32Å; H99-L103 WeakPolarHBondContact O-CB 3.21Å; H99-L103 PolarHBondContact O-N 3.09Å; F100-L103 WeakPolarHBondContact O-CB 3.48Å; F100-L103 PolarHBondContact O-N 2.95Å; K101-L103 VanDerWaalsContact C-N 3.26Å; K101-L103 PolarHBondContact O-N 2.95Å; L103-A106 PolarHBondContact O-N 3.41Å; L103-H107 WeakPolarHBondContact O-CB 3.41Å; L103-H107 PolarHBondContact O-N 2.77Å
104	I	88.9	Confident	85	Confident	31 Å²	31	76 Å²	76	16%	0.159	41%	0.405	C	S	.	.	H	α-helix	trans	-76.5	-38	-176.9	-58.6	-79.2	0	0	0	110.7	N67 V68 L71 F100 K101 A106 H107 D108	N67-I104 HydrophobicContact CB-CG2 3.64Å; V68-I104 HydrophobicContact CG2-CG2 3.93Å; L71-I104 HydrophobicContact CD1-CB 3.8Å; L71-I104 HydrophobicContact CD1-CD1 4.26Å; L71-I104 HydrophobicContact CD1-CG1 3.62Å; L71-I104 HydrophobicContact CD1-CG2 3.64Å; F100-I104 HydrophobicContact CD1-CG1 4.3Å; F100-I104 HydrophobicContact CE1-CD1 4.37Å; F100-I104 HydrophobicContact CE1-CG1 4.01Å; F100-I104 HydrophobicContact CZ-CD1 4.35Å; F100-I104 HydrophobicContact CZ-CG1 4.41Å; F100-I104 VanDerWaalsContact O-CG1 3.29Å; F100-I104 WeakPolarHBondContact O-CG1 3.29Å; F100-I104 PolarHBondContact O-N 2.96Å; F100-I104 VanDerWaalsContact O-N 3.16Å; K101-I104 PolarHBondContact O-N 2.86Å; K101-I104 VanDerWaalsContact O-N 3.12Å; I104-A106 VanDerWaalsContact C-N 3.32Å; I104-A106 PolarHBondContact O-N 3.06Å; I104-H107 WeakPolarHBondContact O-CB 3.48Å; I104-H107 PolarHBondContact O-N 3.03Å; I104-D108 PolarHBondContact O-N 3.03Å
105	E	86.9	Confident	84.1	Confident	85 Å²	85	81.4 Å²	81.4	40%	0.397	42%	0.423	S	S	.	.	H	α-helix	trans	-59.8	-41.8	169.2	-72.7	176	-165.7	0	0	112.3	V68 K101 H107 D108 K109	V68-E105 HydrophobicContact CG2-CB 4.39Å; V68-E105 HydrophobicContact CG2-CG 3.86Å; K101-E105 WeakPolarHBondContact O-CG 3.1Å; K101-E105 PolarHBondContact O-N 3.34Å; E105-H107 VanDerWaalsContact C-N 3.35Å; E105-D108 PolarHBondContact O-N 2.93Å; E105-K109 WeakPolarHBondContact O-CB 3.28Å; E105-K109 VanDerWaalsContact O-CG 3.25Å; E105-K109 WeakPolarHBondContact O-CG 3.48Å; E105-K109 PolarHBondContact O-N 2.99Å
106	A	85.3	Confident	82.5	Confident	48 Å²	48	88.9 Å²	88.9	40%	0.397	46%	0.457	S	S	.	.	H	α-helix	trans	-66	-40.2	176	0	0	0	0	0	111.3	S102 L103 I104 K109 V110	S102-A106 VanDerWaalsContact O-CB 3.27Å; S102-A106 WeakPolarHBondContact O-CB 3.39Å; S102-A106 PolarHBondContact O-N 2.82Å; L103-A106 PolarHBondContact O-N 3.41Å; I104-A106 VanDerWaalsContact C-N 3.32Å; I104-A106 PolarHBondContact O-N 3.06Å; A106-K109 PolarHBondContact O-N 3.33Å; A106-V110 WeakPolarHBondContact O-CB 3.48Å; A106-V110 VanDerWaalsContact O-CG2 3.23Å; A106-V110 WeakPolarHBondContact O-CG2 3.34Å; A106-V110 PolarHBondContact O-N 2.96Å
107	H	87.8	Confident	80.4	Confident	78 Å²	78	92 Å²	92	36%	0.361	47%	0.474	S	S	.	.	H	α-helix	trans	-57.1	-52.5	173.7	173.5	-82.8	0	0	0	111.3	G64 N67 L103 I104 E105 K109 V110 A111	G64-H107 PolarHBondContact O-CE1 3.05Å; G64-H107 VanDerWaalsContact O-CE1 3.26Å; N67-H107 PolarHBondContact ND2-CE1 3.05Å; N67-H107 PolarHBondContact ND2-ND1 3.2Å; N67-H107 VanDerWaalsContact ND2-ND1 3.18Å; L103-H107 WeakPolarHBondContact O-CB 3.41Å; L103-H107 PolarHBondContact O-N 2.77Å; I104-H107 WeakPolarHBondContact O-CB 3.48Å; I104-H107 PolarHBondContact O-N 3.03Å; E105-H107 VanDerWaalsContact C-N 3.35Å; H107-K109 PolarHBondContact O-N 2.69Å; H107-V110 PolarHBondContact O-N 2.9Å; H107-A111 WeakPolarHBondContact O-CB 3.43Å; H107-A111 PolarHBondContact O-N 3.25Å
108	D	88	Confident	78.3	Confident	16 Å²	16	92.9 Å²	92.9	9%	0.086	49%	0.486	C	S	.	.	H	α-helix	trans	-67.4	-36.1	-177.2	-71.4	-3.4	0	0	0	112	D65 N67 V68 I104 E105 V110 A111 A112	D65-D108 WeakPolarHBondContact O-CB 3.45Å; D65-D108 VanDerWaalsContact O-CG 3.26Å; N67-D108 WeakPolarHBondContact CA-OD2 3.22Å; N67-D108 WeakPolarHBondContact CB-OD1 3.37Å; N67-D108 PolarHBondContact N-OD1 3.5Å; N67-D108 PolarHBondContact N-OD2 3.27Å; N67-D108 PolarHBondContact ND2-OD1 3.17Å; V68-D108 WeakPolarHBondContact CG2-OD2 3.26Å; V68-D108 PolarHBondContact N-OD2 3.3Å; I104-D108 PolarHBondContact O-N 3.03Å; E105-D108 PolarHBondContact O-N 2.93Å; D108-V110 VanDerWaalsContact C-N 3.35Å; D108-V110 PolarHBondContact O-N 3.14Å; D108-A111 PolarHBondContact O-N 3.46Å; D108-A112 WeakPolarHBondContact O-CB 3.25Å; D108-A112 PolarHBondContact O-N 3.44Å
109	K	84.1	Confident	76.2	Confident	117 Å²	117	97.9 Å²	97.9	51%	0.509	50%	0.498	S	S	.	.	H	α-helix	trans	-60	-43.2	171.3	-76.3	171.7	-177.3	169.3	0	112.5	E105 A106 H107 K113 S114	E105-K109 WeakPolarHBondContact O-CB 3.28Å; E105-K109 VanDerWaalsContact O-CG 3.25Å; E105-K109 WeakPolarHBondContact O-CG 3.48Å; E105-K109 PolarHBondContact O-N 2.99Å; A106-K109 PolarHBondContact O-N 3.33Å; H107-K109 PolarHBondContact O-N 2.69Å; K109-K113 PolarHBondContact O-N 3.01Å; K109-S114 PolarHBondContact O-N 3.43Å
110	V	82.2	Confident	73.7	Confident	88 Å²	88	97.4 Å²	97.4	53%	0.533	50%	0.501	S	S	.	.	H	α-helix	trans	-69.3	-42.2	177	172.3	0	0	0	0	110.7	A106 H107 D108 K113	A106-V110 WeakPolarHBondContact O-CB 3.48Å; A106-V110 VanDerWaalsContact O-CG2 3.23Å; A106-V110 WeakPolarHBondContact O-CG2 3.34Å; A106-V110 PolarHBondContact O-N 2.96Å; H107-V110 PolarHBondContact O-N 2.9Å; D108-V110 VanDerWaalsContact C-N 3.35Å; D108-V110 PolarHBondContact O-N 3.14Å; V110-K113 PolarHBondContact O-N 3.39Å; V110-K113 VanDerWaalsContact O-N 3.08Å
111	A	83.4	Confident	71.2	Confident	21 Å²	21	102.3 Å²	102.3	17%	0.174	53%	0.527	C	S	.	.	H	α-helix	trans	-60.6	-45	176.6	0	0	0	0	0	111.7	A62 D65 H107 D108 K113	A62-A111 HydrophobicContact CB-CB 3.47Å; A62-A111 VanDerWaalsContact CB-CB 3.47Å; D65-A111 HydrophobicContact CB-CB 3.89Å; H107-A111 WeakPolarHBondContact O-CB 3.43Å; H107-A111 PolarHBondContact O-N 3.25Å; D108-A111 PolarHBondContact O-N 3.46Å; A111-K113 PolarHBondContact O-N 3.43Å
112	A	80.6	Confident	68.7	Low	60 Å²	60	106.5 Å²	106.5	50%	0.496	55%	0.548	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-1.8	175.6	0	0	0	0	0	113.8	D108 S114	D108-A112 WeakPolarHBondContact O-CB 3.25Å; D108-A112 PolarHBondContact O-N 3.44Å; A112-S114 PolarHBondContact O-N 2.95Å; A112-S114 VanDerWaalsContact O-N 3.16Å
113	K	77.8	Confident	66.1	Low	160 Å²	160	110.5 Å²	110.5	70%	0.696	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	55.2	29.4	-176.9	-57.6	176	-176	171	0	113	K109 V110 A111 Y115	K109-K113 PolarHBondContact O-N 3.01Å; V110-K113 PolarHBondContact O-N 3.39Å; V110-K113 VanDerWaalsContact O-N 3.08Å; A111-K113 PolarHBondContact O-N 3.43Å; K113-Y115 HydrophobicContact CB-CD2 4.47Å; K113-Y115 HydrophobicContact CB-CE2 3.78Å; K113-Y115 HydrophobicContact CG-CE2 4.35Å; K113-Y115 WeakPolarHBondContact O-CD2 3.5Å; K113-Y115 PolarHBondContact O-N 3.2Å
114	S	72.3	Confident	63.4	Low	68 Å²	68	110.4 Å²	110.4	48%	0.476	57%	0.572	S	S	.	*			trans	-88.5	87.6	177.2	-171	0	0	0	0	109.1	K109 A112 E116	K109-S114 PolarHBondContact O-N 3.43Å; A112-S114 PolarHBondContact O-N 2.95Å; A112-S114 VanDerWaalsContact O-N 3.16Å; S114-E116 VanDerWaalsContact C-N 3.34Å
115	Y	67.3	Low	60.8	Low	171 Å²	171	116.8 Å²	116.8	67%	0.671	61%	0.607	S	S	*	*			trans	-95.9	17.7	-179.6	-54.5	-73	0	0	0	112.8	K113 M117	K113-Y115 HydrophobicContact CB-CD2 4.47Å; K113-Y115 HydrophobicContact CB-CE2 3.78Å; K113-Y115 HydrophobicContact CG-CE2 4.35Å; K113-Y115 WeakPolarHBondContact O-CD2 3.5Å; K113-Y115 PolarHBondContact O-N 3.2Å; Y115-M117 PolarHBondContact O-N 3.41Å
116	E	54	Low	58	Low	173 Å²	173	117.3 Å²	117.3	81%	0.808	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-65.6	123.3	176.8	-71.2	-167.9	163.5	0	0	109.8	S114	S114-E116 VanDerWaalsContact C-N 3.34Å
117	M	40.5	Very low	55.6	Low	153 Å²	153	123.6 Å²	123.6	75%	0.754	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-61.8	130.2	167.1	-132.6	-160.6	86.2	0	0	107.3	Y115 K119	Y115-M117 PolarHBondContact O-N 3.41Å; M117-K119 PolarHBondContact O-N 2.9Å
118	P	43.7	Very low	52.8	Low	92 Å²	92	124.1 Å²	124.1	60%	0.597	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-54.9	122.6	170.8	-19.3	29.9	0	0	0	107.9	D120	P118-D120 PolarHBondContact O-N 3.19Å
119	K	41.5	Very low	50.5	Low	198 Å²	198	129.7 Å²	129.7	86%	0.861	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-56.9	127	160.4	-69.7	177.6	-179.1	171.8	0	105.5	M117 M121	M117-K119 PolarHBondContact O-N 2.9Å; K119-M121 PolarHBondContact O-N 3.44Å
120	D	34.8	Very low	48	Very low	147 Å²	147	128.7 Å²	128.7	79%	0.786	70%	0.703	S	S	*	*			trans	-37.4	113.5	-179	-66.2	-52.8	0	0	0	110	P118 E122	P118-D120 PolarHBondContact O-N 3.19Å; D120-E122 PolarHBondContact O-N 3.35Å
121	M	33.9	Very low	45.9	Very low	169 Å²	169	129.9 Å²	129.9	83%	0.833	72%	0.715	S	S	*	*			trans	-60.1	116.5	166.8	-69.5	-170.2	-157.9	0	0	105.5	K119 N123	K119-M121 PolarHBondContact O-N 3.44Å; M121-N123 PolarHBondContact O-N 3Å
122	E	34	Very low	43.8	Very low	183 Å²	183	136.3 Å²	136.3	86%	0.855	75%	0.746	S	S	*	*			trans	-50.2	110.2	170.3	-68.9	-175.3	154.5	0	0	108	D120 S124	D120-E122 PolarHBondContact O-N 3.35Å; E122-S124 PolarHBondContact O-N 3.19Å
123	N	31.5	Very low	41.8	Very low	152 Å²	152	140.5 Å²	140.5	81%	0.813	76%	0.757	S	S	*	*			trans	-58.8	91.2	169.8	-93.2	-21.2	0	0	0	108.3	M121 N125	M121-N123 PolarHBondContact O-N 3Å; N123-N125 PolarHBondContact O-N 3.39Å
124	S	32	Very low	40.2	Very low	109 Å²	109	137.5 Å²	137.5	76%	0.762	75%	0.754	S	S	*	*	S	Bend	trans	-73.7	63.5	164.2	55.2	0	0	0	0	109.2	E122	E122-S124 PolarHBondContact O-N 3.19Å
125	N	34.4	Very low	39	Very low	164 Å²	164	138.7 Å²	138.7	88%	0.877	77%	0.768	S	S	*	*			trans	-168	57.7	163.6	-94.3	-23.5	0	0	0	110.8	N123	N123-N125 PolarHBondContact O-N 3.39Å
126	S	29.8	Very low	38.4	Very low	97 Å²	97	137 Å²	137	68%	0.678	77%	0.771	S	S	*	*			trans	-115.5	104.9	154.3	61.1	0	0	0	0	108.8	S128	S126-S128 VanDerWaalsContact C-N 3.33Å; S126-S128 PolarHBondContact O-N 2.84Å
127	L	32.9	Very low	38.8	Very low	179 Å²	179	131.1 Å²	131.1	94%	0.937	75%	0.752	S	S	*	*			trans	-59.3	102.6	156.2	-77.7	151.6	0	0	0	106.2	P129	L127-P129 WeakPolarHBondContact O-CD 3.28Å
128	S	29.9	Very low	40.6	Very low	90 Å²	90	127.5 Å²	127.5	63%	0.629	74%	0.738	S	S	*	*			trans	-79.7	121.8	176.5	47	0	0	0	0	109.7	S126 S130	S126-S128 VanDerWaalsContact C-N 3.33Å; S126-S128 PolarHBondContact O-N 2.84Å; S128-S130 VanDerWaalsContact C-N 3.33Å; S128-S130 PolarHBondContact O-N 2.84Å
129	P	40.1	Very low	42.6	Very low	133 Å²	133	127.1 Å²	127.1	86%	0.864	72%	0.724	S	S	*	*			trans	-88.9	78.1	161	34.1	-25.5	0	0	0	107.8	L127	L127-P129 WeakPolarHBondContact O-CD 3.28Å
130	S	31.9	Very low	44.6	Very low	95 Å²	95	122 Å²	122	66%	0.664	71%	0.71	S	S	*	*			trans	-157	56	170.7	65.9	0	0	0	0	112.4	S128	S128-S130 VanDerWaalsContact C-N 3.33Å; S128-S130 PolarHBondContact O-N 2.84Å
131	S	37.4	Very low	47	Very low	113 Å²	113	115.2 Å²	115.2	79%	0.79	67%	0.673	S	S	*	*			trans	-96.1	101	149.4	-67.7	0	0	0	0	106.6
132	L	40.3	Very low	49.4	Very low	157 Å²	157	109 Å²	109	82%	0.822	65%	0.652	S	S	*	*			trans	161	77.2	155	-85.8	149.9	0	0	0	109.4
133	M	37.2	Very low	51.8	Low	148 Å²	148	100.2 Å²	100.2	73%	0.729	61%	0.611	S	S	*	*	S	Bend	trans	-169.1	145.3	143.9	-88.1	-47.4	95.4	0	0	108.9
134	P	43.9	Very low	54.1	Low	96 Å²	96	98.4 Å²	98.4	62%	0.623	60%	0.598	S	S	*	*			trans	-72.3	135	-175.3	-8.8	25	0	0	0	111.5	D136	P134-D136 PolarHBondContact O-N 3.3Å
135	A	46.8	Very low	56.3	Low	94 Å²	94	93.9 Å²	93.9	78%	0.777	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	7	-176.4	0	0	0	0	0	115.8
136	D	54.7	Low	58.3	Low	136 Å²	136	93 Å²	93	73%	0.727	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.2	15.6	-170.9	-73.6	-33.3	0	0	0	114.7	P134 V138	P134-D136 PolarHBondContact O-N 3.3Å; D136-V138 PolarHBondContact O-N 3.48Å
137	A	64.3	Low	60.4	Low	49 Å²	49	94.2 Å²	94.2	41%	0.405	56%	0.556	S	S	.	*			trans	-73.9	92.9	177.8	0	0	0	0	0	111.5	R139 P217	A137-R139 PolarHBondContact O-N 3.48Å; A137-P217 VanDerWaalsContact O-CD 3.24Å; A137-P217 WeakPolarHBondContact O-CD 3.46Å
138	V	77.3	Confident	62	Low	76 Å²	76	89.2 Å²	89.2	46%	0.461	55%	0.549	S	S	.	.	P	Polyproline II helix	trans	-66.3	124.3	173.4	179.1	0	0	0	0	110.2	D136 K214 L216	D136-V138 PolarHBondContact O-N 3.48Å; V138-K214 HydrophobicContact CG1-CB 3.82Å; V138-K214 HydrophobicContact CG1-CD 4.12Å; V138-K214 HydrophobicContact CG1-CG 4.35Å; V138-L216 HydrophobicContact CG2-CD2 3.77Å
139	R	85.1	Confident	64.1	Low	84 Å²	84	88.3 Å²	88.3	32%	0.317	53%	0.534	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	127.4	175.2	-178.4	171.8	64.7	-159.8	-4	110	A137 I141 M178 D183 V215	A137-R139 PolarHBondContact O-N 3.48Å; R139-I141 HydrophobicContact CG-CG1 4.06Å; R139-M178 PolarHBondContact NH2-O 3.43Å; R139-D183 IonicContact NH2-OD1 3.28Å; R139-D183 IonicContact NH2-OD2 3.53Å; R139-D183 PolarHBondContact NH2-OD2 2.8Å; R139-V215 HydrophobicContact CB-CG2 4Å; R139-V215 PolarHBondContact N-O 3.05Å; R139-V215 PolarHBondContact O-N 3.05Å
140	V	85.3	Confident	65.8	Low	91 Å²	91	86.6 Å²	86.6	55%	0.552	52%	0.523	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	121.7	173.8	-171.5	0	0	0	0	109.1	T212 L213 K214	V140-T212 HydrophobicContact CG1-CG2 3.35Å; V140-L213 CarbonylContact C-O 3.57Å; V140-L213 WeakPolarHBondContact CA-O 3.49Å; V140-K214 HydrophobicContact CG2-CG 4.19Å
141	I	85.2	Confident	67.8	Low	4 Å²	4	82.7 Å²	82.7	2%	0.021	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	125.8	-177.7	-54.6	169.9	0	0	0	108.9	R139 I143 M178 L179 T212 L213 V215	R139-I141 HydrophobicContact CG-CG1 4.06Å; I141-I143 HydrophobicContact CG2-CD1 4.18Å; I141-I143 HydrophobicContact CG2-CG1 3.95Å; I141-M178 WeakPolarHBondContact CD1-O 3.47Å; I141-M178 HydrophobicContact CG2-CB 3.54Å; I141-M178 HydrophobicContact CG2-CE 3.72Å; I141-M178 HydrophobicContact CG2-CG 4.43Å; I141-M178 HydrophobicContact CG2-SD 4.18Å; I141-L179 HydrophobicContact CD1-CB 4.38Å; I141-L179 HydrophobicContact CD1-CD1 3.72Å; I141-T212 CarbonylContact O-C 3.53Å; I141-T212 WeakPolarHBondContact O-CA 3.37Å; I141-L213 HydrophobicContact CB-CB 4.49Å; I141-L213 PolarHBondContact N-O 3.25Å; I141-L213 PolarHBondContact O-N 3.06Å; I141-V215 HydrophobicContact CD1-CB 4.41Å; I141-V215 HydrophobicContact CD1-CG1 4.03Å; I141-V215 HydrophobicContact CD1-CG2 3.44Å; I141-V215 VanDerWaalsContact CD1-CG2 3.44Å; I141-V215 HydrophobicContact CG1-CG2 4.12Å
142	G	83.6	Confident	69.8	Low	38 Å²	38	77.6 Å²	77.6	39%	0.392	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	117.1	173.4	0	0	0	0	0	111.8	M178	G142-M178 WeakPolarHBondContact O-CE 3.36Å
143	I	83.6	Confident	71.7	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	138.4	-176.6	-62.6	147.5	0	0	0	109.8	I141 L151 I173 S210 V211 L213	I141-I143 HydrophobicContact CG2-CD1 4.18Å; I141-I143 HydrophobicContact CG2-CG1 3.95Å; I143-L151 HydrophobicContact CG2-CD2 3.58Å; I143-I173 HydrophobicContact CB-CD1 4.24Å; I143-I173 HydrophobicContact CD1-CD1 3.32Å; I143-I173 HydrophobicContact CG1-CD1 3.51Å; I143-I173 HydrophobicContact CG2-CD1 3.67Å; I143-S210 CarbonylContact O-C 3.54Å; I143-S210 WeakPolarHBondContact O-CA 3.39Å; I143-V211 PolarHBondContact N-O 2.92Å; I143-V211 PolarHBondContact O-N 3.47Å; I143-L213 HydrophobicContact CD1-CD1 3.27Å; I143-L213 HydrophobicContact CD1-CG 3.76Å
144	Q	80.3	Confident	73.7	Confident	114 Å²	114	66.9 Å²	66.9	53%	0.533	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	109.7	174.2	-69	-64	-29.9	0	0	109.4
145	K	79.3	Confident	75.7	Confident	13 Å²	13	64.2 Å²	64.2	6%	0.057	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	122.6	-179	-171.7	-172.7	168.2	-147.2	0	110.8	E149 L151 L204 R205 C207 G209 V211	K145-E149 WeakPolarHBondContact CE-O 3.37Å; K145-L151 HydrophobicContact CB-CD2 4.04Å; K145-L151 HydrophobicContact CD-CD2 4.22Å; K145-L151 HydrophobicContact CD-CG 4.25Å; K145-L151 HydrophobicContact CG-CD2 3.94Å; K145-L151 HydrophobicContact CG-CG 4.45Å; K145-L204 PolarHBondContact NZ-O 3.3Å; K145-R205 PolarHBondContact NZ-O 3.35Å; K145-C207 WeakPolarHBondContact CD-O 3.46Å; K145-C207 WeakPolarHBondContact CE-O 3.3Å; K145-C207 PolarHBondContact NZ-O 3.47Å; K145-G209 PolarHBondContact N-O 2.93Å; K145-G209 PolarHBondContact O-N 3.46Å; K145-V211 HydrophobicContact CB-CG2 3.92Å; K145-V211 HydrophobicContact CD-CG2 4.37Å
146	K	76.5	Confident	77.4	Confident	145 Å²	145	67.4 Å²	67.4	63%	0.63	38%	0.38	S	S	*	.			trans	-73.8	142.2	170.6	-67.4	-177.4	-178.4	175.9	0	110.9	G148 E149	K146-G148 PolarHBondContact O-N 3.45Å; K146-E149 HydrophobicContact CB-CB 4.21Å; K146-E149 PolarHBondContact O-N 3.17Å; K146-E149 VanDerWaalsContact O-N 3.16Å
147	T	72.8	Confident	78.7	Confident	123 Å²	123	62.9 Å²	62.9	76%	0.755	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	124.5	-178.9	-49.3	0	0	0	0	110.9	E149	T147-E149 VanDerWaalsContact C-N 3.32Å; T147-E149 PolarHBondContact O-N 3.07Å
148	G	65.9	Low	79.3	Confident	75 Å²	75	63.5 Å²	63.5	77%	0.773	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.9	-9.6	-180	0	0	0	0	0	116	K146	K146-G148 PolarHBondContact O-N 3.45Å
149	E	74.7	Confident	79.3	Confident	70 Å²	70	67.7 Å²	67.7	33%	0.327	38%	0.38	S	S	.	.			trans	-91.4	132.6	179.1	-164.8	179.2	166.6	0	0	111	K145 K146 T147	K145-E149 WeakPolarHBondContact CE-O 3.37Å; K146-E149 HydrophobicContact CB-CB 4.21Å; K146-E149 PolarHBondContact O-N 3.17Å; K146-E149 VanDerWaalsContact O-N 3.16Å; T147-E149 VanDerWaalsContact C-N 3.32Å; T147-E149 PolarHBondContact O-N 3.07Å
150	P	75.9	Confident	78.9	Confident	97 Å²	97	66.2 Å²	66.2	63%	0.63	39%	0.391	S	S	*	.			trans	-69.7	149.9	173.5	29.9	-33.9	0	0	0	110.6	G152	P150-G152 PolarHBondContact O-N 3.22Å; P150-G152 VanDerWaalsContact O-N 3.15Å
151	L	74.2	Confident	78.8	Confident	13 Å²	13	65 Å²	65	7%	0.068	38%	0.379	C	S	.	.			trans	-65	-17.3	175.6	-72.3	174.2	0	0	0	113.2	I143 K145 S171 I173 L204	I143-L151 HydrophobicContact CG2-CD2 3.58Å; K145-L151 HydrophobicContact CB-CD2 4.04Å; K145-L151 HydrophobicContact CD-CD2 4.22Å; K145-L151 HydrophobicContact CD-CG 4.25Å; K145-L151 HydrophobicContact CG-CD2 3.94Å; K145-L151 HydrophobicContact CG-CG 4.45Å; L151-S171 WeakPolarHBondContact O-CB 3.47Å; L151-S171 PolarHBondContact O-OG 3.48Å; L151-I173 HydrophobicContact CB-CG1 4.09Å; L151-I173 HydrophobicContact CD2-CD1 4.41Å; L151-I173 HydrophobicContact CD2-CG1 4.43Å; L151-I173 WeakPolarHBondContact O-CG1 3.37Å; L151-L204 HydrophobicContact CD1-CD1 4.35Å; L151-L204 HydrophobicContact CD1-CD2 3.83Å; L151-L204 HydrophobicContact CD1-CG 4.5Å
152	G	78.2	Confident	78.7	Confident	7 Å²	7	65 Å²	65	7%	0.072	38%	0.379	C	S	.	.			trans	73.3	39.4	-179	0	0	0	0	0	112.9	P150 L168	P150-G152 PolarHBondContact O-N 3.22Å; P150-G152 VanDerWaalsContact O-N 3.15Å; G152-L168 WeakPolarHBondContact O-CB 3.37Å; G152-L168 PolarHBondContact O-N 3.07Å
153	V	81.2	Confident	78.8	Confident	21 Å²	21	64.5 Å²	64.5	13%	0.127	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	144	177.9	-172.8	0	0	0	0	108.7	F155 V164 R166 I167 I173 L179	V153-F155 HydrophobicContact CB-CE1 3.91Å; V153-F155 HydrophobicContact CB-CE2 4.38Å; V153-F155 HydrophobicContact CB-CZ 3.65Å; V153-F155 HydrophobicContact CG1-CD1 3.97Å; V153-F155 HydrophobicContact CG1-CE1 3.26Å; V153-F155 HydrophobicContact CG1-CE2 4.46Å; V153-F155 HydrophobicContact CG1-CZ 3.58Å; V153-V164 HydrophobicContact CG1-CB 4.5Å; V153-V164 HydrophobicContact CG1-CG1 3.54Å; V153-V164 HydrophobicContact CG1-CG2 4.34Å; V153-R166 CarbonylContact C-O 3.52Å; V153-R166 WeakPolarHBondContact CA-O 3.38Å; V153-R166 WeakPolarHBondContact CG1-O 3.24Å; V153-I167 HydrophobicContact CG1-CG1 4.35Å; V153-I167 HydrophobicContact CG2-CG1 4.38Å; V153-I173 HydrophobicContact CG2-CB 3.76Å; V153-I173 HydrophobicContact CG2-CG1 3.57Å; V153-I173 HydrophobicContact CG2-CG2 3.75Å; V153-L179 HydrophobicContact CG1-CD2 4.05Å; V153-L179 HydrophobicContact CG2-CD2 4.16Å
154	T	79.8	Confident	78.8	Confident	58 Å²	58	64.6 Å²	64.6	36%	0.356	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	143.8	171.4	63.2	0	0	0	0	109.8	T165 R166	T154-T165 PolarHBondContact O-N 3.01Å; T154-T165 PolarHBondContact O-OG1 3Å; T154-T165 VanDerWaalsContact O-OG1 3.07Å; T154-T165 PolarHBondContact OG1-OG1 2.85Å; T154-R166 PolarHBondContact N-O 3.39Å; T154-R166 PolarHBondContact O-N 3.37Å; T154-R166 WeakPolarHBondContact OG1-CB 3.17Å; T154-R166 PolarHBondContact OG1-N 2.83Å
155	F	85.4	Confident	78.7	Confident	40 Å²	40	61.9 Å²	61.9	18%	0.175	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	156.5	-178.5	-41.9	-78.6	0	0	0	110.1	V153 M162 V163 V164 I185 L200 L204	V153-F155 HydrophobicContact CB-CE1 3.91Å; V153-F155 HydrophobicContact CB-CE2 4.38Å; V153-F155 HydrophobicContact CB-CZ 3.65Å; V153-F155 HydrophobicContact CG1-CD1 3.97Å; V153-F155 HydrophobicContact CG1-CE1 3.26Å; V153-F155 HydrophobicContact CG1-CE2 4.46Å; V153-F155 HydrophobicContact CG1-CZ 3.58Å; F155-M162 HydrophobicContact CB-CE 3.56Å; F155-M162 HydrophobicContact CG-CE 4.44Å; F155-V163 CarbonylContact C-O 3.56Å; F155-V163 VanDerWaalsContact CA-O 3.26Å; F155-V163 WeakPolarHBondContact CA-O 3.48Å; F155-V164 HydrophobicContact CD1-CG2 3.9Å; F155-V164 HydrophobicContact CE1-CG2 3.92Å; F155-I185 HydrophobicContact CD1-CD1 3.65Å; F155-I185 HydrophobicContact CE1-CD1 3.21Å; F155-I185 HydrophobicContact CE1-CG1 4.46Å; F155-I185 HydrophobicContact CZ-CD1 3.95Å; F155-L200 HydrophobicContact CB-CD2 4.33Å; F155-L200 HydrophobicContact CD1-CD2 4.39Å; F155-L200 HydrophobicContact CD2-CD2 3.88Å; F155-L200 HydrophobicContact CE2-CD2 4.29Å; F155-L200 HydrophobicContact CG-CD2 3.93Å; F155-L204 HydrophobicContact CE2-CD1 3.57Å; F155-L204 HydrophobicContact CZ-CD1 3.79Å
156	R	81.5	Confident	78.4	Confident	161 Å²	161	65.2 Å²	65.2	61%	0.608	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.4	140.6	172.7	174	-173.3	-69.5	-106.9	0.6	108.9	V158 V163 T165	R156-V158 HydrophobicContact CG-CG2 4.03Å; R156-V158 PolarHBondContact O-N 2.78Å; R156-V163 PolarHBondContact N-O 2.78Å; R156-V163 PolarHBondContact O-N 2.79Å; R156-T165 HydrophobicContact CB-CG2 3.45Å; R156-T165 VanDerWaalsContact CB-CG2 3.45Å
157	A	83.6	Confident	78.5	Confident	41 Å²	41	60 Å²	60	34%	0.339	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	118.2	167.9	0	0	0	0	0	110.2	E161 M162 S195	A157-E161 CarbonylContact C-O 3.59Å; A157-E161 WeakPolarHBondContact CA-O 3.37Å; A157-M162 HydrophobicContact CB-SD 3.99Å; A157-S195 WeakPolarHBondContact CB-O 2.97Å
158	V	77.1	Confident	78.5	Confident	62 Å²	62	58.1 Å²	58.1	38%	0.376	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	120.8	173.9	-177	0	0	0	0	107.2	R156 G160 E161 V163	R156-V158 HydrophobicContact CG-CG2 4.03Å; R156-V158 PolarHBondContact O-N 2.78Å; V158-G160 PolarHBondContact O-N 3.35Å; V158-G160 VanDerWaalsContact O-N 3.15Å; V158-E161 PolarHBondContact N-O 3.39Å; V158-E161 PolarHBondContact O-N 3.29Å; V158-V163 HydrophobicContact CB-CG2 3.87Å; V158-V163 HydrophobicContact CG2-CB 4.41Å; V158-V163 HydrophobicContact CG2-CG2 4.03Å
159	N	77.1	Confident	78.4	Confident	165 Å²	165	58.6 Å²	58.6	88%	0.882	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	32.6	-178.6	-58.1	-21.1	0	0	0	114.7	E161	N159-E161 VanDerWaalsContact C-N 3.3Å
160	G	75.3	Confident	77.9	Confident	52 Å²	52	56.8 Å²	56.8	54%	0.536	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.8	2.3	-177.7	0	0	0	0	0	114.6	V158	V158-G160 PolarHBondContact O-N 3.35Å; V158-G160 VanDerWaalsContact O-N 3.15Å
161	E	82.8	Confident	77.9	Confident	67 Å²	67	52.7 Å²	52.7	31%	0.313	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	144.9	178.5	-60.7	-167.9	156.9	0	0	111.9	A157 V158 N159 V163 V184 R186	A157-E161 CarbonylContact C-O 3.59Å; A157-E161 WeakPolarHBondContact CA-O 3.37Å; V158-E161 PolarHBondContact N-O 3.39Å; V158-E161 PolarHBondContact O-N 3.29Å; N159-E161 VanDerWaalsContact C-N 3.3Å; E161-V163 PolarHBondContact O-N 2.84Å; E161-V184 HydrophobicContact CB-CG1 3.76Å; E161-V184 HydrophobicContact CG-CG1 4.43Å; E161-R186 IonicContact OE1-CZ 3.32Å; E161-R186 VanDerWaalsContact OE1-CZ 3.32Å; E161-R186 IonicContact OE1-NH1 3.56Å; E161-R186 IonicContact OE1-NH2 2.63Å; E161-R186 PolarHBondContact OE1-NH2 3.49Å
162	M	83.9	Confident	77.9	Confident	3 Å²	3	53 Å²	53	2%	0.015	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	100.6	-178.6	-76	-58.6	-67.2	0	0	111.3	F155 A157 V184 I185 V193 G194 P197 L200	F155-M162 HydrophobicContact CB-CE 3.56Å; F155-M162 HydrophobicContact CG-CE 4.44Å; A157-M162 HydrophobicContact CB-SD 3.99Å; M162-V184 CarbonylContact O-C 3.47Å; M162-V184 WeakPolarHBondContact O-CA 3.37Å; M162-I185 PolarHBondContact O-N 2.98Å; M162-V193 HydrophobicContact CB-CG1 3.78Å; M162-V193 HydrophobicContact CG-CG1 3.46Å; M162-V193 VanDerWaalsContact CG-CG1 3.46Å; M162-G194 WeakPolarHBondContact CG-O 2.88Å; M162-P197 HydrophobicContact CE-CB 3.79Å; M162-P197 HydrophobicContact SD-CB 4.39Å; M162-L200 HydrophobicContact CB-CD2 4.33Å; M162-L200 HydrophobicContact CE-CB 4.17Å; M162-L200 HydrophobicContact CE-CD2 3.48Å; M162-L200 VanDerWaalsContact CE-CD2 3.48Å; M162-L200 HydrophobicContact CE-CG 4.45Å; M162-L200 HydrophobicContact CG-CD2 4.41Å
163	V	85.6	Confident	78	Confident	28 Å²	28	52.8 Å²	52.8	17%	0.17	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	134.5	-175.2	-169.4	0	0	0	0	110.8	F155 R156 V158 E161 T165 V184	F155-V163 CarbonylContact C-O 3.56Å; F155-V163 VanDerWaalsContact CA-O 3.26Å; F155-V163 WeakPolarHBondContact CA-O 3.48Å; R156-V163 PolarHBondContact N-O 2.78Å; R156-V163 PolarHBondContact O-N 2.79Å; V158-V163 HydrophobicContact CB-CG2 3.87Å; V158-V163 HydrophobicContact CG2-CB 4.41Å; V158-V163 HydrophobicContact CG2-CG2 4.03Å; E161-V163 PolarHBondContact O-N 2.84Å; V163-T165 PolarHBondContact O-N 2.87Å; V163-V184 HydrophobicContact CG2-CG2 4.21Å
164	V	84.4	Confident	77.6	Confident	1 Å²	1	54.5 Å²	54.5	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	118	171.2	179.1	0	0	0	0	109.4	V153 F155 I167 L179 G182 D183 I185	V153-V164 HydrophobicContact CG1-CB 4.5Å; V153-V164 HydrophobicContact CG1-CG1 3.54Å; V153-V164 HydrophobicContact CG1-CG2 4.34Å; F155-V164 HydrophobicContact CD1-CG2 3.9Å; F155-V164 HydrophobicContact CE1-CG2 3.92Å; V164-I167 HydrophobicContact CG1-CG1 4.12Å; V164-L179 HydrophobicContact CG1-CD2 4.4Å; V164-L179 HydrophobicContact CG2-CD1 4.21Å; V164-L179 HydrophobicContact CG2-CD2 3.78Å; V164-L179 HydrophobicContact CG2-CG 4.04Å; V164-G182 PolarHBondContact O-N 3.12Å; V164-D183 HydrophobicContact CG2-CB 4.17Å; V164-D183 WeakPolarHBondContact CG2-O 3.1Å; V164-D183 PolarHBondContact N-O 2.91Å; V164-I185 HydrophobicContact CG2-CD1 4.16Å; V164-I185 HydrophobicContact CG2-CG1 4.18Å
165	T	78.6	Confident	77.4	Confident	58 Å²	58	60.3 Å²	60.3	36%	0.356	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-28.6	-178.6	51.1	0	0	0	0	113.4	T154 R156 V163 T181	T154-T165 PolarHBondContact O-N 3.01Å; T154-T165 PolarHBondContact O-OG1 3Å; T154-T165 VanDerWaalsContact O-OG1 3.07Å; T154-T165 PolarHBondContact OG1-OG1 2.85Å; R156-T165 HydrophobicContact CB-CG2 3.45Å; R156-T165 VanDerWaalsContact CB-CG2 3.45Å; V163-T165 PolarHBondContact O-N 2.87Å; T165-T181 VanDerWaalsContact O-CG2 3.26Å; T165-T181 WeakPolarHBondContact O-CG2 3.47Å
166	R	72.8	Confident	76.8	Confident	83 Å²	83	61.9 Å²	61.9	31%	0.313	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	146.7	-178.5	-157.4	-175.5	-178.6	152.9	11.9	111.2	V153 T154 N263 D265	V153-R166 CarbonylContact C-O 3.52Å; V153-R166 WeakPolarHBondContact CA-O 3.38Å; V153-R166 WeakPolarHBondContact CG1-O 3.24Å; T154-R166 PolarHBondContact N-O 3.39Å; T154-R166 PolarHBondContact O-N 3.37Å; T154-R166 WeakPolarHBondContact OG1-CB 3.17Å; T154-R166 PolarHBondContact OG1-N 2.83Å; R166-N263 PolarHBondContact NH2-ND2 2.78Å; R166-N263 PolarHBondContact NH2-OD1 3.41Å; R166-D265 IonicContact CZ-OD2 3.46Å; R166-D265 IonicContact NH1-OD2 3.15Å; R166-D265 PolarHBondContact NH1-OD2 3.06Å; R166-D265 IonicContact NH2-OD1 3.65Å; R166-D265 IonicContact NH2-OD2 2.92Å; R166-D265 PolarHBondContact NH2-OD2 3.42Å
167	I	77.9	Confident	76.3	Confident	36 Å²	36	56.3 Å²	56.3	19%	0.185	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	127	168.9	-58.6	172.6	0	0	0	107.3	V153 V164 I173 D174 L179	V153-I167 HydrophobicContact CG1-CG1 4.35Å; V153-I167 HydrophobicContact CG2-CG1 4.38Å; V164-I167 HydrophobicContact CG1-CG1 4.12Å; I167-I173 HydrophobicContact CD1-CG2 4.09Å; I167-I173 HydrophobicContact CG1-CG2 4.38Å; I167-I173 HydrophobicContact CG2-CB 4.29Å; I167-I173 HydrophobicContact CG2-CG2 3.89Å; I167-D174 HydrophobicContact CG2-CB 3.95Å; I167-L179 WeakPolarHBondContact CD1-O 3.48Å
168	L	72.2	Confident	75.9	Confident	82 Å²	82	57.9 Å²	57.9	43%	0.429	32%	0.318	S	S	.	.			trans	-77.1	126.9	177.9	-61.7	-178.2	0	0	0	109.3	G152 S171 D174	G152-L168 WeakPolarHBondContact O-CB 3.37Å; G152-L168 PolarHBondContact O-N 3.07Å; L168-S171 WeakPolarHBondContact O-CB 3.35Å; L168-S171 PolarHBondContact O-N 3.28Å; L168-S171 PolarHBondContact O-OG 3.36Å; L168-D174 WeakPolarHBondContact O-CB 3.29Å
169	H	63.3	Low	76.2	Confident	85 Å²	85	55.1 Å²	55.1	39%	0.394	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	137.7	-179.6	-164.8	58.6	0	0	0	111.6	S171 D174 V262	H169-S171 VanDerWaalsContact C-N 3.27Å; H169-S171 PolarHBondContact O-N 2.78Å; H169-D174 IonicContact CE1-OD2 2.76Å; H169-D174 PolarHBondContact CE1-OD2 3.18Å; H169-D174 IonicContact CG-OD2 3.54Å; H169-D174 IonicContact ND1-OD1 2.67Å; H169-D174 PolarHBondContact ND1-OD1 2.75Å; H169-D174 VanDerWaalsContact ND1-OD1 3.15Å; H169-D174 IonicContact ND1-OD2 3.75Å; H169-D174 PolarHBondContact ND1-OD2 2.77Å; H169-V262 HydrophobicContact CB-CG1 3.82Å
170	G	66.1	Low	76.3	Confident	32 Å²	32	51.9 Å²	51.9	33%	0.33	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	-3.8	-174.9	0	0	0	0	0	115.1	D174 R175	G170-D174 PolarHBondContact N-OD2 3.33Å; G170-R175 PolarHBondContact O-NE 2.99Å; G170-R175 PolarHBondContact O-NH2 3.24Å
171	S	75.3	Confident	76.5	Confident	12 Å²	12	53 Å²	53	8%	0.084	28%	0.276	C	S	.	.	S	Bend	trans	-68.7	167.2	173.6	69.9	0	0	0	0	112.6	L151 L168 H169 I173 D174 R175	L151-S171 WeakPolarHBondContact O-CB 3.47Å; L151-S171 PolarHBondContact O-OG 3.48Å; L168-S171 WeakPolarHBondContact O-CB 3.35Å; L168-S171 PolarHBondContact O-N 3.28Å; L168-S171 PolarHBondContact O-OG 3.36Å; H169-S171 VanDerWaalsContact C-N 3.27Å; H169-S171 PolarHBondContact O-N 2.78Å; S171-I173 PolarHBondContact O-N 2.9Å; S171-D174 PolarHBondContact O-N 2.82Å; S171-D174 WeakPolarHBondContact OG-CB 3.4Å; S171-D174 PolarHBondContact OG-N 3.19Å; S171-R175 WeakPolarHBondContact O-CG 3.38Å; S171-R175 PolarHBondContact O-N 3.2Å; S171-R175 VanDerWaalsContact O-N 3.08Å
172	S	74.4	Confident	76.1	Confident	19 Å²	19	50.7 Å²	50.7	13%	0.133	27%	0.271	C	S	.	.	H	α-helix	trans	-59.1	-35.1	177	-63.5	0	0	0	0	112	Q176	S172-Q176 WeakPolarHBondContact O-CG 3.39Å; S172-Q176 PolarHBondContact O-N 3.26Å
173	I	79.1	Confident	76.2	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.015	27%	0.271	C	S	.	.	H	α-helix	trans	-73	-44.1	178.4	-64.3	-64.5	0	0	0	111.8	I143 L151 V153 I167 S171 R175 Q176 G177 L179	I143-I173 HydrophobicContact CB-CD1 4.24Å; I143-I173 HydrophobicContact CD1-CD1 3.32Å; I143-I173 HydrophobicContact CG1-CD1 3.51Å; I143-I173 HydrophobicContact CG2-CD1 3.67Å; L151-I173 HydrophobicContact CB-CG1 4.09Å; L151-I173 HydrophobicContact CD2-CD1 4.41Å; L151-I173 HydrophobicContact CD2-CG1 4.43Å; L151-I173 WeakPolarHBondContact O-CG1 3.37Å; V153-I173 HydrophobicContact CG2-CB 3.76Å; V153-I173 HydrophobicContact CG2-CG1 3.57Å; V153-I173 HydrophobicContact CG2-CG2 3.75Å; I167-I173 HydrophobicContact CD1-CG2 4.09Å; I167-I173 HydrophobicContact CG1-CG2 4.38Å; I167-I173 HydrophobicContact CG2-CB 4.29Å; I167-I173 HydrophobicContact CG2-CG2 3.89Å; S171-I173 PolarHBondContact O-N 2.9Å; I173-R175 VanDerWaalsContact C-N 3.32Å; I173-R175 PolarHBondContact O-N 3.48Å; I173-Q176 PolarHBondContact O-N 2.8Å; I173-G177 PolarHBondContact O-N 3.01Å; I173-L179 HydrophobicContact CG2-CB 3.71Å; I173-L179 HydrophobicContact CG2-CD2 4.17Å
174	D	73.4	Confident	76.3	Confident	56 Å²	56	50.2 Å²	50.2	30%	0.299	27%	0.268	S	S	.	.	H	α-helix	trans	-60	-40.4	177.2	178.8	76.1	0	0	0	112	I167 L168 H169 G170 S171 Q176	I167-D174 HydrophobicContact CG2-CB 3.95Å; L168-D174 WeakPolarHBondContact O-CB 3.29Å; H169-D174 IonicContact CE1-OD2 2.76Å; H169-D174 PolarHBondContact CE1-OD2 3.18Å; H169-D174 IonicContact CG-OD2 3.54Å; H169-D174 IonicContact ND1-OD1 2.67Å; H169-D174 PolarHBondContact ND1-OD1 2.75Å; H169-D174 VanDerWaalsContact ND1-OD1 3.15Å; H169-D174 IonicContact ND1-OD2 3.75Å; H169-D174 PolarHBondContact ND1-OD2 2.77Å; G170-D174 PolarHBondContact N-OD2 3.33Å; S171-D174 PolarHBondContact O-N 2.82Å; S171-D174 WeakPolarHBondContact OG-CB 3.4Å; S171-D174 PolarHBondContact OG-N 3.19Å; D174-Q176 PolarHBondContact O-N 3.16Å
175	R	75.1	Confident	76.4	Confident	180 Å²	180	50.3 Å²	50.3	68%	0.679	27%	0.269	S	S	*	.	H	α-helix	trans	-69.6	-31	177.9	-66.8	-179.6	-146.5	174	6.7	113.8	G170 S171 I173	G170-R175 PolarHBondContact O-NE 2.99Å; G170-R175 PolarHBondContact O-NH2 3.24Å; S171-R175 WeakPolarHBondContact O-CG 3.38Å; S171-R175 PolarHBondContact O-N 3.2Å; S171-R175 VanDerWaalsContact O-N 3.08Å; I173-R175 VanDerWaalsContact C-N 3.32Å; I173-R175 PolarHBondContact O-N 3.48Å
176	Q	73.7	Confident	76.8	Confident	74 Å²	74	52.7 Å²	52.7	35%	0.346	27%	0.271	S	S	.	.	H	α-helix	trans	-85.2	-26.4	-179.5	-72.5	-175.7	-12.7	0	0	112.3	S172 I173 D174 M178	S172-Q176 WeakPolarHBondContact O-CG 3.39Å; S172-Q176 PolarHBondContact O-N 3.26Å; I173-Q176 PolarHBondContact O-N 2.8Å; D174-Q176 PolarHBondContact O-N 3.16Å; Q176-M178 HydrophobicContact CB-CG 4.27Å; Q176-M178 WeakPolarHBondContact O-CG 3.27Å; Q176-M178 PolarHBondContact O-N 3.27Å; Q176-M178 VanDerWaalsContact O-N 3.16Å
177	G	70.9	Confident	77.6	Confident	43 Å²	43	50.7 Å²	50.7	44%	0.443	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.6	18.7	176.5	0	0	0	0	0	114.6	I173 H180	I173-G177 PolarHBondContact O-N 3.01Å; G177-H180 PolarHBondContact O-CE1 2.93Å
178	M	75.9	Confident	78	Confident	74 Å²	74	49 Å²	49	37%	0.365	26%	0.256	S	S	.	.			trans	-91.8	-19.8	-173.4	-63.2	-153.8	-74.8	0	0	114.2	R139 I141 G142 Q176	R139-M178 PolarHBondContact NH2-O 3.43Å; I141-M178 WeakPolarHBondContact CD1-O 3.47Å; I141-M178 HydrophobicContact CG2-CB 3.54Å; I141-M178 HydrophobicContact CG2-CE 3.72Å; I141-M178 HydrophobicContact CG2-CG 4.43Å; I141-M178 HydrophobicContact CG2-SD 4.18Å; G142-M178 WeakPolarHBondContact O-CE 3.36Å; Q176-M178 HydrophobicContact CB-CG 4.27Å; Q176-M178 WeakPolarHBondContact O-CG 3.27Å; Q176-M178 PolarHBondContact O-N 3.27Å; Q176-M178 VanDerWaalsContact O-N 3.16Å
179	L	81.8	Confident	78.6	Confident	5 Å²	5	48.6 Å²	48.6	3%	0.026	26%	0.255	C	S	.	.			trans	-113.6	141	177.5	-166.6	73.5	0	0	0	108.6	I141 V153 V164 I167 I173 D183 V215	I141-L179 HydrophobicContact CD1-CB 4.38Å; I141-L179 HydrophobicContact CD1-CD1 3.72Å; V153-L179 HydrophobicContact CG1-CD2 4.05Å; V153-L179 HydrophobicContact CG2-CD2 4.16Å; V164-L179 HydrophobicContact CG1-CD2 4.4Å; V164-L179 HydrophobicContact CG2-CD1 4.21Å; V164-L179 HydrophobicContact CG2-CD2 3.78Å; V164-L179 HydrophobicContact CG2-CG 4.04Å; I167-L179 WeakPolarHBondContact CD1-O 3.48Å; I173-L179 HydrophobicContact CG2-CB 3.71Å; I173-L179 HydrophobicContact CG2-CD2 4.17Å; L179-D183 HydrophobicContact CD1-CB 3.99Å; L179-V215 HydrophobicContact CD1-CG1 3.79Å
180	H	79.4	Confident	79.4	Confident	97 Å²	97	47.4 Å²	47.4	45%	0.449	27%	0.265	S	S	.	.			trans	-122.8	154.8	-178.6	-61.1	79.2	0	0	0	111.1	G177 G182 D183	G177-H180 PolarHBondContact O-CE1 2.93Å; H180-G182 PolarHBondContact O-N 2.96Å; H180-D183 PolarHBondContact N-OD2 3.5Å; H180-D183 VanDerWaalsContact O-CB 3.32Å; H180-D183 WeakPolarHBondContact O-CB 3.45Å; H180-D183 PolarHBondContact O-N 3.43Å; H180-D183 VanDerWaalsContact O-N 3.14Å
181	T	80.1	Confident	80.2	Confident	74 Å²	74	51.3 Å²	51.3	45%	0.454	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	131.7	170	-54.1	0	0	0	0	109.4	T165	T165-T181 VanDerWaalsContact O-CG2 3.26Å; T165-T181 WeakPolarHBondContact O-CG2 3.47Å
182	G	74.6	Confident	80.5	Confident	20 Å²	20	58.8 Å²	58.8	21%	0.206	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	96.4	-14.8	-174.3	0	0	0	0	0	114.3	V164 H180 S218	V164-G182 PolarHBondContact O-N 3.12Å; H180-G182 PolarHBondContact O-N 2.96Å; G182-S218 WeakPolarHBondContact O-CB 3.19Å
183	D	84.8	Confident	80.9	Confident	3 Å²	3	59.3 Å²	59.3	2%	0.016	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-60.6	140.6	173.6	-74.6	-11.6	0	0	0	110.6	R139 V164 L179 H180 P217 S218	R139-D183 IonicContact NH2-OD1 3.28Å; R139-D183 IonicContact NH2-OD2 3.53Å; R139-D183 PolarHBondContact NH2-OD2 2.8Å; V164-D183 HydrophobicContact CG2-CB 4.17Å; V164-D183 WeakPolarHBondContact CG2-O 3.1Å; V164-D183 PolarHBondContact N-O 2.91Å; L179-D183 HydrophobicContact CD1-CB 3.99Å; H180-D183 PolarHBondContact N-OD2 3.5Å; H180-D183 VanDerWaalsContact O-CB 3.32Å; H180-D183 WeakPolarHBondContact O-CB 3.45Å; H180-D183 PolarHBondContact O-N 3.43Å; H180-D183 VanDerWaalsContact O-N 3.14Å; D183-P217 WeakPolarHBondContact OD1-CA 3.32Å; D183-S218 PolarHBondContact OD1-N 3.3Å
184	V	87.6	Confident	80.9	Confident	17 Å²	17	61 Å²	61	10%	0.103	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	123.3	177.3	-177.5	0	0	0	0	109.6	E161 M162 V163 V215 L216	E161-V184 HydrophobicContact CB-CG1 3.76Å; E161-V184 HydrophobicContact CG-CG1 4.43Å; M162-V184 CarbonylContact O-C 3.47Å; M162-V184 WeakPolarHBondContact O-CA 3.37Å; V163-V184 HydrophobicContact CG2-CG2 4.21Å; V184-V215 CarbonylContact O-C 3.57Å; V184-V215 WeakPolarHBondContact O-CA 3.29Å; V184-V215 WeakPolarHBondContact O-CB 3.47Å; V184-L216 HydrophobicContact CB-CB 4.21Å; V184-L216 PolarHBondContact N-O 3.25Å; V184-L216 PolarHBondContact O-N 2.88Å
185	I	87.7	Confident	81.1	Confident	3 Å²	3	62 Å²	62	2%	0.015	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	120.5	178.1	-53.6	-176.3	0	0	0	109.2	F155 M162 V164 V188 V193 L200 L213 V215	F155-I185 HydrophobicContact CD1-CD1 3.65Å; F155-I185 HydrophobicContact CE1-CD1 3.21Å; F155-I185 HydrophobicContact CE1-CG1 4.46Å; F155-I185 HydrophobicContact CZ-CD1 3.95Å; M162-I185 PolarHBondContact O-N 2.98Å; V164-I185 HydrophobicContact CG2-CD1 4.16Å; V164-I185 HydrophobicContact CG2-CG1 4.18Å; I185-V188 HydrophobicContact CG2-CG2 4.04Å; I185-V193 HydrophobicContact CG2-CG2 3.89Å; I185-L200 HydrophobicContact CD1-CD2 4.49Å; I185-L213 HydrophobicContact CD1-CD1 4.37Å; I185-L213 HydrophobicContact CG2-CD2 4.34Å; I185-V215 HydrophobicContact CG1-CG1 4.12Å
186	R	87.1	Confident	81.4	Confident	108 Å²	108	56 Å²	56	41%	0.408	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	-41.4	177.4	-71.7	-68.7	-168.2	177.2	-3.1	112.6	E161 V193 K214 L216	E161-R186 IonicContact OE1-CZ 3.32Å; E161-R186 VanDerWaalsContact OE1-CZ 3.32Å; E161-R186 IonicContact OE1-NH1 3.56Å; E161-R186 IonicContact OE1-NH2 2.63Å; E161-R186 PolarHBondContact OE1-NH2 3.49Å; R186-V193 PolarHBondContact O-N 3.46Å; R186-K214 PolarHBondContact N-O 3.13Å; R186-L216 HydrophobicContact CG-CD1 4.08Å; R186-L216 HydrophobicContact CG-CG 4.14Å
187	E	88.4	Confident	81.7	Confident	41 Å²	41	55 Å²	55	19%	0.192	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	147.3	-178.7	-59.7	173.8	-152.4	0	0	111.8	Q191 E192 L213 K214	E187-Q191 CarbonylContact C-O 3.46Å; E187-Q191 WeakPolarHBondContact CA-O 3.49Å; E187-E192 HydrophobicContact CG-CG 4.36Å; E187-L213 CarbonylContact O-C 3.57Å; E187-L213 WeakPolarHBondContact O-CA 3.21Å; E187-K214 HydrophobicContact CB-CB 3.97Å; E187-K214 HydrophobicContact CB-CD 4.45Å; E187-K214 HydrophobicContact CB-CG 4.13Å; E187-K214 HydrophobicContact CG-CB 4.42Å; E187-K214 HydrophobicContact CG-CD 4.37Å; E187-K214 PolarHBondContact N-O 2.92Å; E187-K214 PolarHBondContact O-N 3.09Å; E187-K214 IonicContact OE1-NZ 2.83Å; E187-K214 PolarHBondContact OE1-NZ 3.09Å; E187-K214 VanDerWaalsContact OE2-CD 3.29Å; E187-K214 WeakPolarHBondContact OE2-CD 3.44Å; E187-K214 WeakPolarHBondContact OE2-CE 3.32Å; E187-K214 IonicContact OE2-NZ 2.73Å; E187-K214 PolarHBondContact OE2-NZ 2.82Å
188	V	86.9	Confident	82.1	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	121	168.1	-177.8	0	0	0	0	108.5	I185 G190 Q191 V193 L200 L203 L204 V211 T212 L213	I185-V188 HydrophobicContact CG2-CG2 4.04Å; V188-G190 PolarHBondContact O-N 2.96Å; V188-G190 VanDerWaalsContact O-N 3.11Å; V188-Q191 PolarHBondContact N-O 3.16Å; V188-Q191 PolarHBondContact O-N 3.21Å; V188-V193 HydrophobicContact CG2-CG2 3.67Å; V188-L200 HydrophobicContact CG2-CD1 3.57Å; V188-L203 HydrophobicContact CB-CD2 3.64Å; V188-L203 HydrophobicContact CG1-CD2 3.95Å; V188-L203 HydrophobicContact CG2-CD2 4.17Å; V188-L204 HydrophobicContact CG1-CD2 3.68Å; V188-L204 HydrophobicContact CG2-CD2 4.22Å; V188-V211 HydrophobicContact CG1-CG1 3.9Å; V188-T212 CarbonylContact C-O 3.59Å; V188-T212 WeakPolarHBondContact CA-O 3.27Å; V188-L213 HydrophobicContact CB-CD2 4.01Å; V188-L213 HydrophobicContact CG1-CD2 3.87Å; V188-L213 HydrophobicContact CG2-CD2 3.46Å; V188-L213 VanDerWaalsContact CG2-CD2 3.46Å
189	N	85.8	Confident	82.4	Confident	75 Å²	75	61.1 Å²	61.1	40%	0.401	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	32.8	-178.6	-68.5	-21.4	0	0	0	113.8	Q191 C207 V211 T212	N189-Q191 VanDerWaalsContact C-N 3.32Å; N189-C207 PolarHBondContact ND2-SG 3.01Å; N189-V211 WeakPolarHBondContact OD1-CA 3.48Å; N189-T212 PolarHBondContact N-O 3.27Å; N189-T212 PolarHBondContact OD1-N 3.21Å
190	G	79.2	Confident	82.4	Confident	59 Å²	59	61.1 Å²	61.1	61%	0.608	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	81	4.7	-178.2	0	0	0	0	0	115.1	V188	V188-G190 PolarHBondContact O-N 2.96Å; V188-G190 VanDerWaalsContact O-N 3.11Å
191	Q	82.8	Confident	82.4	Confident	115 Å²	115	61.8 Å²	61.8	54%	0.537	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	130.3	169.3	-67.6	-172	-24.4	0	0	110.2	E187 V188 N189	E187-Q191 CarbonylContact C-O 3.46Å; E187-Q191 WeakPolarHBondContact CA-O 3.49Å; V188-Q191 PolarHBondContact N-O 3.16Å; V188-Q191 PolarHBondContact O-N 3.21Å; N189-Q191 VanDerWaalsContact C-N 3.32Å
192	E	81.8	Confident	82.4	Confident	169 Å²	169	64.3 Å²	64.3	79%	0.79	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.6	138.3	174.7	-74.3	-171.3	166.6	0	0	110.9	E187	E187-E192 HydrophobicContact CG-CG 4.36Å
193	V	83.7	Confident	82.8	Confident	29 Å²	29	65.5 Å²	65.5	18%	0.176	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-88.9	118.1	179.3	176.8	0	0	0	0	109	M162 I185 R186 V188 L200	M162-V193 HydrophobicContact CB-CG1 3.78Å; M162-V193 HydrophobicContact CG-CG1 3.46Å; M162-V193 VanDerWaalsContact CG-CG1 3.46Å; I185-V193 HydrophobicContact CG2-CG2 3.89Å; R186-V193 PolarHBondContact O-N 3.46Å; V188-V193 HydrophobicContact CG2-CG2 3.67Å; V193-L200 HydrophobicContact CG1-CB 4.31Å; V193-L200 HydrophobicContact CG1-CD1 3.9Å; V193-L200 HydrophobicContact CG1-CD2 3.96Å; V193-L200 HydrophobicContact CG1-CG 4.27Å; V193-L200 HydrophobicContact CG2-CD1 3.8Å
194	G	77.8	Confident	82.5	Confident	38 Å²	38	65.9 Å²	65.9	39%	0.392	35%	0.351	S	S	.	.			trans	-70.6	175.3	173	0	0	0	0	0	113	M162 N196	M162-G194 WeakPolarHBondContact CG-O 2.88Å; G194-N196 PolarHBondContact O-N 3.26Å
195	S	78.5	Confident	82.1	Confident	77 Å²	77	72.9 Å²	72.9	54%	0.538	38%	0.376	S	S	.	.	S	Bend	trans	-79.4	2.5	179.8	38.9	0	0	0	0	114.1	A157	A157-S195 WeakPolarHBondContact CB-O 2.97Å
196	N	81.3	Confident	81.6	Confident	56 Å²	56	79 Å²	79	30%	0.299	41%	0.409	S	S	.	.			trans	-98	116.3	179	-170.9	1	0	0	0	111.5	G194 E198 E199 L200	G194-N196 PolarHBondContact O-N 3.26Å; N196-E198 VanDerWaalsContact C-N 3.29Å; N196-E198 PolarHBondContact O-N 3.2Å; N196-E198 PolarHBondContact OD1-N 2.81Å; N196-E199 HydrophobicContact CB-CB 4.29Å; N196-E199 HydrophobicContact CB-CG 4.07Å; N196-E199 WeakPolarHBondContact CB-OE1 3.41Å; N196-E199 PolarHBondContact ND2-OE1 3.32Å; N196-E199 PolarHBondContact O-N 3.08Å; N196-L200 PolarHBondContact O-N 3.06Å
197	P	80.1	Confident	81.2	Confident	51 Å²	51	74.9 Å²	74.9	33%	0.331	40%	0.396	S	S	.	.	H	α-helix	trans	-65.4	-28.1	-179.6	24.8	-33.7	0	0	0	114.2	M162 Q201	M162-P197 HydrophobicContact CE-CB 3.79Å; M162-P197 HydrophobicContact SD-CB 4.39Å; P197-Q201 WeakPolarHBondContact O-CB 3.41Å; P197-Q201 PolarHBondContact O-N 3.13Å
198	E	79.6	Confident	80.5	Confident	135 Å²	135	76.2 Å²	76.2	63%	0.631	41%	0.41	S	S	*	.	H	α-helix	trans	-69.3	-40.4	-179.4	-64.9	178.6	172.9	0	0	111.3	N196 Q201 E202	N196-E198 VanDerWaalsContact C-N 3.29Å; N196-E198 PolarHBondContact O-N 3.2Å; N196-E198 PolarHBondContact OD1-N 2.81Å; E198-Q201 WeakPolarHBondContact O-CB 3.33Å; E198-Q201 PolarHBondContact O-N 3.36Å; E198-Q201 VanDerWaalsContact O-N 3.17Å; E198-E202 PolarHBondContact O-N 2.94Å
199	E	81.9	Confident	80.3	Confident	111 Å²	111	77.7 Å²	77.7	52%	0.519	43%	0.425	S	S	.	.	H	α-helix	trans	-62.7	-44.6	176.2	-73.2	167	-149.2	0	0	111.6	N196 Q201 E202 L203	N196-E199 HydrophobicContact CB-CB 4.29Å; N196-E199 HydrophobicContact CB-CG 4.07Å; N196-E199 WeakPolarHBondContact CB-OE1 3.41Å; N196-E199 PolarHBondContact ND2-OE1 3.32Å; N196-E199 PolarHBondContact O-N 3.08Å; E199-Q201 VanDerWaalsContact C-N 3.27Å; E199-Q201 PolarHBondContact O-N 3.45Å; E199-E202 PolarHBondContact O-N 3.19Å; E199-L203 WeakPolarHBondContact O-CB 3.48Å; E199-L203 PolarHBondContact O-N 2.83Å
200	L	81.2	Confident	80	Confident	5 Å²	5	77.5 Å²	77.5	3%	0.026	43%	0.429	C	S	.	.	H	α-helix	trans	-62.2	-38.2	174.9	-179.4	60.9	0	0	0	111.4	F155 M162 I185 V188 V193 N196 L203 L204	F155-L200 HydrophobicContact CB-CD2 4.33Å; F155-L200 HydrophobicContact CD1-CD2 4.39Å; F155-L200 HydrophobicContact CD2-CD2 3.88Å; F155-L200 HydrophobicContact CE2-CD2 4.29Å; F155-L200 HydrophobicContact CG-CD2 3.93Å; M162-L200 HydrophobicContact CB-CD2 4.33Å; M162-L200 HydrophobicContact CE-CB 4.17Å; M162-L200 HydrophobicContact CE-CD2 3.48Å; M162-L200 VanDerWaalsContact CE-CD2 3.48Å; M162-L200 HydrophobicContact CE-CG 4.45Å; M162-L200 HydrophobicContact CG-CD2 4.41Å; I185-L200 HydrophobicContact CD1-CD2 4.49Å; V188-L200 HydrophobicContact CG2-CD1 3.57Å; V193-L200 HydrophobicContact CG1-CB 4.31Å; V193-L200 HydrophobicContact CG1-CD1 3.9Å; V193-L200 HydrophobicContact CG1-CD2 3.96Å; V193-L200 HydrophobicContact CG1-CG 4.27Å; V193-L200 HydrophobicContact CG2-CD1 3.8Å; N196-L200 PolarHBondContact O-N 3.06Å; L200-L203 PolarHBondContact O-N 3.43Å; L200-L204 HydrophobicContact CD1-CD1 3.99Å; L200-L204 HydrophobicContact CD1-CG 4.08Å; L200-L204 HydrophobicContact CG-CD1 3.92Å; L200-L204 HydrophobicContact CG-CG 4.41Å; L200-L204 WeakPolarHBondContact O-CB 3.36Å; L200-L204 VanDerWaalsContact O-CG 3.27Å; L200-L204 WeakPolarHBondContact O-CG 3.22Å; L200-L204 PolarHBondContact O-N 3.01Å
201	Q	80.1	Confident	80.3	Confident	112 Å²	112	74.7 Å²	74.7	52%	0.523	40%	0.401	S	S	.	.	H	α-helix	trans	-67.3	-40.7	178.5	-169.8	-179.8	-4.2	0	0	111.9	P197 E198 E199 R205	P197-Q201 WeakPolarHBondContact O-CB 3.41Å; P197-Q201 PolarHBondContact O-N 3.13Å; E198-Q201 WeakPolarHBondContact O-CB 3.33Å; E198-Q201 PolarHBondContact O-N 3.36Å; E198-Q201 VanDerWaalsContact O-N 3.17Å; E199-Q201 VanDerWaalsContact C-N 3.27Å; E199-Q201 PolarHBondContact O-N 3.45Å; Q201-R205 VanDerWaalsContact O-CB 3.25Å; Q201-R205 WeakPolarHBondContact O-CB 3.46Å; Q201-R205 PolarHBondContact O-N 3.02Å
202	E	80.1	Confident	80.5	Confident	126 Å²	126	71.8 Å²	71.8	59%	0.589	39%	0.391	S	S	*	.	H	α-helix	trans	-65.5	-43.8	173.5	-72.7	-165.4	162.6	0	0	112	E198 E199 L204 R205 N206	E198-E202 PolarHBondContact O-N 2.94Å; E199-E202 PolarHBondContact O-N 3.19Å; E202-L204 PolarHBondContact O-N 3.32Å; E202-R205 WeakPolarHBondContact O-CB 3.36Å; E202-R205 PolarHBondContact O-N 2.79Å; E202-R205 VanDerWaalsContact O-N 3.14Å; E202-N206 PolarHBondContact O-N 2.9Å; E202-N206 PolarHBondContact O-ND2 2.99Å
203	L	81.8	Confident	80.8	Confident	46 Å²	46	63.9 Å²	63.9	24%	0.241	35%	0.354	C	S	.	.	H	α-helix	trans	-57.8	-50.7	177.2	-164.6	82.4	0	0	0	111.3	V188 E199 L200 R205 N206 C207	V188-L203 HydrophobicContact CB-CD2 3.64Å; V188-L203 HydrophobicContact CG1-CD2 3.95Å; V188-L203 HydrophobicContact CG2-CD2 4.17Å; E199-L203 WeakPolarHBondContact O-CB 3.48Å; E199-L203 PolarHBondContact O-N 2.83Å; L200-L203 PolarHBondContact O-N 3.43Å; L203-R205 VanDerWaalsContact C-N 3.29Å; L203-R205 PolarHBondContact O-N 2.83Å; L203-N206 PolarHBondContact O-N 3.42Å; L203-C207 PolarHBondContact O-N 3.36Å; L203-C207 PolarHBondContact O-SG 2.91Å
204	L	78.9	Confident	80.9	Confident	11 Å²	11	66 Å²	66	6%	0.058	36%	0.361	C	S	.	.	H	α-helix	trans	-66.8	-30.9	178.1	-71	172.5	0	0	0	111.9	K145 L151 F155 V188 L200 E202 V211 L213	K145-L204 PolarHBondContact NZ-O 3.3Å; L151-L204 HydrophobicContact CD1-CD1 4.35Å; L151-L204 HydrophobicContact CD1-CD2 3.83Å; L151-L204 HydrophobicContact CD1-CG 4.5Å; F155-L204 HydrophobicContact CE2-CD1 3.57Å; F155-L204 HydrophobicContact CZ-CD1 3.79Å; V188-L204 HydrophobicContact CG1-CD2 3.68Å; V188-L204 HydrophobicContact CG2-CD2 4.22Å; L200-L204 HydrophobicContact CD1-CD1 3.99Å; L200-L204 HydrophobicContact CD1-CG 4.08Å; L200-L204 HydrophobicContact CG-CD1 3.92Å; L200-L204 HydrophobicContact CG-CG 4.41Å; L200-L204 WeakPolarHBondContact O-CB 3.36Å; L200-L204 VanDerWaalsContact O-CG 3.27Å; L200-L204 WeakPolarHBondContact O-CG 3.22Å; L200-L204 PolarHBondContact O-N 3.01Å; E202-L204 PolarHBondContact O-N 3.32Å; L204-V211 HydrophobicContact CD2-CG1 4.2Å; L204-L213 HydrophobicContact CD2-CD2 4.28Å
205	R	79.2	Confident	81.4	Confident	163 Å²	163	64.2 Å²	64.2	62%	0.615	34%	0.342	S	S	*	.	H	α-helix	trans	-65.2	-42.6	176.1	-170	-176.4	-55.4	-143.7	4.8	111.7	K145 Q201 E202 L203 C207	K145-R205 PolarHBondContact NZ-O 3.35Å; Q201-R205 VanDerWaalsContact O-CB 3.25Å; Q201-R205 WeakPolarHBondContact O-CB 3.46Å; Q201-R205 PolarHBondContact O-N 3.02Å; E202-R205 WeakPolarHBondContact O-CB 3.36Å; E202-R205 PolarHBondContact O-N 2.79Å; E202-R205 VanDerWaalsContact O-N 3.14Å; L203-R205 VanDerWaalsContact C-N 3.29Å; L203-R205 PolarHBondContact O-N 2.83Å; R205-C207 VanDerWaalsContact C-N 3.34Å
206	N	77.6	Confident	81.8	Confident	132 Å²	132	62.1 Å²	62.1	71%	0.706	33%	0.325	S	S	*	.	H	α-helix	trans	-76.8	-19.5	-177.8	-66.1	-20.7	0	0	0	113.3	E202 L203	E202-N206 PolarHBondContact O-N 2.9Å; E202-N206 PolarHBondContact O-ND2 2.99Å; L203-N206 PolarHBondContact O-N 3.42Å
207	C	77.9	Confident	81.7	Confident	21 Å²	21	60.6 Å²	60.6	14%	0.142	32%	0.318	C	S	.	.			trans	-69.7	141	172.7	-67.7	0	0	0	0	111.8	K145 N189 L203 R205 V211	K145-C207 WeakPolarHBondContact CD-O 3.46Å; K145-C207 WeakPolarHBondContact CE-O 3.3Å; K145-C207 PolarHBondContact NZ-O 3.47Å; N189-C207 PolarHBondContact ND2-SG 3.01Å; L203-C207 PolarHBondContact O-N 3.36Å; L203-C207 PolarHBondContact O-SG 2.91Å; R205-C207 VanDerWaalsContact C-N 3.34Å; C207-V211 HydrophobicContact CB-CG2 3.79Å
208	S	75.4	Confident	81.3	Confident	70 Å²	70	60.4 Å²	60.4	49%	0.49	32%	0.318	S	S	.	.			trans	-144.5	149.6	169.8	58.5	0	0	0	0	109.9
209	G	80.9	Confident	80.2	Confident	30 Å²	30	61.9 Å²	61.9	31%	0.309	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	83.2	-134.6	-173.2	0	0	0	0	0	112.6	K145 V211	K145-G209 PolarHBondContact N-O 2.93Å; K145-G209 PolarHBondContact O-N 3.46Å; G209-V211 PolarHBondContact O-N 3.31Å
210	S	81.1	Confident	78.9	Confident	71 Å²	71	66.5 Å²	66.5	50%	0.497	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	114.2	-177.4	-167.3	0	0	0	0	111.1	I143	I143-S210 CarbonylContact O-C 3.54Å; I143-S210 WeakPolarHBondContact O-CA 3.39Å
211	V	85.1	Confident	77.2	Confident	1 Å²	1	74 Å²	74	1%	0.006	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	124.4	175.5	-176.6	0	0	0	0	109	I143 K145 V188 N189 L204 C207 G209 L213	I143-V211 PolarHBondContact N-O 2.92Å; I143-V211 PolarHBondContact O-N 3.47Å; K145-V211 HydrophobicContact CB-CG2 3.92Å; K145-V211 HydrophobicContact CD-CG2 4.37Å; V188-V211 HydrophobicContact CG1-CG1 3.9Å; N189-V211 WeakPolarHBondContact OD1-CA 3.48Å; L204-V211 HydrophobicContact CD2-CG1 4.2Å; C207-V211 HydrophobicContact CB-CG2 3.79Å; G209-V211 PolarHBondContact O-N 3.31Å; V211-L213 HydrophobicContact CG1-CD2 4.19Å
212	T	86.4	Confident	75.7	Confident	54 Å²	54	71.8 Å²	71.8	33%	0.331	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	123.6	178.3	-50.2	0	0	0	0	109.5	V140 I141 V188 N189	V140-T212 HydrophobicContact CG1-CG2 3.35Å; I141-T212 CarbonylContact O-C 3.53Å; I141-T212 WeakPolarHBondContact O-CA 3.37Å; V188-T212 CarbonylContact C-O 3.59Å; V188-T212 WeakPolarHBondContact CA-O 3.27Å; N189-T212 PolarHBondContact N-O 3.27Å; N189-T212 PolarHBondContact OD1-N 3.21Å
213	L	87.9	Confident	74.3	Confident	3 Å²	3	71.4 Å²	71.4	2%	0.016	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	130	175.1	-58.3	179.3	0	0	0	109.5	V140 I141 I143 I185 E187 V188 L204 V211 V215	V140-L213 CarbonylContact C-O 3.57Å; V140-L213 WeakPolarHBondContact CA-O 3.49Å; I141-L213 HydrophobicContact CB-CB 4.49Å; I141-L213 PolarHBondContact N-O 3.25Å; I141-L213 PolarHBondContact O-N 3.06Å; I143-L213 HydrophobicContact CD1-CD1 3.27Å; I143-L213 HydrophobicContact CD1-CG 3.76Å; I185-L213 HydrophobicContact CD1-CD1 4.37Å; I185-L213 HydrophobicContact CG2-CD2 4.34Å; E187-L213 CarbonylContact O-C 3.57Å; E187-L213 WeakPolarHBondContact O-CA 3.21Å; V188-L213 HydrophobicContact CB-CD2 4.01Å; V188-L213 HydrophobicContact CG1-CD2 3.87Å; V188-L213 HydrophobicContact CG2-CD2 3.46Å; V188-L213 VanDerWaalsContact CG2-CD2 3.46Å; L204-L213 HydrophobicContact CD2-CD2 4.28Å; V211-L213 HydrophobicContact CG1-CD2 4.19Å; L213-V215 HydrophobicContact CB-CG1 4Å
214	K	86.9	Confident	72.8	Confident	73 Å²	73	73.3 Å²	73.3	32%	0.317	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	120.4	161.7	-63.5	-160.8	-167.5	145.7	0	108.6	V138 V140 R186 E187	V138-K214 HydrophobicContact CG1-CB 3.82Å; V138-K214 HydrophobicContact CG1-CD 4.12Å; V138-K214 HydrophobicContact CG1-CG 4.35Å; V140-K214 HydrophobicContact CG2-CG 4.19Å; R186-K214 PolarHBondContact N-O 3.13Å; E187-K214 HydrophobicContact CB-CB 3.97Å; E187-K214 HydrophobicContact CB-CD 4.45Å; E187-K214 HydrophobicContact CB-CG 4.13Å; E187-K214 HydrophobicContact CG-CB 4.42Å; E187-K214 HydrophobicContact CG-CD 4.37Å; E187-K214 PolarHBondContact N-O 2.92Å; E187-K214 PolarHBondContact O-N 3.09Å; E187-K214 IonicContact OE1-NZ 2.83Å; E187-K214 PolarHBondContact OE1-NZ 3.09Å; E187-K214 VanDerWaalsContact OE2-CD 3.29Å; E187-K214 WeakPolarHBondContact OE2-CD 3.44Å; E187-K214 WeakPolarHBondContact OE2-CE 3.32Å; E187-K214 IonicContact OE2-NZ 2.73Å; E187-K214 PolarHBondContact OE2-NZ 2.82Å
215	V	88.6	Confident	71.7	Confident	0 Å²	0	78 Å²	78	0%	0	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	142.9	-178	-52.2	0	0	0	0	111.1	R139 I141 L179 V184 I185 L213 P217	R139-V215 HydrophobicContact CB-CG2 4Å; R139-V215 PolarHBondContact N-O 3.05Å; R139-V215 PolarHBondContact O-N 3.05Å; I141-V215 HydrophobicContact CD1-CB 4.41Å; I141-V215 HydrophobicContact CD1-CG1 4.03Å; I141-V215 HydrophobicContact CD1-CG2 3.44Å; I141-V215 VanDerWaalsContact CD1-CG2 3.44Å; I141-V215 HydrophobicContact CG1-CG2 4.12Å; L179-V215 HydrophobicContact CD1-CG1 3.79Å; V184-V215 CarbonylContact O-C 3.57Å; V184-V215 WeakPolarHBondContact O-CA 3.29Å; V184-V215 WeakPolarHBondContact O-CB 3.47Å; I185-V215 HydrophobicContact CG1-CG1 4.12Å; L213-V215 HydrophobicContact CB-CG1 4Å; V215-P217 WeakPolarHBondContact O-CD 3.4Å
216	L	85.6	Confident	71.1	Confident	34 Å²	34	75.8 Å²	75.8	18%	0.178	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	112.3	161.4	-67.8	168.2	0	0	0	106.8	V138 V184 R186 S218	V138-L216 HydrophobicContact CG2-CD2 3.77Å; V184-L216 HydrophobicContact CB-CB 4.21Å; V184-L216 PolarHBondContact N-O 3.25Å; V184-L216 PolarHBondContact O-N 2.88Å; R186-L216 HydrophobicContact CG-CD1 4.08Å; R186-L216 HydrophobicContact CG-CG 4.14Å; L216-S218 PolarHBondContact O-N 2.93Å
217	P	78.9	Confident	71.1	Confident	24 Å²	24	75.6 Å²	75.6	16%	0.156	44%	0.436	C	S	.	.			trans	-65.1	128.3	177.2	25.9	-30.5	0	0	0	108.9	A137 D183 V215 Y219	A137-P217 VanDerWaalsContact O-CD 3.24Å; A137-P217 WeakPolarHBondContact O-CD 3.46Å; D183-P217 WeakPolarHBondContact OD1-CA 3.32Å; V215-P217 WeakPolarHBondContact O-CD 3.4Å; P217-Y219 HydrophobicContact CG-CD2 4.42Å; P217-Y219 HydrophobicContact CG-CE2 3.83Å; P217-Y219 PolarHBondContact O-N 2.84Å
218	S	71.8	Confident	71.7	Confident	47 Å²	47	75.7 Å²	75.7	33%	0.329	44%	0.436	S	S	.	.			trans	-77.1	105.2	166.8	-177.3	0	0	0	0	106.9	G182 D183 L216 R220	G182-S218 WeakPolarHBondContact O-CB 3.19Å; D183-S218 PolarHBondContact OD1-N 3.3Å; L216-S218 PolarHBondContact O-N 2.93Å; S218-R220 PolarHBondContact O-N 3.03Å
219	Y	57.7	Low	72.6	Confident	165 Å²	165	74.5 Å²	74.5	65%	0.647	42%	0.421	S	S	*	.			trans	-69.4	34.5	172.1	-71.5	-83.4	0	0	0	112.4	P217	P217-Y219 HydrophobicContact CG-CD2 4.42Å; P217-Y219 HydrophobicContact CG-CE2 3.83Å; P217-Y219 PolarHBondContact O-N 2.84Å
220	R	53.2	Low	73.3	Confident	208 Å²	208	73.4 Å²	73.4	79%	0.785	41%	0.408	S	S	*	.			trans	-89.5	105.3	155.6	-70	-170.6	157.8	-165.8	-6.7	104.6	S218 A222	S218-R220 PolarHBondContact O-N 3.03Å; R220-A222 PolarHBondContact O-N 3.17Å
221	D	46.6	Very low	74	Confident	163 Å²	163	71.7 Å²	71.7	87%	0.872	39%	0.392	S	S	*	.			trans	-54.9	83.5	150	-82	-38.8	0	0	0	105.6	P223	D221-P223 WeakPolarHBondContact O-CD 3.47Å
222	A	47.7	Very low	74.4	Confident	66 Å²	66	71.6 Å²	71.6	55%	0.545	39%	0.391	S	S	.	.			trans	-59.6	112.7	167.2	0	0	0	0	0	103	R220 A224	R220-A222 PolarHBondContact O-N 3.17Å; A222-A224 PolarHBondContact O-N 3.04Å; A222-A224 VanDerWaalsContact O-N 3.08Å
223	P	50.6	Low	74.7	Confident	118 Å²	118	70.1 Å²	70.1	77%	0.766	38%	0.38	S	S	*	.			trans	-51	129	-179.8	19.3	-30.5	0	0	0	106.6	D221 P225	D221-P223 WeakPolarHBondContact O-CD 3.47Å; P223-P225 VanDerWaalsContact O-N 3.17Å
224	A	51.8	Low	74.8	Confident	86 Å²	86	71 Å²	71	71%	0.711	38%	0.383	S	S	*	.			trans	-45.7	131.1	-179.7	0	0	0	0	0	107.6	A222	A222-A224 PolarHBondContact O-N 3.04Å; A222-A224 VanDerWaalsContact O-N 3.08Å
225	P	55.7	Low	75.2	Confident	110 Å²	110	71.5 Å²	71.5	71%	0.714	40%	0.396	S	S	*	.			trans	-51	132.7	-173.6	17.9	-30.1	0	0	0	108.5	P223 Q227	P223-P225 VanDerWaalsContact O-N 3.17Å; P225-Q227 PolarHBondContact O-N 2.85Å; P225-Q227 VanDerWaalsContact O-N 3.08Å
226	P	64.9	Low	75.5	Confident	116 Å²	116	72.1 Å²	72.1	75%	0.753	40%	0.399	S	S	*	.			trans	-53.9	123.3	-173	18.7	-30.1	0	0	0	108.8	V228	P226-V228 PolarHBondContact O-N 3.19Å
227	Q	79	Confident	75.9	Confident	128 Å²	128	74 Å²	74	60%	0.598	41%	0.409	S	S	*	.			trans	-68.9	108.6	-179.5	-67.7	-177	4.8	0	0	108.5	P225 Y229	P225-Q227 PolarHBondContact O-N 2.85Å; P225-Q227 VanDerWaalsContact O-N 3.08Å; Q227-Y229 HydrophobicContact CB-CD2 4.35Å; Q227-Y229 HydrophobicContact CB-CE2 3.6Å; Q227-Y229 PolarHBondContact OE1-OH 3.31Å
228	V	90.6	Very high	76.6	Confident	22 Å²	22	73.2 Å²	73.2	13%	0.133	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	120	178.1	-179.4	0	0	0	0	108.7	P226 L230 V261 E341	P226-V228 PolarHBondContact O-N 3.19Å; V228-L230 HydrophobicContact CG1-CD2 3.95Å; V228-L230 HydrophobicContact CG1-CG 4.17Å; V228-V261 HydrophobicContact CB-CB 4.27Å; V228-V261 HydrophobicContact CG1-CB 4.36Å; V228-V261 HydrophobicContact CG1-CG2 4.49Å; V228-V261 PolarHBondContact O-N 3.31Å; V228-E341 HydrophobicContact CG1-CG 4.04Å
229	Y	94.8	Very high	77.6	Confident	46 Å²	46	75.1 Å²	75.1	18%	0.18	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	132	170.1	-60.2	-90.5	0	0	0	110.1	Q227 I258 L259 H260 V275 E341 V342 W545	Q227-Y229 HydrophobicContact CB-CD2 4.35Å; Q227-Y229 HydrophobicContact CB-CE2 3.6Å; Q227-Y229 PolarHBondContact OE1-OH 3.31Å; Y229-I258 HydrophobicContact CD1-CG2 4.33Å; Y229-L259 CarbonylContact C-O 3.59Å; Y229-L259 VanDerWaalsContact CA-O 3.29Å; Y229-L259 WeakPolarHBondContact CA-O 3.46Å; Y229-H260 HydrophobicContact CD1-CB 3.87Å; Y229-H260 HydrophobicContact CE1-CB 3.71Å; Y229-H260 AromaticContact CE1-CD2 3.6Å; Y229-H260 AromaticContact CE1-CG 3.86Å; Y229-H260 AromaticContact CZ-CD2 3.71Å; Y229-V275 HydrophobicContact CD1-CG2 3.73Å; Y229-V275 HydrophobicContact CE1-CG2 3.8Å; Y229-E341 WeakPolarHBondContact O-CA 3.48Å; Y229-V342 WeakPolarHBondContact CB-O 3.38Å; Y229-V342 PolarHBondContact O-N 3.39Å; Y229-W545 AromaticContact CD1-CH2 3.59Å; Y229-W545 HydrophobicContact CD1-CH2 3.59Å; Y229-W545 AromaticContact CD1-CZ3 3.89Å; Y229-W545 HydrophobicContact CD1-CZ3 3.89Å; Y229-W545 HydrophobicContact CD2-CH2 4.21Å; Y229-W545 AromaticContact CD2-CZ3 3.95Å; Y229-W545 HydrophobicContact CD2-CZ3 3.95Å; Y229-W545 AromaticContact CE1-CH2 3.9Å; Y229-W545 HydrophobicContact CE1-CH2 3.9Å; Y229-W545 HydrophobicContact CE2-CH2 4.5Å; Y229-W545 AromaticContact CG-CH2 3.75Å; Y229-W545 HydrophobicContact CG-CH2 3.75Å; Y229-W545 AromaticContact CG-CZ3 3.55Å; Y229-W545 HydrophobicContact CG-CZ3 3.55Å
230	L	95	Very high	79.2	Confident	7 Å²	7	72 Å²	72	4%	0.037	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	140.3	179.9	-62.3	-175.2	0	0	0	111.1	V228 L259 V261 W270 Y339 E340 E341	V228-L230 HydrophobicContact CG1-CD2 3.95Å; V228-L230 HydrophobicContact CG1-CG 4.17Å; L230-L259 PolarHBondContact N-O 3.11Å; L230-L259 PolarHBondContact O-N 3.36Å; L230-V261 HydrophobicContact CB-CG2 4.34Å; L230-V261 HydrophobicContact CD1-CG2 3.43Å; L230-V261 VanDerWaalsContact CD1-CG2 3.43Å; L230-V261 HydrophobicContact CG-CG2 3.62Å; L230-W270 HydrophobicContact CD1-CE3 4.07Å; L230-W270 HydrophobicContact CD1-CZ3 3.68Å; L230-Y339 HydrophobicContact CB-CD1 4.22Å; L230-Y339 HydrophobicContact CD1-CD1 4.2Å; L230-Y339 HydrophobicContact CD1-CD2 4.46Å; L230-Y339 HydrophobicContact CD1-CG 4.02Å; L230-E340 CarbonylContact C-O 3.59Å; L230-E340 WeakPolarHBondContact CA-O 3.49Å; L230-E341 HydrophobicContact CD2-CB 4.02Å; L230-E341 HydrophobicContact CD2-CG 4.05Å
231	K	95.1	Very high	81	Confident	34 Å²	34	62.8 Å²	62.8	15%	0.148	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	104.8	168.5	-174.7	179.9	-179	-177.7	0	109.5	I258 Y339 E340 V342 D517	K231-I258 HydrophobicContact CB-CD1 4.07Å; K231-I258 HydrophobicContact CD-CD1 4.39Å; K231-I258 HydrophobicContact CG-CD1 4.1Å; K231-Y339 WeakPolarHBondContact O-CA 3.43Å; K231-E340 PolarHBondContact N-O 2.96Å; K231-E340 PolarHBondContact O-N 3.12Å; K231-V342 HydrophobicContact CB-CG1 3.91Å; K231-V342 HydrophobicContact CB-CG2 4.38Å; K231-D517 IonicContact NZ-OD1 2.75Å
232	P	94.6	Very high	83	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	141.5	172.3	22.3	-36.8	0	0	0	114.2	F234 F253 G256 D257 L259 Y339	P232-F234 HydrophobicContact CB-CD1 4.32Å; P232-F234 HydrophobicContact CB-CE1 4.32Å; P232-F253 HydrophobicContact CB-CD2 3.75Å; P232-F253 HydrophobicContact CB-CE2 3.42Å; P232-F253 VanDerWaalsContact CB-CE2 3.42Å; P232-F253 HydrophobicContact CB-CZ 4.29Å; P232-F253 HydrophobicContact CG-CD2 3.55Å; P232-F253 HydrophobicContact CG-CE2 3.77Å; P232-F253 HydrophobicContact CG-CG 4.33Å; P232-G256 PolarHBondContact O-N 2.88Å; P232-D257 VanDerWaalsContact CD-O 3.24Å; P232-D257 WeakPolarHBondContact CD-O 3.31Å; P232-L259 HydrophobicContact CG-CD1 4.02Å; P232-L259 HydrophobicContact CG-CG 4.35Å; P232-Y339 HydrophobicContact CB-CD1 3.88Å; P232-Y339 HydrophobicContact CB-CE1 3.79Å
233	Y	91.5	Very high	85	Confident	22 Å²	22	63.8 Å²	63.8	9%	0.086	37%	0.373	C	S	.	.	S	Bend	trans	-98.8	12.9	171	-64.7	-68.8	0	0	0	114.5	K255 Q337 I338 E340 H514	Y233-K255 WeakPolarHBondContact O-CD 3.35Å; Y233-Q337 WeakPolarHBondContact CB-O 3.42Å; Y233-Q337 HydrophobicContact CD2-CB 3.87Å; Y233-Q337 HydrophobicContact CD2-CG 3.73Å; Y233-Q337 HydrophobicContact CE2-CB 4.08Å; Y233-Q337 HydrophobicContact CE2-CG 3.47Å; Y233-Q337 VanDerWaalsContact CE2-CG 3.47Å; Y233-Q337 PolarHBondContact OH-NE2 3.23Å; Y233-I338 PolarHBondContact N-O 3.03Å; Y233-E340 HydrophobicContact CE2-CB 3.56Å; Y233-E340 WeakPolarHBondContact OH-CB 3.32Å; Y233-E340 PolarHBondContact OH-OE1 2.98Å; Y233-E340 PolarHBondContact OH-OE2 3.17Å; Y233-H514 HydrophobicContact CD1-CB 3.63Å; Y233-H514 HydrophobicContact CE1-CB 4Å; Y233-H514 WeakPolarHBondContact CE1-O 3.04Å; Y233-H514 HydrophobicContact CG-CB 3.9Å
234	F	91.4	Very high	86.7	Confident	22 Å²	22	58.8 Å²	58.8	10%	0.096	34%	0.34	C	S	.	.	S	Bend	trans	-140.6	164.1	176.5	70.7	-71.6	0	0	0	109.6	P232 F253 K255 P284 E289 I338 Y339	P232-F234 HydrophobicContact CB-CD1 4.32Å; P232-F234 HydrophobicContact CB-CE1 4.32Å; F234-F253 HydrophobicContact CD1-CE2 4.45Å; F234-F253 HydrophobicContact CD2-CE2 4.37Å; F234-F253 HydrophobicContact CE1-CE2 4.07Å; F234-F253 HydrophobicContact CE1-CZ 4.08Å; F234-F253 HydrophobicContact CE2-CE2 4.03Å; F234-F253 AromaticContact CE2-CZ 3.86Å; F234-F253 HydrophobicContact CE2-CZ 3.86Å; F234-F253 AromaticContact CZ-CE2 3.87Å; F234-F253 HydrophobicContact CZ-CE2 3.87Å; F234-F253 AromaticContact CZ-CZ 3.54Å; F234-F253 HydrophobicContact CZ-CZ 3.54Å; F234-F253 WeakPolarHBondContact O-CE2 3.32Å; F234-K255 WeakPolarHBondContact O-CA 3.46Å; F234-K255 PolarHBondContact O-N 2.84Å; F234-P284 HydrophobicContact CE2-CG 4.17Å; F234-P284 HydrophobicContact CZ-CG 3.95Å; F234-E289 HydrophobicContact CD1-CG 4.45Å; F234-E289 HydrophobicContact CD2-CG 4.46Å; F234-E289 HydrophobicContact CE1-CG 4Å; F234-E289 HydrophobicContact CE2-CG 3.97Å; F234-E289 HydrophobicContact CZ-CB 4.41Å; F234-E289 HydrophobicContact CZ-CG 3.71Å; F234-I338 HydrophobicContact CD1-CG2 4Å; F234-I338 HydrophobicContact CE1-CG2 3.45Å; F234-I338 VanDerWaalsContact CE1-CG2 3.45Å; F234-I338 HydrophobicContact CZ-CG2 4.25Å; F234-Y339 AromaticContact CE1-CE1 3.89Å; F234-Y339 HydrophobicContact CE1-CE1 3.89Å; F234-Y339 HydrophobicContact CE1-CE2 4.23Å; F234-Y339 AromaticContact CE1-CZ 3.72Å; F234-Y339 HydrophobicContact CZ-CE1 4.36Å; F234-Y339 AromaticContact CZ-CZ 3.88Å; F234-Y339 WeakPolarHBondContact CZ-OH 3.23Å
235	S	93.5	Very high	88	Confident	83 Å²	83	59.3 Å²	59.3	58%	0.58	34%	0.336	S	S	*	.			trans	-100.1	141.2	173	-57.8	0	0	0	0	109.3	F253 K255	S235-F253 CarbonylContact C-O 3.55Å; S235-F253 WeakPolarHBondContact CA-O 3.44Å; S235-K255 PolarHBondContact OG-N 2.91Å; S235-K255 VanDerWaalsContact OG-N 3.1Å
236	Y	94.9	Very high	89.2	Confident	14 Å²	14	56.5 Å²	56.5	6%	0.055	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-123.3	129.5	-179	178.2	-119.4	0	0	0	110.9	P238 D241 L251 A252 F253 W269 P284	Y236-P238 HydrophobicContact CE1-CB 3.95Å; Y236-D241 HydrophobicContact CE2-CB 3.99Å; Y236-D241 WeakPolarHBondContact CE2-OD2 3.35Å; Y236-D241 PolarHBondContact OH-OD2 3.28Å; Y236-L251 WeakPolarHBondContact CD1-O 3.25Å; Y236-A252 WeakPolarHBondContact O-CA 3.43Å; Y236-F253 VanDerWaalsContact CB-CE1 3.4Å; Y236-F253 HydrophobicContact CD1-CD1 4.11Å; Y236-F253 AromaticContact CD1-CE1 3.69Å; Y236-F253 HydrophobicContact CD1-CE1 3.69Å; Y236-F253 HydrophobicContact CD1-CZ 4.34Å; Y236-F253 HydrophobicContact CG-CD1 4.44Å; Y236-F253 AromaticContact CG-CE1 3.86Å; Y236-F253 HydrophobicContact CG-CE1 3.86Å; Y236-F253 HydrophobicContact CG-CZ 4.05Å; Y236-F253 PolarHBondContact N-O 2.82Å; Y236-F253 PolarHBondContact O-N 3.48Å; Y236-F253 VanDerWaalsContact O-N 3.08Å; Y236-W269 WeakPolarHBondContact OH-CH2 3.46Å; Y236-W269 VanDerWaalsContact OH-CZ3 3.32Å; Y236-W269 WeakPolarHBondContact OH-CZ3 3.12Å; Y236-P284 HydrophobicContact CD1-CG 4.41Å; Y236-P284 HydrophobicContact CD2-CG 4Å; Y236-P284 HydrophobicContact CE2-CG 4.18Å; Y236-P284 HydrophobicContact CG-CG 4.14Å
237	N	95	Very high	90.1	Very high	73 Å²	73	55 Å²	55	39%	0.39	30%	0.3	S	S	.	.			trans	-122.3	110.9	172.9	-176.5	-0	0	0	0	110.1	T239 T240	N237-T239 VanDerWaalsContact C-N 3.27Å; N237-T239 PolarHBondContact ND2-OG1 3.41Å; N237-T239 PolarHBondContact O-N 3.11Å; N237-T239 PolarHBondContact OD1-N 3.33Å; N237-T239 VanDerWaalsContact OD1-N 3.11Å; N237-T239 PolarHBondContact OD1-OG1 3.35Å; N237-T240 PolarHBondContact O-N 3.19Å; N237-T240 PolarHBondContact O-OG1 3.22Å
238	P	92.8	Very high	90.2	Very high	7 Å²	7	56.8 Å²	56.8	5%	0.045	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-67.4	-24.9	-177.8	27.7	-34.9	0	0	0	113.2	Y236 T240 D241 I244 A252	Y236-P238 HydrophobicContact CE1-CB 3.95Å; P238-T240 VanDerWaalsContact C-N 3.26Å; P238-T240 PolarHBondContact O-N 3.11Å; P238-D241 PolarHBondContact O-N 3.08Å; P238-I244 HydrophobicContact CB-CD1 3.84Å; P238-A252 HydrophobicContact CG-CB 4.28Å
239	T	92.8	Very high	89.9	Confident	87 Å²	87	57.6 Å²	57.6	53%	0.534	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-67.6	-31.8	-178.9	66.4	0	0	0	0	112.1	N237 K247	N237-T239 VanDerWaalsContact C-N 3.27Å; N237-T239 PolarHBondContact ND2-OG1 3.41Å; N237-T239 PolarHBondContact O-N 3.11Å; N237-T239 PolarHBondContact OD1-N 3.33Å; N237-T239 VanDerWaalsContact OD1-N 3.11Å; N237-T239 PolarHBondContact OD1-OG1 3.35Å; T239-K247 PolarHBondContact O-NZ 3.3Å
240	T	92.8	Very high	89.6	Confident	101 Å²	101	56.2 Å²	56.2	62%	0.62	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-86.3	-9	177.5	55.8	0	0	0	0	113.7	N237 P238	N237-T240 PolarHBondContact O-N 3.19Å; N237-T240 PolarHBondContact O-OG1 3.22Å; P238-T240 VanDerWaalsContact C-N 3.26Å; P238-T240 PolarHBondContact O-N 3.11Å
241	D	90.8	Very high	89.5	Confident	14 Å²	14	56.9 Å²	56.9	8%	0.075	32%	0.321	C	S	.	.			trans	-87.9	120.6	-177.2	-162.3	-26.3	0	0	0	110.7	Y236 P238 L243 I244 K247 W269 R292	Y236-D241 HydrophobicContact CE2-CB 3.99Å; Y236-D241 WeakPolarHBondContact CE2-OD2 3.35Å; Y236-D241 PolarHBondContact OH-OD2 3.28Å; P238-D241 PolarHBondContact O-N 3.08Å; D241-L243 WeakPolarHBondContact OD1-CB 3.44Å; D241-L243 PolarHBondContact OD1-N 3.14Å; D241-I244 HydrophobicContact CB-CB 4.35Å; D241-I244 HydrophobicContact CB-CG2 4.21Å; D241-I244 WeakPolarHBondContact O-CG2 3.46Å; D241-K247 VanDerWaalsContact O-CE 3.25Å; D241-K247 WeakPolarHBondContact O-CE 3.4Å; D241-W269 WeakPolarHBondContact OD2-CH2 3.42Å; D241-R292 IonicContact OD1-CZ 3.24Å; D241-R292 IonicContact OD1-NH2 3.93Å; D241-R292 PolarHBondContact OD1-NH2 2.85Å; D241-R292 IonicContact OD2-CZ 2.99Å; D241-R292 VanDerWaalsContact OD2-CZ 3.25Å; D241-R292 IonicContact OD2-NH1 2.8Å; D241-R292 PolarHBondContact OD2-NH1 3.25Å; D241-R292 IonicContact OD2-NH2 3.71Å; D241-R292 PolarHBondContact OD2-NH2 3.38Å
242	N	88.6	Confident	89.5	Confident	141 Å²	141	57.4 Å²	57.4	75%	0.754	33%	0.332	S	S	*	.	S	Bend	trans	-90.2	-9.4	178.5	-65.9	-27.5	0	0	0	113
243	L	88.4	Confident	89.5	Confident	108 Å²	108	57.8 Å²	57.8	57%	0.565	33%	0.334	S	S	*	.	S	Bend	trans	-94.5	-10.1	179.6	-59.8	175.2	0	0	0	112.2	D241 W269	D241-L243 WeakPolarHBondContact OD1-CB 3.44Å; D241-L243 PolarHBondContact OD1-N 3.14Å; L243-W269 VanDerWaalsContact C-CZ2 3.47Å; L243-W269 HydrophobicContact CB-CZ2 4.21Å; L243-W269 VanDerWaalsContact O-CZ2 3.28Å; L243-W269 WeakPolarHBondContact O-CZ2 3.13Å
244	I	86.4	Confident	89.6	Confident	13 Å²	13	58.8 Å²	58.8	7%	0.067	35%	0.347	C	S	.	.			trans	-69.8	132.9	178.9	-166.8	174.3	0	0	0	110.4	P238 D241 C246 K247 G250 W269 L282	P238-I244 HydrophobicContact CB-CD1 3.84Å; D241-I244 HydrophobicContact CB-CB 4.35Å; D241-I244 HydrophobicContact CB-CG2 4.21Å; D241-I244 WeakPolarHBondContact O-CG2 3.46Å; I244-C246 VanDerWaalsContact C-N 3.29Å; I244-C246 VanDerWaalsContact CD1-O 3.29Å; I244-C246 WeakPolarHBondContact CD1-O 3.23Å; I244-C246 PolarHBondContact O-N 3.26Å; I244-K247 HydrophobicContact CG2-CB 4.37Å; I244-K247 HydrophobicContact CG2-CG 3.6Å; I244-G250 VanDerWaalsContact CD1-CA 3.46Å; I244-W269 HydrophobicContact CB-CH2 3.55Å; I244-W269 HydrophobicContact CB-CZ2 3.91Å; I244-W269 HydrophobicContact CB-CZ3 4.07Å; I244-W269 HydrophobicContact CD1-CH2 4.49Å; I244-W269 HydrophobicContact CD1-CZ3 4.14Å; I244-W269 HydrophobicContact CG1-CE3 4.24Å; I244-W269 HydrophobicContact CG1-CH2 3.83Å; I244-W269 HydrophobicContact CG1-CZ2 4.29Å; I244-W269 HydrophobicContact CG1-CZ3 3.81Å; I244-L282 HydrophobicContact CD1-CB 4.42Å
245	P	79.6	Confident	89.6	Confident	97 Å²	97	61.6 Å²	61.6	63%	0.63	36%	0.359	S	S	*	.	S	Bend	trans	-61	-36.7	-179.5	-25.8	34.5	0	0	0	113.6	W269	P245-W269 HydrophobicContact CG-CG 4.39Å
246	C	80.9	Confident	89.5	Confident	51 Å²	51	59.3 Å²	59.3	35%	0.345	35%	0.348	S	S	.	.			trans	-147.4	118.1	179.3	169.7	0	0	0	0	108.6	I244 E248 A249	I244-C246 VanDerWaalsContact C-N 3.29Å; I244-C246 VanDerWaalsContact CD1-O 3.29Å; I244-C246 WeakPolarHBondContact CD1-O 3.23Å; I244-C246 PolarHBondContact O-N 3.26Å; C246-E248 VanDerWaalsContact C-N 3.3Å; C246-E248 PolarHBondContact O-N 2.83Å; C246-E248 PolarHBondContact SG-OE2 2.86Å; C246-A249 HydrophobicContact CB-CB 4.01Å; C246-A249 PolarHBondContact O-N 2.99Å
247	K	84.8	Confident	89.4	Confident	84 Å²	84	60.8 Å²	60.8	37%	0.365	36%	0.357	S	S	.	.	S	Bend	trans	-67.6	-34.6	-174.4	-69.7	-173.6	175.2	-163.4	0	111.7	T239 D241 I244 A249 G250	T239-K247 PolarHBondContact O-NZ 3.3Å; D241-K247 VanDerWaalsContact O-CE 3.25Å; D241-K247 WeakPolarHBondContact O-CE 3.4Å; I244-K247 HydrophobicContact CG2-CB 4.37Å; I244-K247 HydrophobicContact CG2-CG 3.6Å; K247-A249 VanDerWaalsContact C-N 3.28Å; K247-A249 PolarHBondContact O-N 3.06Å; K247-G250 PolarHBondContact O-N 3.1Å; K247-G250 VanDerWaalsContact O-N 3.17Å
248	E	80.2	Confident	89.4	Confident	166 Å²	166	58.7 Å²	58.7	78%	0.776	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-29.8	179.6	-56.8	73.4	-160.8	0	0	111.7	C246 G250	C246-E248 VanDerWaalsContact C-N 3.3Å; C246-E248 PolarHBondContact O-N 2.83Å; C246-E248 PolarHBondContact SG-OE2 2.86Å; E248-G250 VanDerWaalsContact C-N 3.3Å
249	A	83.6	Confident	89.5	Confident	40 Å²	40	58.3 Å²	58.3	33%	0.331	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-5.2	175.8	0	0	0	0	0	113.1	C246 K247 G281 L282	C246-A249 HydrophobicContact CB-CB 4.01Å; C246-A249 PolarHBondContact O-N 2.99Å; K247-A249 VanDerWaalsContact C-N 3.28Å; K247-A249 PolarHBondContact O-N 3.06Å; A249-G281 CarbonylContact O-C 3.58Å; A249-G281 WeakPolarHBondContact O-CA 2.94Å; A249-L282 HydrophobicContact CB-CD1 4.17Å; A249-L282 HydrophobicContact CB-CG 4.45Å; A249-L282 PolarHBondContact O-N 2.79Å
250	G	88.6	Confident	89.6	Confident	17 Å²	17	55.2 Å²	55.2	18%	0.175	32%	0.322	C	S	.	.	B	Isolated β-bridge	trans	-75.6	137.9	-177.5	0	0	0	0	0	113.4	I244 K247 E248	I244-G250 VanDerWaalsContact CD1-CA 3.46Å; K247-G250 PolarHBondContact O-N 3.1Å; K247-G250 VanDerWaalsContact O-N 3.17Å; E248-G250 VanDerWaalsContact C-N 3.3Å
251	L	93.4	Very high	89.6	Confident	20 Å²	20	50.9 Å²	50.9	11%	0.105	30%	0.296	C	S	.	.			trans	-96.7	106.6	174.2	179.8	68	0	0	0	110.3	Y236 F253 L259 A272 K274 L282 I283	Y236-L251 WeakPolarHBondContact CD1-O 3.25Å; L251-F253 WeakPolarHBondContact O-CD1 3.48Å; L251-L259 HydrophobicContact CD2-CD2 4.31Å; L251-A272 HydrophobicContact CD2-CB 4.3Å; L251-A272 WeakPolarHBondContact CD2-O 3.4Å; L251-K274 HydrophobicContact CD1-CG 4.37Å; L251-K274 HydrophobicContact CD2-CG 4.48Å; L251-L282 PolarHBondContact N-O 2.9Å; L251-I283 HydrophobicContact CB-CG2 3.83Å; L251-I283 HydrophobicContact CD2-CG2 3.92Å; L251-I283 HydrophobicContact CG-CG2 4.24Å
252	A	94.5	Very high	89.4	Confident	46 Å²	46	52.5 Å²	52.5	38%	0.38	31%	0.306	S	S	.	.			trans	-69.6	137	172.4	0	0	0	0	0	111.6	Y236 P238 K274	Y236-A252 WeakPolarHBondContact O-CA 3.43Å; P238-A252 HydrophobicContact CG-CB 4.28Å; A252-K274 WeakPolarHBondContact O-CE 3.44Å; A252-K274 PolarHBondContact O-NZ 3Å
253	F	95	Very high	89.1	Confident	8 Å²	8	47.1 Å²	47.1	4%	0.035	28%	0.278	C	S	.	.	B	Isolated β-bridge	trans	-144.2	154.2	175.2	59.5	-99.7	0	0	0	112.8	P232 F234 S235 Y236 L251 D257 L259 I283 Y339	P232-F253 HydrophobicContact CB-CD2 3.75Å; P232-F253 HydrophobicContact CB-CE2 3.42Å; P232-F253 VanDerWaalsContact CB-CE2 3.42Å; P232-F253 HydrophobicContact CB-CZ 4.29Å; P232-F253 HydrophobicContact CG-CD2 3.55Å; P232-F253 HydrophobicContact CG-CE2 3.77Å; P232-F253 HydrophobicContact CG-CG 4.33Å; F234-F253 HydrophobicContact CD1-CE2 4.45Å; F234-F253 HydrophobicContact CD2-CE2 4.37Å; F234-F253 HydrophobicContact CE1-CE2 4.07Å; F234-F253 HydrophobicContact CE1-CZ 4.08Å; F234-F253 HydrophobicContact CE2-CE2 4.03Å; F234-F253 AromaticContact CE2-CZ 3.86Å; F234-F253 HydrophobicContact CE2-CZ 3.86Å; F234-F253 AromaticContact CZ-CE2 3.87Å; F234-F253 HydrophobicContact CZ-CE2 3.87Å; F234-F253 AromaticContact CZ-CZ 3.54Å; F234-F253 HydrophobicContact CZ-CZ 3.54Å; F234-F253 WeakPolarHBondContact O-CE2 3.32Å; S235-F253 CarbonylContact C-O 3.55Å; S235-F253 WeakPolarHBondContact CA-O 3.44Å; Y236-F253 VanDerWaalsContact CB-CE1 3.4Å; Y236-F253 HydrophobicContact CD1-CD1 4.11Å; Y236-F253 AromaticContact CD1-CE1 3.69Å; Y236-F253 HydrophobicContact CD1-CE1 3.69Å; Y236-F253 HydrophobicContact CD1-CZ 4.34Å; Y236-F253 HydrophobicContact CG-CD1 4.44Å; Y236-F253 AromaticContact CG-CE1 3.86Å; Y236-F253 HydrophobicContact CG-CE1 3.86Å; Y236-F253 HydrophobicContact CG-CZ 4.05Å; Y236-F253 PolarHBondContact N-O 2.82Å; Y236-F253 PolarHBondContact O-N 3.48Å; Y236-F253 VanDerWaalsContact O-N 3.08Å; L251-F253 WeakPolarHBondContact O-CD1 3.48Å; F253-D257 WeakPolarHBondContact CA-OD2 3.31Å; F253-D257 HydrophobicContact CB-CB 4.33Å; F253-L259 HydrophobicContact CB-CD1 4.49Å; F253-L259 HydrophobicContact CB-CD2 4.09Å; F253-L259 HydrophobicContact CD1-CD1 3.81Å; F253-L259 HydrophobicContact CD2-CD1 4.44Å; F253-L259 HydrophobicContact CE1-CD1 4.05Å; F253-L259 HydrophobicContact CG-CD1 4.01Å; F253-L259 HydrophobicContact CG-CD2 4.48Å; F253-L259 HydrophobicContact CZ-CD1 4.46Å; F253-I283 HydrophobicContact CD1-CG2 3.85Å; F253-I283 HydrophobicContact CE1-CB 3.87Å; F253-I283 HydrophobicContact CE1-CG2 3.65Å; F253-Y339 HydrophobicContact CZ-CE1 4.12Å
254	A	93.7	Very high	89.1	Confident	43 Å²	43	45.9 Å²	45.9	36%	0.355	27%	0.267	S	S	.	.			trans	-96.2	156.5	171.9	0	0	0	0	0	110.6	G256 D257	A254-G256 PolarHBondContact O-N 2.85Å; A254-D257 PolarHBondContact N-OD2 2.62Å; A254-D257 WeakPolarHBondContact O-CB 3.4Å; A254-D257 PolarHBondContact O-N 2.94Å; A254-D257 VanDerWaalsContact O-N 3.14Å
255	K	91.7	Very high	89	Confident	81 Å²	81	50.5 Å²	50.5	35%	0.352	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	127	167.1	176.3	177.2	-178.9	-168.5	0	110.1	Y233 F234 S235 S513	Y233-K255 WeakPolarHBondContact O-CD 3.35Å; F234-K255 WeakPolarHBondContact O-CA 3.46Å; F234-K255 PolarHBondContact O-N 2.84Å; S235-K255 PolarHBondContact OG-N 2.91Å; S235-K255 VanDerWaalsContact OG-N 3.1Å; K255-S513 VanDerWaalsContact NZ-C 3.29Å; K255-S513 PolarHBondContact NZ-O 2.95Å; K255-S513 PolarHBondContact NZ-OG 2.81Å
256	G	90.6	Very high	89.2	Confident	35 Å²	35	49.3 Å²	49.3	36%	0.361	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.1	-5.5	178.6	0	0	0	0	0	115.5	P232 A254	P232-G256 PolarHBondContact O-N 2.88Å; A254-G256 PolarHBondContact O-N 2.85Å
257	D	93.6	Very high	89.4	Confident	45 Å²	45	50.9 Å²	50.9	24%	0.241	29%	0.29	C	S	.	.			trans	-56.8	158.7	168.3	-78.3	-6.4	0	0	0	110.4	P232 F253 A254 L259 K274	P232-D257 VanDerWaalsContact CD-O 3.24Å; P232-D257 WeakPolarHBondContact CD-O 3.31Å; F253-D257 WeakPolarHBondContact CA-OD2 3.31Å; F253-D257 HydrophobicContact CB-CB 4.33Å; A254-D257 PolarHBondContact N-OD2 2.62Å; A254-D257 WeakPolarHBondContact O-CB 3.4Å; A254-D257 PolarHBondContact O-N 2.94Å; A254-D257 VanDerWaalsContact O-N 3.14Å; D257-L259 HydrophobicContact CB-CD2 4.42Å; D257-K274 WeakPolarHBondContact OD2-CE 3.49Å; D257-K274 IonicContact OD2-NZ 2.94Å; D257-K274 PolarHBondContact OD2-NZ 3.21Å
258	I	94.9	Very high	89.5	Confident	28 Å²	28	49.6 Å²	49.6	14%	0.144	29%	0.287	C	S	.	.			trans	-109.9	121.8	172.1	-50.1	-61.4	0	0	0	109.3	Y229 K231 V275 V342 W545	Y229-I258 HydrophobicContact CD1-CG2 4.33Å; K231-I258 HydrophobicContact CB-CD1 4.07Å; K231-I258 HydrophobicContact CD-CD1 4.39Å; K231-I258 HydrophobicContact CG-CD1 4.1Å; I258-V275 HydrophobicContact CB-CG2 4.09Å; I258-V275 HydrophobicContact CG2-CG2 3.7Å; I258-V275 PolarHBondContact O-N 3.42Å; I258-V275 VanDerWaalsContact O-N 3.13Å; I258-V342 HydrophobicContact CD1-CG2 4.28Å; I258-V342 HydrophobicContact CG2-CG2 4.29Å; I258-W545 HydrophobicContact CD1-CB 4.14Å; I258-W545 HydrophobicContact CD1-CD2 4.3Å; I258-W545 HydrophobicContact CD1-CG 3.95Å; I258-W545 HydrophobicContact CG1-CD2 4.12Å; I258-W545 HydrophobicContact CG1-CG 3.98Å; I258-W545 HydrophobicContact CG2-CD2 3.95Å; I258-W545 HydrophobicContact CG2-CE3 4.01Å; I258-W545 HydrophobicContact CG2-CH2 3.89Å; I258-W545 HydrophobicContact CG2-CZ2 3.87Å; I258-W545 HydrophobicContact CG2-CZ3 3.97Å
259	L	95.4	Very high	90	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	124.7	-175.6	-53.5	-178.8	0	0	0	109.6	Y229 L230 P232 L251 F253 D257 A272 R273 K274 I283 Y339	Y229-L259 CarbonylContact C-O 3.59Å; Y229-L259 VanDerWaalsContact CA-O 3.29Å; Y229-L259 WeakPolarHBondContact CA-O 3.46Å; L230-L259 PolarHBondContact N-O 3.11Å; L230-L259 PolarHBondContact O-N 3.36Å; P232-L259 HydrophobicContact CG-CD1 4.02Å; P232-L259 HydrophobicContact CG-CG 4.35Å; L251-L259 HydrophobicContact CD2-CD2 4.31Å; F253-L259 HydrophobicContact CB-CD1 4.49Å; F253-L259 HydrophobicContact CB-CD2 4.09Å; F253-L259 HydrophobicContact CD1-CD1 3.81Å; F253-L259 HydrophobicContact CD2-CD1 4.44Å; F253-L259 HydrophobicContact CE1-CD1 4.05Å; F253-L259 HydrophobicContact CG-CD1 4.01Å; F253-L259 HydrophobicContact CG-CD2 4.48Å; F253-L259 HydrophobicContact CZ-CD1 4.46Å; D257-L259 HydrophobicContact CB-CD2 4.42Å; L259-A272 HydrophobicContact CB-CB 4.43Å; L259-R273 CarbonylContact C-O 3.56Å; L259-R273 WeakPolarHBondContact CA-O 3.28Å; L259-K274 HydrophobicContact CD2-CG 3.94Å; L259-I283 HydrophobicContact CD1-CD1 3.98Å; L259-I283 HydrophobicContact CD1-CG2 4.46Å; L259-Y339 HydrophobicContact CD1-CE1 4.38Å
260	H	93.7	Very high	90.5	Very high	21 Å²	21	42.1 Å²	42.1	10%	0.097	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	113.1	168.5	178.4	-125.9	0	0	0	108.7	Y229 A272 R273 V275	Y229-H260 HydrophobicContact CD1-CB 3.87Å; Y229-H260 HydrophobicContact CE1-CB 3.71Å; Y229-H260 AromaticContact CE1-CD2 3.6Å; Y229-H260 AromaticContact CE1-CG 3.86Å; Y229-H260 AromaticContact CZ-CD2 3.71Å; H260-A272 CarbonylContact O-C 3.54Å; H260-A272 WeakPolarHBondContact O-CA 3.4Å; H260-A272 WeakPolarHBondContact O-CB 3.25Å; H260-R273 HydrophobicContact CB-CG 3.96Å; H260-R273 PolarHBondContact N-O 3.48Å; H260-R273 PolarHBondContact ND1-NE 3.22Å; H260-R273 PolarHBondContact O-N 2.94Å; H260-V275 HydrophobicContact CB-CG2 4.48Å
261	V	92.3	Very high	90.5	Very high	10 Å²	10	44.7 Å²	44.7	6%	0.061	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	119.7	179.5	-177.3	0	0	0	0	109	V228 L230 K264 A272	V228-V261 HydrophobicContact CB-CB 4.27Å; V228-V261 HydrophobicContact CG1-CB 4.36Å; V228-V261 HydrophobicContact CG1-CG2 4.49Å; V228-V261 PolarHBondContact O-N 3.31Å; L230-V261 HydrophobicContact CB-CG2 4.34Å; L230-V261 HydrophobicContact CD1-CG2 3.43Å; L230-V261 VanDerWaalsContact CD1-CG2 3.43Å; L230-V261 HydrophobicContact CG-CG2 3.62Å; V261-K264 HydrophobicContact CG1-CD 4.26Å; V261-K264 HydrophobicContact CG1-CG 3.5Å; V261-K264 VanDerWaalsContact CG1-CG 3.5Å; V261-A272 HydrophobicContact CG2-CB 4.41Å
262	V	87.3	Confident	90.6	Very high	48 Å²	48	43.8 Å²	43.8	29%	0.291	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	-33	-178.3	-177.6	0	0	0	0	110.6	H169 Q271	H169-V262 HydrophobicContact CB-CG1 3.82Å; V262-Q271 PolarHBondContact N-O 2.68Å
263	N	83.4	Confident	90.4	Very high	29 Å²	29	46 Å²	46	16%	0.155	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	131.6	-173.3	-176.3	-0.5	0	0	0	111.4	R166 D265 W270 Q271	R166-N263 PolarHBondContact NH2-ND2 2.78Å; R166-N263 PolarHBondContact NH2-OD1 3.41Å; N263-D265 WeakPolarHBondContact OD1-CB 3.39Å; N263-D265 VanDerWaalsContact OD1-CG 3.26Å; N263-D265 PolarHBondContact OD1-N 3.04Å; N263-D265 PolarHBondContact OD1-OD1 3.03Å; N263-W270 WeakPolarHBondContact O-CA 3.33Å; N263-W270 WeakPolarHBondContact O-CB 3.44Å; N263-Q271 HydrophobicContact CB-CB 3.97Å; N263-Q271 HydrophobicContact CB-CG 4.26Å; N263-Q271 PolarHBondContact N-O 3.07Å; N263-Q271 PolarHBondContact ND2-OE1 3Å; N263-Q271 PolarHBondContact O-N 2.8Å
264	K	87.7	Confident	90.3	Very high	81 Å²	81	48.5 Å²	48.5	35%	0.352	26%	0.256	S	S	.	.			trans	-118.3	7.9	179.5	-65	-175.7	-178.4	177.4	0	113.9	V261 D266 W270	V261-K264 HydrophobicContact CG1-CD 4.26Å; V261-K264 HydrophobicContact CG1-CG 3.5Å; V261-K264 VanDerWaalsContact CG1-CG 3.5Å; K264-D266 VanDerWaalsContact C-N 3.31Å; K264-D266 PolarHBondContact O-N 2.9Å; K264-W270 HydrophobicContact CB-CG 4.45Å; K264-W270 HydrophobicContact CD-CZ2 4.45Å; K264-W270 HydrophobicContact CG-CD2 4.09Å; K264-W270 HydrophobicContact CG-CG 4.25Å; K264-W270 PolarHBondContact O-NE1 3.42Å
265	D	83.3	Confident	89.9	Confident	111 Å²	111	49.3 Å²	49.3	59%	0.594	26%	0.256	S	S	*	.			trans	-65.9	-33.1	-169.5	-69.8	8.6	0	0	0	113.4	R166 N263	R166-D265 IonicContact CZ-OD2 3.46Å; R166-D265 IonicContact NH1-OD2 3.15Å; R166-D265 PolarHBondContact NH1-OD2 3.06Å; R166-D265 IonicContact NH2-OD1 3.65Å; R166-D265 IonicContact NH2-OD2 2.92Å; R166-D265 PolarHBondContact NH2-OD2 3.42Å; N263-D265 WeakPolarHBondContact OD1-CB 3.39Å; N263-D265 VanDerWaalsContact OD1-CG 3.26Å; N263-D265 PolarHBondContact OD1-N 3.04Å; N263-D265 PolarHBondContact OD1-OD1 3.03Å
266	D	83.8	Confident	89.3	Confident	72 Å²	72	51.8 Å²	51.8	39%	0.385	28%	0.277	S	S	.	.	S	Bend	trans	-78.8	125.9	173.8	-176.9	-58.3	0	0	0	109.6	K264 N268 W269 W270	K264-D266 VanDerWaalsContact C-N 3.31Å; K264-D266 PolarHBondContact O-N 2.9Å; D266-N268 PolarHBondContact O-N 3.28Å; D266-N268 WeakPolarHBondContact OD1-CA 3.4Å; D266-N268 WeakPolarHBondContact OD1-CB 3.35Å; D266-N268 PolarHBondContact OD1-N 3.41Å; D266-W269 WeakPolarHBondContact CB-O 3.32Å; D266-W269 PolarHBondContact OD1-N 3.11Å; D266-W270 PolarHBondContact O-NE1 3.35Å
267	P	84.9	Confident	87.8	Confident	84 Å²	84	54.2 Å²	54.2	55%	0.545	30%	0.303	S	S	.	.	S	Bend	trans	-70.5	-12.1	-174.7	29.1	-36.6	0	0	0	114	S285	P267-S285 WeakPolarHBondContact O-CB 3.35Å; P267-S285 PolarHBondContact O-OG 2.83Å
268	N	87	Confident	86.6	Confident	56 Å²	56	53.5 Å²	53.5	30%	0.299	31%	0.306	S	S	.	.	S	Bend	trans	-113.7	-34.8	-178.2	-63.5	-52.9	0	0	0	112.4	D266 S285 L288	D266-N268 PolarHBondContact O-N 3.28Å; D266-N268 WeakPolarHBondContact OD1-CA 3.4Å; D266-N268 WeakPolarHBondContact OD1-CB 3.35Å; D266-N268 PolarHBondContact OD1-N 3.41Å; N268-S285 VanDerWaalsContact C-OG 3.29Å; N268-S285 VanDerWaalsContact CA-OG 3.24Å; N268-S285 WeakPolarHBondContact CA-OG 3.43Å; N268-S285 WeakPolarHBondContact O-CB 3.45Å; N268-S285 PolarHBondContact O-N 3.16Å; N268-S285 PolarHBondContact O-OG 3.15Å; N268-L288 HydrophobicContact CB-CB 4.47Å; N268-L288 HydrophobicContact CB-CD2 4.32Å; N268-L288 VanDerWaalsContact O-CD2 3.25Å; N268-L288 WeakPolarHBondContact O-CD2 3.29Å
269	W	91.4	Very high	85.9	Confident	22 Å²	22	56.1 Å²	56.1	8%	0.083	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	104.1	-170.3	-66.9	104.4	0	0	0	112.9	Y236 D241 L243 I244 P245 D266 L282 I283 P284 L288	Y236-W269 WeakPolarHBondContact OH-CH2 3.46Å; Y236-W269 VanDerWaalsContact OH-CZ3 3.32Å; Y236-W269 WeakPolarHBondContact OH-CZ3 3.12Å; D241-W269 WeakPolarHBondContact OD2-CH2 3.42Å; L243-W269 VanDerWaalsContact C-CZ2 3.47Å; L243-W269 HydrophobicContact CB-CZ2 4.21Å; L243-W269 VanDerWaalsContact O-CZ2 3.28Å; L243-W269 WeakPolarHBondContact O-CZ2 3.13Å; I244-W269 HydrophobicContact CB-CH2 3.55Å; I244-W269 HydrophobicContact CB-CZ2 3.91Å; I244-W269 HydrophobicContact CB-CZ3 4.07Å; I244-W269 HydrophobicContact CD1-CH2 4.49Å; I244-W269 HydrophobicContact CD1-CZ3 4.14Å; I244-W269 HydrophobicContact CG1-CE3 4.24Å; I244-W269 HydrophobicContact CG1-CH2 3.83Å; I244-W269 HydrophobicContact CG1-CZ2 4.29Å; I244-W269 HydrophobicContact CG1-CZ3 3.81Å; P245-W269 HydrophobicContact CG-CG 4.39Å; D266-W269 WeakPolarHBondContact CB-O 3.32Å; D266-W269 PolarHBondContact OD1-N 3.11Å; W269-L282 HydrophobicContact CB-CD2 4.42Å; W269-L282 HydrophobicContact CE3-CB 4.25Å; W269-I283 CarbonylContact C-O 3.53Å; W269-I283 WeakPolarHBondContact CA-O 3.36Å; W269-P284 HydrophobicContact CZ3-CB 4.27Å; W269-L288 HydrophobicContact CD2-CD2 4.29Å; W269-L288 HydrophobicContact CH2-CD2 4.06Å; W269-L288 HydrophobicContact CZ2-CD2 3.6Å
270	W	93.9	Very high	85.5	Confident	27 Å²	27	59.2 Å²	59.2	10%	0.102	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	151.7	176.9	-62.5	-17.2	0	0	0	111.5	L230 N263 K264 D266 L282 I283 S285 Q286 Y339	L230-W270 HydrophobicContact CD1-CE3 4.07Å; L230-W270 HydrophobicContact CD1-CZ3 3.68Å; N263-W270 WeakPolarHBondContact O-CA 3.33Å; N263-W270 WeakPolarHBondContact O-CB 3.44Å; K264-W270 HydrophobicContact CB-CG 4.45Å; K264-W270 HydrophobicContact CD-CZ2 4.45Å; K264-W270 HydrophobicContact CG-CD2 4.09Å; K264-W270 HydrophobicContact CG-CG 4.25Å; K264-W270 PolarHBondContact O-NE1 3.42Å; D266-W270 PolarHBondContact O-NE1 3.35Å; W270-L282 CarbonylContact O-C 3.58Å; W270-L282 WeakPolarHBondContact O-CA 3.48Å; W270-I283 HydrophobicContact CB-CD1 4.39Å; W270-I283 HydrophobicContact CB-CG1 3.87Å; W270-I283 PolarHBondContact N-O 3.44Å; W270-I283 PolarHBondContact O-N 2.85Å; W270-S285 VanDerWaalsContact CE2-CB 3.46Å; W270-Q286 HydrophobicContact CH2-CB 3.53Å; W270-Q286 HydrophobicContact CZ2-CB 4.18Å; W270-Q286 HydrophobicContact CZ3-CB 4.2Å; W270-Y339 HydrophobicContact CZ3-CD2 4.15Å; W270-Y339 HydrophobicContact CZ3-CE2 4.27Å
271	Q	89.8	Confident	85.3	Confident	72 Å²	72	58.6 Å²	58.6	34%	0.336	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	125.5	169.8	-57.1	175.3	-42.5	0	0	109	V262 N263 T280 G281 L282	V262-Q271 PolarHBondContact N-O 2.68Å; N263-Q271 HydrophobicContact CB-CB 3.97Å; N263-Q271 HydrophobicContact CB-CG 4.26Å; N263-Q271 PolarHBondContact N-O 3.07Å; N263-Q271 PolarHBondContact ND2-OE1 3Å; N263-Q271 PolarHBondContact O-N 2.8Å; Q271-T280 HydrophobicContact CB-CG2 4.09Å; Q271-G281 WeakPolarHBondContact CA-O 3.48Å; Q271-L282 HydrophobicContact CG-CD2 3.9Å
272	A	93.6	Very high	85.3	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	167.3	178.9	0	0	0	0	0	110.8	L251 L259 H260 V261 T280 G281 I283	L251-A272 HydrophobicContact CD2-CB 4.3Å; L251-A272 WeakPolarHBondContact CD2-O 3.4Å; L259-A272 HydrophobicContact CB-CB 4.43Å; H260-A272 CarbonylContact O-C 3.54Å; H260-A272 WeakPolarHBondContact O-CA 3.4Å; H260-A272 WeakPolarHBondContact O-CB 3.25Å; V261-A272 HydrophobicContact CG2-CB 4.41Å; A272-T280 CarbonylContact O-C 3.56Å; A272-T280 WeakPolarHBondContact O-CA 3.49Å; A272-G281 PolarHBondContact N-O 3.46Å; A272-G281 PolarHBondContact O-N 2.83Å; A272-G281 VanDerWaalsContact O-O 3.1Å; A272-I283 HydrophobicContact CB-CD1 3.57Å; A272-I283 HydrophobicContact CB-CG1 3.95Å; A272-I283 HydrophobicContact CB-CG2 4.2Å
273	R	91.7	Very high	85.7	Confident	93 Å²	93	57.2 Å²	57.2	35%	0.351	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	152.6	169.2	65.7	179.8	-173.9	-175.2	-0.8	109.7	L259 H260	L259-R273 CarbonylContact C-O 3.56Å; L259-R273 WeakPolarHBondContact CA-O 3.28Å; H260-R273 HydrophobicContact CB-CG 3.96Å; H260-R273 PolarHBondContact N-O 3.48Å; H260-R273 PolarHBondContact ND1-NE 3.22Å; H260-R273 PolarHBondContact O-N 2.94Å
274	K	91.8	Very high	86.3	Confident	61 Å²	61	55.8 Å²	55.8	27%	0.265	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	138.2	169.5	-67.9	-171.6	-176.1	-160.7	0	109.8	L251 A252 D257 L259 V276	L251-K274 HydrophobicContact CD1-CG 4.37Å; L251-K274 HydrophobicContact CD2-CG 4.48Å; A252-K274 WeakPolarHBondContact O-CE 3.44Å; A252-K274 PolarHBondContact O-NZ 3Å; D257-K274 WeakPolarHBondContact OD2-CE 3.49Å; D257-K274 IonicContact OD2-NZ 2.94Å; D257-K274 PolarHBondContact OD2-NZ 3.21Å; L259-K274 HydrophobicContact CD2-CG 3.94Å; K274-V276 PolarHBondContact O-N 3.33Å
275	V	86.3	Confident	86.5	Confident	59 Å²	59	52 Å²	52	36%	0.358	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-35	175.2	175.8	0	0	0	0	111.1	Y229 I258 H260 W545	Y229-V275 HydrophobicContact CD1-CG2 3.73Å; Y229-V275 HydrophobicContact CE1-CG2 3.8Å; I258-V275 HydrophobicContact CB-CG2 4.09Å; I258-V275 HydrophobicContact CG2-CG2 3.7Å; I258-V275 PolarHBondContact O-N 3.42Å; I258-V275 VanDerWaalsContact O-N 3.13Å; H260-V275 HydrophobicContact CB-CG2 4.48Å; V275-W545 HydrophobicContact CG1-CZ2 4.21Å; V275-W545 HydrophobicContact CG2-CH2 4.37Å; V275-W545 HydrophobicContact CG2-CZ2 4.3Å
276	V	78	Confident	86.9	Confident	133 Å²	133	50.6 Å²	50.6	81%	0.806	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	99.1	176.1	-172.3	0	0	0	0	109.4	K274 G278	K274-V276 PolarHBondContact O-N 3.33Å; V276-G278 PolarHBondContact O-N 2.9Å
277	G	60.8	Low	87.2	Confident	87 Å²	87	49.7 Å²	49.7	90%	0.897	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.6	30.5	161.4	0	0	0	0	0	117.6
278	G	67.9	Low	87.4	Confident	29 Å²	29	46.4 Å²	46.4	30%	0.299	28%	0.283	S	S	.	.			trans	-106.5	138.4	-176.9	0	0	0	0	0	115.1	V276	V276-G278 PolarHBondContact O-N 2.9Å
279	A	79.3	Confident	87.6	Confident	84 Å²	84	44.7 Å²	44.7	69%	0.694	27%	0.273	S	S	*	.			trans	-68.1	156.5	157.8	0	0	0	0	0	110.4
280	T	87.6	Confident	87.4	Confident	64 Å²	64	47 Å²	47	39%	0.393	29%	0.285	S	S	.	.			trans	-69	135.5	173.8	-53.3	0	0	0	0	109.9	Q271 A272	Q271-T280 HydrophobicContact CB-CG2 4.09Å; A272-T280 CarbonylContact O-C 3.56Å; A272-T280 WeakPolarHBondContact O-CA 3.49Å
281	G	90.1	Very high	87	Confident	9 Å²	9	50.4 Å²	50.4	9%	0.093	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	176	175	0	0	0	0	0	112.3	A249 Q271 A272	A249-G281 CarbonylContact O-C 3.58Å; A249-G281 WeakPolarHBondContact O-CA 2.94Å; Q271-G281 WeakPolarHBondContact CA-O 3.48Å; A272-G281 PolarHBondContact N-O 3.46Å; A272-G281 PolarHBondContact O-N 2.83Å; A272-G281 VanDerWaalsContact O-O 3.1Å
282	L	90.7	Very high	86.8	Confident	28 Å²	28	49.5 Å²	49.5	15%	0.147	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	132.1	-177.1	-62.6	175.8	0	0	0	111.2	I244 A249 L251 W269 W270 Q271	I244-L282 HydrophobicContact CD1-CB 4.42Å; A249-L282 HydrophobicContact CB-CD1 4.17Å; A249-L282 HydrophobicContact CB-CG 4.45Å; A249-L282 PolarHBondContact O-N 2.79Å; L251-L282 PolarHBondContact N-O 2.9Å; W269-L282 HydrophobicContact CB-CD2 4.42Å; W269-L282 HydrophobicContact CE3-CB 4.25Å; W270-L282 CarbonylContact O-C 3.58Å; W270-L282 WeakPolarHBondContact O-CA 3.48Å; Q271-L282 HydrophobicContact CG-CD2 3.9Å
283	I	96	Very high	86.2	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	149.8	170.6	63.9	168.6	0	0	0	109.5	L251 F253 L259 W269 W270 A272 S285	L251-I283 HydrophobicContact CB-CG2 3.83Å; L251-I283 HydrophobicContact CD2-CG2 3.92Å; L251-I283 HydrophobicContact CG-CG2 4.24Å; F253-I283 HydrophobicContact CD1-CG2 3.85Å; F253-I283 HydrophobicContact CE1-CB 3.87Å; F253-I283 HydrophobicContact CE1-CG2 3.65Å; L259-I283 HydrophobicContact CD1-CD1 3.98Å; L259-I283 HydrophobicContact CD1-CG2 4.46Å; W269-I283 CarbonylContact C-O 3.53Å; W269-I283 WeakPolarHBondContact CA-O 3.36Å; W270-I283 HydrophobicContact CB-CD1 4.39Å; W270-I283 HydrophobicContact CB-CG1 3.87Å; W270-I283 PolarHBondContact N-O 3.44Å; W270-I283 PolarHBondContact O-N 2.85Å; A272-I283 HydrophobicContact CB-CD1 3.57Å; A272-I283 HydrophobicContact CB-CG1 3.95Å; A272-I283 HydrophobicContact CB-CG2 4.2Å; I283-S285 PolarHBondContact O-N 2.8Å
284	P	95.9	Very high	85.2	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	131.8	173.4	26.6	-34.1	0	0	0	109.8	F234 Y236 W269 L288 Y339	F234-P284 HydrophobicContact CE2-CG 4.17Å; F234-P284 HydrophobicContact CZ-CG 3.95Å; Y236-P284 HydrophobicContact CD1-CG 4.41Å; Y236-P284 HydrophobicContact CD2-CG 4Å; Y236-P284 HydrophobicContact CE2-CG 4.18Å; Y236-P284 HydrophobicContact CG-CG 4.14Å; W269-P284 HydrophobicContact CZ3-CB 4.27Å; P284-L288 HydrophobicContact CB-CD2 3.91Å; P284-L288 HydrophobicContact CB-CG 4.42Å; P284-Y339 WeakPolarHBondContact O-CE2 3.28Å; P284-Y339 PolarHBondContact O-OH 2.86Å
285	S	93.5	Very high	83.7	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	34%	0.344	C	S	.	.			trans	-61.5	163.1	172	67	0	0	0	0	111.5	P267 N268 W270 I283 C287 L288 E289	P267-S285 WeakPolarHBondContact O-CB 3.35Å; P267-S285 PolarHBondContact O-OG 2.83Å; N268-S285 VanDerWaalsContact C-OG 3.29Å; N268-S285 VanDerWaalsContact CA-OG 3.24Å; N268-S285 WeakPolarHBondContact CA-OG 3.43Å; N268-S285 WeakPolarHBondContact O-CB 3.45Å; N268-S285 PolarHBondContact O-N 3.16Å; N268-S285 PolarHBondContact O-OG 3.15Å; W270-S285 VanDerWaalsContact CE2-CB 3.46Å; I283-S285 PolarHBondContact O-N 2.8Å; S285-C287 VanDerWaalsContact C-N 3.32Å; S285-C287 PolarHBondContact O-N 3.26Å; S285-L288 PolarHBondContact O-N 3.18Å; S285-L288 VanDerWaalsContact OG-CB 3.31Å; S285-L288 WeakPolarHBondContact OG-CB 3.38Å; S285-L288 PolarHBondContact OG-N 3.08Å; S285-L288 VanDerWaalsContact OG-N 3.07Å; S285-E289 PolarHBondContact O-N 3.41Å; S285-E289 VanDerWaalsContact O-N 3.11Å
286	Q	91.5	Very high	82.1	Confident	82 Å²	82	58.9 Å²	58.9	38%	0.383	35%	0.354	S	S	.	.	H	α-helix	trans	-55.2	-47.4	172	178.4	168.1	-11	0	0	112.1	W270 L288 E289 E290 Y339	W270-Q286 HydrophobicContact CH2-CB 3.53Å; W270-Q286 HydrophobicContact CZ2-CB 4.18Å; W270-Q286 HydrophobicContact CZ3-CB 4.2Å; Q286-L288 PolarHBondContact O-N 3.42Å; Q286-E289 PolarHBondContact O-N 3.13Å; Q286-E290 HydrophobicContact CG-CG 4.3Å; Q286-E290 WeakPolarHBondContact CG-OE1 3.24Å; Q286-E290 PolarHBondContact NE2-OE1 3.49Å; Q286-E290 WeakPolarHBondContact O-CB 3.19Å; Q286-E290 VanDerWaalsContact O-CG 3.29Å; Q286-E290 WeakPolarHBondContact O-CG 3.09Å; Q286-E290 PolarHBondContact O-N 2.86Å; Q286-Y339 HydrophobicContact CB-CD2 4.23Å
287	C	88.4	Confident	80.5	Confident	53 Å²	53	63.8 Å²	63.8	36%	0.358	36%	0.358	S	S	.	.	H	α-helix	trans	-62	-41.1	-179.1	-177.7	0	0	0	0	112.6	S285 K291	S285-C287 VanDerWaalsContact C-N 3.32Å; S285-C287 PolarHBondContact O-N 3.26Å; C287-K291 VanDerWaalsContact O-CG 3.29Å; C287-K291 WeakPolarHBondContact O-CG 3.28Å; C287-K291 PolarHBondContact O-N 3.05Å; C287-K291 VanDerWaalsContact O-N 3.08Å; C287-K291 WeakPolarHBondContact SG-CE 3.18Å; C287-K291 PolarHBondContact SG-NZ 3.21Å; C287-K291 VanDerWaalsContact SG-NZ 3.44Å
288	L	90.7	Very high	79.9	Confident	16 Å²	16	67 Å²	67	8%	0.084	34%	0.343	C	S	.	.	H	α-helix	trans	-64	-44.7	177.4	178.2	60.6	0	0	0	111.6	N268 W269 P284 S285 Q286 K291 R292	N268-L288 HydrophobicContact CB-CB 4.47Å; N268-L288 HydrophobicContact CB-CD2 4.32Å; N268-L288 VanDerWaalsContact O-CD2 3.25Å; N268-L288 WeakPolarHBondContact O-CD2 3.29Å; W269-L288 HydrophobicContact CD2-CD2 4.29Å; W269-L288 HydrophobicContact CH2-CD2 4.06Å; W269-L288 HydrophobicContact CZ2-CD2 3.6Å; P284-L288 HydrophobicContact CB-CD2 3.91Å; P284-L288 HydrophobicContact CB-CG 4.42Å; S285-L288 PolarHBondContact O-N 3.18Å; S285-L288 VanDerWaalsContact OG-CB 3.31Å; S285-L288 WeakPolarHBondContact OG-CB 3.38Å; S285-L288 PolarHBondContact OG-N 3.08Å; S285-L288 VanDerWaalsContact OG-N 3.07Å; Q286-L288 PolarHBondContact O-N 3.42Å; L288-K291 PolarHBondContact O-N 2.81Å; L288-R292 WeakPolarHBondContact O-CG 3.22Å; L288-R292 PolarHBondContact O-N 3.04Å
289	E	90.6	Very high	78.5	Confident	19 Å²	19	73.1 Å²	73.1	9%	0.089	37%	0.369	C	S	.	.	H	α-helix	trans	-73.6	-34.6	-177.4	-168	60.4	-154.3	0	0	112.3	F234 S285 Q286 R292 K293 I338	F234-E289 HydrophobicContact CD1-CG 4.45Å; F234-E289 HydrophobicContact CD2-CG 4.46Å; F234-E289 HydrophobicContact CE1-CG 4Å; F234-E289 HydrophobicContact CE2-CG 3.97Å; F234-E289 HydrophobicContact CZ-CB 4.41Å; F234-E289 HydrophobicContact CZ-CG 3.71Å; S285-E289 PolarHBondContact O-N 3.41Å; S285-E289 VanDerWaalsContact O-N 3.11Å; Q286-E289 PolarHBondContact O-N 3.13Å; E289-R292 PolarHBondContact O-N 3.04Å; E289-R292 VanDerWaalsContact OE2-CD 3.26Å; E289-R292 WeakPolarHBondContact OE2-CD 3.25Å; E289-R292 IonicContact OE2-NH1 3.96Å; E289-R292 PolarHBondContact OE2-NH1 3.31Å; E289-K293 WeakPolarHBondContact O-CG 3.42Å; E289-K293 PolarHBondContact O-N 2.97Å; E289-K293 VanDerWaalsContact OE1-CE 3.24Å; E289-K293 WeakPolarHBondContact OE1-CE 3.46Å; E289-I338 HydrophobicContact CB-CG2 3.76Å; E289-I338 HydrophobicContact CG-CD1 4.03Å; E289-I338 HydrophobicContact CG-CG1 4.46Å; E289-I338 HydrophobicContact CG-CG2 3.66Å
290	E	87.6	Confident	76.6	Confident	70 Å²	70	80.4 Å²	80.4	33%	0.327	38%	0.379	S	S	.	.	H	α-helix	trans	-59.4	-46.3	169.9	-76.3	173.5	-175.4	0	0	111.3	Q286 R292 K293 A294 I338	Q286-E290 HydrophobicContact CG-CG 4.3Å; Q286-E290 WeakPolarHBondContact CG-OE1 3.24Å; Q286-E290 PolarHBondContact NE2-OE1 3.49Å; Q286-E290 WeakPolarHBondContact O-CB 3.19Å; Q286-E290 VanDerWaalsContact O-CG 3.29Å; Q286-E290 WeakPolarHBondContact O-CG 3.09Å; Q286-E290 PolarHBondContact O-N 2.86Å; E290-R292 PolarHBondContact O-N 3.06Å; E290-K293 PolarHBondContact O-N 2.91Å; E290-A294 VanDerWaalsContact O-CB 3.3Å; E290-A294 WeakPolarHBondContact O-CB 3.31Å; E290-A294 PolarHBondContact O-N 3.42Å; E290-I338 HydrophobicContact CG-CG1 3.89Å
291	K	85.3	Confident	74	Confident	100 Å²	100	80.5 Å²	80.5	44%	0.435	39%	0.393	S	S	.	.	H	α-helix	trans	-57.5	-50	174.1	-73.5	167.6	-176.7	167	0	110.8	C287 L288 K293 A294 F295	C287-K291 VanDerWaalsContact O-CG 3.29Å; C287-K291 WeakPolarHBondContact O-CG 3.28Å; C287-K291 PolarHBondContact O-N 3.05Å; C287-K291 VanDerWaalsContact O-N 3.08Å; C287-K291 WeakPolarHBondContact SG-CE 3.18Å; C287-K291 PolarHBondContact SG-NZ 3.21Å; C287-K291 VanDerWaalsContact SG-NZ 3.44Å; L288-K291 PolarHBondContact O-N 2.81Å; K291-K293 VanDerWaalsContact C-N 3.29Å; K291-K293 PolarHBondContact O-N 2.92Å; K291-A294 PolarHBondContact O-N 3.36Å; K291-A294 VanDerWaalsContact O-N 3.17Å; K291-F295 HydrophobicContact CB-CD2 4.46Å; K291-F295 HydrophobicContact CB-CE2 4.28Å; K291-F295 WeakPolarHBondContact O-CD2 3.48Å; K291-F295 PolarHBondContact O-N 3.42Å; K291-F295 VanDerWaalsContact O-N 3.13Å
292	R	86.3	Confident	71.7	Confident	52 Å²	52	87 Å²	87	20%	0.196	43%	0.431	C	S	.	.	H	α-helix	trans	-53.9	-46	178.3	-73.5	168.2	177	-172.2	-5	111.7	D241 L288 E289 E290 V296	D241-R292 IonicContact OD1-CZ 3.24Å; D241-R292 IonicContact OD1-NH2 3.93Å; D241-R292 PolarHBondContact OD1-NH2 2.85Å; D241-R292 IonicContact OD2-CZ 2.99Å; D241-R292 VanDerWaalsContact OD2-CZ 3.25Å; D241-R292 IonicContact OD2-NH1 2.8Å; D241-R292 PolarHBondContact OD2-NH1 3.25Å; D241-R292 IonicContact OD2-NH2 3.71Å; D241-R292 PolarHBondContact OD2-NH2 3.38Å; L288-R292 WeakPolarHBondContact O-CG 3.22Å; L288-R292 PolarHBondContact O-N 3.04Å; E289-R292 PolarHBondContact O-N 3.04Å; E289-R292 VanDerWaalsContact OE2-CD 3.26Å; E289-R292 WeakPolarHBondContact OE2-CD 3.25Å; E289-R292 IonicContact OE2-NH1 3.96Å; E289-R292 PolarHBondContact OE2-NH1 3.31Å; E290-R292 PolarHBondContact O-N 3.06Å; R292-V296 WeakPolarHBondContact O-CG2 3.46Å; R292-V296 PolarHBondContact O-N 2.87Å
293	K	79.8	Confident	69	Low	65 Å²	65	90.5 Å²	90.5	28%	0.283	46%	0.464	S	S	.	.	H	α-helix	trans	-76.6	-26	-178.8	-67	-171.9	-171.3	175.8	0	113.9	E289 E290 K291 L336 I338	E289-K293 WeakPolarHBondContact O-CG 3.42Å; E289-K293 PolarHBondContact O-N 2.97Å; E289-K293 VanDerWaalsContact OE1-CE 3.24Å; E289-K293 WeakPolarHBondContact OE1-CE 3.46Å; E290-K293 PolarHBondContact O-N 2.91Å; K291-K293 VanDerWaalsContact C-N 3.29Å; K291-K293 PolarHBondContact O-N 2.92Å; K293-L336 HydrophobicContact CB-CD1 4.25Å; K293-L336 HydrophobicContact CB-CD2 3.93Å; K293-L336 HydrophobicContact CD-CD2 3.99Å; K293-I338 HydrophobicContact CD-CD1 3.64Å
294	A	70.9	Confident	66	Low	73 Å²	73	93.5 Å²	93.5	60%	0.603	50%	0.495	S	S	*	.	H	α-helix	trans	-71	-32.1	174.5	0	0	0	0	0	112.7	E290 K291	E290-A294 VanDerWaalsContact O-CB 3.3Å; E290-A294 WeakPolarHBondContact O-CB 3.31Å; E290-A294 PolarHBondContact O-N 3.42Å; K291-A294 PolarHBondContact O-N 3.36Å; K291-A294 VanDerWaalsContact O-N 3.17Å
295	F	60.1	Low	63.1	Low	177 Å²	177	100.8 Å²	100.8	78%	0.776	54%	0.54	S	S	*	.	H	α-helix	trans	-87.7	-11.1	-179.6	-69.5	-67.7	0	0	0	114.6	K291 R297	K291-F295 HydrophobicContact CB-CD2 4.46Å; K291-F295 HydrophobicContact CB-CE2 4.28Å; K291-F295 WeakPolarHBondContact O-CD2 3.48Å; K291-F295 PolarHBondContact O-N 3.42Å; K291-F295 VanDerWaalsContact O-N 3.13Å; F295-R297 PolarHBondContact O-N 3.36Å
296	V	53.2	Low	59.9	Low	96 Å²	96	104.5 Å²	104.5	58%	0.582	58%	0.577	S	S	*	*	S	Bend	trans	-76.1	113.1	172.8	174.9	0	0	0	0	108.9	R292 R298	R292-V296 WeakPolarHBondContact O-CG2 3.46Å; R292-V296 PolarHBondContact O-N 2.87Å; V296-R298 PolarHBondContact O-N 2.95Å
297	R	43.6	Very low	57.2	Low	235 Å²	235	109.5 Å²	109.5	89%	0.887	60%	0.603	S	S	*	*			trans	-55.8	106.9	161.4	-86.1	-172	177.2	-177.6	1.7	106.9	F295 D299	F295-R297 PolarHBondContact O-N 3.36Å; R297-D299 PolarHBondContact O-N 2.95Å
298	R	48.8	Very low	54.4	Low	155 Å²	155	115 Å²	115	59%	0.585	63%	0.628	S	S	*	*			trans	-61.6	121.5	169.2	-85.8	-173.8	-178.9	176.4	7.4	107.9	V296 W300 R333	V296-R298 PolarHBondContact O-N 2.95Å; R298-W300 PolarHBondContact O-N 3.08Å; R298-R333 VanDerWaalsContact CZ-O 3.3Å; R298-R333 PolarHBondContact NH1-O 2.92Å; R298-R333 PolarHBondContact NH2-O 3.46Å
299	D	39.2	Very low	51.7	Low	158 Å²	158	120.6 Å²	120.6	85%	0.845	67%	0.667	S	S	*	*			trans	-49.5	115.7	173.4	-71.6	-38.8	0	0	0	109.4	R297 G301	R297-D299 PolarHBondContact O-N 2.95Å; D299-G301 VanDerWaalsContact C-N 3.3Å; D299-G301 PolarHBondContact O-N 2.82Å
300	W	38.7	Very low	48.7	Very low	236 Å²	236	122.7 Å²	122.7	89%	0.894	69%	0.693	S	S	*	*			trans	-65	97.1	165.8	-97.4	-44	0	0	0	107.1	R298 T302	R298-W300 PolarHBondContact O-N 3.08Å; W300-T302 PolarHBondContact O-N 2.93Å
301	G	33.4	Very low	46.3	Very low	66 Å²	66	127.1 Å²	127.1	68%	0.68	72%	0.718	S	S	*	*			trans	-54.5	107.2	171.5	0	0	0	0	0	111.1	D299 A303	D299-G301 VanDerWaalsContact C-N 3.3Å; D299-G301 PolarHBondContact O-N 2.82Å; G301-A303 PolarHBondContact O-N 2.83Å
302	T	42.3	Very low	43.8	Very low	147 Å²	147	130.3 Å²	130.3	90%	0.902	74%	0.739	S	S	*	*			trans	23.8	83.4	141.5	-29.5	0	0	0	0	116.4	W300	W300-T302 PolarHBondContact O-N 2.93Å
303	A	34.1	Very low	41.6	Very low	100 Å²	100	134.4 Å²	134.4	83%	0.826	77%	0.77	S	S	*	*			trans	-131.2	102.7	152.5	0	0	0	0	0	108.2	G301	G301-A303 PolarHBondContact O-N 2.83Å
304	G	31.8	Very low	39.4	Very low	63 Å²	63	135.2 Å²	135.2	65%	0.649	79%	0.788	S	S	*	*	S	Bend	trans	75.3	102.6	157.4	0	0	0	0	0	117.9
305	T	34.7	Very low	37.8	Very low	154 Å²	154	141.4 Å²	141.4	95%	0.945	80%	0.802	S	S	*	*			trans	55.6	119.3	143	34	0	0	0	0	120.1
306	G	27.8	Very low	36.8	Very low	77 Å²	77	141.1 Å²	141.1	79%	0.794	80%	0.8	S	S	*	*			trans	125.2	81.1	149.8	0	0	0	0	0	114.4	L308	G306-L308 PolarHBondContact O-N 2.86Å
307	M	35.3	Very low	35.9	Very low	187 Å²	187	146 Å²	146	92%	0.921	81%	0.813	S	S	*	*			trans	-64.2	120	152	-156.9	-179	57	0	0	106.8
308	L	29	Very low	35.5	Very low	168 Å²	168	144.8 Å²	144.8	88%	0.88	82%	0.815	S	S	*	*			trans	-173.1	123.8	151.5	-97.9	162.3	0	0	0	109.3	G306 G310	G306-L308 PolarHBondContact O-N 2.86Å; L308-G310 PolarHBondContact O-N 2.98Å
309	C	34.3	Very low	35.1	Very low	135 Å²	135	145.6 Å²	145.6	91%	0.912	82%	0.822	S	S	*	*			trans	-49.2	131.1	161.3	-176.8	0	0	0	0	110
310	G	27.4	Very low	35.2	Very low	62 Å²	62	147.8 Å²	147.8	64%	0.639	82%	0.824	S	S	*	*			trans	164.5	108.9	175.6	0	0	0	0	0	114.8	L308 L312	L308-G310 PolarHBondContact O-N 2.98Å; G310-L312 PolarHBondContact O-N 2.81Å
311	I	36.9	Very low	35.4	Very low	164 Å²	164	140.6 Å²	140.6	84%	0.841	80%	0.802	S	S	*	*			trans	-18.8	107.2	153.5	-58.9	162	0	0	0	113.1
312	L	32.8	Very low	35.6	Very low	166 Å²	166	144.8 Å²	144.8	87%	0.869	81%	0.806	S	S	*	*			trans	-145.6	113.3	150.5	-77.6	-176.5	0	0	0	110.8	G310 A314	G310-L312 PolarHBondContact O-N 2.81Å; L312-A314 VanDerWaalsContact C-N 3.27Å; L312-A314 PolarHBondContact O-N 2.86Å
313	T	39.5	Very low	35.7	Very low	139 Å²	139	146.5 Å²	146.5	85%	0.853	80%	0.797	S	S	*	*			trans	-67.3	73	173.2	39.5	0	0	0	0	111.5	K315	T313-K315 PolarHBondContact O-N 2.78Å
314	A	33	Very low	36.2	Very low	81 Å²	81	145.9 Å²	145.9	67%	0.669	78%	0.779	S	S	*	*			trans	-80.2	99.7	163.9	0	0	0	0	0	108.9	L312 K316	L312-A314 VanDerWaalsContact C-N 3.27Å; L312-A314 PolarHBondContact O-N 2.86Å; A314-K316 PolarHBondContact O-N 2.86Å
315	K	37.4	Very low	36.9	Very low	203 Å²	203	148.9 Å²	148.9	88%	0.883	79%	0.785	S	S	*	*			trans	-57	87.5	165.6	-73.2	-178.7	179.7	173.3	0	108.8	T313 K317	T313-K315 PolarHBondContact O-N 2.78Å; K315-K317 PolarHBondContact O-N 3.45Å
316	K	39.8	Very low	37.6	Very low	172 Å²	172	146.9 Å²	146.9	75%	0.748	78%	0.777	S	S	*	*			trans	-63.3	107.5	167.8	-77.2	-175.8	178.5	176.4	0	106.7	A314 K318	A314-K316 PolarHBondContact O-N 2.86Å; K316-K318 PolarHBondContact O-N 2.92Å; K316-K318 VanDerWaalsContact O-N 3.09Å
317	K	33.8	Very low	38.7	Very low	197 Å²	197	146.9 Å²	146.9	86%	0.857	76%	0.755	S	S	*	*			trans	-45.3	119.8	166.4	-88.5	179.8	172.3	176.8	0	107.2	K315 K319	K315-K317 PolarHBondContact O-N 3.45Å; K317-K319 VanDerWaalsContact C-N 3.25Å; K317-K319 PolarHBondContact O-N 2.7Å
318	K	36.3	Very low	39.8	Very low	210 Å²	210	140.4 Å²	140.4	91%	0.913	72%	0.724	S	S	*	*			trans	-54.9	96.5	162.9	-98.7	-175.6	173.1	180	0	105.9	K316 K320	K316-K318 PolarHBondContact O-N 2.92Å; K316-K318 VanDerWaalsContact O-N 3.09Å; K318-K320 PolarHBondContact O-N 2.98Å; K318-K320 VanDerWaalsContact O-N 3.08Å
319	K	40.3	Very low	41.1	Very low	172 Å²	172	135 Å²	135	75%	0.748	70%	0.704	S	S	*	*			trans	-66	108.6	166.2	-90.5	-177.6	174.1	174.8	0	104.9	K317 M321	K317-K319 VanDerWaalsContact C-N 3.25Å; K317-K319 PolarHBondContact O-N 2.7Å; K319-M321 HydrophobicContact CB-CG 4.41Å; K319-M321 PolarHBondContact O-N 2.96Å
320	K	39.7	Very low	42.3	Very low	205 Å²	205	132.6 Å²	132.6	89%	0.891	68%	0.679	S	S	*	*			trans	-57.6	99.7	157.7	-85.7	-174.6	173.3	-176.2	0	105.3	K318 M322	K318-K320 PolarHBondContact O-N 2.98Å; K318-K320 VanDerWaalsContact O-N 3.08Å; K320-M322 PolarHBondContact O-N 2.86Å; K320-M322 VanDerWaalsContact O-N 3.15Å
321	M	43.8	Very low	43.6	Very low	84 Å²	84	132 Å²	132	41%	0.414	66%	0.659	S	S	.	*			trans	-77.3	98.2	174.6	-76.2	-141.7	58.7	0	0	107.1	K319 K327 F331	K319-M321 HydrophobicContact CB-CG 4.41Å; K319-M321 PolarHBondContact O-N 2.96Å; M321-K327 HydrophobicContact CE-CB 4.35Å; M321-K327 HydrophobicContact CE-CD 3.59Å; M321-F331 HydrophobicContact CE-CZ 4.46Å
322	M	38.6	Very low	44.7	Very low	155 Å²	155	125.2 Å²	125.2	76%	0.764	63%	0.625	S	S	*	*			trans	-63	142.8	162.2	-76.3	-152.1	-97.4	0	0	108.8	K320 L324	K320-M322 PolarHBondContact O-N 2.86Å; K320-M322 VanDerWaalsContact O-N 3.15Å; M322-L324 PolarHBondContact O-N 3.17Å
323	Y	42.9	Very low	45.9	Very low	182 Å²	182	124.3 Å²	124.3	71%	0.714	61%	0.61	S	S	*	*			trans	-64.3	95.5	175.5	-126.2	-95.5	0	0	0	108.4	F331	Y323-F331 HydrophobicContact CD2-CE1 4.47Å; Y323-F331 HydrophobicContact CD2-CZ 4.24Å; Y323-F331 HydrophobicContact CE2-CD1 4.45Å; Y323-F331 HydrophobicContact CE2-CE1 4.18Å; Y323-F331 HydrophobicContact CE2-CZ 4.32Å
324	L	44.7	Very low	46.8	Very low	88 Å²	88	126.3 Å²	126.3	46%	0.461	60%	0.603	S	S	.	*			trans	-101.4	119.6	170.4	-78.6	152.7	0	0	0	106.6	M322 S326 K327	M322-L324 PolarHBondContact O-N 3.17Å; L324-S326 PolarHBondContact O-N 3.36Å; L324-S326 VanDerWaalsContact O-N 3.09Å; L324-K327 HydrophobicContact CB-CG 4.4Å; L324-K327 WeakPolarHBondContact O-CA 3.42Å; L324-K327 PolarHBondContact O-N 2.98Å
325	T	47.1	Very low	48.4	Very low	125 Å²	125	126.4 Å²	126.4	77%	0.767	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-52.5	-32.4	177.9	-51.3	0	0	0	0	112.2	K327 N328	T325-K327 PolarHBondContact O-N 3.31Å; T325-N328 WeakPolarHBondContact O-CB 3.23Å; T325-N328 PolarHBondContact O-N 3.01Å
326	S	49.8	Very low	50	Low	112 Å²	112	119.9 Å²	119.9	78%	0.783	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-70.9	-8.4	175.5	33.1	0	0	0	0	115	L324	L324-S326 PolarHBondContact O-N 3.36Å; L324-S326 VanDerWaalsContact O-N 3.09Å
327	K	50.8	Low	52	Low	78 Å²	78	113.7 Å²	113.7	34%	0.339	54%	0.538	S	S	.	.	G	3₁₀ helix	trans	-111.6	12	172.6	-63.5	-170.1	-180	178.2	0	113.4	M321 L324 T325 A329 E330 F331	M321-K327 HydrophobicContact CE-CB 4.35Å; M321-K327 HydrophobicContact CE-CD 3.59Å; L324-K327 HydrophobicContact CB-CG 4.4Å; L324-K327 WeakPolarHBondContact O-CA 3.42Å; L324-K327 PolarHBondContact O-N 2.98Å; T325-K327 PolarHBondContact O-N 3.31Å; K327-A329 PolarHBondContact O-N 3.48Å; K327-A329 VanDerWaalsContact O-N 3.11Å; K327-E330 WeakPolarHBondContact O-CB 3.46Å; K327-E330 PolarHBondContact O-N 3.39Å; K327-F331 WeakPolarHBondContact O-CD2 3.5Å
328	N	57.2	Low	54.7	Low	50 Å²	50	104.4 Å²	104.4	27%	0.267	50%	0.497	S	S	.	.	H	α-helix	trans	-54.9	-32.7	-178.6	-161.5	-0.4	0	0	0	112.4	T325 E330 F331 D332 K454	T325-N328 WeakPolarHBondContact O-CB 3.23Å; T325-N328 PolarHBondContact O-N 3.01Å; N328-E330 PolarHBondContact O-N 3.01Å; N328-F331 WeakPolarHBondContact O-CB 3.5Å; N328-F331 PolarHBondContact O-N 3.37Å; N328-D332 PolarHBondContact O-N 3.18Å; N328-K454 PolarHBondContact ND2-NZ 3.28Å; N328-K454 PolarHBondContact OD1-NZ 3.29Å
329	A	57.7	Low	57.4	Low	54 Å²	54	95.2 Å²	95.2	45%	0.446	46%	0.457	S	S	.	.	H	α-helix	trans	-63.8	-21.7	175.6	0	0	0	0	0	115	K327	K327-A329 PolarHBondContact O-N 3.48Å; K327-A329 VanDerWaalsContact O-N 3.11Å
330	E	57.8	Low	59.9	Low	86 Å²	86	88.1 Å²	88.1	40%	0.402	43%	0.427	S	S	.	.	H	α-helix	trans	-76.3	-28.3	173.1	-66.5	-177.1	170.4	0	0	111.4	K327 N328 Y334	K327-E330 WeakPolarHBondContact O-CB 3.46Å; K327-E330 PolarHBondContact O-N 3.39Å; N328-E330 PolarHBondContact O-N 3.01Å; E330-Y334 WeakPolarHBondContact O-CE2 3.16Å
331	F	56.1	Low	62.5	Low	48 Å²	48	82.4 Å²	82.4	21%	0.211	40%	0.403	C	S	.	.	H	α-helix	trans	-76.2	-26.2	177.8	-66.4	-83.1	0	0	0	112.9	M321 Y323 K327 N328 R333 Y334 E335	M321-F331 HydrophobicContact CE-CZ 4.46Å; Y323-F331 HydrophobicContact CD2-CE1 4.47Å; Y323-F331 HydrophobicContact CD2-CZ 4.24Å; Y323-F331 HydrophobicContact CE2-CD1 4.45Å; Y323-F331 HydrophobicContact CE2-CE1 4.18Å; Y323-F331 HydrophobicContact CE2-CZ 4.32Å; K327-F331 WeakPolarHBondContact O-CD2 3.5Å; N328-F331 WeakPolarHBondContact O-CB 3.5Å; N328-F331 PolarHBondContact O-N 3.37Å; F331-R333 PolarHBondContact O-N 3.06Å; F331-Y334 PolarHBondContact O-N 3.4Å; F331-E335 PolarHBondContact O-N 3.34Å
332	D	60.4	Low	64.9	Low	22 Å²	22	78.6 Å²	78.6	12%	0.118	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-27.5	172.7	-64.6	-3.2	0	0	0	112.6	N328 Y334 Q451 K454 Y512	N328-D332 PolarHBondContact O-N 3.18Å; D332-Y334 PolarHBondContact O-N 3.18Å; D332-Q451 PolarHBondContact OD2-NE2 3.08Å; D332-Q451 PolarHBondContact OD2-OE1 2.86Å; D332-K454 WeakPolarHBondContact OD1-CE 3.46Å; D332-K454 IonicContact OD1-NZ 3.9Å; D332-K454 PolarHBondContact OD1-NZ 3.21Å; D332-K454 IonicContact OD2-NZ 3.25Å; D332-K454 PolarHBondContact OD2-NZ 3.33Å; D332-Y512 PolarHBondContact OD2-OH 3.04Å
333	R	56.4	Low	67.5	Low	147 Å²	147	71.8 Å²	71.8	56%	0.555	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-19.1	177.2	-60.9	-177.9	-176.5	172	2.2	112.1	R298 F331	R298-R333 VanDerWaalsContact CZ-O 3.3Å; R298-R333 PolarHBondContact NH1-O 2.92Å; R298-R333 PolarHBondContact NH2-O 3.46Å; F331-R333 PolarHBondContact O-N 3.06Å
334	Y	60.1	Low	69.9	Low	181 Å²	181	70.6 Å²	70.6	71%	0.71	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107	-3.6	-177.5	-53.3	-74.4	0	0	0	113.1	E330 F331 D332 L336	E330-Y334 WeakPolarHBondContact O-CE2 3.16Å; F331-Y334 PolarHBondContact O-N 3.4Å; D332-Y334 PolarHBondContact O-N 3.18Å; Y334-L336 PolarHBondContact O-N 3.32Å
335	E	65.3	Low	72.1	Confident	83 Å²	83	69.4 Å²	69.4	39%	0.388	34%	0.34	S	S	.	.			trans	-71	111.4	172.8	-167.9	171.2	-158.6	0	0	109.7	F331 H514 Y515	F331-E335 PolarHBondContact O-N 3.34Å; E335-H514 IonicContact OE2-NE2 3.9Å; E335-Y515 PolarHBondContact OE2-OH 2.93Å
336	L	72.3	Confident	74.3	Confident	66 Å²	66	67.6 Å²	67.6	35%	0.346	33%	0.33	S	S	.	.			trans	-106.5	83	178.2	-73.1	173.9	0	0	0	109.4	K293 Y334 I338	K293-L336 HydrophobicContact CB-CD1 4.25Å; K293-L336 HydrophobicContact CB-CD2 3.93Å; K293-L336 HydrophobicContact CD-CD2 3.99Å; Y334-L336 PolarHBondContact O-N 3.32Å; L336-I338 HydrophobicContact CB-CD1 4.46Å; L336-I338 PolarHBondContact O-N 3.08Å
337	Q	80.7	Confident	76.3	Confident	43 Å²	43	65 Å²	65	20%	0.201	31%	0.311	C	S	.	.			trans	-80.1	111.5	170.2	-141.3	-176.2	-6.4	0	0	109.5	Y233 E340 K457 H514	Y233-Q337 WeakPolarHBondContact CB-O 3.42Å; Y233-Q337 HydrophobicContact CD2-CB 3.87Å; Y233-Q337 HydrophobicContact CD2-CG 3.73Å; Y233-Q337 HydrophobicContact CE2-CB 4.08Å; Y233-Q337 HydrophobicContact CE2-CG 3.47Å; Y233-Q337 VanDerWaalsContact CE2-CG 3.47Å; Y233-Q337 PolarHBondContact OH-NE2 3.23Å; Q337-E340 PolarHBondContact NE2-OE1 3.06Å; Q337-K457 VanDerWaalsContact NE2-NZ 3.13Å; Q337-H514 PolarHBondContact OE1-CD2 2.76Å
338	I	90.5	Very high	78.3	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.01	30%	0.304	C	S	.	.			trans	-96.8	-59.6	-179.2	-54.9	-51.7	0	0	0	110.8	Y233 F234 E289 E290 K293 L336	Y233-I338 PolarHBondContact N-O 3.03Å; F234-I338 HydrophobicContact CD1-CG2 4Å; F234-I338 HydrophobicContact CE1-CG2 3.45Å; F234-I338 VanDerWaalsContact CE1-CG2 3.45Å; F234-I338 HydrophobicContact CZ-CG2 4.25Å; E289-I338 HydrophobicContact CB-CG2 3.76Å; E289-I338 HydrophobicContact CG-CD1 4.03Å; E289-I338 HydrophobicContact CG-CG1 4.46Å; E289-I338 HydrophobicContact CG-CG2 3.66Å; E290-I338 HydrophobicContact CG-CG1 3.89Å; K293-I338 HydrophobicContact CD-CD1 3.64Å; L336-I338 HydrophobicContact CB-CD1 4.46Å; L336-I338 PolarHBondContact O-N 3.08Å
339	Y	93	Very high	79.8	Confident	17 Å²	17	66.4 Å²	66.4	7%	0.067	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	149.1	176.1	-62.7	-72.4	0	0	0	108.5	L230 K231 P232 F234 F253 L259 W270 P284 Q286	L230-Y339 HydrophobicContact CB-CD1 4.22Å; L230-Y339 HydrophobicContact CD1-CD1 4.2Å; L230-Y339 HydrophobicContact CD1-CD2 4.46Å; L230-Y339 HydrophobicContact CD1-CG 4.02Å; K231-Y339 WeakPolarHBondContact O-CA 3.43Å; P232-Y339 HydrophobicContact CB-CD1 3.88Å; P232-Y339 HydrophobicContact CB-CE1 3.79Å; F234-Y339 AromaticContact CE1-CE1 3.89Å; F234-Y339 HydrophobicContact CE1-CE1 3.89Å; F234-Y339 HydrophobicContact CE1-CE2 4.23Å; F234-Y339 AromaticContact CE1-CZ 3.72Å; F234-Y339 HydrophobicContact CZ-CE1 4.36Å; F234-Y339 AromaticContact CZ-CZ 3.88Å; F234-Y339 WeakPolarHBondContact CZ-OH 3.23Å; F253-Y339 HydrophobicContact CZ-CE1 4.12Å; L259-Y339 HydrophobicContact CD1-CE1 4.38Å; W270-Y339 HydrophobicContact CZ3-CD2 4.15Å; W270-Y339 HydrophobicContact CZ3-CE2 4.27Å; P284-Y339 WeakPolarHBondContact O-CE2 3.28Å; P284-Y339 PolarHBondContact O-OH 2.86Å; Q286-Y339 HydrophobicContact CB-CD2 4.23Å
340	E	93.4	Very high	81.5	Confident	23 Å²	23	64.4 Å²	64.4	11%	0.107	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	130.7	165	171.5	171.4	-100.3	0	0	108.8	L230 K231 Y233 Q337 V342 K457 P547	L230-E340 CarbonylContact C-O 3.59Å; L230-E340 WeakPolarHBondContact CA-O 3.49Å; K231-E340 PolarHBondContact N-O 2.96Å; K231-E340 PolarHBondContact O-N 3.12Å; Y233-E340 HydrophobicContact CE2-CB 3.56Å; Y233-E340 WeakPolarHBondContact OH-CB 3.32Å; Y233-E340 PolarHBondContact OH-OE1 2.98Å; Y233-E340 PolarHBondContact OH-OE2 3.17Å; Q337-E340 PolarHBondContact NE2-OE1 3.06Å; E340-V342 HydrophobicContact CG-CG1 4.03Å; E340-K457 WeakPolarHBondContact OE1-CE 3.44Å; E340-K457 IonicContact OE1-NZ 3.89Å; E340-K457 PolarHBondContact OE1-NZ 3.41Å; E340-P547 HydrophobicContact CG-CB 4.43Å; E340-P547 HydrophobicContact CG-CG 4.42Å
341	E	93.9	Very high	83.3	Confident	85 Å²	85	63.6 Å²	63.6	40%	0.397	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	129	172.9	-158.7	174.4	144	0	0	109.8	V228 Y229 L230 P547 V548	V228-E341 HydrophobicContact CG1-CG 4.04Å; Y229-E341 WeakPolarHBondContact O-CA 3.48Å; L230-E341 HydrophobicContact CD2-CB 4.02Å; L230-E341 HydrophobicContact CD2-CG 4.05Å; E341-P547 WeakPolarHBondContact O-CA 3.48Å; E341-V548 HydrophobicContact CB-CB 4.47Å; E341-V548 HydrophobicContact CB-CG2 4.12Å; E341-V548 HydrophobicContact CG-CB 4.45Å; E341-V548 HydrophobicContact CG-CG2 3.71Å; E341-V548 PolarHBondContact O-N 3.23Å
342	V	95	Very high	85.2	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.024	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	148.8	-172.4	-66.1	0	0	0	0	112.3	Y229 K231 I258 E340 W545 V546	Y229-V342 WeakPolarHBondContact CB-O 3.38Å; Y229-V342 PolarHBondContact O-N 3.39Å; K231-V342 HydrophobicContact CB-CG1 3.91Å; K231-V342 HydrophobicContact CB-CG2 4.38Å; I258-V342 HydrophobicContact CD1-CG2 4.28Å; I258-V342 HydrophobicContact CG2-CG2 4.29Å; E340-V342 HydrophobicContact CG-CG1 4.03Å; V342-W545 HydrophobicContact CB-CB 4.47Å; V342-W545 HydrophobicContact CB-CE3 4.17Å; V342-W545 HydrophobicContact CG2-CD2 4.43Å; V342-W545 HydrophobicContact CG2-CE3 3.66Å; V342-W545 HydrophobicContact CG2-CZ3 4.25Å; V342-V546 CarbonylContact C-O 3.6Å; V342-V546 WeakPolarHBondContact CA-O 3.42Å; V342-V546 WeakPolarHBondContact CB-O 3.34Å
343	A	93	Very high	87	Confident	12 Å²	12	60.4 Å²	60.4	10%	0.099	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	144.2	171	0	0	0	0	0	110	W545 V546 V548 V551 Y552	A343-W545 WeakPolarHBondContact O-CA 3.07Å; A343-V546 PolarHBondContact N-O 3.3Å; A343-V546 PolarHBondContact O-N 3.33Å; A343-V548 HydrophobicContact CB-CG2 4.24Å; A343-V551 HydrophobicContact CB-CG2 4.12Å; A343-Y552 HydrophobicContact CB-CE2 4.37Å
344	R	92.9	Very high	89	Confident	157 Å²	157	53.4 Å²	53.4	59%	0.592	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-86.7	116.4	173.5	-169.9	178.4	177.7	-169.6	-0.9	109.4	P543 W545	R344-P543 HydrophobicContact CG-CB 4.23Å; R344-W545 HydrophobicContact CB-CD2 4.12Å; R344-W545 HydrophobicContact CB-CE3 3.84Å; R344-W545 HydrophobicContact CB-CH2 3.66Å; R344-W545 HydrophobicContact CB-CZ2 3.89Å; R344-W545 HydrophobicContact CB-CZ3 3.62Å; R344-W545 HydrophobicContact CG-CD2 4.42Å; R344-W545 HydrophobicContact CG-CH2 4.32Å; R344-W545 HydrophobicContact CG-CZ2 4.04Å
345	M	90.8	Very high	90.8	Very high	62 Å²	62	44.8 Å²	44.8	31%	0.305	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	147.8	176.6	-66	-61.8	-76.1	0	0	110.8	F348 P543 Q544 V546 V551	M345-F348 HydrophobicContact CB-CD1 4.08Å; M345-F348 HydrophobicContact CB-CE1 4.01Å; M345-P543 CarbonylContact O-C 3.56Å; M345-P543 VanDerWaalsContact O-CA 3.3Å; M345-P543 WeakPolarHBondContact O-CA 3.36Å; M345-P543 WeakPolarHBondContact O-CB 3.17Å; M345-Q544 PolarHBondContact N-O 2.99Å; M345-Q544 PolarHBondContact O-N 3.44Å; M345-V546 HydrophobicContact CG-CG2 3.54Å; M345-V551 HydrophobicContact CE-CG1 4.41Å; M345-V551 HydrophobicContact CE-CG2 4.31Å; M345-V551 HydrophobicContact CG-CG2 3.99Å; M345-V551 HydrophobicContact SD-CG1 3.93Å; M345-V551 HydrophobicContact SD-CG2 3.68Å
346	P	92.3	Very high	92.3	Very high	88 Å²	88	40.8 Å²	40.8	57%	0.571	19%	0.194	S	C	*	.	P	Polyproline II helix	trans	-58.7	162.7	168.2	28.3	-35.1	0	0	0	110.3	F348	P346-F348 WeakPolarHBondContact O-CD1 3.37Å; P346-F348 PolarHBondContact O-N 3Å
347	P	93.3	Very high	93.4	Very high	57 Å²	57	37.9 Å²	37.9	37%	0.37	18%	0.179	S	C	.	.	S	Bend	trans	-53.8	129.1	178.3	-20.2	29.2	0	0	0	111.3	F540 V541	P347-F540 VanDerWaalsContact CB-O 3.25Å; P347-F540 WeakPolarHBondContact CB-O 3.31Å; P347-V541 VanDerWaalsContact CG-O 3.26Å; P347-V541 WeakPolarHBondContact CG-O 3.45Å
348	F	91.2	Very high	94	Very high	46 Å²	46	35.9 Å²	35.9	20%	0.202	17%	0.17	C	C	.	.			trans	-149.3	157.7	-177.3	77.4	-84.1	0	0	0	111.8	M345 P346 M462 L539 Q544 V546	M345-F348 HydrophobicContact CB-CD1 4.08Å; M345-F348 HydrophobicContact CB-CE1 4.01Å; P346-F348 WeakPolarHBondContact O-CD1 3.37Å; P346-F348 PolarHBondContact O-N 3Å; F348-M462 HydrophobicContact CE2-SD 3.89Å; F348-M462 HydrophobicContact CZ-SD 4.42Å; F348-L539 PolarHBondContact N-O 3.14Å; F348-Q544 HydrophobicContact CD1-CB 4.39Å; F348-Q544 HydrophobicContact CE1-CB 3.88Å; F348-Q544 HydrophobicContact CE1-CG 4.33Å; F348-Q544 PolarHBondContact O-NE2 3.36Å; F348-V546 HydrophobicContact CE1-CG1 3.91Å; F348-V546 HydrophobicContact CZ-CG1 3.8Å
349	R	89	Confident	93.9	Very high	112 Å²	112	43.4 Å²	43.4	42%	0.423	21%	0.206	S	C	.	.			trans	-79.4	124.8	177.3	-175	176.8	-59.8	-170.9	-3	110.6	G441 T443 F540	R349-G441 PolarHBondContact NH1-O 3.25Å; R349-T443 WeakPolarHBondContact CG-OG1 3.37Å; R349-F540 HydrophobicContact CB-CE1 3.72Å; R349-F540 HydrophobicContact CB-CZ 4.35Å; R349-F540 HydrophobicContact CG-CE1 3.68Å; R349-F540 HydrophobicContact CG-CZ 3.9Å
350	R	93.7	Very high	93.5	Very high	11 Å²	11	45.6 Å²	45.6	4%	0.042	23%	0.233	C	C	.	.			trans	-67.5	139.6	168.5	-63.8	-76.4	-177.8	166.1	6.1	110.5	T443 M462 F464 L539	R350-T443 WeakPolarHBondContact O-CG2 3.16Å; R350-T443 PolarHBondContact O-OG1 3.47Å; R350-M462 VanDerWaalsContact CD-O 3.27Å; R350-M462 WeakPolarHBondContact CD-O 3.42Å; R350-F464 HydrophobicContact CB-CB 4.42Å; R350-F464 HydrophobicContact CG-CB 4Å; R350-L539 HydrophobicContact CG-CD1 3.97Å
351	K	95.2	Very high	93.4	Very high	69 Å²	69	44.8 Å²	44.8	30%	0.3	23%	0.23	S	C	.	.	S	Bend	trans	-71.8	-37.5	177	-69.6	173.8	175.3	171.1	0	111.2	V438 T443 C444 A459 E460 F461 M462	K351-V438 HydrophobicContact CB-CG1 4.2Å; K351-V438 HydrophobicContact CB-CG2 4.06Å; K351-V438 HydrophobicContact CD-CG1 4.17Å; K351-V438 HydrophobicContact CG-CG1 3.95Å; K351-T443 WeakPolarHBondContact O-CA 3.49Å; K351-C444 PolarHBondContact O-N 3.39Å; K351-A459 PolarHBondContact NZ-O 2.67Å; K351-E460 WeakPolarHBondContact CD-O 3.34Å; K351-E460 WeakPolarHBondContact CE-O 3.26Å; K351-E460 PolarHBondContact NZ-O 3.39Å; K351-F461 WeakPolarHBondContact CB-O 3.19Å; K351-M462 HydrophobicContact CD-CE 3.74Å; K351-M462 VanDerWaalsContact CE-CE 3.41Å; K351-M462 HydrophobicContact CG-CE 4.16Å
352	T	97.4	Very high	93.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	142.8	-179.8	63.2	0	0	0	0	112.6	I434 C444 L446 F461 P463 F464	T352-I434 HydrophobicContact CG2-CG2 3.74Å; T352-C444 CarbonylContact C-O 3.59Å; T352-C444 VanDerWaalsContact CA-O 3.28Å; T352-C444 WeakPolarHBondContact CA-O 3.31Å; T352-C444 HydrophobicContact CG2-CB 4.26Å; T352-L446 HydrophobicContact CG2-CD1 4.29Å; T352-F461 HydrophobicContact CG2-CB 4.05Å; T352-F461 HydrophobicContact CG2-CD1 4.31Å; T352-F461 WeakPolarHBondContact CG2-O 3.44Å; T352-F461 PolarHBondContact N-O 3.02Å; T352-F461 PolarHBondContact OG1-O 3.34Å; T352-P463 WeakPolarHBondContact O-CA 3.36Å; T352-P463 WeakPolarHBondContact OG1-CA 3.44Å; T352-P463 WeakPolarHBondContact OG1-CB 3.46Å; T352-F464 PolarHBondContact O-N 2.92Å
353	L	97.8	Very high	93.2	Very high	3 Å²	3	43.4 Å²	43.4	2%	0.016	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	113.9	169.8	172.2	64.1	0	0	0	107.5	L355 L370 T443 C444 I445 L446 F464 V466 V536	L353-L355 HydrophobicContact CD1-CD2 4.5Å; L353-L355 HydrophobicContact CG-CD2 4.33Å; L353-L370 HydrophobicContact CD2-CD1 3.72Å; L353-T443 HydrophobicContact CB-CG2 4.03Å; L353-C444 PolarHBondContact N-O 3.45Å; L353-I445 HydrophobicContact CB-CG1 4.3Å; L353-I445 HydrophobicContact CD2-CD1 4.15Å; L353-I445 HydrophobicContact CD2-CG1 4.11Å; L353-I445 HydrophobicContact CD2-CG2 4.2Å; L353-I445 HydrophobicContact CG-CG2 4.33Å; L353-I445 CarbonylContact O-C 3.53Å; L353-I445 WeakPolarHBondContact O-CA 3.19Å; L353-L446 PolarHBondContact O-N 3.37Å; L353-F464 HydrophobicContact CD1-CB 4.4Å; L353-F464 HydrophobicContact CD1-CD1 3.72Å; L353-V466 HydrophobicContact CD1-CG2 3.84Å; L353-V536 HydrophobicContact CD1-CG2 4.03Å; L353-V536 HydrophobicContact CD2-CG2 3.94Å
354	V	97.8	Very high	93.1	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	117.6	-172	-170.7	0	0	0	0	109.9	I356 L446 V448 L453 L456 P463 F464 V465 V466	V354-I356 HydrophobicContact CG1-CD1 3.67Å; V354-I356 HydrophobicContact CG1-CG1 3.97Å; V354-L446 HydrophobicContact CG2-CD1 4.44Å; V354-V448 HydrophobicContact CG1-CG2 3.71Å; V354-L453 HydrophobicContact CG1-CD2 3.98Å; V354-L456 HydrophobicContact CG1-CD1 4.15Å; V354-L456 HydrophobicContact CG2-CD1 3.86Å; V354-P463 HydrophobicContact CG2-CB 3.67Å; V354-F464 PolarHBondContact N-O 3.48Å; V354-V465 HydrophobicContact CB-CG2 4.41Å; V354-V466 PolarHBondContact O-N 2.93Å
355	L	97.8	Very high	93.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	109	177.4	-55.7	-174.9	0	0	0	110.2	L353 R363 L366 K367 I445 L446 V466 L532	L353-L355 HydrophobicContact CD1-CD2 4.5Å; L353-L355 HydrophobicContact CG-CD2 4.33Å; L355-R363 HydrophobicContact CB-CB 4.42Å; L355-R363 HydrophobicContact CB-CG 4.47Å; L355-R363 WeakPolarHBondContact O-CD 3.36Å; L355-L366 HydrophobicContact CD1-CB 4.36Å; L355-K367 HydrophobicContact CD1-CB 4.05Å; L355-I445 HydrophobicContact CD1-CG2 4.17Å; L355-I445 HydrophobicContact CG-CG2 4.26Å; L355-L446 PolarHBondContact N-O 3.24Å; L355-V466 WeakPolarHBondContact CA-O 3.45Å; L355-V466 HydrophobicContact CD2-CB 3.98Å; L355-L532 HydrophobicContact CD2-CD1 4.3Å; L355-L532 HydrophobicContact CD2-CD2 4.24Å
356	I	96.8	Very high	93.3	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	143	-179.7	-58.9	-59	0	0	0	110.1	V354 V448 P450 L453 V465 V466 F467 I468 I508 F516	V354-I356 HydrophobicContact CG1-CD1 3.67Å; V354-I356 HydrophobicContact CG1-CG1 3.97Å; I356-V448 HydrophobicContact CD1-CG2 3.99Å; I356-V448 WeakPolarHBondContact CD1-O 3.28Å; I356-P450 HydrophobicContact CG2-CB 4.03Å; I356-P450 HydrophobicContact CG2-CG 3.63Å; I356-L453 HydrophobicContact CD1-CD1 4.35Å; I356-L453 HydrophobicContact CD1-CD2 4.31Å; I356-L453 HydrophobicContact CD1-CG 4.22Å; I356-L453 HydrophobicContact CG1-CD1 4.05Å; I356-L453 HydrophobicContact CG1-CD2 4.22Å; I356-L453 HydrophobicContact CG1-CG 4.32Å; I356-V465 HydrophobicContact CG1-CG1 4.01Å; I356-V466 PolarHBondContact N-O 2.87Å; I356-F467 HydrophobicContact CB-CD2 4.42Å; I356-F467 HydrophobicContact CG2-CD2 4.14Å; I356-F467 CarbonylContact O-C 3.59Å; I356-F467 WeakPolarHBondContact O-CA 3.28Å; I356-F467 WeakPolarHBondContact O-CD2 3.46Å; I356-I468 PolarHBondContact O-N 3.4Å; I356-I508 HydrophobicContact CG2-CG2 3.84Å; I356-F516 HydrophobicContact CG2-CE1 4.21Å
357	G	95.5	Very high	93.4	Very high	4 Å²	4	39 Å²	39	4%	0.041	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164	168.2	-177.8	0	0	0	0	0	112.5	R363 I468	G357-R363 PolarHBondContact O-NE 3Å; G357-R363 VanDerWaalsContact O-NE 3.09Å; G357-I468 WeakPolarHBondContact CA-O 3.47Å
358	A	94.1	Very high	93.4	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.008	20%	0.203	C	C	.	.			trans	-59.9	158.5	179.4	0	0	0	0	0	112.1	G360 V361 T501 E504	A358-G360 PolarHBondContact O-N 3.45Å; A358-V361 HydrophobicContact CB-CB 4.5Å; A358-V361 WeakPolarHBondContact O-CB 3.46Å; A358-V361 WeakPolarHBondContact O-CG1 3.37Å; A358-V361 PolarHBondContact O-N 3.29Å; A358-T501 HydrophobicContact CB-CG2 3.87Å; A358-T501 VanDerWaalsContact CB-O 3.26Å; A358-T501 WeakPolarHBondContact CB-O 3.33Å; A358-E504 HydrophobicContact CB-CB 4.21Å; A358-E504 HydrophobicContact CB-CG 4.28Å
359	Q	88.3	Confident	93.6	Very high	161 Å²	161	41.5 Å²	41.5	75%	0.752	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.9	134.7	172.3	-170.5	174.8	6.6	0	0	109.6	V361 T501	Q359-V361 VanDerWaalsContact C-N 3.32Å; Q359-V361 PolarHBondContact O-N 3.39Å; Q359-T501 WeakPolarHBondContact O-CG2 3.37Å; Q359-T501 PolarHBondContact O-OG1 3.4Å
360	G	84.6	Confident	93.8	Very high	63 Å²	63	36.1 Å²	36.1	65%	0.649	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.9	-3.2	-180	0	0	0	0	0	115.4	A358 G362	A358-G360 PolarHBondContact O-N 3.45Å; G360-G362 PolarHBondContact O-N 3.13Å; G360-G362 VanDerWaalsContact O-N 3.13Å
361	V	90.5	Very high	93.9	Very high	5 Å²	5	37.3 Å²	37.3	3%	0.03	20%	0.196	C	C	.	.	S	Bend	trans	-74.6	1.5	-178.5	81.9	0	0	0	0	114.8	A358 Q359 R363 I468 A470 N522	A358-V361 HydrophobicContact CB-CB 4.5Å; A358-V361 WeakPolarHBondContact O-CB 3.46Å; A358-V361 WeakPolarHBondContact O-CG1 3.37Å; A358-V361 PolarHBondContact O-N 3.29Å; Q359-V361 VanDerWaalsContact C-N 3.32Å; Q359-V361 PolarHBondContact O-N 3.39Å; V361-R363 HydrophobicContact CG1-CG 3.7Å; V361-I468 HydrophobicContact CG1-CB 4.08Å; V361-I468 HydrophobicContact CG1-CG2 3.93Å; V361-I468 HydrophobicContact CG2-CG2 4.17Å; V361-A470 HydrophobicContact CG2-CB 4.01Å; V361-N522 PolarHBondContact O-ND2 3.4Å
362	G	90.3	Very high	93.8	Very high	17 Å²	17	39.6 Å²	39.6	18%	0.175	22%	0.216	C	C	.	.	S	Bend	trans	94.6	10.7	176.9	0	0	0	0	0	116.6	G360 R364 S365 L366	G360-G362 PolarHBondContact O-N 3.13Å; G360-G362 VanDerWaalsContact O-N 3.13Å; G362-R364 VanDerWaalsContact C-N 3.33Å; G362-R364 PolarHBondContact O-N 3.48Å; G362-S365 PolarHBondContact O-N 3.41Å; G362-L366 PolarHBondContact O-N 3.19Å; G362-L366 VanDerWaalsContact O-N 3.13Å
363	R	94.1	Very high	93.6	Very high	44 Å²	44	44 Å²	44	17%	0.166	24%	0.238	C	C	.	.	H	α-helix	trans	-52.8	-46.8	177.2	-64.2	-178	-68.4	119.3	1	113.2	L355 G357 V361 S365 L366 K367 D447 V448 I468	L355-R363 HydrophobicContact CB-CB 4.42Å; L355-R363 HydrophobicContact CB-CG 4.47Å; L355-R363 WeakPolarHBondContact O-CD 3.36Å; G357-R363 PolarHBondContact O-NE 3Å; G357-R363 VanDerWaalsContact O-NE 3.09Å; V361-R363 HydrophobicContact CG1-CG 3.7Å; R363-S365 VanDerWaalsContact C-N 3.34Å; R363-S365 PolarHBondContact O-N 3.46Å; R363-L366 PolarHBondContact O-N 3.33Å; R363-K367 WeakPolarHBondContact O-CB 3.25Å; R363-K367 PolarHBondContact O-N 2.76Å; R363-D447 HydrophobicContact CB-CB 4.37Å; R363-D447 PolarHBondContact NH1-O 2.77Å; R363-V448 PolarHBondContact NH1-O 2.79Å; R363-I468 HydrophobicContact CG-CB 4.21Å; R363-I468 HydrophobicContact CG-CG1 4.15Å
364	R	91.7	Very high	93.4	Very high	143 Å²	143	46.1 Å²	46.1	54%	0.54	25%	0.249	S	C	.	.	H	α-helix	trans	-63.8	-39.5	-179	-162.3	-179.8	-152.2	171.6	8	112	G362 K367 N368	G362-R364 VanDerWaalsContact C-N 3.33Å; G362-R364 PolarHBondContact O-N 3.48Å; R364-K367 PolarHBondContact O-N 2.91Å; R364-N368 WeakPolarHBondContact O-CB 3.28Å; R364-N368 PolarHBondContact O-N 2.71Å; R364-N368 PolarHBondContact O-OD1 2.8Å
365	S	92.3	Very high	93.1	Very high	62 Å²	62	49.7 Å²	49.7	43%	0.434	27%	0.272	S	S	.	.	H	α-helix	trans	-64.7	-45.7	178.5	-51.2	0	0	0	0	111.4	G362 R363 R369	G362-S365 PolarHBondContact O-N 3.41Å; R363-S365 VanDerWaalsContact C-N 3.34Å; R363-S365 PolarHBondContact O-N 3.46Å; S365-R369 WeakPolarHBondContact O-CB 3.43Å; S365-R369 PolarHBondContact O-N 3.39Å
366	L	94.9	Very high	92.9	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-62.8	-45.9	175.5	-67	173.4	0	0	0	111.9	L355 G362 R363 R369 L370 I468 L525 A528 F529 L532	L355-L366 HydrophobicContact CD1-CB 4.36Å; G362-L366 PolarHBondContact O-N 3.19Å; G362-L366 VanDerWaalsContact O-N 3.13Å; R363-L366 PolarHBondContact O-N 3.33Å; L366-R369 PolarHBondContact O-N 3.34Å; L366-L370 PolarHBondContact O-N 3.27Å; L366-I468 HydrophobicContact CD1-CD1 3.75Å; L366-I468 HydrophobicContact CD1-CG1 4.1Å; L366-I468 HydrophobicContact CD1-CG2 4.28Å; L366-L525 HydrophobicContact CD2-CD1 3.79Å; L366-L525 HydrophobicContact CG-CD1 4.01Å; L366-A528 HydrophobicContact CD2-CB 4.41Å; L366-F529 HydrophobicContact CD2-CB 3.78Å; L366-F529 HydrophobicContact CD2-CD2 4.18Å; L366-L532 HydrophobicContact CB-CD2 4.09Å; L366-L532 HydrophobicContact CD1-CD2 4.46Å
367	K	95.1	Very high	92.7	Very high	19 Å²	19	60.4 Å²	60.4	8%	0.083	32%	0.323	C	S	.	.	H	α-helix	trans	-55.1	-55.8	175.4	178	-177.6	77.7	178.8	0	111.5	L355 R363 R364 R369 L370 V371 A380 I445 D447	L355-K367 HydrophobicContact CD1-CB 4.05Å; R363-K367 WeakPolarHBondContact O-CB 3.25Å; R363-K367 PolarHBondContact O-N 2.76Å; R364-K367 PolarHBondContact O-N 2.91Å; K367-R369 VanDerWaalsContact C-N 3.29Å; K367-R369 PolarHBondContact O-N 3.09Å; K367-L370 PolarHBondContact O-N 2.78Å; K367-V371 WeakPolarHBondContact O-CG2 3.48Å; K367-V371 PolarHBondContact O-N 3Å; K367-V371 VanDerWaalsContact O-N 3.08Å; K367-A380 HydrophobicContact CD-CB 4.35Å; K367-I445 HydrophobicContact CB-CG2 4.18Å; K367-I445 HydrophobicContact CD-CG2 4.33Å; K367-I445 HydrophobicContact CG-CB 4.13Å; K367-I445 HydrophobicContact CG-CG2 3.71Å; K367-D447 HydrophobicContact CD-CB 4.24Å; K367-D447 WeakPolarHBondContact CE-OD2 3.42Å; K367-D447 IonicContact NZ-OD1 3.9Å; K367-D447 PolarHBondContact NZ-OD1 3.08Å; K367-D447 IonicContact NZ-OD2 2.57Å; K367-D447 PolarHBondContact NZ-OD2 3.15Å
368	N	93.8	Very high	92.7	Very high	76 Å²	76	60.3 Å²	60.3	41%	0.406	32%	0.322	S	S	.	.	H	α-helix	trans	-61.9	-40.4	-175.5	-70.7	-2.3	0	0	0	111.1	R364 V371 V372	R364-N368 WeakPolarHBondContact O-CB 3.28Å; R364-N368 PolarHBondContact O-N 2.71Å; R364-N368 PolarHBondContact O-OD1 2.8Å; N368-V371 PolarHBondContact O-N 3.06Å; N368-V372 WeakPolarHBondContact O-CB 3.49Å; N368-V372 VanDerWaalsContact O-CG2 3.28Å; N368-V372 WeakPolarHBondContact O-CG2 3.42Å; N368-V372 PolarHBondContact O-N 2.97Å
369	R	94.3	Very high	92.8	Very high	80 Å²	80	60.3 Å²	60.3	30%	0.302	32%	0.322	S	S	.	.	H	α-helix	trans	-62.5	-43.5	176.9	-169.8	173.9	172.8	163.4	-1.6	112.2	S365 L366 K367 V371 V372 M373 D526 F529	S365-R369 WeakPolarHBondContact O-CB 3.43Å; S365-R369 PolarHBondContact O-N 3.39Å; L366-R369 PolarHBondContact O-N 3.34Å; K367-R369 VanDerWaalsContact C-N 3.29Å; K367-R369 PolarHBondContact O-N 3.09Å; R369-V371 PolarHBondContact O-N 2.87Å; R369-V372 PolarHBondContact O-N 3.44Å; R369-M373 HydrophobicContact CG-CG 4.45Å; R369-M373 HydrophobicContact CG-SD 4.02Å; R369-M373 WeakPolarHBondContact O-CB 3.33Å; R369-M373 WeakPolarHBondContact O-CG 3.29Å; R369-M373 PolarHBondContact O-N 3.26Å; R369-D526 IonicContact CZ-OD1 2.62Å; R369-D526 IonicContact NH1-OD1 3.63Å; R369-D526 PolarHBondContact NH1-OD1 3.1Å; R369-D526 IonicContact NH2-OD1 2.8Å; R369-D526 PolarHBondContact NH2-OD1 3.31Å; R369-D526 VanDerWaalsContact NH2-OD1 3.15Å; R369-F529 HydrophobicContact CB-CD2 3.99Å; R369-F529 HydrophobicContact CB-CE2 3.71Å; R369-F529 HydrophobicContact CB-CZ 4.46Å; R369-F529 VanDerWaalsContact CD-CD2 3.49Å; R369-F529 HydrophobicContact CG-CD2 3.79Å; R369-F529 HydrophobicContact CG-CE1 4.32Å; R369-F529 HydrophobicContact CG-CE2 3.44Å; R369-F529 VanDerWaalsContact CG-CE2 3.44Å; R369-F529 HydrophobicContact CG-CG 4.35Å; R369-F529 HydrophobicContact CG-CZ 3.75Å
370	L	94.4	Very high	93.1	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-60.8	-45.1	176	-80.3	177	0	0	0	112.1	L353 L366 K367 N374 Y378 I445 F529 L532	L353-L370 HydrophobicContact CD2-CD1 3.72Å; L366-L370 PolarHBondContact O-N 3.27Å; K367-L370 PolarHBondContact O-N 2.78Å; L370-N374 PolarHBondContact O-N 3.12Å; L370-N374 VanDerWaalsContact O-N 3.11Å; L370-Y378 HydrophobicContact CB-CD2 4.36Å; L370-Y378 HydrophobicContact CD2-CE2 4.32Å; L370-Y378 WeakPolarHBondContact O-CD2 3.43Å; L370-I445 HydrophobicContact CB-CD1 3.6Å; L370-I445 HydrophobicContact CD1-CD1 3.79Å; L370-I445 HydrophobicContact CG-CD1 4.37Å; L370-F529 HydrophobicContact CB-CE2 4.42Å; L370-F529 HydrophobicContact CD2-CE2 3.65Å; L370-F529 HydrophobicContact CD2-CZ 3.94Å; L370-F529 HydrophobicContact CG-CD2 4.49Å; L370-F529 HydrophobicContact CG-CE2 3.72Å; L370-F529 HydrophobicContact CG-CZ 4.46Å; L370-L532 HydrophobicContact CD1-CD2 3.6Å; L370-L532 HydrophobicContact CD1-CG 4.02Å; L370-L532 HydrophobicContact CG-CD2 4.36Å
371	V	94.4	Very high	93.6	Very high	36 Å²	36	52.1 Å²	52.1	22%	0.218	27%	0.274	C	S	.	.	H	α-helix	trans	-64.4	-44.2	179.7	176.4	0	0	0	0	111.2	K367 N368 R369 N374 P375 A380 I445	K367-V371 WeakPolarHBondContact O-CG2 3.48Å; K367-V371 PolarHBondContact O-N 3Å; K367-V371 VanDerWaalsContact O-N 3.08Å; N368-V371 PolarHBondContact O-N 3.06Å; R369-V371 PolarHBondContact O-N 2.87Å; V371-N374 CarbonylContact O-C 3.52Å; V371-P375 VanDerWaalsContact O-CA 3.25Å; V371-P375 WeakPolarHBondContact O-CA 3.24Å; V371-P375 VanDerWaalsContact O-N 3.13Å; V371-A380 HydrophobicContact CG2-CB 4.23Å; V371-I445 HydrophobicContact CG2-CD1 4.06Å
372	V	94.3	Very high	93.7	Very high	116 Å²	116	53.9 Å²	53.9	70%	0.703	29%	0.285	S	S	*	.	H	α-helix	trans	-67.3	-40.7	-179.9	170.1	0	0	0	0	111.8	N368 R369	N368-V372 WeakPolarHBondContact O-CB 3.49Å; N368-V372 VanDerWaalsContact O-CG2 3.28Å; N368-V372 WeakPolarHBondContact O-CG2 3.42Å; N368-V372 PolarHBondContact O-N 2.97Å; R369-V372 PolarHBondContact O-N 3.44Å
373	M	93	Very high	93.9	Very high	94 Å²	94	54.6 Å²	54.6	46%	0.463	29%	0.287	S	S	.	.	H	α-helix	trans	-71.3	-30.9	-179.3	-73.9	-174.1	65.4	0	0	112.9	R369 F529	R369-M373 HydrophobicContact CG-CG 4.45Å; R369-M373 HydrophobicContact CG-SD 4.02Å; R369-M373 WeakPolarHBondContact O-CB 3.33Å; R369-M373 WeakPolarHBondContact O-CG 3.29Å; R369-M373 PolarHBondContact O-N 3.26Å; M373-F529 HydrophobicContact CE-CE1 4.15Å; M373-F529 HydrophobicContact CE-CZ 4.36Å; M373-F529 HydrophobicContact CG-CZ 4.49Å; M373-F529 HydrophobicContact SD-CE1 3.44Å; M373-F529 WeakPolarHBondContact SD-CE1 3.42Å; M373-F529 HydrophobicContact SD-CE2 4.41Å; M373-F529 HydrophobicContact SD-CZ 3.32Å; M373-F529 WeakPolarHBondContact SD-CZ 3.5Å
374	N	92.4	Very high	94	Very high	47 Å²	47	53.8 Å²	53.8	25%	0.251	28%	0.284	S	S	.	.			trans	-140.2	64.5	-174.7	-72.6	-60.5	0	0	0	112.3	L370 V371 L376 R377 Y378	L370-N374 PolarHBondContact O-N 3.12Å; L370-N374 VanDerWaalsContact O-N 3.11Å; V371-N374 CarbonylContact O-C 3.52Å; N374-L376 VanDerWaalsContact C-N 3.25Å; N374-L376 PolarHBondContact O-N 3.19Å; N374-R377 HydrophobicContact CB-CB 4.28Å; N374-R377 PolarHBondContact O-N 3.49Å; N374-Y378 HydrophobicContact CB-CD2 3.61Å; N374-Y378 HydrophobicContact CB-CE2 3.69Å; N374-Y378 PolarHBondContact O-N 3.44Å
375	P	93.4	Very high	94.3	Very high	75 Å²	75	47 Å²	47	49%	0.487	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-22.4	-171.8	26.6	-35.7	0	0	0	114.1	V371 R377 R442	V371-P375 VanDerWaalsContact O-CA 3.25Å; V371-P375 WeakPolarHBondContact O-CA 3.24Å; V371-P375 VanDerWaalsContact O-N 3.13Å; P375-R377 VanDerWaalsContact C-N 3.33Å; P375-R442 WeakPolarHBondContact O-CD 3.26Å
376	L	93.3	Very high	94.5	Very high	158 Å²	158	44.7 Å²	44.7	83%	0.827	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-18.9	174.7	-64.5	177.3	0	0	0	112.9	N374	N374-L376 VanDerWaalsContact C-N 3.25Å; N374-L376 PolarHBondContact O-N 3.19Å
377	R	92.5	Very high	94.5	Very high	66 Å²	66	46.2 Å²	46.2	25%	0.249	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.9	-35.3	-177.7	-64.2	-174.3	67.3	-178.2	4.3	112.3	N374 P375 R442 T443 F540	N374-R377 HydrophobicContact CB-CB 4.28Å; N374-R377 PolarHBondContact O-N 3.49Å; P375-R377 VanDerWaalsContact C-N 3.33Å; R377-R442 CarbonylContact O-C 3.44Å; R377-R442 WeakPolarHBondContact O-CA 3.16Å; R377-T443 PolarHBondContact O-N 3.04Å; R377-F540 VanDerWaalsContact NH2-CE1 3.32Å
378	Y	95.9	Very high	94.4	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.008	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	141.5	-175.6	-55.1	-64	0	0	0	111.2	L370 N374 T443 I445 V536	L370-Y378 HydrophobicContact CB-CD2 4.36Å; L370-Y378 HydrophobicContact CD2-CE2 4.32Å; L370-Y378 WeakPolarHBondContact O-CD2 3.43Å; N374-Y378 HydrophobicContact CB-CD2 3.61Å; N374-Y378 HydrophobicContact CB-CE2 3.69Å; N374-Y378 PolarHBondContact O-N 3.44Å; Y378-T443 WeakPolarHBondContact CA-O 3.46Å; Y378-T443 HydrophobicContact CD1-CG2 4.38Å; Y378-I445 HydrophobicContact CD1-CD1 3.88Å; Y378-I445 HydrophobicContact CD1-CG1 4.11Å; Y378-I445 HydrophobicContact CD2-CD1 4.49Å; Y378-I445 HydrophobicContact CG-CD1 3.76Å; Y378-I445 HydrophobicContact CG-CG1 4.34Å; Y378-V536 HydrophobicContact CE1-CG1 3.98Å; Y378-V536 WeakPolarHBondContact OH-CG1 3.46Å
379	G	95.5	Very high	94.4	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	158.2	167.7	0	0	0	0	0	110.1	T443 C444 I445	G379-T443 PolarHBondContact N-O 3.28Å; G379-C444 CarbonylContact O-C 3.54Å; G379-C444 WeakPolarHBondContact O-CA 3.31Å; G379-I445 PolarHBondContact O-N 3.09Å
380	A	94.9	Very high	94.3	Very high	37 Å²	37	56.9 Å²	56.9	31%	0.306	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	148.5	170.9	0	0	0	0	0	108.8	K367 V371	K367-A380 HydrophobicContact CD-CB 4.35Å; V371-A380 HydrophobicContact CG2-CB 4.23Å
381	T	94.4	Very high	94.1	Very high	16 Å²	16	66.8 Å²	66.8	10%	0.098	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-75.4	144.5	173.2	54.7	0	0	0	0	110.6	T429 I434 L446	T381-T429 HydrophobicContact CG2-CG2 4.34Å; T381-T429 WeakPolarHBondContact OG1-CG2 3.48Å; T381-I434 HydrophobicContact CG2-CG1 3.99Å; T381-L446 HydrophobicContact CG2-CD2 4.04Å
382	V	93.4	Very high	93.9	Very high	41 Å²	41	74 Å²	74	25%	0.248	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-87.2	120.8	168.3	-175.7	0	0	0	0	108
383	P	94.5	Very high	93.8	Very high	33 Å²	33	70.2 Å²	70.2	21%	0.214	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-70.8	151.3	179.3	28.5	-33.9	0	0	0	111.4	Y399 C400 G428	P383-Y399 HydrophobicContact CB-CD1 4.2Å; P383-Y399 HydrophobicContact CB-CE1 4.19Å; P383-Y399 HydrophobicContact CG-CD1 3.66Å; P383-Y399 HydrophobicContact CG-CE1 3.59Å; P383-Y399 CarbonylContact O-C 3.48Å; P383-Y399 VanDerWaalsContact O-CA 3.23Å; P383-Y399 WeakPolarHBondContact O-CA 3.38Å; P383-C400 PolarHBondContact O-N 3.46Å; P383-G428 CarbonylContact C-O 3.55Å; P383-G428 WeakPolarHBondContact CA-O 3.26Å
384	F	96.4	Very high	93.7	Very high	27 Å²	27	73 Å²	73	12%	0.118	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	149.1	174.8	-69.1	-104.8	0	0	0	110.6	C400 V402 Y416 Y427 G428 K430	F384-C400 CarbonylContact C-O 3.53Å; F384-C400 VanDerWaalsContact CA-O 3.25Å; F384-C400 WeakPolarHBondContact CA-O 3.48Å; F384-C400 HydrophobicContact CD1-CB 3.42Å; F384-C400 VanDerWaalsContact CD1-CB 3.42Å; F384-C400 HydrophobicContact CD2-CB 4.3Å; F384-C400 HydrophobicContact CE1-CB 3.45Å; F384-C400 VanDerWaalsContact CE1-CB 3.45Å; F384-C400 HydrophobicContact CE2-CB 4.31Å; F384-C400 HydrophobicContact CG-CB 3.87Å; F384-C400 HydrophobicContact CZ-CB 3.91Å; F384-V402 HydrophobicContact CB-CG2 4.38Å; F384-V402 HydrophobicContact CD1-CG1 3.78Å; F384-V402 HydrophobicContact CD1-CG2 4.29Å; F384-V402 HydrophobicContact CE1-CG1 4.23Å; F384-Y416 HydrophobicContact CB-CE1 4.01Å; F384-Y416 WeakPolarHBondContact CB-OH 3.27Å; F384-Y416 HydrophobicContact CD2-CE1 4.48Å; F384-Y416 HydrophobicContact CG-CE1 4.4Å; F384-Y427 CarbonylContact O-C 3.47Å; F384-Y427 VanDerWaalsContact O-CA 3.31Å; F384-Y427 WeakPolarHBondContact O-CA 3.37Å; F384-G428 PolarHBondContact N-O 3.29Å; F384-G428 PolarHBondContact O-N 3.46Å; F384-K430 HydrophobicContact CD1-CD 4.42Å; F384-K430 HydrophobicContact CD2-CB 4.28Å; F384-K430 HydrophobicContact CD2-CD 4.07Å; F384-K430 HydrophobicContact CD2-CG 3.7Å; F384-K430 HydrophobicContact CE1-CD 4.1Å; F384-K430 HydrophobicContact CE2-CB 3.97Å; F384-K430 HydrophobicContact CE2-CD 3.73Å; F384-K430 HydrophobicContact CE2-CG 3.68Å; F384-K430 HydrophobicContact CG-CD 4.42Å; F384-K430 HydrophobicContact CG-CG 4.3Å; F384-K430 HydrophobicContact CZ-CD 3.75Å; F384-K430 HydrophobicContact CZ-CG 4.24Å
385	T	96.8	Very high	93.7	Very high	0 Å²	0	76 Å²	76	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	148.6	173	-173	0	0	0	0	112.7	R387 Y399 C400 F401 V402 L426 Y427	T385-R387 VanDerWaalsContact C-N 3.3Å; T385-R387 HydrophobicContact CG2-CB 4.15Å; T385-R387 WeakPolarHBondContact OG1-CB 3.48Å; T385-R387 PolarHBondContact OG1-N 3.13Å; T385-R387 VanDerWaalsContact OG1-N 3.15Å; T385-Y399 HydrophobicContact CG2-CD1 3.97Å; T385-Y399 HydrophobicContact CG2-CG 3.99Å; T385-C400 PolarHBondContact N-O 3.32Å; T385-F401 HydrophobicContact CG2-CD1 3.49Å; T385-F401 VanDerWaalsContact CG2-CD1 3.49Å; T385-F401 HydrophobicContact CG2-CE1 3.69Å; T385-V402 PolarHBondContact O-N 2.81Å; T385-L426 CarbonylContact C-O 3.41Å; T385-L426 WeakPolarHBondContact CA-O 3.45Å; T385-L426 WeakPolarHBondContact CB-O 3.3Å; T385-L426 PolarHBondContact OG1-O 3.03Å; T385-Y427 HydrophobicContact CG2-CE1 4.37Å; T385-Y427 WeakPolarHBondContact OG1-CD1 3.09Å; T385-Y427 WeakPolarHBondContact OG1-CE1 3.14Å
386	S	96.4	Very high	93.4	Very high	14 Å²	14	74.3 Å²	74.3	10%	0.098	37%	0.373	C	S	.	.	S	Bend	trans	-83.5	-4.1	169.6	77.9	0	0	0	0	114	V402 L426	S386-V402 WeakPolarHBondContact CA-O 3.39Å; S386-L426 PolarHBondContact N-O 3.24Å; S386-L426 PolarHBondContact OG-N 2.85Å
387	R	95.8	Very high	93.1	Very high	32 Å²	32	72.7 Å²	72.7	12%	0.121	36%	0.36	C	S	.	.	S	Bend	trans	-69.9	146	-179.8	-174	-176.5	55.3	91.2	-11.8	110.2	T385 E393 F401 N425 Y427	T385-R387 VanDerWaalsContact C-N 3.3Å; T385-R387 HydrophobicContact CG2-CB 4.15Å; T385-R387 WeakPolarHBondContact OG1-CB 3.48Å; T385-R387 PolarHBondContact OG1-N 3.13Å; T385-R387 VanDerWaalsContact OG1-N 3.15Å; R387-E393 IonicContact CZ-OE1 3.41Å; R387-E393 IonicContact CZ-OE2 3.88Å; R387-E393 VanDerWaalsContact CZ-OE2 3.24Å; R387-E393 IonicContact NH1-OE2 2.79Å; R387-E393 PolarHBondContact NH1-OE2 2.77Å; R387-E393 IonicContact NH2-OE1 3.17Å; R387-E393 PolarHBondContact NH2-OE1 2.89Å; R387-E393 IonicContact NH2-OE2 2.82Å; R387-E393 PolarHBondContact NH2-OE2 2.85Å; R387-F401 WeakPolarHBondContact O-CD1 3.35Å; R387-N425 VanDerWaalsContact CA-OD1 3.3Å; R387-N425 WeakPolarHBondContact CA-OD1 3.29Å; R387-N425 HydrophobicContact CB-CB 3.97Å; R387-Y427 WeakPolarHBondContact CD-OH 3.46Å; R387-Y427 PolarHBondContact NE-OH 3.17Å
388	H	93.2	Very high	92.9	Very high	160 Å²	160	74 Å²	74	74%	0.741	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-65.3	140.9	169.1	-67.3	-66	0	0	0	112.4
389	P	93.6	Very high	92.8	Very high	71 Å²	71	76.1 Å²	76.1	46%	0.461	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-61.8	140.8	175	25.1	-32.9	0	0	0	111.1	F401	P389-F401 HydrophobicContact CB-CD1 4.2Å; P389-F401 HydrophobicContact CB-CD2 3.87Å; P389-F401 HydrophobicContact CB-CE1 4.02Å; P389-F401 HydrophobicContact CB-CE2 3.7Å; P389-F401 HydrophobicContact CB-CG 4.1Å; P389-F401 HydrophobicContact CB-CZ 3.76Å; P389-F401 HydrophobicContact CG-CD2 4.48Å; P389-F401 HydrophobicContact CG-CG 4.43Å
390	R	92.8	Very high	92.7	Very high	169 Å²	169	77.2 Å²	77.2	64%	0.638	39%	0.388	S	S	*	.	P	Polyproline II helix	trans	-79.2	162.6	168.7	-69.6	160.6	-174.3	-175.2	0.2	110.2	E392 E393	R390-E392 PolarHBondContact O-N 2.95Å; R390-E393 HydrophobicContact CB-CB 4.45Å; R390-E393 HydrophobicContact CB-CG 4.05Å; R390-E393 WeakPolarHBondContact CB-OE2 3.24Å; R390-E393 PolarHBondContact N-OE2 2.98Å; R390-E393 PolarHBondContact O-N 2.78Å
391	E	88.9	Confident	92.8	Very high	207 Å²	207	77.1 Å²	77.1	97%	0.967	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-31.9	-177.8	-64.6	-172.8	162.5	0	0	113.8
392	E	91.4	Very high	92.9	Very high	188 Å²	188	77.6 Å²	77.6	88%	0.879	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.4	-3.2	-178.6	-52.6	-160.1	-139.3	0	0	113.9	R390	R390-E392 PolarHBondContact O-N 2.95Å
393	E	92.3	Very high	93.1	Very high	37 Å²	37	79.3 Å²	79.3	17%	0.173	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-94.8	127.1	-177.7	-69.6	178.3	141.9	0	0	111.2	R387 R390 F401	R387-E393 IonicContact CZ-OE1 3.41Å; R387-E393 IonicContact CZ-OE2 3.88Å; R387-E393 VanDerWaalsContact CZ-OE2 3.24Å; R387-E393 IonicContact NH1-OE2 2.79Å; R387-E393 PolarHBondContact NH1-OE2 2.77Å; R387-E393 IonicContact NH2-OE1 3.17Å; R387-E393 PolarHBondContact NH2-OE1 2.89Å; R387-E393 IonicContact NH2-OE2 2.82Å; R387-E393 PolarHBondContact NH2-OE2 2.85Å; R390-E393 HydrophobicContact CB-CB 4.45Å; R390-E393 HydrophobicContact CB-CG 4.05Å; R390-E393 WeakPolarHBondContact CB-OE2 3.24Å; R390-E393 PolarHBondContact N-OE2 2.98Å; R390-E393 PolarHBondContact O-N 2.78Å; E393-F401 HydrophobicContact CB-CE2 4.27Å; E393-F401 HydrophobicContact CB-CZ 3.95Å
394	K	90.5	Very high	93.1	Very high	152 Å²	152	81.4 Å²	81.4	66%	0.661	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-98.6	138	172.1	-64.8	-177.3	-179.5	179.8	0	110.6	Q397	K394-Q397 HydrophobicContact CB-CB 4.33Å; K394-Q397 PolarHBondContact O-N 3.35Å
395	D	92.4	Very high	93.2	Very high	109 Å²	109	86.5 Å²	86.5	58%	0.583	42%	0.422	S	S	*	.	B	Isolated β-bridge	trans	-60.4	139.4	173.8	-171.7	50.9	0	0	0	111.1	Q397 C400 F401	D395-Q397 PolarHBondContact O-N 2.56Å; D395-C400 WeakPolarHBondContact OD1-CA 3.4Å; D395-F401 HydrophobicContact CB-CD2 4.04Å; D395-F401 WeakPolarHBondContact OD1-CD2 3.45Å; D395-F401 PolarHBondContact OD1-N 3.48Å
396	G	87	Confident	93.1	Very high	41 Å²	41	89.8 Å²	89.8	42%	0.423	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	-0.3	-178.7	0	0	0	0	0	115.3	Y399	G396-Y399 PolarHBondContact N-O 2.96Å
397	Q	86.4	Confident	93.1	Very high	123 Å²	123	89.1 Å²	89.1	58%	0.575	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-68.8	177.4	-170	174.3	20.4	0	0	111.9	K394 D395	K394-Q397 HydrophobicContact CB-CB 4.33Å; K394-Q397 PolarHBondContact O-N 3.35Å; D395-Q397 PolarHBondContact O-N 2.56Å
398	N	87.4	Confident	93.1	Very high	93 Å²	93	91.8 Å²	91.8	50%	0.497	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-33.7	178.9	-70.1	-39.5	0	0	0	111.9
399	Y	94.1	Very high	93.3	Very high	48 Å²	48	91.1 Å²	91.1	19%	0.188	44%	0.437	C	S	.	.	B	Isolated β-bridge	trans	-144.3	150	177.7	-70.5	-82.2	0	0	0	109.7	P383 T385 G396 Y427	P383-Y399 HydrophobicContact CB-CD1 4.2Å; P383-Y399 HydrophobicContact CB-CE1 4.19Å; P383-Y399 HydrophobicContact CG-CD1 3.66Å; P383-Y399 HydrophobicContact CG-CE1 3.59Å; P383-Y399 CarbonylContact O-C 3.48Å; P383-Y399 VanDerWaalsContact O-CA 3.23Å; P383-Y399 WeakPolarHBondContact O-CA 3.38Å; T385-Y399 HydrophobicContact CG2-CD1 3.97Å; T385-Y399 HydrophobicContact CG2-CG 3.99Å; G396-Y399 PolarHBondContact N-O 2.96Å; Y399-Y427 HydrophobicContact CD1-CD1 4.29Å; Y399-Y427 HydrophobicContact CD1-CE1 4.44Å; Y399-Y427 AromaticContact CE1-CD1 3.73Å; Y399-Y427 HydrophobicContact CE1-CD1 3.73Å; Y399-Y427 AromaticContact CE1-CE1 3.91Å; Y399-Y427 HydrophobicContact CE1-CE1 3.91Å
400	C	95.2	Very high	93.4	Very high	23 Å²	23	87.8 Å²	87.8	16%	0.155	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	117.9	162.1	-61.3	0	0	0	0	108.2	P383 F384 T385 D395	P383-C400 PolarHBondContact O-N 3.46Å; F384-C400 CarbonylContact C-O 3.53Å; F384-C400 VanDerWaalsContact CA-O 3.25Å; F384-C400 WeakPolarHBondContact CA-O 3.48Å; F384-C400 HydrophobicContact CD1-CB 3.42Å; F384-C400 VanDerWaalsContact CD1-CB 3.42Å; F384-C400 HydrophobicContact CD2-CB 4.3Å; F384-C400 HydrophobicContact CE1-CB 3.45Å; F384-C400 VanDerWaalsContact CE1-CB 3.45Å; F384-C400 HydrophobicContact CE2-CB 4.31Å; F384-C400 HydrophobicContact CG-CB 3.87Å; F384-C400 HydrophobicContact CZ-CB 3.91Å; T385-C400 PolarHBondContact N-O 3.32Å; D395-C400 WeakPolarHBondContact OD1-CA 3.4Å
401	F	96.4	Very high	93.5	Very high	36 Å²	36	81.4 Å²	81.4	16%	0.158	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	117.8	-175.7	-60.5	-76.4	0	0	0	109.9	T385 R387 P389 E393 D395	T385-F401 HydrophobicContact CG2-CD1 3.49Å; T385-F401 VanDerWaalsContact CG2-CD1 3.49Å; T385-F401 HydrophobicContact CG2-CE1 3.69Å; R387-F401 WeakPolarHBondContact O-CD1 3.35Å; P389-F401 HydrophobicContact CB-CD1 4.2Å; P389-F401 HydrophobicContact CB-CD2 3.87Å; P389-F401 HydrophobicContact CB-CE1 4.02Å; P389-F401 HydrophobicContact CB-CE2 3.7Å; P389-F401 HydrophobicContact CB-CG 4.1Å; P389-F401 HydrophobicContact CB-CZ 3.76Å; P389-F401 HydrophobicContact CG-CD2 4.48Å; P389-F401 HydrophobicContact CG-CG 4.43Å; E393-F401 HydrophobicContact CB-CE2 4.27Å; E393-F401 HydrophobicContact CB-CZ 3.95Å; D395-F401 HydrophobicContact CB-CD2 4.04Å; D395-F401 WeakPolarHBondContact OD1-CD2 3.45Å; D395-F401 PolarHBondContact OD1-N 3.48Å
402	V	96.3	Very high	93.7	Very high	26 Å²	26	80.5 Å²	80.5	16%	0.158	39%	0.387	C	S	.	.			trans	-128	162.9	-179.1	-69.1	0	0	0	0	110.1	F384 T385 S386 M407	F384-V402 HydrophobicContact CB-CG2 4.38Å; F384-V402 HydrophobicContact CD1-CG1 3.78Å; F384-V402 HydrophobicContact CD1-CG2 4.29Å; F384-V402 HydrophobicContact CE1-CG1 4.23Å; T385-V402 PolarHBondContact O-N 2.81Å; S386-V402 WeakPolarHBondContact CA-O 3.39Å; V402-M407 HydrophobicContact CG2-CB 4.14Å; V402-M407 HydrophobicContact CG2-SD 4.28Å
403	T	96.7	Very high	93.9	Very high	77 Å²	77	73.9 Å²	73.9	47%	0.472	37%	0.369	S	S	.	.			trans	-72.3	155.3	174.7	68.6	0	0	0	0	110.9	E405 E406 M407	T403-E405 VanDerWaalsContact C-N 3.3Å; T403-E405 WeakPolarHBondContact CB-OE2 3.5Å; T403-E405 PolarHBondContact O-N 3.03Å; T403-E406 PolarHBondContact O-N 2.99Å; T403-E406 VanDerWaalsContact OG1-CB 3.3Å; T403-E406 WeakPolarHBondContact OG1-CB 3.24Å; T403-E406 PolarHBondContact OG1-N 2.75Å; T403-M407 PolarHBondContact O-N 3.22Å
404	R	95.9	Very high	93.9	Very high	76 Å²	76	76.6 Å²	76.6	29%	0.287	39%	0.392	S	S	.	.	H	α-helix	trans	-62.7	-40.9	178.2	-174.3	172.3	176.1	118.9	5	110.9	E406 M407 E408 E421 G424 L426	R404-E406 PolarHBondContact O-N 2.94Å; R404-M407 PolarHBondContact O-N 3.28Å; R404-E408 HydrophobicContact CG-CG 4.28Å; R404-E408 IonicContact CZ-OE1 3.6Å; R404-E408 IonicContact NE-OE1 2.98Å; R404-E408 PolarHBondContact NE-OE1 2.57Å; R404-E408 IonicContact NH2-OE1 2.76Å; R404-E408 PolarHBondContact NH2-OE1 3Å; R404-E408 WeakPolarHBondContact O-CB 3.43Å; R404-E408 WeakPolarHBondContact O-CG 3.4Å; R404-E408 PolarHBondContact O-N 3.31Å; R404-E421 IonicContact CZ-OE1 3.48Å; R404-E421 IonicContact NH1-OE1 3.97Å; R404-E421 PolarHBondContact NH1-OE1 3.46Å; R404-E421 IonicContact NH2-OE1 2.8Å; R404-E421 PolarHBondContact NH2-OE1 3.4Å; R404-E421 IonicContact NH2-OE2 3.63Å; R404-G424 PolarHBondContact NH1-O 3.44Å; R404-L426 HydrophobicContact CG-CD1 3.93Å; R404-L426 HydrophobicContact CG-CG 4.48Å
405	E	96.7	Very high	94.1	Very high	135 Å²	135	74.1 Å²	74.1	63%	0.631	38%	0.379	S	S	*	.	H	α-helix	trans	-63.5	-41.4	-179.9	-59.7	74.5	-161.4	0	0	111.6	T403 R409	T403-E405 VanDerWaalsContact C-N 3.3Å; T403-E405 WeakPolarHBondContact CB-OE2 3.5Å; T403-E405 PolarHBondContact O-N 3.03Å; E405-R409 WeakPolarHBondContact O-CB 3.41Å; E405-R409 PolarHBondContact O-N 3.32Å; E405-R409 VanDerWaalsContact O-N 3.08Å
406	E	96.2	Very high	94.2	Very high	68 Å²	68	69.7 Å²	69.7	32%	0.318	35%	0.354	S	S	.	.	H	α-helix	trans	-62.2	-48.3	174	169.2	167.4	-164.4	0	0	110.8	T403 R404 E408 R409 D410	T403-E406 PolarHBondContact O-N 2.99Å; T403-E406 VanDerWaalsContact OG1-CB 3.3Å; T403-E406 WeakPolarHBondContact OG1-CB 3.24Å; T403-E406 PolarHBondContact OG1-N 2.75Å; R404-E406 PolarHBondContact O-N 2.94Å; E406-E408 PolarHBondContact O-N 3.32Å; E406-R409 PolarHBondContact O-N 3.44Å; E406-R409 IonicContact OE1-NH2 3.24Å; E406-D410 WeakPolarHBondContact O-CB 3.03Å; E406-D410 VanDerWaalsContact O-CG 3.32Å; E406-D410 PolarHBondContact O-N 2.88Å; E406-D410 VanDerWaalsContact O-OD1 3.13Å
407	M	96.5	Very high	94.5	Very high	0 Å²	0	68.4 Å²	68.4	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-62.7	-42.2	-178.9	-172	159.8	-170.7	0	0	112.2	V402 T403 R404 D410 I411 Y416 L426 G428	V402-M407 HydrophobicContact CG2-CB 4.14Å; V402-M407 HydrophobicContact CG2-SD 4.28Å; T403-M407 PolarHBondContact O-N 3.22Å; R404-M407 PolarHBondContact O-N 3.28Å; M407-D410 PolarHBondContact O-N 3.33Å; M407-I411 HydrophobicContact CG-CD1 3.92Å; M407-I411 WeakPolarHBondContact O-CB 3.47Å; M407-I411 WeakPolarHBondContact O-CD1 3.38Å; M407-I411 WeakPolarHBondContact O-CG1 3.45Å; M407-I411 PolarHBondContact O-N 2.78Å; M407-Y416 HydrophobicContact CE-CD1 4.42Å; M407-Y416 HydrophobicContact CE-CE1 3.73Å; M407-Y416 HydrophobicContact CG-CE2 4.1Å; M407-L426 HydrophobicContact CB-CD1 4.33Å; M407-L426 HydrophobicContact CE-CB 3.93Å; M407-L426 HydrophobicContact CG-CB 4.17Å; M407-L426 HydrophobicContact CG-CD1 4.11Å; M407-L426 HydrophobicContact SD-CB 3.43Å; M407-L426 WeakPolarHBondContact SD-CB 3.43Å; M407-L426 HydrophobicContact SD-CD1 4.43Å; M407-G428 VanDerWaalsContact CE-N 3.35Å
408	E	96.1	Very high	94.8	Very high	88 Å²	88	65 Å²	65	41%	0.411	32%	0.322	S	S	.	.	H	α-helix	trans	-64.8	-40.2	177.3	-73.8	179.8	172.9	0	0	112.4	R404 E406 D410 I411 K412 L426	R404-E408 HydrophobicContact CG-CG 4.28Å; R404-E408 IonicContact CZ-OE1 3.6Å; R404-E408 IonicContact NE-OE1 2.98Å; R404-E408 PolarHBondContact NE-OE1 2.57Å; R404-E408 IonicContact NH2-OE1 2.76Å; R404-E408 PolarHBondContact NH2-OE1 3Å; R404-E408 WeakPolarHBondContact O-CB 3.43Å; R404-E408 WeakPolarHBondContact O-CG 3.4Å; R404-E408 PolarHBondContact O-N 3.31Å; E406-E408 PolarHBondContact O-N 3.32Å; E408-D410 VanDerWaalsContact C-N 3.35Å; E408-I411 PolarHBondContact O-N 2.97Å; E408-K412 WeakPolarHBondContact O-CB 3.23Å; E408-K412 PolarHBondContact O-N 3.38Å; E408-L426 HydrophobicContact CG-CD1 3.64Å
409	R	96.9	Very high	95.1	Very high	146 Å²	146	65.6 Å²	65.6	55%	0.551	32%	0.321	S	S	*	.	H	α-helix	trans	-61.3	-44.2	173.5	175.7	-174.9	56.4	127.4	0.9	111.4	E405 E406 K412 G413	E405-R409 WeakPolarHBondContact O-CB 3.41Å; E405-R409 PolarHBondContact O-N 3.32Å; E405-R409 VanDerWaalsContact O-N 3.08Å; E406-R409 PolarHBondContact O-N 3.44Å; E406-R409 IonicContact OE1-NH2 3.24Å; R409-K412 PolarHBondContact O-N 3.46Å; R409-G413 PolarHBondContact O-N 3.45Å
410	D	95.9	Very high	95	Very high	1 Å²	1	65 Å²	65	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-67.9	-38.5	179.5	-75.6	20.1	0	0	0	112.4	E406 M407 E408 G413 S414 R415 Y416 K430	E406-D410 WeakPolarHBondContact O-CB 3.03Å; E406-D410 VanDerWaalsContact O-CG 3.32Å; E406-D410 PolarHBondContact O-N 2.88Å; E406-D410 VanDerWaalsContact O-OD1 3.13Å; M407-D410 PolarHBondContact O-N 3.33Å; E408-D410 VanDerWaalsContact C-N 3.35Å; D410-G413 CarbonylContact O-C 3.54Å; D410-G413 PolarHBondContact O-N 2.98Å; D410-S414 PolarHBondContact O-N 3.06Å; D410-R415 HydrophobicContact CB-CB 4.46Å; D410-R415 VanDerWaalsContact CG-NH2 3.26Å; D410-R415 PolarHBondContact O-N 3.44Å; D410-R415 IonicContact OD1-CZ 3.38Å; D410-R415 VanDerWaalsContact OD1-CZ 3.28Å; D410-R415 IonicContact OD1-NE 3.45Å; D410-R415 IonicContact OD1-NH2 2.82Å; D410-R415 PolarHBondContact OD1-NH2 3.21Å; D410-R415 IonicContact OD2-CZ 2.68Å; D410-R415 IonicContact OD2-NE 3.15Å; D410-R415 IonicContact OD2-NH2 2.75Å; D410-Y416 HydrophobicContact CB-CD2 3.95Å; D410-Y416 HydrophobicContact CB-CE2 3.48Å; D410-Y416 VanDerWaalsContact CB-CE2 3.48Å; D410-K430 WeakPolarHBondContact OD2-CE 3.42Å; D410-K430 IonicContact OD2-NZ 2.7Å; D410-K430 PolarHBondContact OD2-NZ 3.31Å
411	I	93.6	Very high	94.9	Very high	36 Å²	36	69.5 Å²	69.5	19%	0.185	35%	0.348	C	S	.	.	H	α-helix	trans	-61.4	-45.5	172.4	-72.7	164.8	0	0	0	110	M407 E408 G413 S414 Y416 H419 L426	M407-I411 HydrophobicContact CG-CD1 3.92Å; M407-I411 WeakPolarHBondContact O-CB 3.47Å; M407-I411 WeakPolarHBondContact O-CD1 3.38Å; M407-I411 WeakPolarHBondContact O-CG1 3.45Å; M407-I411 PolarHBondContact O-N 2.78Å; E408-I411 PolarHBondContact O-N 2.97Å; I411-G413 PolarHBondContact O-N 3.13Å; I411-S414 PolarHBondContact O-N 3.45Å; I411-Y416 HydrophobicContact CB-CD2 4.47Å; I411-Y416 HydrophobicContact CG1-CD2 3.58Å; I411-Y416 HydrophobicContact CG1-CE2 4.07Å; I411-Y416 HydrophobicContact CG1-CG 4.08Å; I411-H419 HydrophobicContact CD1-CB 3.89Å; I411-H419 HydrophobicContact CG1-CB 4.14Å; I411-H419 WeakPolarHBondContact CG2-NE2 3.42Å; I411-L426 HydrophobicContact CD1-CD1 4.25Å
412	K	94.3	Very high	94.6	Very high	187 Å²	187	76 Å²	76	81%	0.813	37%	0.373	S	S	*	.	H	α-helix	trans	-62.2	-31.7	175.9	-174.5	177.6	178.7	-176.1	0	112.2	E408 R409 S414	E408-K412 WeakPolarHBondContact O-CB 3.23Å; E408-K412 PolarHBondContact O-N 3.38Å; R409-K412 PolarHBondContact O-N 3.46Å; K412-S414 VanDerWaalsContact C-N 3.26Å; K412-S414 PolarHBondContact O-N 2.97Å
413	G	94.4	Very high	94.3	Very high	49 Å²	49	81.2 Å²	81.2	51%	0.505	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	10	173.1	0	0	0	0	0	115.1	R409 D410 I411 R415	R409-G413 PolarHBondContact O-N 3.45Å; D410-G413 CarbonylContact O-C 3.54Å; D410-G413 PolarHBondContact O-N 2.98Å; I411-G413 PolarHBondContact O-N 3.13Å; G413-R415 PolarHBondContact O-N 3.45Å
414	S	92.4	Very high	94.1	Very high	95 Å²	95	79.9 Å²	79.9	66%	0.664	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.5	29.8	179.4	-60.9	0	0	0	0	114.9	D410 I411 K412	D410-S414 PolarHBondContact O-N 3.06Å; I411-S414 PolarHBondContact O-N 3.45Å; K412-S414 VanDerWaalsContact C-N 3.26Å; K412-S414 PolarHBondContact O-N 2.97Å
415	R	94.6	Very high	94.1	Very high	99 Å²	99	78 Å²	78	37%	0.374	40%	0.397	S	S	.	.			trans	-84.3	-10.5	179.5	-62	-161.3	-84	-176.8	-11.1	114.4	D410 G413 K430 I431	D410-R415 HydrophobicContact CB-CB 4.46Å; D410-R415 VanDerWaalsContact CG-NH2 3.26Å; D410-R415 PolarHBondContact O-N 3.44Å; D410-R415 IonicContact OD1-CZ 3.38Å; D410-R415 VanDerWaalsContact OD1-CZ 3.28Å; D410-R415 IonicContact OD1-NE 3.45Å; D410-R415 IonicContact OD1-NH2 2.82Å; D410-R415 PolarHBondContact OD1-NH2 3.21Å; D410-R415 IonicContact OD2-CZ 2.68Å; D410-R415 IonicContact OD2-NE 3.15Å; D410-R415 IonicContact OD2-NH2 2.75Å; G413-R415 PolarHBondContact O-N 3.45Å; R415-K430 WeakPolarHBondContact O-CA 3.5Å; R415-I431 PolarHBondContact O-N 2.92Å
416	Y	94.5	Very high	94	Very high	17 Å²	17	72 Å²	72	7%	0.067	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	129.7	178.9	-79.8	-89.5	0	0	0	110.8	F384 M407 D410 I411 K430	F384-Y416 HydrophobicContact CB-CE1 4.01Å; F384-Y416 WeakPolarHBondContact CB-OH 3.27Å; F384-Y416 HydrophobicContact CD2-CE1 4.48Å; F384-Y416 HydrophobicContact CG-CE1 4.4Å; M407-Y416 HydrophobicContact CE-CD1 4.42Å; M407-Y416 HydrophobicContact CE-CE1 3.73Å; M407-Y416 HydrophobicContact CG-CE2 4.1Å; D410-Y416 HydrophobicContact CB-CD2 3.95Å; D410-Y416 HydrophobicContact CB-CE2 3.48Å; D410-Y416 VanDerWaalsContact CB-CE2 3.48Å; I411-Y416 HydrophobicContact CB-CD2 4.47Å; I411-Y416 HydrophobicContact CG1-CD2 3.58Å; I411-Y416 HydrophobicContact CG1-CE2 4.07Å; I411-Y416 HydrophobicContact CG1-CG 4.08Å; Y416-K430 HydrophobicContact CD1-CG 3.96Å; Y416-K430 HydrophobicContact CD2-CG 4.47Å; Y416-K430 HydrophobicContact CE1-CG 3.53Å; Y416-K430 HydrophobicContact CE2-CG 4.13Å; Y416-K430 HydrophobicContact CG-CG 4.4Å; Y416-K430 WeakPolarHBondContact OH-CE 3.48Å
417	L	93.7	Very high	94	Very high	14 Å²	14	71.1 Å²	71.1	7%	0.073	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	-47.7	171.6	171.9	65	0	0	0	110.5	T429 I431 I434 L446 V448 A452 V455 L456	L417-T429 PolarHBondContact N-O 2.63Å; L417-I431 HydrophobicContact CB-CG1 4.02Å; L417-I434 HydrophobicContact CD2-CD1 3.76Å; L417-L446 HydrophobicContact CD2-CD1 4.4Å; L417-V448 HydrophobicContact CD2-CG1 3.9Å; L417-A452 HydrophobicContact CD1-CB 3.95Å; L417-A452 HydrophobicContact CD2-CB 4.23Å; L417-A452 HydrophobicContact CG-CB 3.96Å; L417-V455 HydrophobicContact CD1-CB 3.77Å; L417-V455 HydrophobicContact CD1-CG1 3.92Å; L417-V455 HydrophobicContact CD1-CG2 4.46Å; L417-L456 HydrophobicContact CD1-CD1 4.42Å; L417-L456 HydrophobicContact CD1-CD2 3.99Å; L417-L456 HydrophobicContact CD1-CG 3.84Å; L417-L456 HydrophobicContact CD2-CD1 3.99Å; L417-L456 HydrophobicContact CD2-CD2 3.99Å; L417-L456 HydrophobicContact CD2-CG 4.14Å
418	E	93.1	Very high	93.9	Very high	52 Å²	52	71.4 Å²	71.4	24%	0.243	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	148.2	173.5	65.4	175.1	-175.8	0	0	109.6	G428 T429 V448 N449	E418-G428 CarbonylContact O-C 3.59Å; E418-G428 WeakPolarHBondContact O-CA 3.34Å; E418-T429 PolarHBondContact O-N 2.68Å; E418-V448 HydrophobicContact CG-CG1 4.37Å; E418-V448 WeakPolarHBondContact OE1-CA 3.47Å; E418-V448 WeakPolarHBondContact OE1-CG1 3.43Å; E418-V448 WeakPolarHBondContact OE2-CB 3.33Å; E418-N449 WeakPolarHBondContact OE2-CB 3Å; E418-N449 PolarHBondContact OE2-N 2.88Å
419	H	93.3	Very high	93.8	Very high	105 Å²	105	67.8 Å²	67.8	49%	0.486	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	154.3	172.6	65.7	85.5	0	0	0	110.1	I411 Y427	I411-H419 HydrophobicContact CD1-CB 3.89Å; I411-H419 HydrophobicContact CG1-CB 4.14Å; I411-H419 WeakPolarHBondContact CG2-NE2 3.42Å; H419-Y427 CarbonylContact C-O 3.51Å; H419-Y427 WeakPolarHBondContact CA-O 3.49Å
420	G	91.6	Very high	93.7	Very high	36 Å²	36	61.9 Å²	61.9	37%	0.371	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.8	162.3	177.8	0	0	0	0	0	111	L426 Y427	G420-L426 WeakPolarHBondContact O-CA 3.35Å; G420-Y427 PolarHBondContact N-O 2.68Å; G420-Y427 PolarHBondContact O-N 2.95Å
421	E	92.9	Very high	93.7	Very high	117 Å²	117	63.3 Å²	63.3	55%	0.547	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	131.9	176	-172.2	162.3	-165.6	0	0	109.5	R404 N425 L426	R404-E421 IonicContact CZ-OE1 3.48Å; R404-E421 IonicContact NH1-OE1 3.97Å; R404-E421 PolarHBondContact NH1-OE1 3.46Å; R404-E421 IonicContact NH2-OE1 2.8Å; R404-E421 PolarHBondContact NH2-OE1 3.4Å; R404-E421 IonicContact NH2-OE2 3.63Å; E421-N425 CarbonylContact C-O 3.57Å; E421-N425 WeakPolarHBondContact CA-O 3.25Å; E421-L426 HydrophobicContact CB-CD2 4.02Å; E421-L426 HydrophobicContact CG-CD2 4.26Å
422	Y	90.1	Very high	93.8	Very high	171 Å²	171	65.5 Å²	65.5	67%	0.671	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.1	125.2	176.4	-179	-101.6	0	0	0	109.2	G424 N425 Y427	Y422-G424 VanDerWaalsContact C-N 3.29Å; Y422-G424 PolarHBondContact O-N 3.09Å; Y422-N425 PolarHBondContact N-O 3.3Å; Y422-N425 PolarHBondContact O-N 3.05Å; Y422-Y427 HydrophobicContact CD1-CE2 4.36Å
423	D	91.3	Very high	93.9	Very high	137 Å²	137	57 Å²	57	73%	0.733	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	46.5	-179.9	-160.7	34.9	0	0	0	112.8	N425	D423-N425 PolarHBondContact O-N 3.49Å; D423-N425 VanDerWaalsContact O-N 3.12Å; D423-N425 PolarHBondContact O-ND2 3.42Å
424	G	91.6	Very high	94	Very high	48 Å²	48	54.6 Å²	54.6	50%	0.495	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	2	-179.3	0	0	0	0	0	115.8	R404 Y422	R404-G424 PolarHBondContact NH1-O 3.44Å; Y422-G424 VanDerWaalsContact C-N 3.29Å; Y422-G424 PolarHBondContact O-N 3.09Å
425	N	95.7	Very high	94.2	Very high	37 Å²	37	52.4 Å²	52.4	20%	0.198	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	142.9	-179.1	-65.5	-75.8	0	0	0	111.1	R387 E421 Y422 D423 Y427	R387-N425 VanDerWaalsContact CA-OD1 3.3Å; R387-N425 WeakPolarHBondContact CA-OD1 3.29Å; R387-N425 HydrophobicContact CB-CB 3.97Å; E421-N425 CarbonylContact C-O 3.57Å; E421-N425 WeakPolarHBondContact CA-O 3.25Å; Y422-N425 PolarHBondContact N-O 3.3Å; Y422-N425 PolarHBondContact O-N 3.05Å; D423-N425 PolarHBondContact O-N 3.49Å; D423-N425 VanDerWaalsContact O-N 3.12Å; D423-N425 PolarHBondContact O-ND2 3.42Å; N425-Y427 HydrophobicContact CB-CE2 3.84Å; N425-Y427 WeakPolarHBondContact O-CD2 2.87Å
426	L	95.6	Very high	94.3	Very high	10 Å²	10	53.5 Å²	53.5	5%	0.052	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	144.4	175.1	-62.1	178.4	0	0	0	110.4	T385 S386 R404 M407 E408 I411 G420 E421	T385-L426 CarbonylContact C-O 3.41Å; T385-L426 WeakPolarHBondContact CA-O 3.45Å; T385-L426 WeakPolarHBondContact CB-O 3.3Å; T385-L426 PolarHBondContact OG1-O 3.03Å; S386-L426 PolarHBondContact N-O 3.24Å; S386-L426 PolarHBondContact OG-N 2.85Å; R404-L426 HydrophobicContact CG-CD1 3.93Å; R404-L426 HydrophobicContact CG-CG 4.48Å; M407-L426 HydrophobicContact CB-CD1 4.33Å; M407-L426 HydrophobicContact CE-CB 3.93Å; M407-L426 HydrophobicContact CG-CB 4.17Å; M407-L426 HydrophobicContact CG-CD1 4.11Å; M407-L426 HydrophobicContact SD-CB 3.43Å; M407-L426 WeakPolarHBondContact SD-CB 3.43Å; M407-L426 HydrophobicContact SD-CD1 4.43Å; E408-L426 HydrophobicContact CG-CD1 3.64Å; I411-L426 HydrophobicContact CD1-CD1 4.25Å; G420-L426 WeakPolarHBondContact O-CA 3.35Å; E421-L426 HydrophobicContact CB-CD2 4.02Å; E421-L426 HydrophobicContact CG-CD2 4.26Å
427	Y	95.2	Very high	94.4	Very high	48 Å²	48	53.1 Å²	53.1	19%	0.188	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	144.6	173.7	-64.6	-93.6	0	0	0	109	F384 T385 R387 Y399 H419 G420 Y422 N425	F384-Y427 CarbonylContact O-C 3.47Å; F384-Y427 VanDerWaalsContact O-CA 3.31Å; F384-Y427 WeakPolarHBondContact O-CA 3.37Å; T385-Y427 HydrophobicContact CG2-CE1 4.37Å; T385-Y427 WeakPolarHBondContact OG1-CD1 3.09Å; T385-Y427 WeakPolarHBondContact OG1-CE1 3.14Å; R387-Y427 WeakPolarHBondContact CD-OH 3.46Å; R387-Y427 PolarHBondContact NE-OH 3.17Å; Y399-Y427 HydrophobicContact CD1-CD1 4.29Å; Y399-Y427 HydrophobicContact CD1-CE1 4.44Å; Y399-Y427 AromaticContact CE1-CD1 3.73Å; Y399-Y427 HydrophobicContact CE1-CD1 3.73Å; Y399-Y427 AromaticContact CE1-CE1 3.91Å; Y399-Y427 HydrophobicContact CE1-CE1 3.91Å; H419-Y427 CarbonylContact C-O 3.51Å; H419-Y427 WeakPolarHBondContact CA-O 3.49Å; G420-Y427 PolarHBondContact N-O 2.68Å; G420-Y427 PolarHBondContact O-N 2.95Å; Y422-Y427 HydrophobicContact CD1-CE2 4.36Å; N425-Y427 HydrophobicContact CB-CE2 3.84Å; N425-Y427 WeakPolarHBondContact O-CD2 2.87Å
428	G	94.6	Very high	94.5	Very high	6 Å²	6	54.2 Å²	54.2	6%	0.062	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.7	164.8	179.2	0	0	0	0	0	114.2	P383 F384 M407 E418	P383-G428 CarbonylContact C-O 3.55Å; P383-G428 WeakPolarHBondContact CA-O 3.26Å; F384-G428 PolarHBondContact N-O 3.29Å; F384-G428 PolarHBondContact O-N 3.46Å; M407-G428 VanDerWaalsContact CE-N 3.35Å; E418-G428 CarbonylContact O-C 3.59Å; E418-G428 WeakPolarHBondContact O-CA 3.34Å
429	T	95.2	Very high	94.7	Very high	12 Å²	12	59.3 Å²	59.3	7%	0.074	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	120.9	177.5	-57.7	0	0	0	0	108.6	T381 L417 E418	T381-T429 HydrophobicContact CG2-CG2 4.34Å; T381-T429 WeakPolarHBondContact OG1-CG2 3.48Å; L417-T429 PolarHBondContact N-O 2.63Å; E418-T429 PolarHBondContact O-N 2.68Å
430	K	95.2	Very high	94.8	Very high	22 Å²	22	57.3 Å²	57.3	10%	0.096	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	148.3	176.7	-69.7	-167.2	-171.1	-166.8	0	111	F384 D410 R415 Y416	F384-K430 HydrophobicContact CD1-CD 4.42Å; F384-K430 HydrophobicContact CD2-CB 4.28Å; F384-K430 HydrophobicContact CD2-CD 4.07Å; F384-K430 HydrophobicContact CD2-CG 3.7Å; F384-K430 HydrophobicContact CE1-CD 4.1Å; F384-K430 HydrophobicContact CE2-CB 3.97Å; F384-K430 HydrophobicContact CE2-CD 3.73Å; F384-K430 HydrophobicContact CE2-CG 3.68Å; F384-K430 HydrophobicContact CG-CD 4.42Å; F384-K430 HydrophobicContact CG-CG 4.3Å; F384-K430 HydrophobicContact CZ-CD 3.75Å; F384-K430 HydrophobicContact CZ-CG 4.24Å; D410-K430 WeakPolarHBondContact OD2-CE 3.42Å; D410-K430 IonicContact OD2-NZ 2.7Å; D410-K430 PolarHBondContact OD2-NZ 3.31Å; R415-K430 WeakPolarHBondContact O-CA 3.5Å; Y416-K430 HydrophobicContact CD1-CG 3.96Å; Y416-K430 HydrophobicContact CD2-CG 4.47Å; Y416-K430 HydrophobicContact CE1-CG 3.53Å; Y416-K430 HydrophobicContact CE2-CG 4.13Å; Y416-K430 HydrophobicContact CG-CG 4.4Å; Y416-K430 WeakPolarHBondContact OH-CE 3.48Å
431	I	95.3	Very high	94.9	Very high	31 Å²	31	57.6 Å²	57.6	16%	0.159	31%	0.311	C	S	.	.	H	α-helix	trans	-66.9	-41.1	175.4	-64.3	172.4	0	0	0	110.2	R415 L417 S433 I434 H435 V455 F461	R415-I431 PolarHBondContact O-N 2.92Å; L417-I431 HydrophobicContact CB-CG1 4.02Å; I431-S433 VanDerWaalsContact C-N 3.26Å; I431-S433 PolarHBondContact O-N 2.85Å; I431-I434 WeakPolarHBondContact O-CA 3.36Å; I431-I434 VanDerWaalsContact O-CB 3.22Å; I431-I434 WeakPolarHBondContact O-CB 3.37Å; I431-I434 PolarHBondContact O-N 3.42Å; I431-H435 WeakPolarHBondContact CG2-NE2 3.5Å; I431-H435 PolarHBondContact O-CD2 2.91Å; I431-H435 PolarHBondContact O-N 2.79Å; I431-V455 HydrophobicContact CD1-CG1 4.44Å; I431-F461 HydrophobicContact CG2-CE1 4.15Å; I431-F461 HydrophobicContact CG2-CZ 3.7Å
432	D	95.6	Very high	95	Very high	82 Å²	82	56.1 Å²	56.1	44%	0.439	30%	0.301	S	S	.	.	H	α-helix	trans	-55.7	-38.5	178.7	-62.7	-25.2	0	0	0	112.9	I434 H435 E436	D432-I434 PolarHBondContact O-N 2.98Å; D432-H435 WeakPolarHBondContact O-CA 3.37Å; D432-H435 WeakPolarHBondContact O-CB 3.17Å; D432-H435 PolarHBondContact O-N 2.84Å; D432-E436 WeakPolarHBondContact O-CG 3.5Å; D432-E436 PolarHBondContact O-N 2.86Å
433	S	96.3	Very high	95.3	Very high	8 Å²	8	48.2 Å²	48.2	6%	0.056	27%	0.27	C	S	.	.	H	α-helix	trans	-62.2	-28.3	176.6	-56	0	0	0	0	112.9	I431 V437	I431-S433 VanDerWaalsContact C-N 3.26Å; I431-S433 PolarHBondContact O-N 2.85Å; S433-V437 WeakPolarHBondContact O-CG2 3.39Å; S433-V437 PolarHBondContact O-N 3.4Å
434	I	96.8	Very high	95.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-70.5	-43.9	174.1	-51.2	173.8	0	0	0	109.1	T352 T381 L417 I431 D432 E436 V437 V438 C444 L446 L456 F461	T352-I434 HydrophobicContact CG2-CG2 3.74Å; T381-I434 HydrophobicContact CG2-CG1 3.99Å; L417-I434 HydrophobicContact CD2-CD1 3.76Å; I431-I434 WeakPolarHBondContact O-CA 3.36Å; I431-I434 VanDerWaalsContact O-CB 3.22Å; I431-I434 WeakPolarHBondContact O-CB 3.37Å; I431-I434 PolarHBondContact O-N 3.42Å; D432-I434 PolarHBondContact O-N 2.98Å; I434-E436 PolarHBondContact O-N 2.97Å; I434-V437 PolarHBondContact O-N 3Å; I434-V438 VanDerWaalsContact O-CG2 3.32Å; I434-V438 WeakPolarHBondContact O-CG2 3.45Å; I434-V438 PolarHBondContact O-N 3.21Å; I434-V438 VanDerWaalsContact O-N 3.07Å; I434-C444 HydrophobicContact CG2-CB 4.16Å; I434-L446 HydrophobicContact CD1-CD1 3.97Å; I434-L446 HydrophobicContact CD1-CD2 4.34Å; I434-L446 HydrophobicContact CG1-CD1 4.44Å; I434-L446 HydrophobicContact CG1-CD2 4.17Å; I434-L446 HydrophobicContact CG2-CD1 4.46Å; I434-L456 HydrophobicContact CD1-CD2 4.21Å; I434-F461 HydrophobicContact CB-CE1 4.36Å; I434-F461 HydrophobicContact CD1-CE1 4.38Å; I434-F461 HydrophobicContact CG2-CD1 3.92Å; I434-F461 HydrophobicContact CG2-CE1 4.09Å
435	H	96.6	Very high	95.9	Very high	48 Å²	48	39.4 Å²	39.4	22%	0.222	21%	0.212	C	C	.	.	H	α-helix	trans	-61.3	-42.6	177	-66.5	-57.7	0	0	0	112.3	I431 D432 V437 V438 Q439 E460 F461	I431-H435 WeakPolarHBondContact CG2-NE2 3.5Å; I431-H435 PolarHBondContact O-CD2 2.91Å; I431-H435 PolarHBondContact O-N 2.79Å; D432-H435 WeakPolarHBondContact O-CA 3.37Å; D432-H435 WeakPolarHBondContact O-CB 3.17Å; D432-H435 PolarHBondContact O-N 2.84Å; H435-V437 VanDerWaalsContact C-N 3.32Å; H435-V437 PolarHBondContact O-N 3.11Å; H435-V438 PolarHBondContact O-N 3.25Å; H435-Q439 VanDerWaalsContact O-CB 3.3Å; H435-Q439 WeakPolarHBondContact O-CB 3.45Å; H435-Q439 WeakPolarHBondContact O-CG 3.26Å; H435-Q439 PolarHBondContact O-N 2.82Å; H435-E460 IonicContact CE1-OE1 2.69Å; H435-E460 PolarHBondContact CE1-OE1 3.36Å; H435-E460 IonicContact NE2-OE1 2.91Å; H435-E460 PolarHBondContact NE2-OE1 3.4Å; H435-F461 AromaticContact CE1-CE1 3.7Å; H435-F461 AromaticContact NE2-CE1 3.91Å
436	E	96.6	Very high	96	Very high	123 Å²	123	37.7 Å²	37.7	58%	0.575	20%	0.203	S	C	*	.	H	α-helix	trans	-56.1	-45.1	176.5	-70.8	169.6	-172.7	0	0	112	D432 I434 A440	D432-E436 WeakPolarHBondContact O-CG 3.5Å; D432-E436 PolarHBondContact O-N 2.86Å; I434-E436 PolarHBondContact O-N 2.97Å; E436-A440 WeakPolarHBondContact O-CB 3.36Å; E436-A440 PolarHBondContact O-N 3.02Å
437	V	96.6	Very high	95.9	Very high	9 Å²	9	39.2 Å²	39.2	6%	0.055	21%	0.21	C	C	.	.	H	α-helix	trans	-65.9	-42.4	178.3	176.8	0	0	0	0	111.4	S433 I434 H435 A440 R442 C444	S433-V437 WeakPolarHBondContact O-CG2 3.39Å; S433-V437 PolarHBondContact O-N 3.4Å; I434-V437 PolarHBondContact O-N 3Å; H435-V437 VanDerWaalsContact C-N 3.32Å; H435-V437 PolarHBondContact O-N 3.11Å; V437-A440 PolarHBondContact O-N 3.23Å; V437-R442 HydrophobicContact CG1-CB 4.02Å; V437-R442 PolarHBondContact O-N 2.87Å; V437-C444 HydrophobicContact CB-CB 3.93Å; V437-C444 HydrophobicContact CG1-CB 3.64Å
438	V	96.1	Very high	95.7	Very high	37 Å²	37	37 Å²	37	22%	0.224	20%	0.202	C	C	.	.	H	α-helix	trans	-67.7	-41.6	179.7	173.1	0	0	0	0	111.5	K351 I434 H435 A440 G441 C444	K351-V438 HydrophobicContact CB-CG1 4.2Å; K351-V438 HydrophobicContact CB-CG2 4.06Å; K351-V438 HydrophobicContact CD-CG1 4.17Å; K351-V438 HydrophobicContact CG-CG1 3.95Å; I434-V438 VanDerWaalsContact O-CG2 3.32Å; I434-V438 WeakPolarHBondContact O-CG2 3.45Å; I434-V438 PolarHBondContact O-N 3.21Å; I434-V438 VanDerWaalsContact O-N 3.07Å; H435-V438 PolarHBondContact O-N 3.25Å; V438-A440 VanDerWaalsContact C-N 3.28Å; V438-A440 PolarHBondContact O-N 2.92Å; V438-G441 WeakPolarHBondContact O-CA 3.32Å; V438-G441 PolarHBondContact O-N 2.69Å; V438-C444 HydrophobicContact CG2-CB 4.32Å
439	Q	96	Very high	95.6	Very high	159 Å²	159	40.9 Å²	40.9	74%	0.743	22%	0.221	S	C	*	.	H	α-helix	trans	-65.3	-31.3	176.6	-74.2	172.9	-3.2	0	0	112	H435 G441	H435-Q439 VanDerWaalsContact O-CB 3.3Å; H435-Q439 WeakPolarHBondContact O-CB 3.45Å; H435-Q439 WeakPolarHBondContact O-CG 3.26Å; H435-Q439 PolarHBondContact O-N 2.82Å; Q439-G441 PolarHBondContact O-N 3.49Å; Q439-G441 VanDerWaalsContact O-N 3.09Å
440	A	95.4	Very high	95.4	Very high	62 Å²	62	40.6 Å²	40.6	51%	0.512	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	6.1	169.7	0	0	0	0	0	113.8	E436 V437 V438 R442	E436-A440 WeakPolarHBondContact O-CB 3.36Å; E436-A440 PolarHBondContact O-N 3.02Å; V437-A440 PolarHBondContact O-N 3.23Å; V438-A440 VanDerWaalsContact C-N 3.28Å; V438-A440 PolarHBondContact O-N 2.92Å; A440-R442 VanDerWaalsContact C-N 3.29Å; A440-R442 PolarHBondContact O-N 3.22Å
441	G	94.1	Very high	95.1	Very high	42 Å²	42	42.3 Å²	42.3	43%	0.433	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.4	11.6	177.5	0	0	0	0	0	114.6	R349 V438 Q439	R349-G441 PolarHBondContact NH1-O 3.25Å; V438-G441 WeakPolarHBondContact O-CA 3.32Å; V438-G441 PolarHBondContact O-N 2.69Å; Q439-G441 PolarHBondContact O-N 3.49Å; Q439-G441 VanDerWaalsContact O-N 3.09Å
442	R	95.9	Very high	95	Very high	87 Å²	87	41 Å²	41	33%	0.328	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-103.2	150.6	-177.9	-64.8	-178.8	-66.2	172.3	-1.3	111.2	P375 R377 V437 A440	P375-R442 WeakPolarHBondContact O-CD 3.26Å; R377-R442 CarbonylContact O-C 3.44Å; R377-R442 WeakPolarHBondContact O-CA 3.16Å; V437-R442 HydrophobicContact CG1-CB 4.02Å; V437-R442 PolarHBondContact O-N 2.87Å; A440-R442 VanDerWaalsContact C-N 3.29Å; A440-R442 PolarHBondContact O-N 3.22Å
443	T	96.8	Very high	94.8	Very high	5 Å²	5	37.1 Å²	37.1	3%	0.031	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	122.4	168.5	-63.7	0	0	0	0	108.7	R349 R350 K351 L353 R377 Y378 G379 I445	R349-T443 WeakPolarHBondContact CG-OG1 3.37Å; R350-T443 WeakPolarHBondContact O-CG2 3.16Å; R350-T443 PolarHBondContact O-OG1 3.47Å; K351-T443 WeakPolarHBondContact O-CA 3.49Å; L353-T443 HydrophobicContact CB-CG2 4.03Å; R377-T443 PolarHBondContact O-N 3.04Å; Y378-T443 WeakPolarHBondContact CA-O 3.46Å; Y378-T443 HydrophobicContact CD1-CG2 4.38Å; G379-T443 PolarHBondContact N-O 3.28Å; T443-I445 PolarHBondContact O-N 2.91Å
444	C	97.7	Very high	94.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	118.5	179.8	-173.9	0	0	0	0	111	K351 T352 L353 G379 I434 V437 V438	K351-C444 PolarHBondContact O-N 3.39Å; T352-C444 CarbonylContact C-O 3.59Å; T352-C444 VanDerWaalsContact CA-O 3.28Å; T352-C444 WeakPolarHBondContact CA-O 3.31Å; T352-C444 HydrophobicContact CG2-CB 4.26Å; L353-C444 PolarHBondContact N-O 3.45Å; G379-C444 CarbonylContact O-C 3.54Å; G379-C444 WeakPolarHBondContact O-CA 3.31Å; I434-C444 HydrophobicContact CG2-CB 4.16Å; V437-C444 HydrophobicContact CB-CB 3.93Å; V437-C444 HydrophobicContact CG1-CB 3.64Å; V438-C444 HydrophobicContact CG2-CB 4.32Å
445	I	97.7	Very high	94.1	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	122	176.3	-48.1	-176.8	0	0	0	109.7	L353 L355 K367 L370 V371 Y378 G379 T443	L353-I445 HydrophobicContact CB-CG1 4.3Å; L353-I445 HydrophobicContact CD2-CD1 4.15Å; L353-I445 HydrophobicContact CD2-CG1 4.11Å; L353-I445 HydrophobicContact CD2-CG2 4.2Å; L353-I445 HydrophobicContact CG-CG2 4.33Å; L353-I445 CarbonylContact O-C 3.53Å; L353-I445 WeakPolarHBondContact O-CA 3.19Å; L355-I445 HydrophobicContact CD1-CG2 4.17Å; L355-I445 HydrophobicContact CG-CG2 4.26Å; K367-I445 HydrophobicContact CB-CG2 4.18Å; K367-I445 HydrophobicContact CD-CG2 4.33Å; K367-I445 HydrophobicContact CG-CB 4.13Å; K367-I445 HydrophobicContact CG-CG2 3.71Å; L370-I445 HydrophobicContact CB-CD1 3.6Å; L370-I445 HydrophobicContact CD1-CD1 3.79Å; L370-I445 HydrophobicContact CG-CD1 4.37Å; V371-I445 HydrophobicContact CG2-CD1 4.06Å; Y378-I445 HydrophobicContact CD1-CD1 3.88Å; Y378-I445 HydrophobicContact CD1-CG1 4.11Å; Y378-I445 HydrophobicContact CD2-CD1 4.49Å; Y378-I445 HydrophobicContact CG-CD1 3.76Å; Y378-I445 HydrophobicContact CG-CG1 4.34Å; G379-I445 PolarHBondContact O-N 3.09Å; T443-I445 PolarHBondContact O-N 2.91Å
446	L	96.4	Very high	94	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	126.8	-175.4	-63.7	174.3	0	0	0	110.4	T352 L353 V354 L355 T381 L417 I434 V448 L456	T352-L446 HydrophobicContact CG2-CD1 4.29Å; L353-L446 PolarHBondContact O-N 3.37Å; V354-L446 HydrophobicContact CG2-CD1 4.44Å; L355-L446 PolarHBondContact N-O 3.24Å; T381-L446 HydrophobicContact CG2-CD2 4.04Å; L417-L446 HydrophobicContact CD2-CD1 4.4Å; I434-L446 HydrophobicContact CD1-CD1 3.97Å; I434-L446 HydrophobicContact CD1-CD2 4.34Å; I434-L446 HydrophobicContact CG1-CD1 4.44Å; I434-L446 HydrophobicContact CG1-CD2 4.17Å; I434-L446 HydrophobicContact CG2-CD1 4.46Å; L446-V448 HydrophobicContact CB-CG1 4.06Å; L446-V448 HydrophobicContact CB-CG2 4.46Å; L446-L456 HydrophobicContact CD1-CD1 3.94Å; L446-L456 HydrophobicContact CD1-CD2 3.99Å
447	D	93.9	Very high	93.7	Very high	41 Å²	41	36.7 Å²	36.7	22%	0.219	20%	0.201	C	C	.	.			trans	-108.7	59.4	173.4	60.4	-30.1	0	0	0	111.9	R363 K367	R363-D447 HydrophobicContact CB-CB 4.37Å; R363-D447 PolarHBondContact NH1-O 2.77Å; K367-D447 HydrophobicContact CD-CB 4.24Å; K367-D447 WeakPolarHBondContact CE-OD2 3.42Å; K367-D447 IonicContact NZ-OD1 3.9Å; K367-D447 PolarHBondContact NZ-OD1 3.08Å; K367-D447 IonicContact NZ-OD2 2.57Å; K367-D447 PolarHBondContact NZ-OD2 3.15Å
448	V	91.8	Very high	93.6	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.012	21%	0.213	C	C	.	.			trans	-93.1	170.8	-171.4	-61.8	0	0	0	0	113.7	V354 I356 R363 L417 E418 L446 A452 L456	V354-V448 HydrophobicContact CG1-CG2 3.71Å; I356-V448 HydrophobicContact CD1-CG2 3.99Å; I356-V448 WeakPolarHBondContact CD1-O 3.28Å; R363-V448 PolarHBondContact NH1-O 2.79Å; L417-V448 HydrophobicContact CD2-CG1 3.9Å; E418-V448 HydrophobicContact CG-CG1 4.37Å; E418-V448 WeakPolarHBondContact OE1-CA 3.47Å; E418-V448 WeakPolarHBondContact OE1-CG1 3.43Å; E418-V448 WeakPolarHBondContact OE2-CB 3.33Å; L446-V448 HydrophobicContact CB-CG1 4.06Å; L446-V448 HydrophobicContact CB-CG2 4.46Å; V448-A452 HydrophobicContact CB-CB 3.9Å; V448-A452 HydrophobicContact CG2-CB 3.67Å; V448-L456 HydrophobicContact CG2-CD1 4.14Å
449	N	91.6	Very high	93.4	Very high	87 Å²	87	38.9 Å²	38.9	47%	0.465	22%	0.219	S	C	.	.			trans	-69.4	145.5	170.2	-170.9	-59.4	0	0	0	111.1	E418 Q451 A452	E418-N449 WeakPolarHBondContact OE2-CB 3Å; E418-N449 PolarHBondContact OE2-N 2.88Å; N449-Q451 PolarHBondContact O-N 3.14Å; N449-Q451 PolarHBondContact OD1-N 3.43Å; N449-A452 VanDerWaalsContact O-CB 3.27Å; N449-A452 WeakPolarHBondContact O-CB 3.46Å; N449-A452 PolarHBondContact O-N 3.34Å
450	P	91.1	Very high	93.3	Very high	7 Å²	7	36 Å²	36	5%	0.045	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-47.3	-31.7	174.1	-21.1	18.2	0	0	0	115.7	I356 A452 L453 I508 Y512	I356-P450 HydrophobicContact CG2-CB 4.03Å; I356-P450 HydrophobicContact CG2-CG 3.63Å; P450-A452 PolarHBondContact O-N 2.95Å; P450-L453 VanDerWaalsContact O-CB 3.26Å; P450-L453 WeakPolarHBondContact O-CB 3.42Å; P450-L453 WeakPolarHBondContact O-CD1 3.43Å; P450-L453 VanDerWaalsContact O-CG 3.31Å; P450-L453 WeakPolarHBondContact O-CG 3.21Å; P450-L453 PolarHBondContact O-N 2.98Å; P450-L453 VanDerWaalsContact O-N 3.12Å; P450-I508 HydrophobicContact CB-CG2 4.42Å; P450-I508 HydrophobicContact CG-CB 4.45Å; P450-I508 HydrophobicContact CG-CD1 4.01Å; P450-I508 HydrophobicContact CG-CG1 3.94Å; P450-I508 HydrophobicContact CG-CG2 3.69Å; P450-Y512 HydrophobicContact CB-CD1 4.04Å; P450-Y512 HydrophobicContact CB-CD2 3.48Å; P450-Y512 VanDerWaalsContact CB-CD2 3.48Å; P450-Y512 HydrophobicContact CB-CE1 4.18Å; P450-Y512 HydrophobicContact CB-CE2 3.62Å; P450-Y512 HydrophobicContact CB-CG 3.73Å; P450-Y512 HydrophobicContact CG-CD2 4.14Å; P450-Y512 HydrophobicContact CG-CE2 4.28Å
451	Q	89.4	Confident	93.3	Very high	57 Å²	57	33.2 Å²	33.2	27%	0.266	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-60.1	-30.3	178.2	-70.2	-67	-27.8	0	0	113.6	D332 N449 L453 K454 Y512	D332-Q451 PolarHBondContact OD2-NE2 3.08Å; D332-Q451 PolarHBondContact OD2-OE1 2.86Å; N449-Q451 PolarHBondContact O-N 3.14Å; N449-Q451 PolarHBondContact OD1-N 3.43Å; Q451-L453 PolarHBondContact O-N 3.21Å; Q451-K454 PolarHBondContact O-N 3.35Å; Q451-K454 VanDerWaalsContact OE1-NZ 3.09Å; Q451-Y512 PolarHBondContact NE2-OH 2.72Å
452	A	91.9	Very high	93.4	Very high	4 Å²	4	33 Å²	33	3%	0.033	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-63	-21.6	178.6	0	0	0	0	0	112.6	L417 V448 N449 P450 K454 V455 L456	L417-A452 HydrophobicContact CD1-CB 3.95Å; L417-A452 HydrophobicContact CD2-CB 4.23Å; L417-A452 HydrophobicContact CG-CB 3.96Å; V448-A452 HydrophobicContact CB-CB 3.9Å; V448-A452 HydrophobicContact CG2-CB 3.67Å; N449-A452 VanDerWaalsContact O-CB 3.27Å; N449-A452 WeakPolarHBondContact O-CB 3.46Å; N449-A452 PolarHBondContact O-N 3.34Å; P450-A452 PolarHBondContact O-N 2.95Å; A452-K454 PolarHBondContact O-N 3.36Å; A452-V455 PolarHBondContact O-N 3.06Å; A452-L456 HydrophobicContact CB-CD1 4.35Å; A452-L456 WeakPolarHBondContact O-CG 3.45Å; A452-L456 PolarHBondContact O-N 3.34Å
453	L	91.8	Very high	93.4	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-60.9	-26.5	179.9	-67	170.6	0	0	0	113.3	V354 I356 P450 Q451 V455 L456 K457 V465 Y515	V354-L453 HydrophobicContact CG1-CD2 3.98Å; I356-L453 HydrophobicContact CD1-CD1 4.35Å; I356-L453 HydrophobicContact CD1-CD2 4.31Å; I356-L453 HydrophobicContact CD1-CG 4.22Å; I356-L453 HydrophobicContact CG1-CD1 4.05Å; I356-L453 HydrophobicContact CG1-CD2 4.22Å; I356-L453 HydrophobicContact CG1-CG 4.32Å; P450-L453 VanDerWaalsContact O-CB 3.26Å; P450-L453 WeakPolarHBondContact O-CB 3.42Å; P450-L453 WeakPolarHBondContact O-CD1 3.43Å; P450-L453 VanDerWaalsContact O-CG 3.31Å; P450-L453 WeakPolarHBondContact O-CG 3.21Å; P450-L453 PolarHBondContact O-N 2.98Å; P450-L453 VanDerWaalsContact O-N 3.12Å; Q451-L453 PolarHBondContact O-N 3.21Å; L453-V455 VanDerWaalsContact C-N 3.26Å; L453-V455 PolarHBondContact O-N 3.35Å; L453-L456 PolarHBondContact O-N 2.94Å; L453-K457 VanDerWaalsContact O-CB 3.23Å; L453-K457 WeakPolarHBondContact O-CB 3.3Å; L453-K457 PolarHBondContact O-N 2.92Å; L453-V465 HydrophobicContact CD1-CG1 4.3Å; L453-V465 HydrophobicContact CD2-CB 4.42Å; L453-V465 HydrophobicContact CD2-CG1 3.79Å; L453-V465 HydrophobicContact CD2-CG2 3.68Å; L453-Y515 HydrophobicContact CB-CD1 3.84Å; L453-Y515 HydrophobicContact CB-CE1 4.16Å; L453-Y515 HydrophobicContact CB-CG 4.2Å; L453-Y515 HydrophobicContact CD1-CD1 4.32Å; L453-Y515 HydrophobicContact CD1-CD2 4.37Å; L453-Y515 HydrophobicContact CD1-CG 3.89Å
454	K	87.7	Confident	93.4	Very high	56 Å²	56	29.7 Å²	29.7	24%	0.243	16%	0.158	C	C	.	.	H	α-helix	trans	-64.2	-32.7	176	-67.1	178.9	180	167.5	0	113.1	N328 D332 Q451 A452	N328-K454 PolarHBondContact ND2-NZ 3.28Å; N328-K454 PolarHBondContact OD1-NZ 3.29Å; D332-K454 WeakPolarHBondContact OD1-CE 3.46Å; D332-K454 IonicContact OD1-NZ 3.9Å; D332-K454 PolarHBondContact OD1-NZ 3.21Å; D332-K454 IonicContact OD2-NZ 3.25Å; D332-K454 PolarHBondContact OD2-NZ 3.33Å; Q451-K454 PolarHBondContact O-N 3.35Å; Q451-K454 VanDerWaalsContact OE1-NZ 3.09Å; A452-K454 PolarHBondContact O-N 3.36Å
455	V	91	Very high	93.4	Very high	65 Å²	65	29.9 Å²	29.9	39%	0.394	16%	0.159	S	C	.	.	H	α-helix	trans	-86.8	-38.1	177.4	-176.8	0	0	0	0	109.6	L417 I431 A452 L453	L417-V455 HydrophobicContact CD1-CB 3.77Å; L417-V455 HydrophobicContact CD1-CG1 3.92Å; L417-V455 HydrophobicContact CD1-CG2 4.46Å; I431-V455 HydrophobicContact CD1-CG1 4.44Å; A452-V455 PolarHBondContact O-N 3.06Å; L453-V455 VanDerWaalsContact C-N 3.26Å; L453-V455 PolarHBondContact O-N 3.35Å
456	L	94.1	Very high	93.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-76.8	-25.8	-175.8	-67.6	173.5	0	0	0	114.5	V354 L417 I434 L446 V448 A452 L453 T458 F461 P463	V354-L456 HydrophobicContact CG1-CD1 4.15Å; V354-L456 HydrophobicContact CG2-CD1 3.86Å; L417-L456 HydrophobicContact CD1-CD1 4.42Å; L417-L456 HydrophobicContact CD1-CD2 3.99Å; L417-L456 HydrophobicContact CD1-CG 3.84Å; L417-L456 HydrophobicContact CD2-CD1 3.99Å; L417-L456 HydrophobicContact CD2-CD2 3.99Å; L417-L456 HydrophobicContact CD2-CG 4.14Å; I434-L456 HydrophobicContact CD1-CD2 4.21Å; L446-L456 HydrophobicContact CD1-CD1 3.94Å; L446-L456 HydrophobicContact CD1-CD2 3.99Å; V448-L456 HydrophobicContact CG2-CD1 4.14Å; A452-L456 HydrophobicContact CB-CD1 4.35Å; A452-L456 WeakPolarHBondContact O-CG 3.45Å; A452-L456 PolarHBondContact O-N 3.34Å; L453-L456 PolarHBondContact O-N 2.94Å; L456-T458 PolarHBondContact O-N 3.49Å; L456-F461 HydrophobicContact CD2-CB 4.15Å; L456-F461 HydrophobicContact CD2-CD1 4.13Å; L456-F461 HydrophobicContact CD2-CD2 4.02Å; L456-F461 HydrophobicContact CD2-CG 3.82Å; L456-F461 WeakPolarHBondContact O-CB 3.49Å; L456-P463 HydrophobicContact CB-CG 4.47Å; L456-P463 WeakPolarHBondContact O-CD 3.47Å; L456-P463 VanDerWaalsContact O-CG 3.28Å; L456-P463 WeakPolarHBondContact O-CG 3.32Å
457	K	91.8	Very high	93.5	Very high	49 Å²	49	29.9 Å²	29.9	21%	0.213	16%	0.159	C	C	.	.	S	Bend	trans	-77.1	61.1	-174.5	-164.9	-171.1	176.4	-166.5	0	112.3	Q337 E340 L453 Y515 W550	Q337-K457 VanDerWaalsContact NE2-NZ 3.13Å; E340-K457 WeakPolarHBondContact OE1-CE 3.44Å; E340-K457 IonicContact OE1-NZ 3.89Å; E340-K457 PolarHBondContact OE1-NZ 3.41Å; L453-K457 VanDerWaalsContact O-CB 3.23Å; L453-K457 WeakPolarHBondContact O-CB 3.3Å; L453-K457 PolarHBondContact O-N 2.92Å; K457-Y515 HydrophobicContact CB-CD1 4.39Å; K457-Y515 HydrophobicContact CB-CE1 4.17Å; K457-Y515 HydrophobicContact CD-CD1 3.63Å; K457-Y515 HydrophobicContact CD-CE1 3.51Å; K457-Y515 HydrophobicContact CG-CD1 4.42Å; K457-Y515 HydrophobicContact CG-CE1 4.39Å; K457-W550 HydrophobicContact CG-CH2 4.46Å; K457-W550 HydrophobicContact CG-CZ2 3.71Å
458	T	93.3	Very high	93.7	Very high	49 Å²	49	27.9 Å²	27.9	30%	0.301	15%	0.148	S	C	.	.	S	Bend	trans	-135.7	165.2	-177.6	66	0	0	0	0	111.5	L456 E460 F461 M462	L456-T458 PolarHBondContact O-N 3.49Å; T458-E460 PolarHBondContact O-N 3.24Å; T458-E460 WeakPolarHBondContact OG1-CB 3.36Å; T458-E460 PolarHBondContact OG1-N 3.04Å; T458-F461 PolarHBondContact O-N 2.94Å; T458-F461 WeakPolarHBondContact OG1-CD2 3.43Å; T458-M462 PolarHBondContact O-N 3.24Å
459	A	92.7	Very high	93.9	Very high	42 Å²	42	27.8 Å²	27.8	35%	0.347	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-24.3	173.7	0	0	0	0	0	112.8	K351 M462 W550	K351-A459 PolarHBondContact NZ-O 2.67Å; A459-M462 WeakPolarHBondContact O-CG 3.48Å; A459-W550 HydrophobicContact CB-CB 4.26Å; A459-W550 HydrophobicContact CB-CG 4.39Å
460	E	93.7	Very high	94.1	Very high	98 Å²	98	24.1 Å²	24.1	46%	0.458	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-48.1	179.2	-178.7	175.8	-160.8	0	0	111.6	K351 H435 T458	K351-E460 WeakPolarHBondContact CD-O 3.34Å; K351-E460 WeakPolarHBondContact CE-O 3.26Å; K351-E460 PolarHBondContact NZ-O 3.39Å; H435-E460 IonicContact CE1-OE1 2.69Å; H435-E460 PolarHBondContact CE1-OE1 3.36Å; H435-E460 IonicContact NE2-OE1 2.91Å; H435-E460 PolarHBondContact NE2-OE1 3.4Å; T458-E460 PolarHBondContact O-N 3.24Å; T458-E460 WeakPolarHBondContact OG1-CB 3.36Å; T458-E460 PolarHBondContact OG1-N 3.04Å
461	F	95.6	Very high	94.2	Very high	5 Å²	5	24.2 Å²	24.2	2%	0.022	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-18.4	-175.3	-57.5	-71.7	0	0	0	114.2	K351 T352 I431 I434 H435 L456 T458 P463	K351-F461 WeakPolarHBondContact CB-O 3.19Å; T352-F461 HydrophobicContact CG2-CB 4.05Å; T352-F461 HydrophobicContact CG2-CD1 4.31Å; T352-F461 WeakPolarHBondContact CG2-O 3.44Å; T352-F461 PolarHBondContact N-O 3.02Å; T352-F461 PolarHBondContact OG1-O 3.34Å; I431-F461 HydrophobicContact CG2-CE1 4.15Å; I431-F461 HydrophobicContact CG2-CZ 3.7Å; I434-F461 HydrophobicContact CB-CE1 4.36Å; I434-F461 HydrophobicContact CD1-CE1 4.38Å; I434-F461 HydrophobicContact CG2-CD1 3.92Å; I434-F461 HydrophobicContact CG2-CE1 4.09Å; H435-F461 AromaticContact CE1-CE1 3.7Å; H435-F461 AromaticContact NE2-CE1 3.91Å; L456-F461 HydrophobicContact CD2-CB 4.15Å; L456-F461 HydrophobicContact CD2-CD1 4.13Å; L456-F461 HydrophobicContact CD2-CD2 4.02Å; L456-F461 HydrophobicContact CD2-CG 3.82Å; L456-F461 WeakPolarHBondContact O-CB 3.49Å; T458-F461 PolarHBondContact O-N 2.94Å; T458-F461 WeakPolarHBondContact OG1-CD2 3.43Å; F461-P463 VanDerWaalsContact C-N 3.34Å
462	M	94.8	Very high	94.4	Very high	36 Å²	36	28.6 Å²	28.6	18%	0.177	15%	0.151	C	C	.	.			trans	34.5	60.7	-179.4	-73.4	-174	-88.4	0	0	113.1	F348 R350 K351 T458 A459 W550	F348-M462 HydrophobicContact CE2-SD 3.89Å; F348-M462 HydrophobicContact CZ-SD 4.42Å; R350-M462 VanDerWaalsContact CD-O 3.27Å; R350-M462 WeakPolarHBondContact CD-O 3.42Å; K351-M462 HydrophobicContact CD-CE 3.74Å; K351-M462 VanDerWaalsContact CE-CE 3.41Å; K351-M462 HydrophobicContact CG-CE 4.16Å; T458-M462 PolarHBondContact O-N 3.24Å; A459-M462 WeakPolarHBondContact O-CG 3.48Å; M462-W550 HydrophobicContact CB-CE3 4.28Å; M462-W550 HydrophobicContact CB-CZ3 4.5Å; M462-W550 HydrophobicContact CG-CD2 4.33Å; M462-W550 HydrophobicContact CG-CE3 4Å
463	P	96.6	Very high	94.4	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.013	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	143.9	-172	29.3	-37.2	0	0	0	111.6	T352 V354 L456 F461 V465 W550	T352-P463 WeakPolarHBondContact O-CA 3.36Å; T352-P463 WeakPolarHBondContact OG1-CA 3.44Å; T352-P463 WeakPolarHBondContact OG1-CB 3.46Å; V354-P463 HydrophobicContact CG2-CB 3.67Å; L456-P463 HydrophobicContact CB-CG 4.47Å; L456-P463 WeakPolarHBondContact O-CD 3.47Å; L456-P463 VanDerWaalsContact O-CG 3.28Å; L456-P463 WeakPolarHBondContact O-CG 3.32Å; F461-P463 VanDerWaalsContact C-N 3.34Å; P463-V465 HydrophobicContact CB-CG2 3.99Å; P463-V465 HydrophobicContact CG-CG2 4.3Å; P463-W550 HydrophobicContact CG-CH2 3.95Å; P463-W550 HydrophobicContact CG-CZ2 4.31Å
464	F	97.1	Very high	94.3	Very high	21 Å²	21	35.3 Å²	35.3	9%	0.092	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	112.3	156.4	-172.6	-109	0	0	0	108.4	R350 T352 L353 V354 V466 D517 L518 A535 L539	R350-F464 HydrophobicContact CB-CB 4.42Å; R350-F464 HydrophobicContact CG-CB 4Å; T352-F464 PolarHBondContact O-N 2.92Å; L353-F464 HydrophobicContact CD1-CB 4.4Å; L353-F464 HydrophobicContact CD1-CD1 3.72Å; V354-F464 PolarHBondContact N-O 3.48Å; F464-V466 HydrophobicContact CD1-CG2 3.7Å; F464-V466 HydrophobicContact CE1-CG2 3.62Å; F464-D517 WeakPolarHBondContact CA-OD2 3.25Å; F464-D517 HydrophobicContact CD2-CB 3.69Å; F464-D517 HydrophobicContact CE2-CB 3.45Å; F464-D517 VanDerWaalsContact CE2-CB 3.45Å; F464-D517 HydrophobicContact CG-CB 4.48Å; F464-D517 HydrophobicContact CZ-CB 4.08Å; F464-L518 HydrophobicContact CZ-CB 4.3Å; F464-A535 HydrophobicContact CE1-CB 4.47Å; F464-L539 HydrophobicContact CB-CD1 4.2Å; F464-L539 HydrophobicContact CD1-CD1 3.9Å; F464-L539 HydrophobicContact CD2-CD1 3.97Å; F464-L539 HydrophobicContact CD2-CD2 3.89Å; F464-L539 HydrophobicContact CE1-CD1 4.21Å; F464-L539 HydrophobicContact CE2-CD1 4.29Å; F464-L539 HydrophobicContact CE2-CD2 3.7Å; F464-L539 HydrophobicContact CG-CD1 3.76Å; F464-L539 HydrophobicContact CZ-CD1 4.39Å; F464-L539 HydrophobicContact CZ-CD2 4.19Å
465	V	97.1	Very high	94.5	Very high	5 Å²	5	35.1 Å²	35.1	3%	0.03	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	113.2	-169.1	-175	0	0	0	0	109.9	V354 I356 L453 P463 Y515 F516 D517 L518	V354-V465 HydrophobicContact CB-CG2 4.41Å; I356-V465 HydrophobicContact CG1-CG1 4.01Å; L453-V465 HydrophobicContact CD1-CG1 4.3Å; L453-V465 HydrophobicContact CD2-CB 4.42Å; L453-V465 HydrophobicContact CD2-CG1 3.79Å; L453-V465 HydrophobicContact CD2-CG2 3.68Å; P463-V465 HydrophobicContact CB-CG2 3.99Å; P463-V465 HydrophobicContact CG-CG2 4.3Å; V465-Y515 VanDerWaalsContact CB-O 3.29Å; V465-Y515 WeakPolarHBondContact CB-O 3.48Å; V465-F516 HydrophobicContact CG1-CD1 3.92Å; V465-D517 PolarHBondContact N-OD2 2.96Å; V465-D517 PolarHBondContact O-N 3.32Å; V465-L518 PolarHBondContact O-N 2.94Å
466	V	98	Very high	94.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	117.2	177.1	-171.8	0	0	0	0	109.7	L353 V354 L355 I356 F464 I468 L518 I520 L532	L353-V466 HydrophobicContact CD1-CG2 3.84Å; V354-V466 PolarHBondContact O-N 2.93Å; L355-V466 WeakPolarHBondContact CA-O 3.45Å; L355-V466 HydrophobicContact CD2-CB 3.98Å; I356-V466 PolarHBondContact N-O 2.87Å; F464-V466 HydrophobicContact CD1-CG2 3.7Å; F464-V466 HydrophobicContact CE1-CG2 3.62Å; V466-I468 HydrophobicContact CG1-CD1 3.82Å; V466-L518 WeakPolarHBondContact CA-O 3.49Å; V466-L518 HydrophobicContact CG1-CB 4.23Å; V466-L518 HydrophobicContact CG1-CD2 4.13Å; V466-L518 HydrophobicContact CG1-CG 4.25Å; V466-L518 HydrophobicContact CG2-CB 4.31Å; V466-L518 HydrophobicContact CG2-CD2 4.45Å; V466-I520 HydrophobicContact CG1-CD1 3.84Å; V466-I520 HydrophobicContact CG1-CG1 4.11Å; V466-L532 HydrophobicContact CB-CD1 4.33Å; V466-L532 HydrophobicContact CG1-CD1 4.14Å; V466-L532 HydrophobicContact CG2-CD1 3.88Å
467	F	97.9	Very high	94.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	115.9	172.2	179	-114.3	0	0	0	110.9	I356 A469 S505 I508 R509 F516 L518 T519 I520	I356-F467 HydrophobicContact CB-CD2 4.42Å; I356-F467 HydrophobicContact CG2-CD2 4.14Å; I356-F467 CarbonylContact O-C 3.59Å; I356-F467 WeakPolarHBondContact O-CA 3.28Å; I356-F467 WeakPolarHBondContact O-CD2 3.46Å; F467-A469 HydrophobicContact CD1-CB 4.14Å; F467-A469 HydrophobicContact CE1-CB 3.64Å; F467-A469 HydrophobicContact CZ-CB 4.37Å; F467-A469 PolarHBondContact O-N 3.4Å; F467-S505 WeakPolarHBondContact CZ-O 3.44Å; F467-I508 HydrophobicContact CD2-CG2 4Å; F467-I508 HydrophobicContact CE2-CB 4Å; F467-I508 HydrophobicContact CE2-CG2 3.46Å; F467-I508 VanDerWaalsContact CE2-CG2 3.46Å; F467-I508 HydrophobicContact CZ-CB 4.5Å; F467-I508 HydrophobicContact CZ-CG2 4.34Å; F467-R509 HydrophobicContact CE1-CB 3.83Å; F467-R509 HydrophobicContact CE1-CG 4.14Å; F467-R509 HydrophobicContact CZ-CB 3.99Å; F467-F516 HydrophobicContact CB-CB 4.32Å; F467-F516 HydrophobicContact CB-CD1 3.93Å; F467-F516 HydrophobicContact CB-CD2 3.3Å; F467-F516 HydrophobicContact CB-CE1 4.04Å; F467-F516 HydrophobicContact CB-CE2 3.43Å; F467-F516 VanDerWaalsContact CB-CE2 3.43Å; F467-F516 HydrophobicContact CB-CG 3.59Å; F467-F516 HydrophobicContact CB-CZ 3.82Å; F467-F516 HydrophobicContact CD1-CD2 4.01Å; F467-F516 AromaticContact CD1-CE2 3.6Å; F467-F516 HydrophobicContact CD1-CE2 3.6Å; F467-F516 HydrophobicContact CD1-CZ 4.34Å; F467-F516 HydrophobicContact CD2-CD2 4.41Å; F467-F516 HydrophobicContact CD2-CE1 4.19Å; F467-F516 AromaticContact CD2-CE2 3.64Å; F467-F516 HydrophobicContact CD2-CE2 3.64Å; F467-F516 AromaticContact CD2-CZ 3.52Å; F467-F516 HydrophobicContact CD2-CZ 3.52Å; F467-F516 HydrophobicContact CE1-CE2 4.28Å; F467-F516 HydrophobicContact CE2-CE2 4.31Å; F467-F516 HydrophobicContact CE2-CZ 4.18Å; F467-F516 AromaticContact CG-CD2 3.67Å; F467-F516 HydrophobicContact CG-CD2 3.67Å; F467-F516 HydrophobicContact CG-CE1 4.3Å; F467-F516 AromaticContact CG-CE2 3.24Å; F467-F516 HydrophobicContact CG-CE2 3.24Å; F467-F516 HydrophobicContact CG-CG 4.36Å; F467-F516 AromaticContact CG-CZ 3.63Å; F467-F516 HydrophobicContact CG-CZ 3.63Å; F467-L518 PolarHBondContact N-O 3.42Å; F467-T519 HydrophobicContact CD1-CG2 3.8Å; F467-T519 CarbonylContact O-C 3.59Å; F467-T519 WeakPolarHBondContact O-CA 3.45Å; F467-I520 PolarHBondContact O-N 3.19Å
468	I	97.8	Very high	94	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	102.1	172.6	-48.6	-56.7	0	0	0	108.1	I356 G357 V361 R363 L366 V466 I520 N522	I356-I468 PolarHBondContact O-N 3.4Å; G357-I468 WeakPolarHBondContact CA-O 3.47Å; V361-I468 HydrophobicContact CG1-CB 4.08Å; V361-I468 HydrophobicContact CG1-CG2 3.93Å; V361-I468 HydrophobicContact CG2-CG2 4.17Å; R363-I468 HydrophobicContact CG-CB 4.21Å; R363-I468 HydrophobicContact CG-CG1 4.15Å; L366-I468 HydrophobicContact CD1-CD1 3.75Å; L366-I468 HydrophobicContact CD1-CG1 4.1Å; L366-I468 HydrophobicContact CD1-CG2 4.28Å; V466-I468 HydrophobicContact CG1-CD1 3.82Å; I468-I520 CarbonylContact C-O 3.58Å; I468-I520 WeakPolarHBondContact CA-O 3.38Å; I468-I520 HydrophobicContact CD1-CB 4.18Å; I468-I520 HydrophobicContact CD1-CD1 4.45Å; I468-N522 HydrophobicContact CG2-CB 3.77Å
469	A	97	Very high	93.7	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	138.6	178.5	0	0	0	0	0	111.7	F467 T519 I520 V521 N522	F467-A469 HydrophobicContact CD1-CB 4.14Å; F467-A469 HydrophobicContact CE1-CB 3.64Å; F467-A469 HydrophobicContact CZ-CB 4.37Å; F467-A469 PolarHBondContact O-N 3.4Å; A469-T519 HydrophobicContact CB-CG2 4.3Å; A469-I520 PolarHBondContact N-O 2.95Å; A469-V521 HydrophobicContact CB-CG2 4.05Å; A469-N522 PolarHBondContact O-N 3.13Å
470	A	95.5	Very high	93.3	Very high	10 Å²	10	40.2 Å²	40.2	8%	0.083	20%	0.198	C	C	.	.			trans	-62.2	140.4	165.4	0	0	0	0	0	110.2	V361 T501 V502 S505	V361-A470 HydrophobicContact CG2-CB 4.01Å; A470-T501 HydrophobicContact CB-CG2 4.4Å; A470-V502 HydrophobicContact CB-CG2 4.34Å; A470-S505 PolarHBondContact N-OG 3.31Å
471	P	94.4	Very high	93	Very high	8 Å²	8	41.6 Å²	41.6	5%	0.052	20%	0.203	C	C	.	.			trans	-72.2	-176.6	168.8	35.4	-35.8	0	0	0	110	T475 L476 M479 V521 N522 D523	P471-T475 HydrophobicContact CB-CG2 4.03Å; P471-T475 HydrophobicContact CG-CG2 4.34Å; P471-L476 HydrophobicContact CG-CB 3.98Å; P471-L476 HydrophobicContact CG-CD1 4.17Å; P471-M479 HydrophobicContact CG-SD 4.08Å; P471-V521 HydrophobicContact CB-CG1 4.11Å; P471-N522 WeakPolarHBondContact CD-O 3.3Å; P471-N522 WeakPolarHBondContact CG-O 3.22Å; P471-D523 HydrophobicContact CB-CB 4.04Å
472	E	92.7	Very high	92.5	Very high	150 Å²	150	44.1 Å²	44.1	70%	0.701	22%	0.224	S	C	*	.			trans	-61.6	154.5	173.1	-63.7	-175.5	176.2	0	0	111.2	D474 T475 L476	E472-D474 VanDerWaalsContact C-N 3.28Å; E472-D474 PolarHBondContact O-N 3.18Å; E472-T475 PolarHBondContact O-N 3.23Å; E472-L476 PolarHBondContact O-N 2.88Å
473	L	91.1	Very high	91.9	Very high	56 Å²	56	45.3 Å²	45.3	29%	0.293	23%	0.233	S	C	.	.	H	α-helix	trans	-57.1	-41.8	-172.7	-179.7	62.2	0	0	0	112.3	L476 R477 L498 K499 V502	L473-L476 PolarHBondContact O-N 2.94Å; L473-R477 WeakPolarHBondContact O-CB 3.44Å; L473-R477 PolarHBondContact O-N 2.97Å; L473-L498 HydrophobicContact CD1-CB 3.82Å; L473-K499 HydrophobicContact CD1-CB 4.37Å; L473-V502 HydrophobicContact CB-CG2 4.43Å; L473-V502 HydrophobicContact CD1-CG2 4.28Å
474	D	91.3	Very high	91.3	Very high	90 Å²	90	47.3 Å²	47.3	48%	0.481	25%	0.246	S	C	.	.	H	α-helix	trans	-65.2	-46.3	178.8	-72.3	-45.1	0	0	0	111.9	E472 L476 R477 D478	E472-D474 VanDerWaalsContact C-N 3.28Å; E472-D474 PolarHBondContact O-N 3.18Å; D474-L476 VanDerWaalsContact C-N 3.33Å; D474-L476 PolarHBondContact O-N 3.35Å; D474-R477 WeakPolarHBondContact O-CB 3.27Å; D474-R477 PolarHBondContact O-N 3.41Å; D474-R477 IonicContact OD1-CZ 3.64Å; D474-R477 IonicContact OD1-NE 3.74Å; D474-R477 IonicContact OD1-NH2 2.85Å; D474-R477 PolarHBondContact OD1-NH2 3.27Å; D474-D478 PolarHBondContact O-N 3.3Å
475	T	90.6	Very high	90.7	Very high	52 Å²	52	52 Å²	52	32%	0.319	27%	0.271	S	S	.	.	H	α-helix	trans	-60.8	-43.3	175	-49.8	0	0	0	0	111.6	P471 E472 R477 D478 M479 D523	P471-T475 HydrophobicContact CB-CG2 4.03Å; P471-T475 HydrophobicContact CG-CG2 4.34Å; E472-T475 PolarHBondContact O-N 3.23Å; T475-R477 VanDerWaalsContact C-N 3.28Å; T475-R477 PolarHBondContact O-N 3.39Å; T475-D478 PolarHBondContact O-N 3.17Å; T475-M479 HydrophobicContact CG2-SD 4.26Å; T475-M479 WeakPolarHBondContact O-CB 3.23Å; T475-M479 VanDerWaalsContact O-CG 3.23Å; T475-M479 WeakPolarHBondContact O-CG 3.47Å; T475-M479 PolarHBondContact O-N 2.93Å; T475-D523 HydrophobicContact CG2-CB 4.06Å
476	L	89	Confident	89.9	Confident	18 Å²	18	55 Å²	55	9%	0.094	30%	0.297	C	S	.	.	H	α-helix	trans	-62.5	-38.3	178.1	-172.9	61	0	0	0	111.6	P471 E472 L473 D474 H480 L498 T501 V502	P471-L476 HydrophobicContact CG-CB 3.98Å; P471-L476 HydrophobicContact CG-CD1 4.17Å; E472-L476 PolarHBondContact O-N 2.88Å; L473-L476 PolarHBondContact O-N 2.94Å; D474-L476 VanDerWaalsContact C-N 3.33Å; D474-L476 PolarHBondContact O-N 3.35Å; L476-H480 WeakPolarHBondContact O-CB 3.22Å; L476-H480 PolarHBondContact O-N 3.15Å; L476-L498 HydrophobicContact CD2-CB 4.27Å; L476-L498 HydrophobicContact CD2-CD2 4.24Å; L476-L498 HydrophobicContact CG-CD2 4.15Å; L476-T501 HydrophobicContact CD2-CG2 4.04Å; L476-V502 HydrophobicContact CD2-CG2 3.92Å
477	R	89.1	Confident	88.8	Confident	119 Å²	119	57.9 Å²	57.9	45%	0.449	33%	0.327	S	S	.	.	H	α-helix	trans	-65.2	-46.2	176	177.1	174.1	60.1	119.7	-2.5	111.6	L473 D474 T475 H480 K481 L498	L473-R477 WeakPolarHBondContact O-CB 3.44Å; L473-R477 PolarHBondContact O-N 2.97Å; D474-R477 WeakPolarHBondContact O-CB 3.27Å; D474-R477 PolarHBondContact O-N 3.41Å; D474-R477 IonicContact OD1-CZ 3.64Å; D474-R477 IonicContact OD1-NE 3.74Å; D474-R477 IonicContact OD1-NH2 2.85Å; D474-R477 PolarHBondContact OD1-NH2 3.27Å; T475-R477 VanDerWaalsContact C-N 3.28Å; T475-R477 PolarHBondContact O-N 3.39Å; R477-H480 PolarHBondContact O-N 3.06Å; R477-K481 WeakPolarHBondContact O-CB 3.41Å; R477-K481 PolarHBondContact O-N 2.82Å; R477-L498 HydrophobicContact CB-CD1 3.95Å; R477-L498 HydrophobicContact CG-CD1 4.29Å
478	D	88.9	Confident	87.6	Confident	97 Å²	97	64.9 Å²	64.9	52%	0.519	36%	0.363	S	S	.	.	H	α-helix	trans	-64.5	-41.6	178.1	-68.6	-22.2	0	0	0	111.7	D474 T475 K481 A482	D474-D478 PolarHBondContact O-N 3.3Å; T475-D478 PolarHBondContact O-N 3.17Å; D478-K481 PolarHBondContact O-N 3.47Å; D478-A482 WeakPolarHBondContact O-CB 3.36Å; D478-A482 PolarHBondContact O-N 2.89Å
479	M	86.1	Confident	86.4	Confident	46 Å²	46	67 Å²	67	23%	0.227	38%	0.376	C	S	.	.	H	α-helix	trans	-61.1	-46.9	173.7	-71.1	174.4	78.1	0	0	111.8	P471 T475 K481 A482 V483 D523	P471-M479 HydrophobicContact CG-SD 4.08Å; T475-M479 HydrophobicContact CG2-SD 4.26Å; T475-M479 WeakPolarHBondContact O-CB 3.23Å; T475-M479 VanDerWaalsContact O-CG 3.23Å; T475-M479 WeakPolarHBondContact O-CG 3.47Å; T475-M479 PolarHBondContact O-N 2.93Å; M479-K481 VanDerWaalsContact C-N 3.34Å; M479-K481 PolarHBondContact O-N 2.9Å; M479-A482 PolarHBondContact O-N 2.82Å; M479-V483 VanDerWaalsContact O-CG2 3.27Å; M479-V483 WeakPolarHBondContact O-CG2 3.26Å; M479-V483 PolarHBondContact O-N 3.05Å; M479-D523 VanDerWaalsContact SD-C 3.51Å
480	H	85.3	Confident	84.9	Confident	32 Å²	32	74 Å²	74	15%	0.148	42%	0.419	C	S	.	.	H	α-helix	trans	-62.4	-43.5	179.1	177.6	-95.7	0	0	0	111.2	L476 R477 A482 V483 V484 K491 L493 L498	L476-H480 WeakPolarHBondContact O-CB 3.22Å; L476-H480 PolarHBondContact O-N 3.15Å; R477-H480 PolarHBondContact O-N 3.06Å; H480-A482 PolarHBondContact O-N 3.18Å; H480-V483 PolarHBondContact O-N 3.5Å; H480-V484 VanDerWaalsContact CE1-CG2 3.46Å; H480-V484 WeakPolarHBondContact CE1-CG2 3.45Å; H480-V484 WeakPolarHBondContact O-CG2 3.47Å; H480-V484 PolarHBondContact O-N 2.95Å; H480-K491 PolarHBondContact NE2-O 2.89Å; H480-K491 VanDerWaalsContact NE2-O 3.13Å; H480-L493 PolarHBondContact CE1-N 3Å; H480-L493 PolarHBondContact NE2-N 2.75Å; H480-L498 HydrophobicContact CB-CD2 4.24Å
481	K	86.6	Confident	84	Confident	127 Å²	127	80 Å²	80	55%	0.552	44%	0.443	S	S	*	.	H	α-helix	trans	-58.4	-47.8	174.8	-174.2	179.2	177.5	-177	0	111.6	R477 D478 M479 V483 V484 D485	R477-K481 WeakPolarHBondContact O-CB 3.41Å; R477-K481 PolarHBondContact O-N 2.82Å; D478-K481 PolarHBondContact O-N 3.47Å; M479-K481 VanDerWaalsContact C-N 3.34Å; M479-K481 PolarHBondContact O-N 2.9Å; K481-V483 VanDerWaalsContact C-N 3.3Å; K481-V483 PolarHBondContact O-N 2.89Å; K481-V484 PolarHBondContact O-N 3.15Å; K481-D485 WeakPolarHBondContact O-CB 3.41Å; K481-D485 VanDerWaalsContact O-CG 3.23Å; K481-D485 PolarHBondContact O-N 2.85Å
482	A	84.8	Confident	83.3	Confident	58 Å²	58	86.1 Å²	86.1	48%	0.479	47%	0.474	S	S	.	.	H	α-helix	trans	-60.4	-38.3	178.1	0	0	0	0	0	112.8	D478 M479 H480 A486	D478-A482 WeakPolarHBondContact O-CB 3.36Å; D478-A482 PolarHBondContact O-N 2.89Å; M479-A482 PolarHBondContact O-N 2.82Å; H480-A482 PolarHBondContact O-N 3.18Å; A482-A486 WeakPolarHBondContact O-CB 3.47Å; A482-A486 PolarHBondContact O-N 2.94Å
483	V	82.8	Confident	82.7	Confident	60 Å²	60	81.1 Å²	81.1	36%	0.364	45%	0.452	S	S	.	.	H	α-helix	trans	-69.9	-36	177.7	176.5	0	0	0	0	111.7	M479 H480 K481 G487 L488 T489	M479-V483 VanDerWaalsContact O-CG2 3.27Å; M479-V483 WeakPolarHBondContact O-CG2 3.26Å; M479-V483 PolarHBondContact O-N 3.05Å; H480-V483 PolarHBondContact O-N 3.5Å; K481-V483 VanDerWaalsContact C-N 3.3Å; K481-V483 PolarHBondContact O-N 2.89Å; V483-G487 PolarHBondContact O-N 2.92Å; V483-L488 HydrophobicContact CG1-CB 3.71Å; V483-L488 PolarHBondContact O-N 3.48Å; V483-T489 HydrophobicContact CB-CG2 4.45Å; V483-T489 HydrophobicContact CG1-CG2 3.68Å
484	V	84.2	Confident	82.5	Confident	45 Å²	45	82.1 Å²	82.1	27%	0.273	46%	0.46	S	S	.	.	H	α-helix	trans	-67.9	-47.2	173.5	172.4	0	0	0	0	110.6	H480 K481 A486 G487 T489	H480-V484 VanDerWaalsContact CE1-CG2 3.46Å; H480-V484 WeakPolarHBondContact CE1-CG2 3.45Å; H480-V484 WeakPolarHBondContact O-CG2 3.47Å; H480-V484 PolarHBondContact O-N 2.95Å; K481-V484 PolarHBondContact O-N 3.15Å; V484-A486 VanDerWaalsContact C-N 3.25Å; V484-A486 PolarHBondContact O-N 3.43Å; V484-G487 PolarHBondContact O-N 2.9Å; V484-T489 HydrophobicContact CG2-CG2 3.68Å
485	D	83.9	Confident	82.3	Confident	119 Å²	119	84.5 Å²	84.5	64%	0.636	47%	0.469	S	S	*	.	H	α-helix	trans	-63	-33.3	179.3	-68.7	-13.7	0	0	0	111.6	K481 G487	K481-D485 WeakPolarHBondContact O-CB 3.41Å; K481-D485 VanDerWaalsContact O-CG 3.23Å; K481-D485 PolarHBondContact O-N 2.85Å; D485-G487 PolarHBondContact O-N 3.13Å
486	A	81.4	Confident	82.2	Confident	68 Å²	68	86.5 Å²	86.5	56%	0.562	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-2.8	173.7	0	0	0	0	0	114.1	A482 V484 L488	A482-A486 WeakPolarHBondContact O-CB 3.47Å; A482-A486 PolarHBondContact O-N 2.94Å; V484-A486 VanDerWaalsContact C-N 3.25Å; V484-A486 PolarHBondContact O-N 3.43Å; A486-L488 HydrophobicContact CB-CD1 4.44Å; A486-L488 PolarHBondContact O-N 3.45Å
487	G	75.4	Confident	82.2	Confident	61 Å²	61	88.1 Å²	88.1	63%	0.629	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	13.9	-178.8	0	0	0	0	0	114.7	V483 V484 D485 T489	V483-G487 PolarHBondContact O-N 2.92Å; V484-G487 PolarHBondContact O-N 2.9Å; D485-G487 PolarHBondContact O-N 3.13Å; G487-T489 VanDerWaalsContact C-N 3.31Å; G487-T489 PolarHBondContact O-N 3.46Å
488	L	72.4	Confident	82.2	Confident	146 Å²	146	82.8 Å²	82.8	76%	0.764	47%	0.467	S	S	*	.	S	Bend	trans	-77.7	-16.3	-178.6	-111.2	72	0	0	0	113.1	V483 A486	V483-L488 HydrophobicContact CG1-CB 3.71Å; V483-L488 PolarHBondContact O-N 3.48Å; A486-L488 HydrophobicContact CB-CD1 4.44Å; A486-L488 PolarHBondContact O-N 3.45Å
489	T	72.1	Confident	82.4	Confident	45 Å²	45	83.5 Å²	83.5	28%	0.276	47%	0.465	S	S	.	.			trans	-140	137.7	174.6	-170.8	0	0	0	0	111	V483 V484 G487 K491	V483-T489 HydrophobicContact CB-CG2 4.45Å; V483-T489 HydrophobicContact CG1-CG2 3.68Å; V484-T489 HydrophobicContact CG2-CG2 3.68Å; G487-T489 VanDerWaalsContact C-N 3.31Å; G487-T489 PolarHBondContact O-N 3.46Å; T489-K491 PolarHBondContact OG1-N 2.97Å
490	T	66.2	Low	82.8	Confident	146 Å²	146	86.6 Å²	86.6	90%	0.896	48%	0.478	S	S	*	.			trans	-90	-10.1	171	53.2	0	0	0	0	112.2	I492	T490-I492 PolarHBondContact O-N 3.4Å
491	K	76	Confident	83.1	Confident	136 Å²	136	85.9 Å²	85.9	59%	0.591	48%	0.475	S	S	*	.			trans	-86.9	105.4	-178.1	-168.5	177.5	-177.5	179.2	0	110.9	H480 T489 L493	H480-K491 PolarHBondContact NE2-O 2.89Å; H480-K491 VanDerWaalsContact NE2-O 3.13Å; T489-K491 PolarHBondContact OG1-N 2.97Å; K491-L493 HydrophobicContact CD-CD2 4.12Å; K491-L493 HydrophobicContact CG-CD2 4.25Å; K491-L493 PolarHBondContact O-N 3.14Å
492	I	78.6	Confident	83.5	Confident	137 Å²	137	81.6 Å²	81.6	70%	0.703	46%	0.46	S	S	*	.			trans	-77.3	114	170.2	-55.6	175	0	0	0	108	T490	T490-I492 PolarHBondContact O-N 3.4Å
493	L	81.3	Confident	83.9	Confident	45 Å²	45	83.2 Å²	83.2	24%	0.236	46%	0.46	C	S	.	.			trans	-85	139.8	174.6	-64.7	177.9	0	0	0	109.4	H480 K491 D497 L498	H480-L493 PolarHBondContact CE1-N 3Å; H480-L493 PolarHBondContact NE2-N 2.75Å; K491-L493 HydrophobicContact CD-CD2 4.12Å; K491-L493 HydrophobicContact CG-CD2 4.25Å; K491-L493 PolarHBondContact O-N 3.14Å; L493-D497 HydrophobicContact CB-CB 4.36Å; L493-D497 HydrophobicContact CD2-CB 4.37Å; L493-L498 HydrophobicContact CB-CD2 4.05Å; L493-L498 HydrophobicContact CB-CG 4.45Å; L493-L498 HydrophobicContact CD1-CD2 3.84Å
494	T	86.1	Confident	84.5	Confident	77 Å²	77	84 Å²	84	47%	0.472	46%	0.46	S	S	.	.			trans	-78.8	159.2	172.8	67	0	0	0	0	110.5	N496 D497 L498	T494-N496 PolarHBondContact O-N 2.83Å; T494-D497 PolarHBondContact N-OD2 3.18Å; T494-D497 VanDerWaalsContact N-OD2 3.07Å; T494-D497 WeakPolarHBondContact O-CB 3.45Å; T494-D497 PolarHBondContact O-N 3.17Å; T494-D497 PolarHBondContact OG1-N 2.95Å; T494-D497 PolarHBondContact OG1-OD2 3.43Å; T494-L498 PolarHBondContact O-N 3.43Å; T494-L498 VanDerWaalsContact O-N 3.14Å
495	E	87.1	Confident	85	Confident	140 Å²	140	82 Å²	82	65%	0.654	45%	0.448	S	S	*	.	H	α-helix	trans	-55.6	-35.1	174.2	-171.2	175	-176.7	0	0	112.2	D497 L498 K499	E495-D497 VanDerWaalsContact C-N 3.32Å; E495-D497 PolarHBondContact O-N 3.25Å; E495-L498 PolarHBondContact O-N 3.29Å; E495-K499 WeakPolarHBondContact O-CB 3.34Å; E495-K499 PolarHBondContact O-N 2.89Å
496	N	89.6	Confident	85.6	Confident	94 Å²	94	77.6 Å²	77.6	50%	0.503	43%	0.428	S	S	.	.	H	α-helix	trans	-64.3	-35.1	174.8	-168.7	36.7	0	0	0	112.4	T494 K500	T494-N496 PolarHBondContact O-N 2.83Å; N496-K500 WeakPolarHBondContact ND2-CE 3.09Å; N496-K500 WeakPolarHBondContact O-CB 3.38Å; N496-K500 WeakPolarHBondContact O-CG 3.3Å; N496-K500 PolarHBondContact O-N 2.79Å
497	D	88.6	Confident	86.1	Confident	52 Å²	52	81.5 Å²	81.5	28%	0.278	43%	0.429	S	S	.	.	H	α-helix	trans	-71.9	-37.8	177.4	-58.6	-42.6	0	0	0	112	L493 T494 E495 K500 T501	L493-D497 HydrophobicContact CB-CB 4.36Å; L493-D497 HydrophobicContact CD2-CB 4.37Å; T494-D497 PolarHBondContact N-OD2 3.18Å; T494-D497 VanDerWaalsContact N-OD2 3.07Å; T494-D497 WeakPolarHBondContact O-CB 3.45Å; T494-D497 PolarHBondContact O-N 3.17Å; T494-D497 PolarHBondContact OG1-N 2.95Å; T494-D497 PolarHBondContact OG1-OD2 3.43Å; E495-D497 VanDerWaalsContact C-N 3.32Å; E495-D497 PolarHBondContact O-N 3.25Å; D497-K500 PolarHBondContact O-N 3.17Å; D497-K500 IonicContact OD1-NZ 3.77Å; D497-T501 PolarHBondContact O-N 2.89Å; D497-T501 PolarHBondContact O-OG1 3.24Å
498	L	89.6	Confident	87	Confident	8 Å²	8	78.9 Å²	78.9	4%	0.042	40%	0.4	C	S	.	.	H	α-helix	trans	-64.7	-45.1	174	-59.1	178.5	0	0	0	110.5	L473 L476 R477 H480 L493 T494 E495 K500 T501 V502	L473-L498 HydrophobicContact CD1-CB 3.82Å; L476-L498 HydrophobicContact CD2-CB 4.27Å; L476-L498 HydrophobicContact CD2-CD2 4.24Å; L476-L498 HydrophobicContact CG-CD2 4.15Å; R477-L498 HydrophobicContact CB-CD1 3.95Å; R477-L498 HydrophobicContact CG-CD1 4.29Å; H480-L498 HydrophobicContact CB-CD2 4.24Å; L493-L498 HydrophobicContact CB-CD2 4.05Å; L493-L498 HydrophobicContact CB-CG 4.45Å; L493-L498 HydrophobicContact CD1-CD2 3.84Å; T494-L498 PolarHBondContact O-N 3.43Å; T494-L498 VanDerWaalsContact O-N 3.14Å; E495-L498 PolarHBondContact O-N 3.29Å; L498-K500 PolarHBondContact O-N 3.42Å; L498-T501 VanDerWaalsContact O-CB 3.31Å; L498-T501 WeakPolarHBondContact O-CB 3.37Å; L498-T501 PolarHBondContact O-N 2.96Å; L498-T501 VanDerWaalsContact O-N 3.1Å; L498-V502 PolarHBondContact O-N 3.48Å; L498-V502 VanDerWaalsContact O-N 3.1Å
499	K	92.8	Very high	87.9	Confident	112 Å²	112	76.8 Å²	76.8	49%	0.487	38%	0.382	S	S	.	.	H	α-helix	trans	-59.9	-45.7	175.1	-173.8	175.6	179.9	177	0	112.1	L473 E495 T501 V502 D503	L473-K499 HydrophobicContact CD1-CB 4.37Å; E495-K499 WeakPolarHBondContact O-CB 3.34Å; E495-K499 PolarHBondContact O-N 2.89Å; K499-T501 PolarHBondContact O-N 3.18Å; K499-V502 PolarHBondContact O-N 2.94Å; K499-V502 VanDerWaalsContact O-N 3.17Å; K499-D503 WeakPolarHBondContact O-CB 3.31Å; K499-D503 PolarHBondContact O-N 2.91Å
500	K	93.1	Very high	88.7	Confident	111 Å²	111	83.6 Å²	83.6	48%	0.483	40%	0.403	S	S	.	.	H	α-helix	trans	-56.5	-38.1	173.8	-76.6	170.4	-171.7	169.1	0	112.2	N496 D497 L498 E504	N496-K500 WeakPolarHBondContact ND2-CE 3.09Å; N496-K500 WeakPolarHBondContact O-CB 3.38Å; N496-K500 WeakPolarHBondContact O-CG 3.3Å; N496-K500 PolarHBondContact O-N 2.79Å; D497-K500 PolarHBondContact O-N 3.17Å; D497-K500 IonicContact OD1-NZ 3.77Å; L498-K500 PolarHBondContact O-N 3.42Å; K500-E504 WeakPolarHBondContact O-CB 3.49Å; K500-E504 PolarHBondContact O-N 3.42Å
501	T	92.6	Very high	89.7	Confident	17 Å²	17	78.8 Å²	78.8	10%	0.104	38%	0.377	C	S	.	.	H	α-helix	trans	-64.8	-44.2	178.2	-57.7	0	0	0	0	111.5	A358 Q359 A470 L476 D497 L498 K499 S505	A358-T501 HydrophobicContact CB-CG2 3.87Å; A358-T501 VanDerWaalsContact CB-O 3.26Å; A358-T501 WeakPolarHBondContact CB-O 3.33Å; Q359-T501 WeakPolarHBondContact O-CG2 3.37Å; Q359-T501 PolarHBondContact O-OG1 3.4Å; A470-T501 HydrophobicContact CB-CG2 4.4Å; L476-T501 HydrophobicContact CD2-CG2 4.04Å; D497-T501 PolarHBondContact O-N 2.89Å; D497-T501 PolarHBondContact O-OG1 3.24Å; L498-T501 VanDerWaalsContact O-CB 3.31Å; L498-T501 WeakPolarHBondContact O-CB 3.37Å; L498-T501 PolarHBondContact O-N 2.96Å; L498-T501 VanDerWaalsContact O-N 3.1Å; K499-T501 PolarHBondContact O-N 3.18Å; T501-S505 VanDerWaalsContact O-CB 3.26Å; T501-S505 WeakPolarHBondContact O-CB 3.22Å; T501-S505 PolarHBondContact O-N 2.85Å
502	V	94.5	Very high	90.4	Very high	37 Å²	37	73.4 Å²	73.4	22%	0.224	35%	0.354	C	S	.	.	H	α-helix	trans	-65.9	-46.8	176.9	177.4	0	0	0	0	111.1	A470 L473 L476 L498 K499 E504 S505 A506	A470-V502 HydrophobicContact CB-CG2 4.34Å; L473-V502 HydrophobicContact CB-CG2 4.43Å; L473-V502 HydrophobicContact CD1-CG2 4.28Å; L476-V502 HydrophobicContact CD2-CG2 3.92Å; L498-V502 PolarHBondContact O-N 3.48Å; L498-V502 VanDerWaalsContact O-N 3.1Å; K499-V502 PolarHBondContact O-N 2.94Å; K499-V502 VanDerWaalsContact O-N 3.17Å; V502-E504 PolarHBondContact O-N 3.41Å; V502-S505 WeakPolarHBondContact O-CB 3.49Å; V502-S505 PolarHBondContact O-N 3.29Å; V502-A506 PolarHBondContact O-N 3.3Å
503	D	94.3	Very high	90.9	Very high	91 Å²	91	68.5 Å²	68.5	49%	0.487	33%	0.332	S	S	.	.	H	α-helix	trans	-62.1	-44	179.6	-73.6	-23.2	0	0	0	111.5	K499 A506 R507	K499-D503 WeakPolarHBondContact O-CB 3.31Å; K499-D503 PolarHBondContact O-N 2.91Å; D503-A506 PolarHBondContact O-N 2.97Å; D503-R507 WeakPolarHBondContact O-CB 3.45Å; D503-R507 PolarHBondContact O-N 3.04Å
504	E	94.4	Very high	91.2	Very high	76 Å²	76	67.6 Å²	67.6	36%	0.355	33%	0.326	S	S	.	.	H	α-helix	trans	-67.2	-40.6	177.3	-175.8	57.4	-161.1	0	0	111.7	A358 K500 V502 A506 R507 I508	A358-E504 HydrophobicContact CB-CB 4.21Å; A358-E504 HydrophobicContact CB-CG 4.28Å; K500-E504 WeakPolarHBondContact O-CB 3.49Å; K500-E504 PolarHBondContact O-N 3.42Å; V502-E504 PolarHBondContact O-N 3.41Å; E504-A506 VanDerWaalsContact C-N 3.32Å; E504-A506 PolarHBondContact O-N 3.4Å; E504-R507 WeakPolarHBondContact O-CB 3.11Å; E504-R507 PolarHBondContact O-N 3.04Å; E504-R507 VanDerWaalsContact O-N 3.15Å; E504-I508 HydrophobicContact CG-CD1 3.96Å; E504-I508 HydrophobicContact CG-CG1 4.37Å; E504-I508 WeakPolarHBondContact O-CG1 3.21Å; E504-I508 PolarHBondContact O-N 2.78Å
505	S	96	Very high	91.4	Very high	4 Å²	4	64.9 Å²	64.9	3%	0.028	31%	0.307	C	S	.	.	H	α-helix	trans	-57.1	-46.6	173.3	170.9	0	0	0	0	111.2	F467 A470 T501 V502 R507 I508 R509	F467-S505 WeakPolarHBondContact CZ-O 3.44Å; A470-S505 PolarHBondContact N-OG 3.31Å; T501-S505 VanDerWaalsContact O-CB 3.26Å; T501-S505 WeakPolarHBondContact O-CB 3.22Å; T501-S505 PolarHBondContact O-N 2.85Å; V502-S505 WeakPolarHBondContact O-CB 3.49Å; V502-S505 PolarHBondContact O-N 3.29Å; S505-R507 VanDerWaalsContact C-N 3.34Å; S505-R507 PolarHBondContact O-N 3.08Å; S505-I508 PolarHBondContact O-N 3.3Å; S505-R509 WeakPolarHBondContact O-CB 3.28Å; S505-R509 PolarHBondContact O-N 3.16Å
506	A	94.9	Very high	91.7	Very high	27 Å²	27	59.2 Å²	59.2	22%	0.223	28%	0.28	C	S	.	.	H	α-helix	trans	-64.3	-38.5	176.9	0	0	0	0	0	112	V502 D503 E504 R509 R510	V502-A506 PolarHBondContact O-N 3.3Å; D503-A506 PolarHBondContact O-N 2.97Å; E504-A506 VanDerWaalsContact C-N 3.32Å; E504-A506 PolarHBondContact O-N 3.4Å; A506-R509 PolarHBondContact O-N 2.81Å; A506-R510 WeakPolarHBondContact O-CG 3.41Å; A506-R510 PolarHBondContact O-N 3.37Å; A506-R510 PolarHBondContact O-NH1 2.91Å
507	R	93.4	Very high	91.9	Very high	150 Å²	150	57.5 Å²	57.5	57%	0.566	27%	0.271	S	S	*	.	H	α-helix	trans	-63.5	-49.2	176	-175.5	-178	176.4	171.7	-4.2	112	D503 E504 S505 R509 R510 A511	D503-R507 WeakPolarHBondContact O-CB 3.45Å; D503-R507 PolarHBondContact O-N 3.04Å; E504-R507 WeakPolarHBondContact O-CB 3.11Å; E504-R507 PolarHBondContact O-N 3.04Å; E504-R507 VanDerWaalsContact O-N 3.15Å; S505-R507 VanDerWaalsContact C-N 3.34Å; S505-R507 PolarHBondContact O-N 3.08Å; R507-R509 VanDerWaalsContact C-N 3.31Å; R507-R509 PolarHBondContact O-N 3.18Å; R507-R510 PolarHBondContact O-N 3.32Å; R507-A511 PolarHBondContact O-N 3.12Å
508	I	92.9	Very high	92.2	Very high	6 Å²	6	57.2 Å²	57.2	3%	0.031	27%	0.269	C	S	.	.	H	α-helix	trans	-59.1	-45.2	177.4	-67.8	169.3	0	0	0	110	I356 P450 F467 E504 S505 R510 A511 Y512 F516	I356-I508 HydrophobicContact CG2-CG2 3.84Å; P450-I508 HydrophobicContact CB-CG2 4.42Å; P450-I508 HydrophobicContact CG-CB 4.45Å; P450-I508 HydrophobicContact CG-CD1 4.01Å; P450-I508 HydrophobicContact CG-CG1 3.94Å; P450-I508 HydrophobicContact CG-CG2 3.69Å; F467-I508 HydrophobicContact CD2-CG2 4Å; F467-I508 HydrophobicContact CE2-CB 4Å; F467-I508 HydrophobicContact CE2-CG2 3.46Å; F467-I508 VanDerWaalsContact CE2-CG2 3.46Å; F467-I508 HydrophobicContact CZ-CB 4.5Å; F467-I508 HydrophobicContact CZ-CG2 4.34Å; E504-I508 HydrophobicContact CG-CD1 3.96Å; E504-I508 HydrophobicContact CG-CG1 4.37Å; E504-I508 WeakPolarHBondContact O-CG1 3.21Å; E504-I508 PolarHBondContact O-N 2.78Å; S505-I508 PolarHBondContact O-N 3.3Å; I508-R510 PolarHBondContact O-N 3.21Å; I508-A511 PolarHBondContact O-N 3.39Å; I508-Y512 HydrophobicContact CG2-CD2 4.17Å; I508-Y512 PolarHBondContact O-N 2.86Å; I508-F516 HydrophobicContact CG2-CZ 4.11Å
509	R	92.6	Very high	92.5	Very high	102 Å²	102	60 Å²	60	39%	0.385	29%	0.287	S	S	.	.	H	α-helix	trans	-57.6	-48.4	177	-170.9	-174.7	-66.8	168.9	1.8	111.6	F467 S505 A506 R507 A511 S513	F467-R509 HydrophobicContact CE1-CB 3.83Å; F467-R509 HydrophobicContact CE1-CG 4.14Å; F467-R509 HydrophobicContact CZ-CB 3.99Å; S505-R509 WeakPolarHBondContact O-CB 3.28Å; S505-R509 PolarHBondContact O-N 3.16Å; A506-R509 PolarHBondContact O-N 2.81Å; R507-R509 VanDerWaalsContact C-N 3.31Å; R507-R509 PolarHBondContact O-N 3.18Å; R509-A511 PolarHBondContact O-N 3.35Å; R509-S513 WeakPolarHBondContact O-CB 3.44Å; R509-S513 PolarHBondContact O-N 3.4Å; R509-S513 VanDerWaalsContact O-N 3.09Å; R509-S513 PolarHBondContact O-OG 3.48Å
510	R	88.5	Confident	92.7	Very high	188 Å²	188	54.9 Å²	54.9	71%	0.709	27%	0.265	S	S	*	.	H	α-helix	trans	-62.5	-41.8	179.9	-69.7	-177.7	-147.4	101.8	-4.6	112.4	A506 R507 I508	A506-R510 WeakPolarHBondContact O-CG 3.41Å; A506-R510 PolarHBondContact O-N 3.37Å; A506-R510 PolarHBondContact O-NH1 2.91Å; R507-R510 PolarHBondContact O-N 3.32Å; I508-R510 PolarHBondContact O-N 3.21Å
511	A	87.2	Confident	92.9	Very high	44 Å²	44	52.4 Å²	52.4	36%	0.364	26%	0.259	S	S	.	.	H	α-helix	trans	-77.3	-41.6	-175.2	0	0	0	0	0	113.4	R507 I508 R509 H514	R507-A511 PolarHBondContact O-N 3.12Å; I508-A511 PolarHBondContact O-N 3.39Å; R509-A511 PolarHBondContact O-N 3.35Å; A511-H514 PolarHBondContact O-CE1 3.18Å; A511-H514 PolarHBondContact O-ND1 2.83Å
512	Y	89.5	Confident	93	Very high	24 Å²	24	52 Å²	52	9%	0.094	26%	0.256	C	S	.	.	H	α-helix	trans	-115	7.2	-168	-59.1	-80.8	0	0	0	114.5	D332 P450 Q451 I508 H514 Y515 F516	D332-Y512 PolarHBondContact OD2-OH 3.04Å; P450-Y512 HydrophobicContact CB-CD1 4.04Å; P450-Y512 HydrophobicContact CB-CD2 3.48Å; P450-Y512 VanDerWaalsContact CB-CD2 3.48Å; P450-Y512 HydrophobicContact CB-CE1 4.18Å; P450-Y512 HydrophobicContact CB-CE2 3.62Å; P450-Y512 HydrophobicContact CB-CG 3.73Å; P450-Y512 HydrophobicContact CG-CD2 4.14Å; P450-Y512 HydrophobicContact CG-CE2 4.28Å; Q451-Y512 PolarHBondContact NE2-OH 2.72Å; I508-Y512 HydrophobicContact CG2-CD2 4.17Å; I508-Y512 PolarHBondContact O-N 2.86Å; Y512-H514 PolarHBondContact O-N 3.31Å; Y512-Y515 AromaticContact CD1-CD2 3.99Å; Y512-Y515 HydrophobicContact CD1-CD2 3.99Å; Y512-Y515 HydrophobicContact CD1-CE2 4.15Å; Y512-Y515 WeakPolarHBondContact O-CB 3.32Å; Y512-Y515 PolarHBondContact O-N 2.98Å; Y512-F516 WeakPolarHBondContact O-CD1 3.32Å; Y512-F516 VanDerWaalsContact O-CE1 3.24Å; Y512-F516 WeakPolarHBondContact O-CE1 3.36Å
513	S	89.4	Confident	92.8	Very high	34 Å²	34	53.7 Å²	53.7	24%	0.238	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-15	-175.7	63	0	0	0	0	115.7	K255 R509 Y515	K255-S513 VanDerWaalsContact NZ-C 3.29Å; K255-S513 PolarHBondContact NZ-O 2.95Å; K255-S513 PolarHBondContact NZ-OG 2.81Å; R509-S513 WeakPolarHBondContact O-CB 3.44Å; R509-S513 PolarHBondContact O-N 3.4Å; R509-S513 VanDerWaalsContact O-N 3.09Å; R509-S513 PolarHBondContact O-OG 3.48Å; S513-Y515 VanDerWaalsContact C-N 3.33Å
514	H	87.3	Confident	92.8	Very high	26 Å²	26	52.2 Å²	52.2	12%	0.12	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-19.4	174	56.3	-83.8	0	0	0	112.6	Y233 E335 Q337 A511 Y512	Y233-H514 HydrophobicContact CD1-CB 3.63Å; Y233-H514 HydrophobicContact CE1-CB 4Å; Y233-H514 WeakPolarHBondContact CE1-O 3.04Å; Y233-H514 HydrophobicContact CG-CB 3.9Å; E335-H514 IonicContact OE2-NE2 3.9Å; Q337-H514 PolarHBondContact OE1-CD2 2.76Å; A511-H514 PolarHBondContact O-CE1 3.18Å; A511-H514 PolarHBondContact O-ND1 2.83Å; Y512-H514 PolarHBondContact O-N 3.31Å
515	Y	90.7	Very high	92.5	Very high	19 Å²	19	51.5 Å²	51.5	8%	0.075	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-16.7	174	-73.7	-85.3	0	0	0	113.7	E335 L453 K457 V465 Y512 S513	E335-Y515 PolarHBondContact OE2-OH 2.93Å; L453-Y515 HydrophobicContact CB-CD1 3.84Å; L453-Y515 HydrophobicContact CB-CE1 4.16Å; L453-Y515 HydrophobicContact CB-CG 4.2Å; L453-Y515 HydrophobicContact CD1-CD1 4.32Å; L453-Y515 HydrophobicContact CD1-CD2 4.37Å; L453-Y515 HydrophobicContact CD1-CG 3.89Å; K457-Y515 HydrophobicContact CB-CD1 4.39Å; K457-Y515 HydrophobicContact CB-CE1 4.17Å; K457-Y515 HydrophobicContact CD-CD1 3.63Å; K457-Y515 HydrophobicContact CD-CE1 3.51Å; K457-Y515 HydrophobicContact CG-CD1 4.42Å; K457-Y515 HydrophobicContact CG-CE1 4.39Å; V465-Y515 VanDerWaalsContact CB-O 3.29Å; V465-Y515 WeakPolarHBondContact CB-O 3.48Å; Y512-Y515 AromaticContact CD1-CD2 3.99Å; Y512-Y515 HydrophobicContact CD1-CD2 3.99Å; Y512-Y515 HydrophobicContact CD1-CE2 4.15Å; Y512-Y515 WeakPolarHBondContact O-CB 3.32Å; Y512-Y515 PolarHBondContact O-N 2.98Å; S513-Y515 VanDerWaalsContact C-N 3.33Å
516	F	93.2	Very high	92.4	Very high	21 Å²	21	55.3 Å²	55.3	9%	0.092	27%	0.274	C	S	.	.			trans	-82.8	132.3	-169.8	-51.1	-20.8	0	0	0	111.6	I356 V465 F467 I508 Y512	I356-F516 HydrophobicContact CG2-CE1 4.21Å; V465-F516 HydrophobicContact CG1-CD1 3.92Å; F467-F516 HydrophobicContact CB-CB 4.32Å; F467-F516 HydrophobicContact CB-CD1 3.93Å; F467-F516 HydrophobicContact CB-CD2 3.3Å; F467-F516 HydrophobicContact CB-CE1 4.04Å; F467-F516 HydrophobicContact CB-CE2 3.43Å; F467-F516 VanDerWaalsContact CB-CE2 3.43Å; F467-F516 HydrophobicContact CB-CG 3.59Å; F467-F516 HydrophobicContact CB-CZ 3.82Å; F467-F516 HydrophobicContact CD1-CD2 4.01Å; F467-F516 AromaticContact CD1-CE2 3.6Å; F467-F516 HydrophobicContact CD1-CE2 3.6Å; F467-F516 HydrophobicContact CD1-CZ 4.34Å; F467-F516 HydrophobicContact CD2-CD2 4.41Å; F467-F516 HydrophobicContact CD2-CE1 4.19Å; F467-F516 AromaticContact CD2-CE2 3.64Å; F467-F516 HydrophobicContact CD2-CE2 3.64Å; F467-F516 AromaticContact CD2-CZ 3.52Å; F467-F516 HydrophobicContact CD2-CZ 3.52Å; F467-F516 HydrophobicContact CE1-CE2 4.28Å; F467-F516 HydrophobicContact CE2-CE2 4.31Å; F467-F516 HydrophobicContact CE2-CZ 4.18Å; F467-F516 AromaticContact CG-CD2 3.67Å; F467-F516 HydrophobicContact CG-CD2 3.67Å; F467-F516 HydrophobicContact CG-CE1 4.3Å; F467-F516 AromaticContact CG-CE2 3.24Å; F467-F516 HydrophobicContact CG-CE2 3.24Å; F467-F516 HydrophobicContact CG-CG 4.36Å; F467-F516 AromaticContact CG-CZ 3.63Å; F467-F516 HydrophobicContact CG-CZ 3.63Å; I508-F516 HydrophobicContact CG2-CZ 4.11Å; Y512-F516 WeakPolarHBondContact O-CD1 3.32Å; Y512-F516 VanDerWaalsContact O-CE1 3.24Å; Y512-F516 WeakPolarHBondContact O-CE1 3.36Å
517	D	93.6	Very high	92.4	Very high	59 Å²	59	60 Å²	60	32%	0.316	29%	0.29	S	S	.	.	S	Bend	trans	-85.1	-34.4	167.2	-63.1	-64.5	0	0	0	111.3	K231 F464 V465	K231-D517 IonicContact NZ-OD1 2.75Å; F464-D517 WeakPolarHBondContact CA-OD2 3.25Å; F464-D517 HydrophobicContact CD2-CB 3.69Å; F464-D517 HydrophobicContact CE2-CB 3.45Å; F464-D517 VanDerWaalsContact CE2-CB 3.45Å; F464-D517 HydrophobicContact CG-CB 4.48Å; F464-D517 HydrophobicContact CZ-CB 4.08Å; V465-D517 PolarHBondContact N-OD2 2.96Å; V465-D517 PolarHBondContact O-N 3.32Å
518	L	95.3	Very high	92.5	Very high	45 Å²	45	53 Å²	53	24%	0.236	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	145.1	-178.6	-178.6	63.8	0	0	0	111.2	F464 V465 V466 F467 I520 A535	F464-L518 HydrophobicContact CZ-CB 4.3Å; V465-L518 PolarHBondContact O-N 2.94Å; V466-L518 WeakPolarHBondContact CA-O 3.49Å; V466-L518 HydrophobicContact CG1-CB 4.23Å; V466-L518 HydrophobicContact CG1-CD2 4.13Å; V466-L518 HydrophobicContact CG1-CG 4.25Å; V466-L518 HydrophobicContact CG2-CB 4.31Å; V466-L518 HydrophobicContact CG2-CD2 4.45Å; F467-L518 PolarHBondContact N-O 3.42Å; L518-I520 HydrophobicContact CD2-CD1 3.84Å; L518-I520 HydrophobicContact CD2-CG1 3.93Å; L518-I520 HydrophobicContact CG-CD1 4.45Å; L518-I520 HydrophobicContact CG-CG1 4.02Å; L518-A535 HydrophobicContact CD2-CB 3.42Å; L518-A535 VanDerWaalsContact CD2-CB 3.42Å
519	T	96.6	Very high	92.7	Very high	66 Å²	66	52.7 Å²	52.7	41%	0.405	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	126.7	168.7	-66.9	0	0	0	0	109.8	F467 A469	F467-T519 HydrophobicContact CD1-CG2 3.8Å; F467-T519 CarbonylContact O-C 3.59Å; F467-T519 WeakPolarHBondContact O-CA 3.45Å; A469-T519 HydrophobicContact CB-CG2 4.3Å
520	I	97.6	Very high	92.8	Very high	5 Å²	5	51.6 Å²	51.6	3%	0.026	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	122.5	176.2	-60	176.8	0	0	0	107.8	V466 F467 I468 A469 L518 A528 K531 L532	V466-I520 HydrophobicContact CG1-CD1 3.84Å; V466-I520 HydrophobicContact CG1-CG1 4.11Å; F467-I520 PolarHBondContact O-N 3.19Å; I468-I520 CarbonylContact C-O 3.58Å; I468-I520 WeakPolarHBondContact CA-O 3.38Å; I468-I520 HydrophobicContact CD1-CB 4.18Å; I468-I520 HydrophobicContact CD1-CD1 4.45Å; A469-I520 PolarHBondContact N-O 2.95Å; L518-I520 HydrophobicContact CD2-CD1 3.84Å; L518-I520 HydrophobicContact CD2-CG1 3.93Å; L518-I520 HydrophobicContact CG-CD1 4.45Å; L518-I520 HydrophobicContact CG-CG1 4.02Å; I520-A528 HydrophobicContact CG2-CB 3.84Å; I520-K531 HydrophobicContact CD1-CB 4.16Å; I520-K531 HydrophobicContact CG2-CD 4.45Å; I520-L532 HydrophobicContact CD1-CB 3.82Å; I520-L532 HydrophobicContact CD1-CD1 4.4Å
521	V	96.9	Very high	93.3	Very high	60 Å²	60	47.9 Å²	47.9	36%	0.364	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	122	167.4	-179.6	0	0	0	0	107.9	A469 P471 D523	A469-V521 HydrophobicContact CB-CG2 4.05Å; P471-V521 HydrophobicContact CB-CG1 4.11Å; V521-D523 PolarHBondContact O-N 3.38Å
522	N	93.9	Very high	93.7	Very high	9 Å²	9	45.8 Å²	45.8	5%	0.048	24%	0.236	C	C	.	.			trans	-93.2	72.8	-179.6	-172.7	22.1	0	0	0	110.9	V361 I468 A469 P471 N524 A528	V361-N522 PolarHBondContact O-ND2 3.4Å; I468-N522 HydrophobicContact CG2-CB 3.77Å; A469-N522 PolarHBondContact O-N 3.13Å; P471-N522 WeakPolarHBondContact CD-O 3.3Å; P471-N522 WeakPolarHBondContact CG-O 3.22Å; N522-N524 PolarHBondContact OD1-O 3.4Å; N522-A528 HydrophobicContact CB-CB 4.34Å; N522-A528 WeakPolarHBondContact OD1-CB 3.44Å
523	D	91.6	Very high	94	Very high	72 Å²	72	46.5 Å²	46.5	39%	0.385	24%	0.24	S	C	.	.	S	Bend	trans	-87.1	-16.3	171.1	57.1	-2.3	0	0	0	112.9	P471 T475 M479 V521	P471-D523 HydrophobicContact CB-CB 4.04Å; T475-D523 HydrophobicContact CG2-CB 4.06Å; M479-D523 VanDerWaalsContact SD-C 3.51Å; V521-D523 PolarHBondContact O-N 3.38Å
524	N	92.4	Very high	94.3	Very high	59 Å²	59	49.1 Å²	49.1	32%	0.316	25%	0.251	S	S	.	.	S	Bend	trans	-153.2	127.5	174	177.3	-73.3	0	0	0	109.2	N522 D526 K527 A528	N522-N524 PolarHBondContact OD1-O 3.4Å; N524-D526 PolarHBondContact O-N 3.1Å; N524-D526 WeakPolarHBondContact OD1-CB 3.39Å; N524-D526 PolarHBondContact OD1-N 3.24Å; N524-K527 HydrophobicContact CB-CB 4.21Å; N524-K527 HydrophobicContact CB-CD 4.21Å; N524-K527 HydrophobicContact CB-CG 4.25Å; N524-K527 PolarHBondContact O-N 3.03Å; N524-K527 PolarHBondContact OD1-N 2.95Å; N524-A528 VanDerWaalsContact O-CB 3.24Å; N524-A528 WeakPolarHBondContact O-CB 3.49Å; N524-A528 PolarHBondContact O-N 3.28Å
525	L	89.6	Confident	94.6	Very high	62 Å²	62	48 Å²	48	33%	0.325	25%	0.247	S	C	.	.	H	α-helix	trans	-64.8	-37.3	-172.7	-173.1	67.4	0	0	0	113	L366 F529	L366-L525 HydrophobicContact CD2-CD1 3.79Å; L366-L525 HydrophobicContact CG-CD1 4.01Å; L525-F529 VanDerWaalsContact O-CB 3.26Å; L525-F529 WeakPolarHBondContact O-CB 3.16Å; L525-F529 PolarHBondContact O-N 3.44Å
526	D	92.7	Very high	94.8	Very high	83 Å²	83	47.4 Å²	47.4	44%	0.444	25%	0.245	S	C	.	.	H	α-helix	trans	-69	-50.5	179	-63.7	-55.9	0	0	0	110.8	R369 N524 A528 F529 D530	R369-D526 IonicContact CZ-OD1 2.62Å; R369-D526 IonicContact NH1-OD1 3.63Å; R369-D526 PolarHBondContact NH1-OD1 3.1Å; R369-D526 IonicContact NH2-OD1 2.8Å; R369-D526 PolarHBondContact NH2-OD1 3.31Å; R369-D526 VanDerWaalsContact NH2-OD1 3.15Å; N524-D526 PolarHBondContact O-N 3.1Å; N524-D526 WeakPolarHBondContact OD1-CB 3.39Å; N524-D526 PolarHBondContact OD1-N 3.24Å; D526-A528 VanDerWaalsContact C-N 3.28Å; D526-A528 PolarHBondContact O-N 3.47Å; D526-F529 WeakPolarHBondContact O-CA 3.35Å; D526-F529 WeakPolarHBondContact O-CB 3.42Å; D526-F529 PolarHBondContact O-N 2.95Å; D526-D530 VanDerWaalsContact O-CG 3.28Å; D526-D530 PolarHBondContact O-N 2.92Å
527	K	95.4	Very high	94.7	Very high	127 Å²	127	50 Å²	50	55%	0.552	26%	0.257	S	S	*	.	H	α-helix	trans	-61.9	-37.3	177.5	-65.3	-177.2	-178.5	177.4	0	112.4	N524 F529 K531	N524-K527 HydrophobicContact CB-CB 4.21Å; N524-K527 HydrophobicContact CB-CD 4.21Å; N524-K527 HydrophobicContact CB-CG 4.25Å; N524-K527 PolarHBondContact O-N 3.03Å; N524-K527 PolarHBondContact OD1-N 2.95Å; K527-F529 VanDerWaalsContact C-N 3.33Å; K527-K531 VanDerWaalsContact O-CG 3.28Å; K527-K531 WeakPolarHBondContact O-CG 3.45Å; K527-K531 PolarHBondContact O-N 3.04Å; K527-K531 VanDerWaalsContact O-N 3.13Å
528	A	95.9	Very high	94.7	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.008	26%	0.264	C	S	.	.	H	α-helix	trans	-66.8	-37.9	175.5	0	0	0	0	0	111.3	L366 I520 N522 N524 D526 L532	L366-A528 HydrophobicContact CD2-CB 4.41Å; I520-A528 HydrophobicContact CG2-CB 3.84Å; N522-A528 HydrophobicContact CB-CB 4.34Å; N522-A528 WeakPolarHBondContact OD1-CB 3.44Å; N524-A528 VanDerWaalsContact O-CB 3.24Å; N524-A528 WeakPolarHBondContact O-CB 3.49Å; N524-A528 PolarHBondContact O-N 3.28Å; D526-A528 VanDerWaalsContact C-N 3.28Å; D526-A528 PolarHBondContact O-N 3.47Å; A528-L532 WeakPolarHBondContact O-CB 3.48Å; A528-L532 PolarHBondContact O-N 2.85Å
529	F	96.2	Very high	94.6	Very high	1 Å²	1	51.6 Å²	51.6	0%	0.004	26%	0.257	C	S	.	.	H	α-helix	trans	-65.9	-47.2	175.2	-179.5	-96	0	0	0	111.9	L366 R369 L370 M373 L525 D526 K527 K531 L532 Q533	L366-F529 HydrophobicContact CD2-CB 3.78Å; L366-F529 HydrophobicContact CD2-CD2 4.18Å; R369-F529 HydrophobicContact CB-CD2 3.99Å; R369-F529 HydrophobicContact CB-CE2 3.71Å; R369-F529 HydrophobicContact CB-CZ 4.46Å; R369-F529 VanDerWaalsContact CD-CD2 3.49Å; R369-F529 HydrophobicContact CG-CD2 3.79Å; R369-F529 HydrophobicContact CG-CE1 4.32Å; R369-F529 HydrophobicContact CG-CE2 3.44Å; R369-F529 VanDerWaalsContact CG-CE2 3.44Å; R369-F529 HydrophobicContact CG-CG 4.35Å; R369-F529 HydrophobicContact CG-CZ 3.75Å; L370-F529 HydrophobicContact CB-CE2 4.42Å; L370-F529 HydrophobicContact CD2-CE2 3.65Å; L370-F529 HydrophobicContact CD2-CZ 3.94Å; L370-F529 HydrophobicContact CG-CD2 4.49Å; L370-F529 HydrophobicContact CG-CE2 3.72Å; L370-F529 HydrophobicContact CG-CZ 4.46Å; M373-F529 HydrophobicContact CE-CE1 4.15Å; M373-F529 HydrophobicContact CE-CZ 4.36Å; M373-F529 HydrophobicContact CG-CZ 4.49Å; M373-F529 HydrophobicContact SD-CE1 3.44Å; M373-F529 WeakPolarHBondContact SD-CE1 3.42Å; M373-F529 HydrophobicContact SD-CE2 4.41Å; M373-F529 HydrophobicContact SD-CZ 3.32Å; M373-F529 WeakPolarHBondContact SD-CZ 3.5Å; L525-F529 VanDerWaalsContact O-CB 3.26Å; L525-F529 WeakPolarHBondContact O-CB 3.16Å; L525-F529 PolarHBondContact O-N 3.44Å; D526-F529 WeakPolarHBondContact O-CA 3.35Å; D526-F529 WeakPolarHBondContact O-CB 3.42Å; D526-F529 PolarHBondContact O-N 2.95Å; K527-F529 VanDerWaalsContact C-N 3.33Å; F529-K531 VanDerWaalsContact C-N 3.34Å; F529-K531 PolarHBondContact O-N 2.98Å; F529-L532 WeakPolarHBondContact O-CB 3.45Å; F529-L532 PolarHBondContact O-N 2.97Å; F529-L532 VanDerWaalsContact O-N 3.08Å; F529-Q533 HydrophobicContact CE1-CB 4.5Å; F529-Q533 VanDerWaalsContact CE1-OE1 3.25Å; F529-Q533 WeakPolarHBondContact O-CB 3.41Å; F529-Q533 PolarHBondContact O-N 2.92Å
530	D	96.4	Very high	94.2	Very high	79 Å²	79	51.1 Å²	51.1	42%	0.422	25%	0.249	S	C	.	.	H	α-helix	trans	-58.9	-47	178.6	-62.2	-21	0	0	0	110.6	D526 L532 Q533 D534	D526-D530 VanDerWaalsContact O-CG 3.28Å; D526-D530 PolarHBondContact O-N 2.92Å; D530-L532 VanDerWaalsContact C-N 3.3Å; D530-L532 PolarHBondContact O-N 3.33Å; D530-Q533 PolarHBondContact O-N 3.12Å; D530-D534 WeakPolarHBondContact O-CB 3.23Å; D530-D534 VanDerWaalsContact O-CG 3.25Å; D530-D534 PolarHBondContact O-N 3.11Å
531	K	97.1	Very high	94	Very high	110 Å²	110	55.9 Å²	55.9	48%	0.478	28%	0.278	S	S	.	.	H	α-helix	trans	-58.7	-39.6	174.8	-73.6	174	-175.9	174.7	0	113	I520 K527 F529 A535	I520-K531 HydrophobicContact CD1-CB 4.16Å; I520-K531 HydrophobicContact CG2-CD 4.45Å; K527-K531 VanDerWaalsContact O-CG 3.28Å; K527-K531 WeakPolarHBondContact O-CG 3.45Å; K527-K531 PolarHBondContact O-N 3.04Å; K527-K531 VanDerWaalsContact O-N 3.13Å; F529-K531 VanDerWaalsContact C-N 3.34Å; F529-K531 PolarHBondContact O-N 2.98Å; K531-A535 VanDerWaalsContact O-CB 3.31Å; K531-A535 WeakPolarHBondContact O-CB 3.09Å; K531-A535 PolarHBondContact O-N 3.03Å; K531-A535 VanDerWaalsContact O-N 3.11Å
532	L	96.7	Very high	93.8	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-68.6	-43.5	178.1	176.4	60	0	0	0	110.7	L355 L366 L370 V466 I520 A528 F529 D530 A535 V536	L355-L532 HydrophobicContact CD2-CD1 4.3Å; L355-L532 HydrophobicContact CD2-CD2 4.24Å; L366-L532 HydrophobicContact CB-CD2 4.09Å; L366-L532 HydrophobicContact CD1-CD2 4.46Å; L370-L532 HydrophobicContact CD1-CD2 3.6Å; L370-L532 HydrophobicContact CD1-CG 4.02Å; L370-L532 HydrophobicContact CG-CD2 4.36Å; V466-L532 HydrophobicContact CB-CD1 4.33Å; V466-L532 HydrophobicContact CG1-CD1 4.14Å; V466-L532 HydrophobicContact CG2-CD1 3.88Å; I520-L532 HydrophobicContact CD1-CB 3.82Å; I520-L532 HydrophobicContact CD1-CD1 4.4Å; A528-L532 WeakPolarHBondContact O-CB 3.48Å; A528-L532 PolarHBondContact O-N 2.85Å; F529-L532 WeakPolarHBondContact O-CB 3.45Å; F529-L532 PolarHBondContact O-N 2.97Å; F529-L532 VanDerWaalsContact O-N 3.08Å; D530-L532 VanDerWaalsContact C-N 3.3Å; D530-L532 PolarHBondContact O-N 3.33Å; L532-A535 PolarHBondContact O-N 3.48Å; L532-V536 HydrophobicContact CD1-CG2 4.18Å; L532-V536 VanDerWaalsContact O-CG2 3.31Å; L532-V536 WeakPolarHBondContact O-CG2 3.42Å; L532-V536 PolarHBondContact O-N 3.2Å
533	Q	94.9	Very high	93.7	Very high	38 Å²	38	59.9 Å²	59.9	18%	0.178	30%	0.298	C	S	.	.	H	α-helix	trans	-61.8	-51.7	177.4	-179.6	170.6	-5.5	0	0	110.8	F529 D530 A535 V536 E537	F529-Q533 HydrophobicContact CE1-CB 4.5Å; F529-Q533 VanDerWaalsContact CE1-OE1 3.25Å; F529-Q533 WeakPolarHBondContact O-CB 3.41Å; F529-Q533 PolarHBondContact O-N 2.92Å; D530-Q533 PolarHBondContact O-N 3.12Å; Q533-A535 VanDerWaalsContact C-N 3.27Å; Q533-A535 PolarHBondContact O-N 3.41Å; Q533-V536 PolarHBondContact O-N 2.94Å; Q533-V536 VanDerWaalsContact O-N 3.12Å; Q533-E537 HydrophobicContact CG-CG 4.33Å; Q533-E537 VanDerWaalsContact CG-OE1 3.28Å; Q533-E537 WeakPolarHBondContact CG-OE1 3.46Å; Q533-E537 PolarHBondContact NE2-OE1 2.67Å; Q533-E537 WeakPolarHBondContact O-CB 3.42Å; Q533-E537 WeakPolarHBondContact O-CG 3.36Å; Q533-E537 PolarHBondContact O-N 2.87Å
534	D	95.6	Very high	93.8	Very high	89 Å²	89	57 Å²	57	48%	0.476	28%	0.282	S	S	.	.	H	α-helix	trans	-56.1	-41.6	177.3	-70.4	-14.2	0	0	0	112	D530 R538	D530-D534 WeakPolarHBondContact O-CB 3.23Å; D530-D534 VanDerWaalsContact O-CG 3.25Å; D530-D534 PolarHBondContact O-N 3.11Å; D534-R538 WeakPolarHBondContact O-CG 3.34Å; D534-R538 PolarHBondContact O-N 3.04Å; D534-R538 PolarHBondContact O-NE 2.8Å
535	A	94.9	Very high	93.9	Very high	4 Å²	4	57 Å²	57	3%	0.033	28%	0.277	C	S	.	.	H	α-helix	trans	-65.4	-43.9	178.2	0	0	0	0	0	112.2	F464 L518 K531 L532 Q533 R538	F464-A535 HydrophobicContact CE1-CB 4.47Å; L518-A535 HydrophobicContact CD2-CB 3.42Å; L518-A535 VanDerWaalsContact CD2-CB 3.42Å; K531-A535 VanDerWaalsContact O-CB 3.31Å; K531-A535 WeakPolarHBondContact O-CB 3.09Å; K531-A535 PolarHBondContact O-N 3.03Å; K531-A535 VanDerWaalsContact O-N 3.11Å; L532-A535 PolarHBondContact O-N 3.48Å; Q533-A535 VanDerWaalsContact C-N 3.27Å; Q533-A535 PolarHBondContact O-N 3.41Å; A535-R538 PolarHBondContact O-N 3.21Å
536	V	93.3	Very high	94.1	Very high	5 Å²	5	54.2 Å²	54.2	3%	0.03	26%	0.263	C	S	.	.	H	α-helix	trans	-71.1	-35.8	179.7	177.6	0	0	0	0	110.9	L353 Y378 L532 Q533 L539 F540	L353-V536 HydrophobicContact CD1-CG2 4.03Å; L353-V536 HydrophobicContact CD2-CG2 3.94Å; Y378-V536 HydrophobicContact CE1-CG1 3.98Å; Y378-V536 WeakPolarHBondContact OH-CG1 3.46Å; L532-V536 HydrophobicContact CD1-CG2 4.18Å; L532-V536 VanDerWaalsContact O-CG2 3.31Å; L532-V536 WeakPolarHBondContact O-CG2 3.42Å; L532-V536 PolarHBondContact O-N 3.2Å; Q533-V536 PolarHBondContact O-N 2.94Å; Q533-V536 VanDerWaalsContact O-N 3.12Å; V536-L539 WeakPolarHBondContact O-CB 3.44Å; V536-L539 PolarHBondContact O-N 2.92Å; V536-F540 HydrophobicContact CG1-CE2 4.07Å; V536-F540 WeakPolarHBondContact O-CD2 3.45Å; V536-F540 WeakPolarHBondContact O-CE2 3.16Å
537	E	92.3	Very high	94.1	Very high	77 Å²	77	50.8 Å²	50.8	36%	0.36	25%	0.245	S	C	.	.	H	α-helix	trans	-63.1	-41.1	174.9	-75.2	179.8	-173.1	0	0	112.3	Q533 L539 F540	Q533-E537 HydrophobicContact CG-CG 4.33Å; Q533-E537 VanDerWaalsContact CG-OE1 3.28Å; Q533-E537 WeakPolarHBondContact CG-OE1 3.46Å; Q533-E537 PolarHBondContact NE2-OE1 2.67Å; Q533-E537 WeakPolarHBondContact O-CB 3.42Å; Q533-E537 WeakPolarHBondContact O-CG 3.36Å; Q533-E537 PolarHBondContact O-N 2.87Å; E537-L539 PolarHBondContact O-N 2.79Å; E537-F540 WeakPolarHBondContact O-CB 3.43Å; E537-F540 PolarHBondContact O-N 3.09Å
538	R	93.8	Very high	93.9	Very high	119 Å²	119	46.4 Å²	46.4	45%	0.449	23%	0.229	S	C	.	.	H	α-helix	trans	-58.2	-31.2	175.9	-79.8	-174.6	-67.7	152.6	-3.5	113.8	D534 A535 F540 V541 E542	D534-R538 WeakPolarHBondContact O-CG 3.34Å; D534-R538 PolarHBondContact O-N 3.04Å; D534-R538 PolarHBondContact O-NE 2.8Å; A535-R538 PolarHBondContact O-N 3.21Å; R538-F540 PolarHBondContact O-N 3.23Å; R538-F540 VanDerWaalsContact O-N 3.1Å; R538-V541 WeakPolarHBondContact O-CG2 3.48Å; R538-V541 PolarHBondContact O-N 3.19Å; R538-V541 VanDerWaalsContact O-N 3.09Å; R538-E542 WeakPolarHBondContact CD-OE1 3.38Å; R538-E542 WeakPolarHBondContact O-CB 3.4Å; R538-E542 PolarHBondContact O-N 3.07Å
539	L	92.1	Very high	93.6	Very high	18 Å²	18	50.4 Å²	50.4	9%	0.094	26%	0.257	C	S	.	.	H	α-helix	trans	-59.4	-25.6	177.1	-57.1	173.6	0	0	0	112.8	F348 R350 F464 V536 E537 Q544	F348-L539 PolarHBondContact N-O 3.14Å; R350-L539 HydrophobicContact CG-CD1 3.97Å; F464-L539 HydrophobicContact CB-CD1 4.2Å; F464-L539 HydrophobicContact CD1-CD1 3.9Å; F464-L539 HydrophobicContact CD2-CD1 3.97Å; F464-L539 HydrophobicContact CD2-CD2 3.89Å; F464-L539 HydrophobicContact CE1-CD1 4.21Å; F464-L539 HydrophobicContact CE2-CD1 4.29Å; F464-L539 HydrophobicContact CE2-CD2 3.7Å; F464-L539 HydrophobicContact CG-CD1 3.76Å; F464-L539 HydrophobicContact CZ-CD1 4.39Å; F464-L539 HydrophobicContact CZ-CD2 4.19Å; V536-L539 WeakPolarHBondContact O-CB 3.44Å; V536-L539 PolarHBondContact O-N 2.92Å; E537-L539 PolarHBondContact O-N 2.79Å; L539-Q544 HydrophobicContact CD2-CG 4.26Å; L539-Q544 PolarHBondContact O-NE2 2.67Å
540	F	88.7	Confident	93.4	Very high	56 Å²	56	51.9 Å²	51.9	25%	0.246	26%	0.263	C	S	.	.	H	α-helix	trans	-85.5	-18.4	-179.3	-64	-86.6	0	0	0	113.8	P347 R349 R377 V536 E537 R538	P347-F540 VanDerWaalsContact CB-O 3.25Å; P347-F540 WeakPolarHBondContact CB-O 3.31Å; R349-F540 HydrophobicContact CB-CE1 3.72Å; R349-F540 HydrophobicContact CB-CZ 4.35Å; R349-F540 HydrophobicContact CG-CE1 3.68Å; R349-F540 HydrophobicContact CG-CZ 3.9Å; R377-F540 VanDerWaalsContact NH2-CE1 3.32Å; V536-F540 HydrophobicContact CG1-CE2 4.07Å; V536-F540 WeakPolarHBondContact O-CD2 3.45Å; V536-F540 WeakPolarHBondContact O-CE2 3.16Å; E537-F540 WeakPolarHBondContact O-CB 3.43Å; E537-F540 PolarHBondContact O-N 3.09Å; R538-F540 PolarHBondContact O-N 3.23Å; R538-F540 VanDerWaalsContact O-N 3.1Å
541	V	92.6	Very high	92.9	Very high	104 Å²	104	50.7 Å²	50.7	63%	0.63	26%	0.258	S	S	*	.	H	α-helix	trans	-116	-30.8	-173	-68.8	0	0	0	0	112.7	P347 R538	P347-V541 VanDerWaalsContact CG-O 3.26Å; P347-V541 WeakPolarHBondContact CG-O 3.45Å; R538-V541 WeakPolarHBondContact O-CG2 3.48Å; R538-V541 PolarHBondContact O-N 3.19Å; R538-V541 VanDerWaalsContact O-N 3.09Å
542	E	93.2	Very high	91.8	Very high	96 Å²	96	56.6 Å²	56.6	45%	0.449	28%	0.279	S	S	.	.	S	Bend	trans	-98.9	142.3	-177.7	-70.6	173.8	-168.1	0	0	111.6	R538	R538-E542 WeakPolarHBondContact CD-OE1 3.38Å; R538-E542 WeakPolarHBondContact O-CB 3.4Å; R538-E542 PolarHBondContact O-N 3.07Å
543	P	93.1	Very high	91.6	Very high	57 Å²	57	59.4 Å²	59.4	37%	0.37	29%	0.293	S	S	.	.			trans	-58.5	143.2	168.4	-24.5	35.6	0	0	0	111.3	R344 M345	R344-P543 HydrophobicContact CG-CB 4.23Å; M345-P543 CarbonylContact O-C 3.56Å; M345-P543 VanDerWaalsContact O-CA 3.3Å; M345-P543 WeakPolarHBondContact O-CA 3.36Å; M345-P543 WeakPolarHBondContact O-CB 3.17Å
544	Q	93.3	Very high	91.4	Very high	11 Å²	11	60.5 Å²	60.5	5%	0.051	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	142.9	-173.7	-66	178.8	57.5	0	0	111.5	M345 F348 L539	M345-Q544 PolarHBondContact N-O 2.99Å; M345-Q544 PolarHBondContact O-N 3.44Å; F348-Q544 HydrophobicContact CD1-CB 4.39Å; F348-Q544 HydrophobicContact CE1-CB 3.88Å; F348-Q544 HydrophobicContact CE1-CG 4.33Å; F348-Q544 PolarHBondContact O-NE2 3.36Å; L539-Q544 HydrophobicContact CD2-CG 4.26Å; L539-Q544 PolarHBondContact O-NE2 2.67Å
545	W	93.3	Very high	91.2	Very high	60 Å²	60	58.9 Å²	58.9	23%	0.227	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	123.6	168.4	-66.3	95.8	0	0	0	109.2	Y229 I258 V275 V342 A343 R344	Y229-W545 AromaticContact CD1-CH2 3.59Å; Y229-W545 HydrophobicContact CD1-CH2 3.59Å; Y229-W545 AromaticContact CD1-CZ3 3.89Å; Y229-W545 HydrophobicContact CD1-CZ3 3.89Å; Y229-W545 HydrophobicContact CD2-CH2 4.21Å; Y229-W545 AromaticContact CD2-CZ3 3.95Å; Y229-W545 HydrophobicContact CD2-CZ3 3.95Å; Y229-W545 AromaticContact CE1-CH2 3.9Å; Y229-W545 HydrophobicContact CE1-CH2 3.9Å; Y229-W545 HydrophobicContact CE2-CH2 4.5Å; Y229-W545 AromaticContact CG-CH2 3.75Å; Y229-W545 HydrophobicContact CG-CH2 3.75Å; Y229-W545 AromaticContact CG-CZ3 3.55Å; Y229-W545 HydrophobicContact CG-CZ3 3.55Å; I258-W545 HydrophobicContact CD1-CB 4.14Å; I258-W545 HydrophobicContact CD1-CD2 4.3Å; I258-W545 HydrophobicContact CD1-CG 3.95Å; I258-W545 HydrophobicContact CG1-CD2 4.12Å; I258-W545 HydrophobicContact CG1-CG 3.98Å; I258-W545 HydrophobicContact CG2-CD2 3.95Å; I258-W545 HydrophobicContact CG2-CE3 4.01Å; I258-W545 HydrophobicContact CG2-CH2 3.89Å; I258-W545 HydrophobicContact CG2-CZ2 3.87Å; I258-W545 HydrophobicContact CG2-CZ3 3.97Å; V275-W545 HydrophobicContact CG1-CZ2 4.21Å; V275-W545 HydrophobicContact CG2-CH2 4.37Å; V275-W545 HydrophobicContact CG2-CZ2 4.3Å; V342-W545 HydrophobicContact CB-CB 4.47Å; V342-W545 HydrophobicContact CB-CE3 4.17Å; V342-W545 HydrophobicContact CG2-CD2 4.43Å; V342-W545 HydrophobicContact CG2-CE3 3.66Å; V342-W545 HydrophobicContact CG2-CZ3 4.25Å; A343-W545 WeakPolarHBondContact O-CA 3.07Å; R344-W545 HydrophobicContact CB-CD2 4.12Å; R344-W545 HydrophobicContact CB-CE3 3.84Å; R344-W545 HydrophobicContact CB-CH2 3.66Å; R344-W545 HydrophobicContact CB-CZ2 3.89Å; R344-W545 HydrophobicContact CB-CZ3 3.62Å; R344-W545 HydrophobicContact CG-CD2 4.42Å; R344-W545 HydrophobicContact CG-CH2 4.32Å; R344-W545 HydrophobicContact CG-CZ2 4.04Å
546	V	94	Very high	91	Very high	4 Å²	4	62.2 Å²	62.2	2%	0.024	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	154.3	179.5	-63.6	0	0	0	0	110.1	V342 A343 M345 F348 V548 W550 V551	V342-V546 CarbonylContact C-O 3.6Å; V342-V546 WeakPolarHBondContact CA-O 3.42Å; V342-V546 WeakPolarHBondContact CB-O 3.34Å; A343-V546 PolarHBondContact N-O 3.3Å; A343-V546 PolarHBondContact O-N 3.33Å; M345-V546 HydrophobicContact CG-CG2 3.54Å; F348-V546 HydrophobicContact CE1-CG1 3.91Å; F348-V546 HydrophobicContact CZ-CG1 3.8Å; V546-V548 PolarHBondContact O-N 3.4Å; V546-W550 HydrophobicContact CB-CE3 3.98Å; V546-W550 HydrophobicContact CG1-CE3 4.2Å; V546-V551 HydrophobicContact CG2-CG2 3.62Å
547	P	93.9	Very high	90.8	Very high	10 Å²	10	65.8 Å²	65.8	7%	0.065	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-50	137.8	170	-26	33.9	0	0	0	111.8	E340 E341 S549 W550	E340-P547 HydrophobicContact CG-CB 4.43Å; E340-P547 HydrophobicContact CG-CG 4.42Å; E341-P547 WeakPolarHBondContact O-CA 3.48Å; P547-S549 PolarHBondContact O-N 3.02Å; P547-W550 HydrophobicContact CB-CD2 4.21Å; P547-W550 HydrophobicContact CB-CG 4.13Å; P547-W550 HydrophobicContact CG-CD2 3.87Å; P547-W550 HydrophobicContact CG-CE3 4.21Å; P547-W550 HydrophobicContact CG-CG 4.32Å; P547-W550 HydrophobicContact CG-CH2 4.21Å; P547-W550 HydrophobicContact CG-CZ2 3.92Å; P547-W550 HydrophobicContact CG-CZ3 4.31Å; P547-W550 WeakPolarHBondContact O-CB 3.22Å; P547-W550 PolarHBondContact O-N 2.75Å
548	V	91.4	Very high	90.7	Very high	35 Å²	35	65 Å²	65	21%	0.212	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-55.5	-36.5	176.7	164.6	0	0	0	0	111.4	E341 A343 V546 W550 V551 Y552	E341-V548 HydrophobicContact CB-CB 4.47Å; E341-V548 HydrophobicContact CB-CG2 4.12Å; E341-V548 HydrophobicContact CG-CB 4.45Å; E341-V548 HydrophobicContact CG-CG2 3.71Å; E341-V548 PolarHBondContact O-N 3.23Å; A343-V548 HydrophobicContact CB-CG2 4.24Å; V546-V548 PolarHBondContact O-N 3.4Å; V548-W550 PolarHBondContact O-N 3.49Å; V548-V551 PolarHBondContact O-N 3.2Å; V548-Y552 HydrophobicContact CB-CD2 4.46Å; V548-Y552 HydrophobicContact CG1-CD2 3.57Å; V548-Y552 HydrophobicContact CG1-CE2 4.21Å; V548-Y552 HydrophobicContact CG1-CG 4.44Å; V548-Y552 PolarHBondContact O-N 2.93Å
549	S	89	Confident	90.5	Very high	85 Å²	85	61.1 Å²	61.1	59%	0.594	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-64.5	-6.1	176.6	59.6	0	0	0	0	115	P547	P547-S549 PolarHBondContact O-N 3.02Å
550	W	91.9	Very high	90.4	Very high	33 Å²	33	64.5 Å²	64.5	13%	0.125	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-93.7	-10.3	173.5	-63.4	3.2	0	0	0	112.7	K457 A459 M462 P463 V546 P547 V548	K457-W550 HydrophobicContact CG-CH2 4.46Å; K457-W550 HydrophobicContact CG-CZ2 3.71Å; A459-W550 HydrophobicContact CB-CB 4.26Å; A459-W550 HydrophobicContact CB-CG 4.39Å; M462-W550 HydrophobicContact CB-CE3 4.28Å; M462-W550 HydrophobicContact CB-CZ3 4.5Å; M462-W550 HydrophobicContact CG-CD2 4.33Å; M462-W550 HydrophobicContact CG-CE3 4Å; P463-W550 HydrophobicContact CG-CH2 3.95Å; P463-W550 HydrophobicContact CG-CZ2 4.31Å; V546-W550 HydrophobicContact CB-CE3 3.98Å; V546-W550 HydrophobicContact CG1-CE3 4.2Å; P547-W550 HydrophobicContact CB-CD2 4.21Å; P547-W550 HydrophobicContact CB-CG 4.13Å; P547-W550 HydrophobicContact CG-CD2 3.87Å; P547-W550 HydrophobicContact CG-CE3 4.21Å; P547-W550 HydrophobicContact CG-CG 4.32Å; P547-W550 HydrophobicContact CG-CH2 4.21Å; P547-W550 HydrophobicContact CG-CZ2 3.92Å; P547-W550 HydrophobicContact CG-CZ3 4.31Å; P547-W550 WeakPolarHBondContact O-CB 3.22Å; P547-W550 PolarHBondContact O-N 2.75Å; V548-W550 PolarHBondContact O-N 3.49Å
551	V	85.3	Confident	90.5	Very high	54 Å²	54	65.2 Å²	65.2	33%	0.327	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.8	-42.6	-173.6	-177.2	0	0	0	0	111.5	A343 M345 V546 V548	A343-V551 HydrophobicContact CB-CG2 4.12Å; M345-V551 HydrophobicContact CE-CG1 4.41Å; M345-V551 HydrophobicContact CE-CG2 4.31Å; M345-V551 HydrophobicContact CG-CG2 3.99Å; M345-V551 HydrophobicContact SD-CG1 3.93Å; M345-V551 HydrophobicContact SD-CG2 3.68Å; V546-V551 HydrophobicContact CG2-CG2 3.62Å; V548-V551 PolarHBondContact O-N 3.2Å
552	Y	75.1	Confident	90.3	Very high	233 Å²	233	61.6 Å²	61.6	91%	0.914	31%	0.305	S	S	*	.			trans	-107.4	0	-174	-59.8	-81.3	0	0	0	112.9	A343 V548	A343-Y552 HydrophobicContact CB-CE2 4.37Å; V548-Y552 HydrophobicContact CB-CD2 4.46Å; V548-Y552 HydrophobicContact CG1-CD2 3.57Å; V548-Y552 HydrophobicContact CG1-CE2 4.21Å; V548-Y552 HydrophobicContact CG1-CG 4.44Å; V548-Y552 PolarHBondContact O-N 2.93Å

Retrieved 552 of 552 residues in 153.3 ms (Link to these results)

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