A0A087XGU8_POEFO Loading...

DDB1 and CUL4 associated factor 15

AlphaFold DB , UniProt , Accession A0A087XGU8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 642 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	30.6	Very low	30.4	Very low	249 Å²	249	147.9 Å²	147.9	100%	1.227	83%	0.825	S	S	*	*				0	130.5	0	-66.7	-162.1	-75.7	0	0	108.4
2	A	24.5	Very low	30.2	Very low	95 Å²	95	142.8 Å²	142.8	79%	0.785	81%	0.806	S	S	*	*			trans	-107.3	137.9	178.3	0	0	0	0	0	110	S4	A2-S4 PolarHBondContact O-N 2.73Å
3	P	31.6	Very low	31	Very low	131 Å²	131	147 Å²	147	85%	0.851	81%	0.81	S	S	*	*			trans	-74.2	122.3	176.2	29.4	-32.1	0	0	0	110.5
4	S	28	Very low	31.2	Very low	101 Å²	101	149.6 Å²	149.6	71%	0.706	81%	0.814	S	S	*	*			trans	-85.1	117.1	172	146.5	0	0	0	0	110	A2	A2-S4 PolarHBondContact O-N 2.73Å
5	S	29.9	Very low	31.7	Very low	118 Å²	118	152.9 Å²	152.9	83%	0.825	82%	0.817	S	S	*	*			trans	-110.3	90.4	164	45.5	0	0	0	0	110.5	S7	S5-S7 PolarHBondContact O-N 2.9Å
6	K	31.7	Very low	31.8	Very low	193 Å²	193	151.4 Å²	151.4	84%	0.839	82%	0.815	S	S	*	*			trans	-70.2	108.9	162.5	-70	177.9	178.8	175.9	0	107.9
7	S	30.6	Very low	32.2	Very low	114 Å²	114	149.4 Å²	149.4	80%	0.797	81%	0.812	S	S	*	*			trans	-82.6	136.3	161.9	56.6	0	0	0	0	109.4	S5	S5-S7 PolarHBondContact O-N 2.9Å
8	E	28.7	Very low	32.8	Very low	193 Å²	193	154.7 Å²	154.7	90%	0.902	82%	0.819	S	S	*	*			trans	-68.3	163.1	-172.8	-69.8	173.9	117.7	0	0	113.9	D10	E8-D10 PolarHBondContact O-N 2.95Å
9	K	34.7	Very low	33.8	Very low	174 Å²	174	156.9 Å²	156.9	76%	0.757	82%	0.821	S	S	*	*			trans	-92.6	91.4	-167	-174.1	-168.1	178.2	-144.1	0	110.2	D11	K9-D11 VanDerWaalsContact CE-OD2 3.22Å; K9-D11 WeakPolarHBondContact CE-OD2 3.37Å; K9-D11 IonicContact NZ-OD2 2.74Å; K9-D11 PolarHBondContact NZ-OD2 3.11Å; K9-D11 PolarHBondContact O-N 3.15Å
10	D	27.7	Very low	34.8	Very low	145 Å²	145	156.8 Å²	156.8	78%	0.775	82%	0.815	S	S	*	*			trans	-83.2	99.2	177.7	-154.2	-9.9	0	0	0	110.6	E8 S12	E8-D10 PolarHBondContact O-N 2.95Å; D10-S12 PolarHBondContact O-N 3.37Å
11	D	35.9	Very low	36.3	Very low	114 Å²	114	156.7 Å²	156.7	61%	0.61	81%	0.809	S	S	*	*			trans	-78.8	62.3	-173.7	-109.6	-51.3	0	0	0	111.7	K9	K9-D11 VanDerWaalsContact CE-OD2 3.22Å; K9-D11 WeakPolarHBondContact CE-OD2 3.37Å; K9-D11 IonicContact NZ-OD2 2.74Å; K9-D11 PolarHBondContact NZ-OD2 3.11Å; K9-D11 PolarHBondContact O-N 3.15Å
12	S	28.1	Very low	38.6	Very low	86 Å²	86	148.7 Å²	148.7	60%	0.601	77%	0.771	S	S	*	*			trans	-112.8	83.1	172.3	59	0	0	0	0	111.9	D10 Q14	D10-S12 PolarHBondContact O-N 3.37Å; S12-Q14 PolarHBondContact O-N 3.17Å
13	K	40.9	Very low	41.6	Very low	198 Å²	198	149.8 Å²	149.8	86%	0.861	76%	0.759	S	S	*	*			trans	-69.8	65.9	171.8	-78.1	-177.9	179.6	169.3	0	112.4	K15	K13-K15 PolarHBondContact O-N 3.44Å; K13-K15 VanDerWaalsContact O-N 3.09Å
14	Q	34.3	Very low	44.3	Very low	183 Å²	183	145.6 Å²	145.6	86%	0.855	73%	0.731	S	S	*	*			trans	-65.2	108.6	162.3	-125.2	-178.1	20	0	0	108	S12 T16	S12-Q14 PolarHBondContact O-N 3.17Å; Q14-T16 PolarHBondContact O-N 2.92Å
15	K	37.7	Very low	47.2	Very low	199 Å²	199	144.8 Å²	144.8	87%	0.865	72%	0.722	S	S	*	*			trans	-54.4	114.9	171.4	-75.8	175.7	177.7	170.2	0	107.7	K13	K13-K15 PolarHBondContact O-N 3.44Å; K13-K15 VanDerWaalsContact O-N 3.09Å
16	T	34.1	Very low	50	Low	129 Å²	129	145 Å²	145	79%	0.791	71%	0.708	S	S	*	*			trans	-53.9	126.6	175.1	42.4	0	0	0	0	108.5	Q14 R18	Q14-T16 PolarHBondContact O-N 2.92Å; T16-R18 PolarHBondContact O-N 3.31Å
17	P	37.6	Very low	52.7	Low	117 Å²	117	136.5 Å²	136.5	76%	0.76	67%	0.671	S	S	*	*			trans	-60.4	128.4	-174.9	22.3	-32.2	0	0	0	108.7	K19	P17-K19 PolarHBondContact O-N 3.46Å
18	R	44	Very low	55.6	Low	246 Å²	246	134.5 Å²	134.5	93%	0.928	65%	0.652	S	S	*	*			trans	-49.8	105.9	174.3	-82.9	179.4	165.9	174.5	-5	107.7	T16 H20	T16-R18 PolarHBondContact O-N 3.31Å; R18-H20 PolarHBondContact O-N 3.08Å
19	K	52	Low	58.6	Low	197 Å²	197	129 Å²	129	86%	0.857	63%	0.631	S	S	*	*			trans	-50.5	112	-179.1	-76.4	178.9	177.3	172.3	0	107.9	P17 K21	P17-K19 PolarHBondContact O-N 3.46Å; K19-K21 PolarHBondContact O-N 3.39Å
20	H	53.2	Low	61.1	Low	154 Å²	154	128 Å²	128	71%	0.713	62%	0.622	S	S	*	*			trans	-61.1	105.7	-174.9	-160.3	70.9	0	0	0	107.3	R18 D22	R18-H20 PolarHBondContact O-N 3.08Å; H20-D22 PolarHBondContact O-N 3.08Å
21	K	66.7	Low	64	Low	155 Å²	155	121.2 Å²	121.2	67%	0.674	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-70.4	117.1	177.5	-74	-171.1	177.5	-174.9	0	106.8	K19 H23	K19-K21 PolarHBondContact O-N 3.39Å; K21-H23 PolarHBondContact O-N 3.06Å
22	D	77.9	Confident	66.5	Low	81 Å²	81	123.7 Å²	123.7	43%	0.433	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-55.8	124.8	178.6	-71.9	-48.7	0	0	0	110.1	H20 L27 L45	H20-D22 PolarHBondContact O-N 3.08Å; D22-L27 HydrophobicContact CB-CD1 3.96Å; D22-L27 HydrophobicContact CB-CD2 3.86Å; D22-L27 HydrophobicContact CB-CG 3.78Å; D22-L45 WeakPolarHBondContact O-CD2 3.34Å
23	H	87.2	Confident	69.5	Low	117 Å²	117	126.6 Å²	126.6	54%	0.542	60%	0.6	S	S	.	*	P	Polyproline II helix	trans	-64.2	140.9	179.9	-170.3	-106.8	0	0	0	110.2	K21 V25 K26 L27	K21-H23 PolarHBondContact O-N 3.06Å; H23-V25 PolarHBondContact ND1-N 2.98Å; H23-V25 PolarHBondContact O-N 3.35Å; H23-V25 VanDerWaalsContact O-N 3.13Å; H23-K26 HydrophobicContact CB-CB 4.49Å; H23-K26 HydrophobicContact CB-CD 4.24Å; H23-K26 HydrophobicContact CB-CG 4.15Å; H23-K26 WeakPolarHBondContact O-CA 3.5Å; H23-K26 WeakPolarHBondContact O-CB 3.27Å; H23-K26 PolarHBondContact O-N 3.15Å; H23-L27 PolarHBondContact O-N 3.3Å; H23-L27 VanDerWaalsContact O-N 3.14Å
24	V	88.9	Confident	71.8	Confident	43 Å²	43	119.9 Å²	119.9	26%	0.261	58%	0.578	S	S	.	*	H	α-helix	trans	-49.9	-46	-176.4	-178.8	0	0	0	0	111.8	K26 L27 L28 L45 R48	V24-K26 VanDerWaalsContact C-N 3.34Å; V24-K26 PolarHBondContact O-N 3.32Å; V24-L27 PolarHBondContact O-N 2.96Å; V24-L28 HydrophobicContact CG1-CD1 4.02Å; V24-L28 HydrophobicContact CG1-CG 4.43Å; V24-L28 WeakPolarHBondContact O-CG 3.41Å; V24-L28 PolarHBondContact O-N 3.41Å; V24-L45 HydrophobicContact CG2-CD1 4.07Å; V24-L45 HydrophobicContact CG2-CD2 4.14Å; V24-R48 VanDerWaalsContact CG1-NH1 3.27Å
25	V	89.4	Confident	74.4	Confident	84 Å²	84	114 Å²	114	51%	0.509	57%	0.566	S	S	.	*	H	α-helix	trans	-63.2	-38.2	179.4	-178.5	0	0	0	0	111.8	H23 L27 L28 V29	H23-V25 PolarHBondContact ND1-N 2.98Å; H23-V25 PolarHBondContact O-N 3.35Å; H23-V25 VanDerWaalsContact O-N 3.13Å; V25-L27 PolarHBondContact O-N 3.08Å; V25-L28 PolarHBondContact O-N 3.3Å; V25-V29 HydrophobicContact CG1-CG2 4.31Å; V25-V29 WeakPolarHBondContact O-CB 3.44Å; V25-V29 VanDerWaalsContact O-CG2 3.32Å; V25-V29 WeakPolarHBondContact O-CG2 3.44Å; V25-V29 PolarHBondContact O-N 3.19Å
26	K	89.4	Confident	76.6	Confident	123 Å²	123	111 Å²	111	54%	0.535	56%	0.555	S	S	.	*	H	α-helix	trans	-63.9	-41.2	176.4	-68	-178.2	178.2	-177.3	0	111.2	H23 V24 R30	H23-K26 HydrophobicContact CB-CB 4.49Å; H23-K26 HydrophobicContact CB-CD 4.24Å; H23-K26 HydrophobicContact CB-CG 4.15Å; H23-K26 WeakPolarHBondContact O-CA 3.5Å; H23-K26 WeakPolarHBondContact O-CB 3.27Å; H23-K26 PolarHBondContact O-N 3.15Å; V24-K26 VanDerWaalsContact C-N 3.34Å; V24-K26 PolarHBondContact O-N 3.32Å; K26-R30 VanDerWaalsContact O-CB 3.3Å; K26-R30 WeakPolarHBondContact O-CB 3.49Å; K26-R30 PolarHBondContact O-N 3.15Å
27	L	88.2	Confident	78.9	Confident	14 Å²	14	110.5 Å²	110.5	7%	0.073	54%	0.542	C	S	.	.	H	α-helix	trans	-66.9	-39.2	176	-68.4	170.9	0	0	0	112.3	D22 H23 V24 V25 R30 G31 F42 L45	D22-L27 HydrophobicContact CB-CD1 3.96Å; D22-L27 HydrophobicContact CB-CD2 3.86Å; D22-L27 HydrophobicContact CB-CG 3.78Å; H23-L27 PolarHBondContact O-N 3.3Å; H23-L27 VanDerWaalsContact O-N 3.14Å; V24-L27 PolarHBondContact O-N 2.96Å; V25-L27 PolarHBondContact O-N 3.08Å; L27-R30 PolarHBondContact O-N 3.23Å; L27-G31 PolarHBondContact O-N 2.84Å; L27-F42 HydrophobicContact CB-CD1 4.36Å; L27-F42 HydrophobicContact CB-CE1 3.87Å; L27-F42 HydrophobicContact CD1-CD1 4.28Å; L27-L45 HydrophobicContact CD1-CD1 3.93Å; L27-L45 HydrophobicContact CD1-CD2 4.12Å; L27-L45 HydrophobicContact CD1-CG 4.13Å
28	L	90.4	Very high	81	Confident	73 Å²	73	107.3 Å²	107.3	38%	0.382	52%	0.523	S	S	.	.	H	α-helix	trans	-67.4	-43.3	176	-69.8	173	0	0	0	112.4	V24 V25 G31 K32 F37 F42	V24-L28 HydrophobicContact CG1-CD1 4.02Å; V24-L28 HydrophobicContact CG1-CG 4.43Å; V24-L28 WeakPolarHBondContact O-CG 3.41Å; V24-L28 PolarHBondContact O-N 3.41Å; V25-L28 PolarHBondContact O-N 3.3Å; L28-G31 PolarHBondContact O-N 2.98Å; L28-K32 WeakPolarHBondContact O-CG 3.29Å; L28-K32 PolarHBondContact O-N 2.95Å; L28-F37 HydrophobicContact CD2-CE1 4.26Å; L28-F42 HydrophobicContact CD2-CE1 4.15Å; L28-F42 HydrophobicContact CD2-CZ 4.07Å
29	V	91.1	Very high	82.6	Confident	76 Å²	76	99.6 Å²	99.6	46%	0.461	50%	0.497	S	S	.	.	H	α-helix	trans	-62	-45.1	174.3	170.3	0	0	0	0	110.4	V25 G31 K32 L33	V25-V29 HydrophobicContact CG1-CG2 4.31Å; V25-V29 WeakPolarHBondContact O-CB 3.44Å; V25-V29 VanDerWaalsContact O-CG2 3.32Å; V25-V29 WeakPolarHBondContact O-CG2 3.44Å; V25-V29 PolarHBondContact O-N 3.19Å; V29-G31 PolarHBondContact O-N 3.46Å; V29-K32 PolarHBondContact O-N 2.92Å; V29-L33 HydrophobicContact CG1-CD1 3.88Å; V29-L33 HydrophobicContact CG1-CG 4.45Å; V29-L33 WeakPolarHBondContact O-CG 3.4Å; V29-L33 PolarHBondContact O-N 2.7Å
30	R	88	Confident	83.9	Confident	155 Å²	155	97 Å²	97	59%	0.585	48%	0.482	S	S	*	.	H	α-helix	trans	-57.5	-47	174.3	-178	178.9	177.2	176.9	0.6	112	K26 L27 K32 L33 S34	K26-R30 VanDerWaalsContact O-CB 3.3Å; K26-R30 WeakPolarHBondContact O-CB 3.49Å; K26-R30 PolarHBondContact O-N 3.15Å; L27-R30 PolarHBondContact O-N 3.23Å; R30-K32 PolarHBondContact O-N 3.01Å; R30-L33 PolarHBondContact O-N 2.98Å; R30-S34 PolarHBondContact O-N 3.31Å; R30-S34 PolarHBondContact O-OG 2.89Å; R30-S34 VanDerWaalsContact O-OG 3.07Å
31	G	87.9	Confident	85.3	Confident	1 Å²	1	92.5 Å²	92.5	1%	0.01	46%	0.463	C	S	.	.	H	α-helix	trans	-62.6	-38	178.1	0	0	0	0	0	113.3	L27 L28 V29 G35 Q36 F37	L27-G31 PolarHBondContact O-N 2.84Å; L28-G31 PolarHBondContact O-N 2.98Å; V29-G31 PolarHBondContact O-N 3.46Å; G31-G35 CarbonylContact O-C 3.51Å; G31-G35 WeakPolarHBondContact O-CA 3.2Å; G31-G35 PolarHBondContact O-N 3.05Å; G31-Q36 PolarHBondContact O-N 2.8Å; G31-F37 VanDerWaalsContact C-CE2 3.48Å; G31-F37 WeakPolarHBondContact O-CE2 3.44Å
32	K	90.3	Very high	86.1	Confident	167 Å²	167	86.6 Å²	86.6	73%	0.726	44%	0.437	S	S	*	.	H	α-helix	trans	-63.5	-43	172.4	-74.5	-172	176.8	-170.7	0	112.2	L28 V29 R30 F37	L28-K32 WeakPolarHBondContact O-CG 3.29Å; L28-K32 PolarHBondContact O-N 2.95Å; V29-K32 PolarHBondContact O-N 2.92Å; R30-K32 PolarHBondContact O-N 3.01Å; K32-F37 HydrophobicContact CG-CZ 4.01Å
33	L	90.6	Very high	86.3	Confident	147 Å²	147	86.9 Å²	86.9	77%	0.77	43%	0.432	S	S	*	.	H	α-helix	trans	-73.8	-34.1	-178.1	-68.5	171.7	0	0	0	113.3	V29 R30	V29-L33 HydrophobicContact CG1-CD1 3.88Å; V29-L33 HydrophobicContact CG1-CG 4.45Å; V29-L33 WeakPolarHBondContact O-CG 3.4Å; V29-L33 PolarHBondContact O-N 2.7Å; R30-L33 PolarHBondContact O-N 2.98Å
34	S	89	Confident	86.2	Confident	57 Å²	57	89.2 Å²	89.2	40%	0.399	44%	0.441	S	S	.	.	H	α-helix	trans	-92.6	-8.7	179.1	68.1	0	0	0	0	114.4	R30 Q36	R30-S34 PolarHBondContact O-N 3.31Å; R30-S34 PolarHBondContact O-OG 2.89Å; R30-S34 VanDerWaalsContact O-OG 3.07Å; S34-Q36 PolarHBondContact O-N 3.4Å; S34-Q36 VanDerWaalsContact O-N 3.14Å; S34-Q36 PolarHBondContact OG-N 2.86Å
35	G	88	Confident	86	Confident	60 Å²	60	88.6 Å²	88.6	62%	0.619	44%	0.436	S	S	*	.			trans	66.9	1	-169.1	0	0	0	0	0	114.6	G31	G31-G35 CarbonylContact O-C 3.51Å; G31-G35 WeakPolarHBondContact O-CA 3.2Å; G31-G35 PolarHBondContact O-N 3.05Å
36	Q	83.9	Confident	85.9	Confident	135 Å²	135	88.4 Å²	88.4	63%	0.631	44%	0.437	S	S	*	.			trans	-100.7	101	-171.9	-66.8	176.4	-6.3	0	0	111.7	G31 S34 L41	G31-Q36 PolarHBondContact O-N 2.8Å; S34-Q36 PolarHBondContact O-N 3.4Å; S34-Q36 VanDerWaalsContact O-N 3.14Å; S34-Q36 PolarHBondContact OG-N 2.86Å; Q36-L41 VanDerWaalsContact O-CD1 3.25Å; Q36-L41 WeakPolarHBondContact O-CD1 3.5Å
37	F	82.5	Confident	85.9	Confident	118 Å²	118	84.2 Å²	84.2	52%	0.518	42%	0.422	S	S	.	.			trans	-103.7	106.1	167.1	-69.1	-85.2	0	0	0	110.1	L28 G31 K32 F42	L28-F37 HydrophobicContact CD2-CE1 4.26Å; G31-F37 VanDerWaalsContact C-CE2 3.48Å; G31-F37 WeakPolarHBondContact O-CE2 3.44Å; K32-F37 HydrophobicContact CG-CZ 4.01Å; F37-F42 HydrophobicContact CD1-CE2 4.4Å; F37-F42 HydrophobicContact CD1-CZ 4.26Å
38	S	81.3	Confident	85.9	Confident	51 Å²	51	88.9 Å²	88.9	36%	0.357	44%	0.438	S	S	.	.			trans	-125	137.5	172.4	-179.3	0	0	0	0	109.9	R40 L41 F42	S38-R40 PolarHBondContact O-N 3.14Å; S38-R40 VanDerWaalsContact O-N 3.08Å; S38-R40 PolarHBondContact OG-N 3.15Å; S38-L41 WeakPolarHBondContact O-CB 3.14Å; S38-L41 PolarHBondContact O-N 3.34Å; S38-F42 WeakPolarHBondContact O-CD2 3.46Å
39	Q	78.4	Confident	86	Confident	83 Å²	83	87.2 Å²	87.2	39%	0.388	43%	0.431	S	S	.	.	H	α-helix	trans	-50.3	-33.5	170.8	-71.6	163.4	-32.6	0	0	112	L41 F42 R43 D635	Q39-L41 PolarHBondContact O-N 3.2Å; Q39-F42 PolarHBondContact O-N 2.8Å; Q39-R43 PolarHBondContact O-N 3.11Å; Q39-R43 VanDerWaalsContact O-N 3.16Å; Q39-D635 VanDerWaalsContact NE2-CB 3.3Å; Q39-D635 PolarHBondContact NE2-O 3.15Å
40	R	79.9	Confident	86.2	Confident	143 Å²	143	86.6 Å²	86.6	54%	0.54	43%	0.43	S	S	.	.	H	α-helix	trans	-57.6	-30.2	177.6	-62.5	-174.4	177.8	-170.5	-3.5	113.1	S38 F42	S38-R40 PolarHBondContact O-N 3.14Å; S38-R40 VanDerWaalsContact O-N 3.08Å; S38-R40 PolarHBondContact OG-N 3.15Å; R40-F42 VanDerWaalsContact C-N 3.34Å
41	L	81.6	Confident	86.5	Confident	59 Å²	59	79.2 Å²	79.2	31%	0.309	40%	0.402	S	S	.	.	H	α-helix	trans	-69.4	-31.8	175.5	-62.7	171.5	0	0	0	112.2	Q36 S38 Q39	Q36-L41 VanDerWaalsContact O-CD1 3.25Å; Q36-L41 WeakPolarHBondContact O-CD1 3.5Å; S38-L41 WeakPolarHBondContact O-CB 3.14Å; S38-L41 PolarHBondContact O-N 3.34Å; Q39-L41 PolarHBondContact O-N 3.2Å
42	F	83.9	Confident	86.8	Confident	31 Å²	31	81.5 Å²	81.5	14%	0.136	42%	0.417	C	S	.	.	H	α-helix	trans	-93.9	-12.3	-174.7	-58.5	-71.6	0	0	0	113.6	L27 L28 F37 S38 Q39 R40 K44 L45	L27-F42 HydrophobicContact CB-CD1 4.36Å; L27-F42 HydrophobicContact CB-CE1 3.87Å; L27-F42 HydrophobicContact CD1-CD1 4.28Å; L28-F42 HydrophobicContact CD2-CE1 4.15Å; L28-F42 HydrophobicContact CD2-CZ 4.07Å; F37-F42 HydrophobicContact CD1-CE2 4.4Å; F37-F42 HydrophobicContact CD1-CZ 4.26Å; S38-F42 WeakPolarHBondContact O-CD2 3.46Å; Q39-F42 PolarHBondContact O-N 2.8Å; R40-F42 VanDerWaalsContact C-N 3.34Å; F42-K44 PolarHBondContact O-N 3.05Å; F42-L45 HydrophobicContact CB-CD1 4.21Å; F42-L45 HydrophobicContact CD1-CD1 3.77Å; F42-L45 HydrophobicContact CG-CD1 4.49Å; F42-L45 VanDerWaalsContact O-CB 3.3Å; F42-L45 WeakPolarHBondContact O-CB 3.47Å; F42-L45 WeakPolarHBondContact O-CG 3.35Å; F42-L45 PolarHBondContact O-N 3.25Å
43	R	82.5	Confident	86.9	Confident	88 Å²	88	74.1 Å²	74.1	33%	0.332	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-20.4	-178.7	-80.2	-176.5	179	164	1.4	116.7	Q39 Q311	Q39-R43 PolarHBondContact O-N 3.11Å; Q39-R43 VanDerWaalsContact O-N 3.16Å; R43-Q311 VanDerWaalsContact NE-OE1 3.14Å
44	K	84.1	Confident	86.9	Confident	165 Å²	165	74.6 Å²	74.6	72%	0.717	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-5.1	178.3	-69.1	-178.8	-179.2	171.1	0	113.9	F42	F42-K44 PolarHBondContact O-N 3.05Å
45	L	85.3	Confident	87.1	Confident	30 Å²	30	76.4 Å²	76.4	16%	0.157	39%	0.386	C	S	.	.	S	Bend	trans	-85.4	157.8	178.2	-61.6	175.8	0	0	0	111.1	D22 V24 L27 F42	D22-L45 WeakPolarHBondContact O-CD2 3.34Å; V24-L45 HydrophobicContact CG2-CD1 4.07Å; V24-L45 HydrophobicContact CG2-CD2 4.14Å; L27-L45 HydrophobicContact CD1-CD1 3.93Å; L27-L45 HydrophobicContact CD1-CD2 4.12Å; L27-L45 HydrophobicContact CD1-CG 4.13Å; F42-L45 HydrophobicContact CB-CD1 4.21Å; F42-L45 HydrophobicContact CD1-CD1 3.77Å; F42-L45 HydrophobicContact CG-CD1 4.49Å; F42-L45 VanDerWaalsContact O-CB 3.3Å; F42-L45 WeakPolarHBondContact O-CB 3.47Å; F42-L45 WeakPolarHBondContact O-CG 3.35Å; F42-L45 PolarHBondContact O-N 3.25Å
46	P	88	Confident	87.4	Confident	81 Å²	81	73.5 Å²	73.5	53%	0.526	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-57.7	161.6	164.1	-20.6	33.7	0	0	0	112.1
47	P	88.6	Confident	87.7	Confident	34 Å²	34	67.5 Å²	67.5	22%	0.221	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-52.2	150.1	167.3	26.7	-38.4	0	0	0	111.5	C50 C637 W639	P47-C50 WeakPolarHBondContact CG-SG 3.25Å; P47-C637 CarbonylContact C-O 3.34Å; P47-C637 WeakPolarHBondContact CA-O 3.11Å; P47-C637 WeakPolarHBondContact CB-O 3.5Å; P47-W639 HydrophobicContact CB-CB 4.49Å; P47-W639 HydrophobicContact CB-CD2 3.85Å; P47-W639 HydrophobicContact CB-CE3 4.45Å; P47-W639 HydrophobicContact CB-CG 3.85Å; P47-W639 HydrophobicContact CG-CD2 3.62Å; P47-W639 HydrophobicContact CG-CE3 3.74Å; P47-W639 HydrophobicContact CG-CG 4.11Å; P47-W639 HydrophobicContact CG-CH2 4.28Å; P47-W639 HydrophobicContact CG-CZ2 4.18Å; P47-W639 HydrophobicContact CG-CZ3 4.07Å
48	R	88.3	Confident	88	Confident	112 Å²	112	63.2 Å²	63.2	42%	0.423	31%	0.314	S	S	.	.	S	Bend	trans	-78.6	-37.5	177.5	-61.1	-55.4	-171	-178.9	5.1	112	V24 C637	V24-R48 VanDerWaalsContact CG1-NH1 3.27Å; R48-C637 HydrophobicContact CB-CB 4.45Å; R48-C637 HydrophobicContact CG-CB 3.83Å; R48-C637 PolarHBondContact N-O 3.33Å
49	V	93.1	Very high	88.1	Confident	38 Å²	38	66.7 Å²	66.7	23%	0.23	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	133.9	-177.7	-174.4	0	0	0	0	108.2	V51 L105 T638 W639	V49-V51 HydrophobicContact CG1-CG2 3.77Å; V49-L105 HydrophobicContact CG1-CD2 4.43Å; V49-T638 HydrophobicContact CB-CG2 4.33Å; V49-T638 WeakPolarHBondContact O-CA 3.46Å; V49-W639 PolarHBondContact O-N 3.02Å
50	C	94.7	Very high	88.5	Confident	64 Å²	64	69.8 Å²	69.8	43%	0.432	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	129.6	169.2	-64.7	0	0	0	0	107.8	P47 W639 V641	P47-C50 WeakPolarHBondContact CG-SG 3.25Å; C50-W639 CarbonylContact C-O 3.57Å; C50-W639 WeakPolarHBondContact CA-O 3.42Å; C50-V641 HydrophobicContact CB-CG2 4.48Å
51	V	94.6	Very high	88.8	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	121.2	-178.6	-168.8	0	0	0	0	109.1	V49 I56 W639 I640 V641	V49-V51 HydrophobicContact CG1-CG2 3.77Å; V51-I56 HydrophobicContact CG1-CD1 4.15Å; V51-I56 HydrophobicContact CG1-CG1 4.42Å; V51-I56 HydrophobicContact CG1-CG2 3.54Å; V51-W639 PolarHBondContact N-O 3.15Å; V51-I640 CarbonylContact O-C 3.59Å; V51-I640 VanDerWaalsContact O-CA 3.25Å; V51-I640 WeakPolarHBondContact O-CA 3.45Å; V51-V641 PolarHBondContact O-N 3.08Å
52	P	93.5	Very high	88.9	Confident	49 Å²	49	66 Å²	66	32%	0.318	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	132.7	172.1	-20.1	33	0	0	0	110.8	K54 N55 V641	P52-K54 VanDerWaalsContact C-N 3.28Å; P52-K54 HydrophobicContact CB-CG 4.01Å; P52-K54 PolarHBondContact O-N 2.84Å; P52-N55 WeakPolarHBondContact O-CB 3.49Å; P52-N55 PolarHBondContact O-N 2.85Å; P52-V641 CarbonylContact C-O 3.48Å; P52-V641 WeakPolarHBondContact CA-O 3.21Å
53	L	92.5	Very high	89	Confident	12 Å²	12	74 Å²	74	6%	0.063	36%	0.356	C	S	.	.	H	α-helix	trans	-54.1	-46.1	179.6	-174.6	79.2	0	0	0	111.2	N55 I56 V57 L62 F68 I640 V641 L642	L53-N55 PolarHBondContact O-N 2.85Å; L53-I56 VanDerWaalsContact O-CG1 3.29Å; L53-I56 WeakPolarHBondContact O-CG1 3.15Å; L53-I56 PolarHBondContact O-N 3.06Å; L53-V57 HydrophobicContact CD1-CG2 3.5Å; L53-V57 HydrophobicContact CD2-CG2 4.4Å; L53-V57 HydrophobicContact CG-CB 4.45Å; L53-V57 HydrophobicContact CG-CG2 3.6Å; L53-V57 PolarHBondContact O-N 2.92Å; L53-L62 HydrophobicContact CD2-CD2 4.1Å; L53-F68 HydrophobicContact CD1-CD1 4.26Å; L53-F68 HydrophobicContact CD1-CD2 4.12Å; L53-F68 HydrophobicContact CD1-CE1 4.29Å; L53-F68 HydrophobicContact CD1-CE2 4.15Å; L53-F68 HydrophobicContact CD1-CG 4.19Å; L53-F68 HydrophobicContact CD1-CZ 4.24Å; L53-F68 HydrophobicContact CD2-CD2 3.87Å; L53-F68 HydrophobicContact CD2-CE2 3.96Å; L53-I640 HydrophobicContact CB-CG2 3.95Å; L53-I640 HydrophobicContact CD1-CG2 3.77Å; L53-V641 WeakPolarHBondContact CB-O 3.48Å; L53-V641 PolarHBondContact N-O 3.36Å; L53-L642 HydrophobicContact CB-CD2 4.19Å; L53-L642 HydrophobicContact CD1-CD2 3.95Å; L53-L642 HydrophobicContact CD2-CD2 3.73Å; L53-L642 HydrophobicContact CG-CD2 4.16Å
54	K	91.4	Very high	89.2	Confident	156 Å²	156	72.2 Å²	72.2	68%	0.678	36%	0.36	S	S	*	.	H	α-helix	trans	-55.2	-19.5	176.3	70	178.4	-173.8	177.5	0	115.4	P52	P52-K54 VanDerWaalsContact C-N 3.28Å; P52-K54 HydrophobicContact CB-CG 4.01Å; P52-K54 PolarHBondContact O-N 2.84Å
55	N	92.8	Very high	89.4	Confident	95 Å²	95	66.4 Å²	66.4	51%	0.508	35%	0.347	S	S	.	.	H	α-helix	trans	-87.2	-21	177.5	-67.2	12.5	0	0	0	112.3	P52 L53	P52-N55 WeakPolarHBondContact O-CB 3.49Å; P52-N55 PolarHBondContact O-N 2.85Å; L53-N55 PolarHBondContact O-N 2.85Å
56	I	93.8	Very high	89.7	Confident	0 Å²	0	66 Å²	66	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-114.9	-17.1	-174.7	58.7	174.1	0	0	0	113.7	V51 L53 F103 S107 R108 L109 I640	V51-I56 HydrophobicContact CG1-CD1 4.15Å; V51-I56 HydrophobicContact CG1-CG1 4.42Å; V51-I56 HydrophobicContact CG1-CG2 3.54Å; L53-I56 VanDerWaalsContact O-CG1 3.29Å; L53-I56 WeakPolarHBondContact O-CG1 3.15Å; L53-I56 PolarHBondContact O-N 3.06Å; I56-F103 HydrophobicContact CD1-CD2 4.22Å; I56-F103 HydrophobicContact CD1-CE2 3.99Å; I56-S107 VanDerWaalsContact CG2-O 3.32Å; I56-S107 WeakPolarHBondContact CG2-O 3.45Å; I56-R108 CarbonylContact O-C 3.59Å; I56-R108 WeakPolarHBondContact O-CA 3.32Å; I56-L109 HydrophobicContact CB-CG 4.39Å; I56-L109 HydrophobicContact CD1-CD2 4.16Å; I56-L109 HydrophobicContact CD1-CG 4.21Å; I56-L109 HydrophobicContact CG1-CG 4.28Å; I56-L109 PolarHBondContact O-N 3.46Å; I56-I640 HydrophobicContact CD1-CD1 4.01Å; I56-I640 HydrophobicContact CD1-CG1 4.17Å; I56-I640 HydrophobicContact CD1-CG2 4.36Å
57	V	91.7	Very high	89.9	Confident	8 Å²	8	63.5 Å²	63.5	5%	0.048	33%	0.326	C	S	.	.	S	Bend	trans	-98.7	136.3	174.3	-172.9	0	0	0	0	109.8	L53 F61 L62 F68 L109	L53-V57 HydrophobicContact CD1-CG2 3.5Å; L53-V57 HydrophobicContact CD2-CG2 4.4Å; L53-V57 HydrophobicContact CG-CB 4.45Å; L53-V57 HydrophobicContact CG-CG2 3.6Å; L53-V57 PolarHBondContact O-N 2.92Å; V57-F61 HydrophobicContact CG1-CB 3.92Å; V57-F61 HydrophobicContact CG1-CD2 4.49Å; V57-L62 HydrophobicContact CB-CD2 4.21Å; V57-L62 HydrophobicContact CB-CG 4.32Å; V57-L62 HydrophobicContact CG1-CD2 3.81Å; V57-L62 HydrophobicContact CG1-CG 3.82Å; V57-F68 HydrophobicContact CG1-CE2 4.46Å; V57-F68 HydrophobicContact CG1-CZ 4.08Å; V57-F68 HydrophobicContact CG2-CE1 4.29Å; V57-F68 HydrophobicContact CG2-CE2 4.19Å; V57-F68 HydrophobicContact CG2-CZ 3.66Å; V57-L109 HydrophobicContact CG2-CD1 3.83Å; V57-L109 HydrophobicContact CG2-CG 4.43Å
58	S	88.1	Confident	90.2	Very high	29 Å²	29	62.2 Å²	62.2	20%	0.203	32%	0.317	C	S	.	.			trans	-72.8	142	170.5	-65.2	0	0	0	0	110.4	E60 F61 L62 R108	S58-E60 PolarHBondContact O-N 2.83Å; S58-E60 VanDerWaalsContact O-N 3.08Å; S58-F61 PolarHBondContact O-N 3.44Å; S58-L62 PolarHBondContact O-N 2.65Å; S58-R108 PolarHBondContact OG-NH1 2.86Å
59	E	84.3	Confident	90.5	Very high	124 Å²	124	57.1 Å²	57.1	58%	0.579	30%	0.299	S	S	*	.	H	α-helix	trans	-54	-32.9	-178.3	-69.8	-172.1	-156.4	0	0	114.2	F61 L62 R63	E59-F61 VanDerWaalsContact C-N 3.32Å; E59-F61 PolarHBondContact O-N 3.2Å; E59-L62 PolarHBondContact O-N 3.11Å; E59-L62 VanDerWaalsContact O-N 3.08Å; E59-R63 WeakPolarHBondContact O-CG 3.16Å; E59-R63 PolarHBondContact O-N 2.83Å; E59-R63 IonicContact OE2-CZ 3.67Å; E59-R63 IonicContact OE2-NE 3.86Å; E59-R63 IonicContact OE2-NH2 2.73Å; E59-R63 PolarHBondContact OE2-NH2 2.78Å
60	E	86.3	Confident	90.5	Very high	147 Å²	147	55.7 Å²	55.7	69%	0.687	29%	0.291	S	S	*	.	H	α-helix	trans	-54	-45.9	176.5	-169.1	169.7	-147.8	0	0	112.2	S58 R63 A64	S58-E60 PolarHBondContact O-N 2.83Å; S58-E60 VanDerWaalsContact O-N 3.08Å; E60-R63 PolarHBondContact O-N 3.03Å; E60-A64 WeakPolarHBondContact O-CB 3.41Å; E60-A64 PolarHBondContact O-N 2.89Å
61	F	86.3	Confident	90.6	Very high	50 Å²	50	53.2 Å²	53.2	22%	0.219	27%	0.273	C	S	.	.	H	α-helix	trans	-74.2	-25	177.2	-53.3	-54.2	0	0	0	113.2	V57 S58 E59 H66 W101	V57-F61 HydrophobicContact CG1-CB 3.92Å; V57-F61 HydrophobicContact CG1-CD2 4.49Å; S58-F61 PolarHBondContact O-N 3.44Å; E59-F61 VanDerWaalsContact C-N 3.32Å; E59-F61 PolarHBondContact O-N 3.2Å; F61-H66 WeakPolarHBondContact O-CB 3.36Å; F61-H66 PolarHBondContact O-CD2 3.01Å; F61-W101 HydrophobicContact CB-CH2 4.25Å; F61-W101 AromaticContact CD1-CH2 3.66Å; F61-W101 HydrophobicContact CD1-CH2 3.66Å; F61-W101 HydrophobicContact CD1-CZ2 4.4Å; F61-W101 AromaticContact CD2-CH2 3.54Å; F61-W101 HydrophobicContact CD2-CH2 3.54Å; F61-W101 AromaticContact CD2-CZ3 3.8Å; F61-W101 HydrophobicContact CD2-CZ3 3.8Å; F61-W101 AromaticContact CE1-CH2 3.79Å; F61-W101 HydrophobicContact CE1-CH2 3.79Å; F61-W101 HydrophobicContact CE1-CZ3 4.48Å; F61-W101 AromaticContact CE2-CH2 3.67Å; F61-W101 HydrophobicContact CE2-CH2 3.67Å; F61-W101 AromaticContact CE2-CZ3 3.67Å; F61-W101 HydrophobicContact CE2-CZ3 3.67Å; F61-W101 AromaticContact CG-CH2 3.54Å; F61-W101 HydrophobicContact CG-CH2 3.54Å; F61-W101 HydrophobicContact CG-CZ2 4.26Å; F61-W101 HydrophobicContact CG-CZ3 4.29Å; F61-W101 AromaticContact CZ-CH2 3.8Å; F61-W101 HydrophobicContact CZ-CH2 3.8Å; F61-W101 HydrophobicContact CZ-CZ3 4.04Å
62	L	82.5	Confident	90.6	Very high	74 Å²	74	53.3 Å²	53.3	39%	0.387	27%	0.274	S	S	.	.	H	α-helix	trans	-72.4	-35.8	172	-63.9	175.5	0	0	0	111.2	L53 V57 S58 E59	L53-L62 HydrophobicContact CD2-CD2 4.1Å; V57-L62 HydrophobicContact CB-CD2 4.21Å; V57-L62 HydrophobicContact CB-CG 4.32Å; V57-L62 HydrophobicContact CG1-CD2 3.81Å; V57-L62 HydrophobicContact CG1-CG 3.82Å; S58-L62 PolarHBondContact O-N 2.65Å; E59-L62 PolarHBondContact O-N 3.11Å; E59-L62 VanDerWaalsContact O-N 3.08Å
63	R	86	Confident	90.5	Very high	198 Å²	198	52.3 Å²	52.3	75%	0.747	26%	0.264	S	S	*	.	H	α-helix	trans	-73.8	-30.8	175.3	-65.4	175.8	-163	-163.4	6.7	112.4	E59 E60 G65	E59-R63 WeakPolarHBondContact O-CG 3.16Å; E59-R63 PolarHBondContact O-N 2.83Å; E59-R63 IonicContact OE2-CZ 3.67Å; E59-R63 IonicContact OE2-NE 3.86Å; E59-R63 IonicContact OE2-NH2 2.73Å; E59-R63 PolarHBondContact OE2-NH2 2.78Å; E60-R63 PolarHBondContact O-N 3.03Å; R63-G65 PolarHBondContact O-N 2.98Å; R63-G65 VanDerWaalsContact O-N 3.15Å
64	A	87.3	Confident	90.4	Very high	50 Å²	50	54.1 Å²	54.1	41%	0.413	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	17.8	173.5	0	0	0	0	0	114.5	E60 H66 T82	E60-A64 WeakPolarHBondContact O-CB 3.41Å; E60-A64 PolarHBondContact O-N 2.89Å; A64-H66 PolarHBondContact O-N 2.87Å; A64-T82 WeakPolarHBondContact O-CG2 3.24Å
65	G	88.8	Confident	90.4	Very high	44 Å²	44	46.8 Å²	46.8	45%	0.454	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	20.8	167.8	0	0	0	0	0	116.5	R63 I67	R63-G65 PolarHBondContact O-N 2.98Å; R63-G65 VanDerWaalsContact O-N 3.15Å; G65-I67 PolarHBondContact O-N 3.15Å
66	H	92.1	Very high	90.4	Very high	22 Å²	22	47 Å²	47	10%	0.102	24%	0.24	C	C	.	.			trans	-65.6	116.2	-177.8	-78.3	-101.9	0	0	0	113.4	F61 A64 F68 S80 Y99 W101	F61-H66 WeakPolarHBondContact O-CB 3.36Å; F61-H66 PolarHBondContact O-CD2 3.01Å; A64-H66 PolarHBondContact O-N 2.87Å; H66-F68 HydrophobicContact CB-CE2 4.01Å; H66-F68 HydrophobicContact CB-CZ 4.39Å; H66-S80 PolarHBondContact ND1-OG 3.14Å; H66-Y99 AromaticContact CE1-CD1 3.77Å; H66-Y99 AromaticContact CE1-CD2 3.54Å; H66-Y99 AromaticContact CE1-CE1 3.79Å; H66-Y99 AromaticContact CE1-CE2 3.57Å; H66-Y99 AromaticContact CE1-CG 3.65Å; H66-Y99 AromaticContact CE1-CZ 3.7Å; H66-Y99 AromaticContact ND1-CD2 3.82Å; H66-W101 AromaticContact CE1-CZ2 3.69Å; H66-W101 AromaticContact ND1-CZ2 3.78Å
67	I	92.3	Very high	90.5	Very high	27 Å²	27	47.8 Å²	47.8	14%	0.138	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	105.3	175.7	-59.9	154.1	0	0	0	108.8	G65 S80 Y81 N619 L622	G65-I67 PolarHBondContact O-N 3.15Å; I67-S80 CarbonylContact O-C 3.54Å; I67-S80 WeakPolarHBondContact O-CA 3.33Å; I67-S80 WeakPolarHBondContact O-CB 3.33Å; I67-Y81 HydrophobicContact CB-CD1 3.94Å; I67-Y81 HydrophobicContact CB-CE1 3.65Å; I67-Y81 HydrophobicContact CB-CE2 4.47Å; I67-Y81 HydrophobicContact CB-CG 4.48Å; I67-Y81 HydrophobicContact CD1-CD2 4.28Å; I67-Y81 HydrophobicContact CD1-CE1 4.2Å; I67-Y81 HydrophobicContact CD1-CE2 3.61Å; I67-Y81 HydrophobicContact CG2-CD1 4.11Å; I67-Y81 HydrophobicContact CG2-CE1 3.42Å; I67-Y81 VanDerWaalsContact CG2-CE1 3.42Å; I67-Y81 PolarHBondContact N-O 3.31Å; I67-Y81 PolarHBondContact O-N 3.15Å; I67-N619 HydrophobicContact CG2-CB 4.05Å; I67-L622 HydrophobicContact CD1-CD2 3.65Å; I67-L622 HydrophobicContact CG1-CD1 4.36Å; I67-L622 HydrophobicContact CG1-CD2 4.33Å; I67-L622 HydrophobicContact CG2-CD1 4.49Å
68	F	93.5	Very high	90.7	Very high	8 Å²	8	47.4 Å²	47.4	4%	0.035	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	136.3	179.9	-67.5	-93.5	0	0	0	112.4	L53 V57 H66 V78 W101 L109 L631 L642	L53-F68 HydrophobicContact CD1-CD1 4.26Å; L53-F68 HydrophobicContact CD1-CD2 4.12Å; L53-F68 HydrophobicContact CD1-CE1 4.29Å; L53-F68 HydrophobicContact CD1-CE2 4.15Å; L53-F68 HydrophobicContact CD1-CG 4.19Å; L53-F68 HydrophobicContact CD1-CZ 4.24Å; L53-F68 HydrophobicContact CD2-CD2 3.87Å; L53-F68 HydrophobicContact CD2-CE2 3.96Å; V57-F68 HydrophobicContact CG1-CE2 4.46Å; V57-F68 HydrophobicContact CG1-CZ 4.08Å; V57-F68 HydrophobicContact CG2-CE1 4.29Å; V57-F68 HydrophobicContact CG2-CE2 4.19Å; V57-F68 HydrophobicContact CG2-CZ 3.66Å; H66-F68 HydrophobicContact CB-CE2 4.01Å; H66-F68 HydrophobicContact CB-CZ 4.39Å; F68-V78 HydrophobicContact CD1-CG1 3.83Å; F68-V78 HydrophobicContact CE1-CG1 4.46Å; F68-W101 AromaticContact CE1-CD1 3.96Å; F68-W101 HydrophobicContact CE1-CG 4.48Å; F68-W101 AromaticContact CE1-NE1 3.95Å; F68-L109 HydrophobicContact CE1-CD1 3.75Å; F68-L109 HydrophobicContact CZ-CD1 4.35Å; F68-L631 HydrophobicContact CB-CD1 3.84Å; F68-L642 HydrophobicContact CB-CD2 4.35Å
69	L	94.4	Very high	91.1	Very high	5 Å²	5	46 Å²	46	3%	0.026	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	-40.7	-169.5	-70.6	171	0	0	0	113.8	L79 Y81 L98 V131 M617	L69-L79 HydrophobicContact CB-CB 4.39Å; L69-L79 HydrophobicContact CD1-CB 4.4Å; L69-L79 PolarHBondContact N-O 3.05Å; L69-Y81 HydrophobicContact CD1-CD1 3.92Å; L69-Y81 HydrophobicContact CD2-CD1 3.75Å; L69-Y81 HydrophobicContact CD2-CE1 3.7Å; L69-Y81 HydrophobicContact CG-CD1 3.84Å; L69-Y81 HydrophobicContact CG-CE1 4.27Å; L69-L98 HydrophobicContact CD1-CD1 3.91Å; L69-V131 HydrophobicContact CD1-CB 4.35Å; L69-V131 HydrophobicContact CD1-CG2 3.56Å; L69-M617 HydrophobicContact CB-CB 4.16Å
70	G	94.4	Very high	91.6	Very high	7 Å²	7	40.1 Å²	40.1	7%	0.072	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.7	-179.1	-173.9	0	0	0	0	0	114.5	V78 L79	G70-V78 WeakPolarHBondContact O-CA 3.36Å; G70-L79 PolarHBondContact O-N 2.75Å
71	F	95.3	Very high	92.1	Very high	12 Å²	12	33.2 Å²	33.2	5%	0.053	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	141.6	171.9	-76.3	-85.3	0	0	0	110.9	Y77 V78 F103 N615 L631 D633 I640	F71-Y77 WeakPolarHBondContact CA-O 3.09Å; F71-V78 HydrophobicContact CD1-CG2 3.65Å; F71-V78 HydrophobicContact CE1-CG2 3.48Å; F71-V78 VanDerWaalsContact CE1-CG2 3.48Å; F71-V78 HydrophobicContact CG-CG2 4.28Å; F71-V78 HydrophobicContact CZ-CG2 3.98Å; F71-F103 HydrophobicContact CE1-CB 4.26Å; F71-F103 AromaticContact CE1-CD1 3.62Å; F71-F103 HydrophobicContact CE1-CD1 3.62Å; F71-F103 HydrophobicContact CE1-CD2 4.19Å; F71-F103 AromaticContact CE1-CE1 3.91Å; F71-F103 HydrophobicContact CE1-CE1 3.91Å; F71-F103 HydrophobicContact CE1-CE2 4.46Å; F71-F103 AromaticContact CE1-CG 3.75Å; F71-F103 HydrophobicContact CE1-CG 3.75Å; F71-F103 HydrophobicContact CE1-CZ 4.31Å; F71-F103 HydrophobicContact CZ-CD1 4.23Å; F71-F103 HydrophobicContact CZ-CD2 4.38Å; F71-F103 HydrophobicContact CZ-CE1 4.09Å; F71-F103 HydrophobicContact CZ-CE2 4.26Å; F71-F103 HydrophobicContact CZ-CG 4.35Å; F71-F103 HydrophobicContact CZ-CZ 4.1Å; F71-N615 PolarHBondContact O-ND2 3.12Å; F71-L631 HydrophobicContact CD2-CB 4.33Å; F71-L631 HydrophobicContact CE2-CB 4.29Å; F71-D633 HydrophobicContact CB-CB 4.48Å; F71-D633 HydrophobicContact CD1-CB 4.4Å; F71-D633 HydrophobicContact CD2-CB 3.94Å; F71-D633 HydrophobicContact CE2-CB 4.2Å; F71-D633 HydrophobicContact CG-CB 4.03Å; F71-I640 HydrophobicContact CE1-CD1 4.19Å; F71-I640 HydrophobicContact CE2-CD1 3.82Å; F71-I640 HydrophobicContact CE2-CG1 3.97Å; F71-I640 HydrophobicContact CZ-CD1 3.42Å; F71-I640 VanDerWaalsContact CZ-CD1 3.42Å; F71-I640 HydrophobicContact CZ-CG1 3.71Å
72	T	94.5	Very high	92.4	Very high	3 Å²	3	31 Å²	31	2%	0.018	16%	0.161	C	C	.	.			trans	-65.1	157.8	163	59.8	0	0	0	0	110.9	C74 G75 Y77 L79 E133 M175	T72-C74 PolarHBondContact O-N 2.94Å; T72-C74 PolarHBondContact OG1-SG 2.86Å; T72-G75 VanDerWaalsContact O-CA 3.3Å; T72-G75 WeakPolarHBondContact O-CA 3.31Å; T72-G75 PolarHBondContact O-N 3.09Å; T72-Y77 PolarHBondContact N-O 3.27Å; T72-Y77 PolarHBondContact OG1-N 2.97Å; T72-Y77 PolarHBondContact OG1-O 2.83Å; T72-L79 HydrophobicContact CG2-CD1 4.19Å; T72-L79 HydrophobicContact CG2-CD2 4.05Å; T72-L79 HydrophobicContact CG2-CG 4.03Å; T72-E133 VanDerWaalsContact CA-OE2 3.29Å; T72-E133 WeakPolarHBondContact CA-OE2 3.35Å; T72-E133 WeakPolarHBondContact CB-OE1 3.41Å; T72-M175 HydrophobicContact CG2-CE 4.12Å
73	K	92.2	Very high	92.7	Very high	27 Å²	27	29.3 Å²	29.3	12%	0.117	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-37.1	177.8	-78.3	179	169.2	-173.1	0	113.7	G75 E133 W134 P135 Y613 N615	K73-G75 PolarHBondContact O-N 3.3Å; K73-E133 HydrophobicContact CD-CB 4.18Å; K73-E133 HydrophobicContact CG-CB 4.44Å; K73-E133 VanDerWaalsContact N-CD 3.29Å; K73-E133 PolarHBondContact N-OE1 3.47Å; K73-E133 PolarHBondContact N-OE2 2.93Å; K73-W134 PolarHBondContact NZ-O 2.75Å; K73-P135 VanDerWaalsContact NZ-C 3.32Å; K73-P135 VanDerWaalsContact NZ-CA 3.31Å; K73-P135 PolarHBondContact NZ-O 3.32Å; K73-Y613 WeakPolarHBondContact CE-O 3.49Å; K73-Y613 PolarHBondContact NZ-O 3.38Å; K73-N615 HydrophobicContact CD-CB 4.38Å; K73-N615 HydrophobicContact CG-CB 3.78Å
74	C	90.6	Very high	92.7	Very high	50 Å²	50	23 Å²	23	34%	0.338	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	0.5	177.2	71.7	0	0	0	0	113	T72 R76 R636	T72-C74 PolarHBondContact O-N 2.94Å; T72-C74 PolarHBondContact OG1-SG 2.86Å; C74-R76 PolarHBondContact O-N 2.87Å; C74-R636 PolarHBondContact O-NH1 3.27Å; C74-R636 PolarHBondContact O-NH2 3.03Å
75	G	91.8	Very high	92.3	Very high	2 Å²	2	23.5 Å²	23.5	2%	0.021	14%	0.137	C	C	.	.	S	Bend	trans	53.7	12.5	176.8	0	0	0	0	0	115.1	T72 K73 R636	T72-G75 VanDerWaalsContact O-CA 3.3Å; T72-G75 WeakPolarHBondContact O-CA 3.31Å; T72-G75 PolarHBondContact O-N 3.09Å; K73-G75 PolarHBondContact O-N 3.3Å; G75-R636 PolarHBondContact O-NH1 3.49Å
76	R	92.7	Very high	91.3	Very high	100 Å²	100	23 Å²	23	38%	0.377	13%	0.132	S	C	.	.	S	Bend	trans	-87.7	-32.9	-178.2	-176.8	-172.1	-70.9	-178	-3.8	110.6	C74 F103 S178	C74-R76 PolarHBondContact O-N 2.87Å; R76-F103 PolarHBondContact O-N 3.12Å; R76-S178 PolarHBondContact NH1-O 3.2Å; R76-S178 PolarHBondContact NH2-O 2.71Å
77	Y	95.4	Very high	89.6	Confident	16 Å²	16	31.3 Å²	31.3	6%	0.063	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	139.8	-177.2	-52	-59.9	0	0	0	110.5	F71 T72 W101 V112 M175 P176	F71-Y77 WeakPolarHBondContact CA-O 3.09Å; T72-Y77 PolarHBondContact N-O 3.27Å; T72-Y77 PolarHBondContact OG1-N 2.97Å; T72-Y77 PolarHBondContact OG1-O 2.83Å; Y77-W101 CarbonylContact C-O 3.01Å; Y77-W101 WeakPolarHBondContact CA-O 2.91Å; Y77-V112 HydrophobicContact CD1-CG2 3.92Å; Y77-V112 HydrophobicContact CE1-CG2 3.71Å; Y77-M175 HydrophobicContact CD2-CE 4.15Å; Y77-P176 HydrophobicContact CD2-CG 4.41Å; Y77-P176 HydrophobicContact CE2-CG 3.92Å
78	V	96	Very high	88	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	136.8	161.6	176.2	0	0	0	0	106.8	F68 G70 F71 W101 F103 L631 I640	F68-V78 HydrophobicContact CD1-CG1 3.83Å; F68-V78 HydrophobicContact CE1-CG1 4.46Å; G70-V78 WeakPolarHBondContact O-CA 3.36Å; F71-V78 HydrophobicContact CD1-CG2 3.65Å; F71-V78 HydrophobicContact CE1-CG2 3.48Å; F71-V78 VanDerWaalsContact CE1-CG2 3.48Å; F71-V78 HydrophobicContact CG-CG2 4.28Å; F71-V78 HydrophobicContact CZ-CG2 3.98Å; V78-W101 HydrophobicContact CB-CB 4.38Å; V78-W101 PolarHBondContact N-O 3.3Å; V78-W101 WeakPolarHBondContact O-CB 3.49Å; V78-W101 PolarHBondContact O-N 2.86Å; V78-F103 HydrophobicContact CG2-CB 3.96Å; V78-F103 HydrophobicContact CG2-CD2 4.32Å; V78-F103 HydrophobicContact CG2-CG 4.29Å; V78-L631 HydrophobicContact CG1-CD1 4.14Å; V78-I640 HydrophobicContact CG1-CD1 4.49Å; V78-I640 HydrophobicContact CG2-CD1 3.66Å
79	L	96.8	Very high	86.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	143.9	178.1	-55.2	-173.5	0	0	0	110.9	L69 G70 T72 Y99 W100 V131 I141 M617	L69-L79 HydrophobicContact CB-CB 4.39Å; L69-L79 HydrophobicContact CD1-CB 4.4Å; L69-L79 PolarHBondContact N-O 3.05Å; G70-L79 PolarHBondContact O-N 2.75Å; T72-L79 HydrophobicContact CG2-CD1 4.19Å; T72-L79 HydrophobicContact CG2-CD2 4.05Å; T72-L79 HydrophobicContact CG2-CG 4.03Å; L79-Y99 WeakPolarHBondContact CA-O 3.31Å; L79-W100 HydrophobicContact CD2-CB 4.3Å; L79-W100 VanDerWaalsContact CD2-CD1 3.43Å; L79-W100 HydrophobicContact CD2-CD2 4.03Å; L79-W100 HydrophobicContact CD2-CG 3.66Å; L79-V131 HydrophobicContact CD1-CG1 3.84Å; L79-I141 HydrophobicContact CD1-CD1 4.25Å; L79-M617 HydrophobicContact CD1-CE 3.72Å; L79-M617 HydrophobicContact CD1-SD 4.05Å; L79-M617 HydrophobicContact CG-SD 4.44Å
80	S	95.4	Very high	84.8	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	156.5	167.5	69.4	0	0	0	0	110.1	H66 I67 Y99 W101	H66-S80 PolarHBondContact ND1-OG 3.14Å; I67-S80 CarbonylContact O-C 3.54Å; I67-S80 WeakPolarHBondContact O-CA 3.33Å; I67-S80 WeakPolarHBondContact O-CB 3.33Å; S80-Y99 PolarHBondContact N-O 3.18Å; S80-Y99 PolarHBondContact O-N 2.81Å; S80-W101 PolarHBondContact OG-NE1 3.38Å
81	Y	95	Very high	83.2	Confident	3 Å²	3	55.4 Å²	55.4	1%	0.012	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	159.2	166.2	72.7	-79.8	0	0	0	112	I67 L69 Y96 H97 L129	I67-Y81 HydrophobicContact CB-CD1 3.94Å; I67-Y81 HydrophobicContact CB-CE1 3.65Å; I67-Y81 HydrophobicContact CB-CE2 4.47Å; I67-Y81 HydrophobicContact CB-CG 4.48Å; I67-Y81 HydrophobicContact CD1-CD2 4.28Å; I67-Y81 HydrophobicContact CD1-CE1 4.2Å; I67-Y81 HydrophobicContact CD1-CE2 3.61Å; I67-Y81 HydrophobicContact CG2-CD1 4.11Å; I67-Y81 HydrophobicContact CG2-CE1 3.42Å; I67-Y81 VanDerWaalsContact CG2-CE1 3.42Å; I67-Y81 PolarHBondContact N-O 3.31Å; I67-Y81 PolarHBondContact O-N 3.15Å; L69-Y81 HydrophobicContact CD1-CD1 3.92Å; L69-Y81 HydrophobicContact CD2-CD1 3.75Å; L69-Y81 HydrophobicContact CD2-CE1 3.7Å; L69-Y81 HydrophobicContact CG-CD1 3.84Å; L69-Y81 HydrophobicContact CG-CE1 4.27Å; Y81-Y96 HydrophobicContact CD2-CD1 4.12Å; Y81-Y96 HydrophobicContact CE2-CD1 4.36Å; Y81-Y96 HydrophobicContact CE2-CE1 4.31Å; Y81-H97 CarbonylContact C-O 3.54Å; Y81-H97 WeakPolarHBondContact CA-O 3.48Å; Y81-H97 WeakPolarHBondContact CB-O 3.43Å; Y81-L129 HydrophobicContact CD1-CD1 4.35Å; Y81-L129 HydrophobicContact CD2-CD1 3.57Å; Y81-L129 HydrophobicContact CD2-CG 4.46Å; Y81-L129 HydrophobicContact CE2-CD1 3.84Å; Y81-L129 HydrophobicContact CE2-CG 4.25Å; Y81-L129 HydrophobicContact CG-CD1 3.83Å
82	T	92.8	Very high	82.1	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.012	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	157.2	161.8	60.6	0	0	0	0	109.5	A64 D84 H97 Y99	A64-T82 WeakPolarHBondContact O-CG2 3.24Å; T82-D84 PolarHBondContact OG1-OD1 3.36Å; T82-D84 PolarHBondContact OG1-OD2 2.92Å; T82-D84 VanDerWaalsContact OG1-OD2 3.06Å; T82-H97 PolarHBondContact N-O 3.24Å; T82-H97 PolarHBondContact O-N 3.04Å; T82-Y99 HydrophobicContact CG2-CE2 3.72Å
83	S	90.3	Very high	81.5	Confident	39 Å²	39	60 Å²	60	27%	0.273	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	100.2	170.8	-174.7	0	0	0	0	106.3	Y96	S83-Y96 WeakPolarHBondContact OG-CE1 3.16Å; S83-Y96 PolarHBondContact OG-OH 3.36Å
84	D	86.1	Confident	81.3	Confident	65 Å²	65	61.8 Å²	61.8	35%	0.348	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	114.9	-172.8	-51	-53	0	0	0	107.6	T82 S95 H97	T82-D84 PolarHBondContact OG1-OD1 3.36Å; T82-D84 PolarHBondContact OG1-OD2 2.92Å; T82-D84 VanDerWaalsContact OG1-OD2 3.06Å; D84-S95 PolarHBondContact N-O 2.92Å; D84-S95 PolarHBondContact O-N 3.02Å; D84-H97 IonicContact OD2-CE1 2.79Å; D84-H97 IonicContact OD2-ND1 2.75Å; D84-H97 PolarHBondContact OD2-ND1 3.38Å
85	C	77.5	Confident	81.3	Confident	62 Å²	62	60.7 Å²	60.7	42%	0.419	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	124.7	176.2	-173	0	0	0	0	109.6	F93	C85-F93 CarbonylContact C-O 3.48Å; C85-F93 WeakPolarHBondContact CA-O 3.38Å
86	G	68	Low	81.5	Confident	34 Å²	34	60.7 Å²	60.7	35%	0.351	32%	0.318	S	S	.	.			trans	-68.6	130.5	168.2	0	0	0	0	0	110.8	F93	G86-F93 PolarHBondContact N-O 2.85Å
87	E	57.6	Low	81.5	Confident	195 Å²	195	57.8 Å²	57.8	91%	0.911	31%	0.309	S	S	*	.			trans	-94.9	74	168.6	-66	-178.8	165	0	0	108.9
88	D	57.7	Low	81.6	Confident	120 Å²	120	57 Å²	57	64%	0.642	31%	0.306	S	S	*	.	B	Isolated β-bridge	trans	-93.7	135.4	156.8	-92.8	-38.8	0	0	0	107.7	D90 F91	D88-D90 PolarHBondContact O-N 2.9Å; D88-F91 PolarHBondContact O-N 2.94Å; D88-F91 VanDerWaalsContact O-N 3.15Å
89	D	56.4	Low	81.5	Confident	176 Å²	176	58.4 Å²	58.4	94%	0.941	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-18.3	-162.8	-81.7	-42	0	0	0	115.8
90	D	64.5	Low	81.5	Confident	144 Å²	144	58.4 Å²	58.4	77%	0.77	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.6	-19.2	-179.9	-72.1	-48	0	0	0	115	D88	D88-D90 PolarHBondContact O-N 2.9Å
91	F	61.7	Low	81.4	Confident	114 Å²	114	58.4 Å²	58.4	50%	0.5	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-145.6	124.3	-171	-63.4	-79.3	0	0	0	114.5	D88 F93	D88-F91 PolarHBondContact O-N 2.94Å; D88-F91 VanDerWaalsContact O-N 3.15Å; F91-F93 HydrophobicContact CB-CD2 4.27Å; F91-F93 HydrophobicContact CB-CE2 3.65Å; F91-F93 HydrophobicContact CB-CZ 4.14Å; F91-F93 WeakPolarHBondContact O-CD2 3.41Å
92	S	70.9	Confident	81.4	Confident	48 Å²	48	61.7 Å²	61.7	34%	0.336	33%	0.327	S	S	.	.			trans	-85.2	109.7	174	-57	0	0	0	0	112.2
93	F	82.9	Confident	81.5	Confident	62 Å²	62	62.7 Å²	62.7	27%	0.272	33%	0.331	S	S	.	.			trans	-102.3	134	172	-62.9	-88.5	0	0	0	111.2	C85 G86 F91 E122 Y124	C85-F93 CarbonylContact C-O 3.48Å; C85-F93 WeakPolarHBondContact CA-O 3.38Å; G86-F93 PolarHBondContact N-O 2.85Å; F91-F93 HydrophobicContact CB-CD2 4.27Å; F91-F93 HydrophobicContact CB-CE2 3.65Å; F91-F93 HydrophobicContact CB-CZ 4.14Å; F91-F93 WeakPolarHBondContact O-CD2 3.41Å; F93-E122 HydrophobicContact CD1-CB 4.25Å; F93-E122 HydrophobicContact CD1-CG 4.44Å; F93-E122 HydrophobicContact CE1-CB 4.2Å; F93-E122 HydrophobicContact CE1-CG 4.22Å; F93-Y124 HydrophobicContact CD1-CD1 4.43Å; F93-Y124 HydrophobicContact CD1-CE1 4.08Å; F93-Y124 HydrophobicContact CE1-CD1 4.18Å; F93-Y124 AromaticContact CE1-CE1 3.42Å; F93-Y124 HydrophobicContact CE1-CE1 3.42Å; F93-Y124 VanDerWaalsContact CE1-CE1 3.42Å; F93-Y124 HydrophobicContact CE1-CE2 4.44Å; F93-Y124 AromaticContact CE1-CZ 3.57Å; F93-Y124 AromaticContact CZ-CE1 3.96Å; F93-Y124 HydrophobicContact CZ-CE1 3.96Å
94	Y	87.7	Confident	81.7	Confident	65 Å²	65	65.6 Å²	65.6	26%	0.255	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	125.2	178.6	-66.7	-95	0	0	0	111.5	I123 D126	Y94-I123 PolarHBondContact N-O 3.14Å; Y94-D126 HydrophobicContact CE1-CB 4.07Å
95	S	91.1	Very high	81.9	Confident	27 Å²	27	66 Å²	66	19%	0.189	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	134	170.3	-163.7	0	0	0	0	109.9	D84 R116	D84-S95 PolarHBondContact N-O 2.92Å; D84-S95 PolarHBondContact O-N 3.02Å; S95-R116 PolarHBondContact OG-NE 3.12Å
96	Y	94.1	Very high	82.6	Confident	2 Å²	2	69.3 Å²	69.3	1%	0.008	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	129.1	-176.9	-69.6	-84.1	0	0	0	111.2	Y81 S83 L117 F118 I123 D126 L127 L129	Y81-Y96 HydrophobicContact CD2-CD1 4.12Å; Y81-Y96 HydrophobicContact CE2-CD1 4.36Å; Y81-Y96 HydrophobicContact CE2-CE1 4.31Å; S83-Y96 WeakPolarHBondContact OG-CE1 3.16Å; S83-Y96 PolarHBondContact OG-OH 3.36Å; Y96-L117 PolarHBondContact O-N 2.82Å; Y96-F118 HydrophobicContact CD2-CD2 4.25Å; Y96-F118 HydrophobicContact CD2-CE2 4.36Å; Y96-F118 HydrophobicContact CG-CE2 4.46Å; Y96-I123 HydrophobicContact CD2-CD1 3.93Å; Y96-I123 HydrophobicContact CE2-CD1 4.16Å; Y96-I123 HydrophobicContact CE2-CG2 4.14Å; Y96-D126 WeakPolarHBondContact OH-CA 3.39Å; Y96-D126 PolarHBondContact OH-OD1 2.89Å; Y96-L127 HydrophobicContact CD2-CD1 4.36Å; Y96-L127 HydrophobicContact CE2-CB 4.15Å; Y96-L127 HydrophobicContact CE2-CD1 3.97Å; Y96-L127 HydrophobicContact CE2-CG 3.95Å; Y96-L127 PolarHBondContact OH-N 3.26Å; Y96-L129 HydrophobicContact CD1-CD1 3.81Å; Y96-L129 HydrophobicContact CD1-CG 4.44Å; Y96-L129 HydrophobicContact CE1-CD1 4.36Å; Y96-L129 HydrophobicContact CG-CD1 4.42Å
97	H	94.3	Very high	83.8	Confident	40 Å²	40	70.1 Å²	70.1	19%	0.185	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	132	176.1	-62.3	100.3	0	0	0	110.3	Y81 T82 D84 Y99 V115	Y81-H97 CarbonylContact C-O 3.54Å; Y81-H97 WeakPolarHBondContact CA-O 3.48Å; Y81-H97 WeakPolarHBondContact CB-O 3.43Å; T82-H97 PolarHBondContact N-O 3.24Å; T82-H97 PolarHBondContact O-N 3.04Å; D84-H97 IonicContact OD2-CE1 2.79Å; D84-H97 IonicContact OD2-ND1 2.75Å; D84-H97 PolarHBondContact OD2-ND1 3.38Å; H97-Y99 HydrophobicContact CB-CD2 4.42Å; H97-Y99 HydrophobicContact CB-CE2 3.48Å; H97-Y99 VanDerWaalsContact CB-CE2 3.48Å; H97-Y99 WeakPolarHBondContact CB-OH 3.34Å; H97-Y99 WeakPolarHBondContact O-CD2 3.49Å; H97-Y99 WeakPolarHBondContact O-CE2 3.27Å; H97-V115 CarbonylContact C-O 3.6Å; H97-V115 WeakPolarHBondContact CA-O 3.06Å
98	L	96	Very high	85.5	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	136.9	174.1	-173.2	69.9	0	0	0	110.1	L69 W100 H114 V115 L117 V131 I141 I143	L69-L98 HydrophobicContact CD1-CD1 3.91Å; L98-W100 HydrophobicContact CB-CZ3 4.19Å; L98-W100 HydrophobicContact CD2-CH2 3.67Å; L98-W100 HydrophobicContact CD2-CZ2 4.12Å; L98-W100 HydrophobicContact CD2-CZ3 4Å; L98-W100 HydrophobicContact CG-CE3 4.49Å; L98-W100 HydrophobicContact CG-CH2 4.19Å; L98-W100 HydrophobicContact CG-CZ3 3.98Å; L98-H114 CarbonylContact O-C 3.52Å; L98-H114 WeakPolarHBondContact O-CA 3.32Å; L98-V115 PolarHBondContact N-O 3.24Å; L98-V115 PolarHBondContact O-N 3.1Å; L98-L117 HydrophobicContact CB-CD1 4.15Å; L98-L117 HydrophobicContact CB-CD2 4Å; L98-L117 HydrophobicContact CB-CG 4.13Å; L98-V131 HydrophobicContact CD1-CG2 4.11Å; L98-V131 HydrophobicContact CD2-CG2 4.49Å; L98-I141 HydrophobicContact CD2-CD1 3.75Å; L98-I143 HydrophobicContact CD2-CD1 4.01Å; L98-I143 HydrophobicContact CD2-CG1 3.92Å
99	Y	95.1	Very high	87.2	Confident	29 Å²	29	63.2 Å²	63.2	11%	0.114	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	140.8	-175.1	-57.9	-101	0	0	0	111.6	H66 L79 S80 T82 H97 Q111 H114	H66-Y99 AromaticContact CE1-CD1 3.77Å; H66-Y99 AromaticContact CE1-CD2 3.54Å; H66-Y99 AromaticContact CE1-CE1 3.79Å; H66-Y99 AromaticContact CE1-CE2 3.57Å; H66-Y99 AromaticContact CE1-CG 3.65Å; H66-Y99 AromaticContact CE1-CZ 3.7Å; H66-Y99 AromaticContact ND1-CD2 3.82Å; L79-Y99 WeakPolarHBondContact CA-O 3.31Å; S80-Y99 PolarHBondContact N-O 3.18Å; S80-Y99 PolarHBondContact O-N 2.81Å; T82-Y99 HydrophobicContact CG2-CE2 3.72Å; H97-Y99 HydrophobicContact CB-CD2 4.42Å; H97-Y99 HydrophobicContact CB-CE2 3.48Å; H97-Y99 VanDerWaalsContact CB-CE2 3.48Å; H97-Y99 WeakPolarHBondContact CB-OH 3.34Å; H97-Y99 WeakPolarHBondContact O-CD2 3.49Å; H97-Y99 WeakPolarHBondContact O-CE2 3.27Å; Y99-Q111 HydrophobicContact CD1-CG 4.46Å; Y99-H114 HydrophobicContact CD1-CB 3.62Å; Y99-H114 HydrophobicContact CE1-CB 3.9Å; Y99-H114 HydrophobicContact CG-CB 4.27Å
100	W	95.5	Very high	88.9	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	124.6	172.8	-70.5	-113.9	0	0	0	109.8	L79 L98 V112 H113 V115 I141 A173 M175 P176	L79-W100 HydrophobicContact CD2-CB 4.3Å; L79-W100 VanDerWaalsContact CD2-CD1 3.43Å; L79-W100 HydrophobicContact CD2-CD2 4.03Å; L79-W100 HydrophobicContact CD2-CG 3.66Å; L98-W100 HydrophobicContact CB-CZ3 4.19Å; L98-W100 HydrophobicContact CD2-CH2 3.67Å; L98-W100 HydrophobicContact CD2-CZ2 4.12Å; L98-W100 HydrophobicContact CD2-CZ3 4Å; L98-W100 HydrophobicContact CG-CE3 4.49Å; L98-W100 HydrophobicContact CG-CH2 4.19Å; L98-W100 HydrophobicContact CG-CZ3 3.98Å; W100-V112 HydrophobicContact CB-CG2 3.73Å; W100-V112 WeakPolarHBondContact O-CG2 3.4Å; W100-V112 PolarHBondContact O-N 2.85Å; W100-H113 HydrophobicContact CB-CB 3.99Å; W100-H113 HydrophobicContact CD2-CB 4.17Å; W100-H113 HydrophobicContact CE3-CB 4.03Å; W100-H113 AromaticContact CE3-CD2 3.76Å; W100-H113 HydrophobicContact CG-CB 4.2Å; W100-H113 AromaticContact CZ3-CD2 3.83Å; W100-H113 PolarHBondContact N-O 2.91Å; W100-V115 HydrophobicContact CH2-CB 4.27Å; W100-V115 HydrophobicContact CH2-CG2 3.88Å; W100-V115 HydrophobicContact CZ3-CB 4.03Å; W100-V115 HydrophobicContact CZ3-CG2 3.75Å; W100-I141 HydrophobicContact CH2-CD1 4.18Å; W100-I141 HydrophobicContact CZ2-CD1 3.46Å; W100-I141 VanDerWaalsContact CZ2-CD1 3.46Å; W100-I141 HydrophobicContact CZ2-CG1 4.17Å; W100-A173 HydrophobicContact CH2-CB 4.24Å; W100-M175 HydrophobicContact CZ2-SD 4.26Å; W100-M175 PolarHBondContact NE1-SD 3.39Å; W100-P176 HydrophobicContact CB-CG 4.47Å; W100-P176 HydrophobicContact CG-CG 4.09Å
101	W	94.9	Very high	90.2	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	118.4	178.5	-60.7	95.4	0	0	0	110.5	F61 H66 F68 Y77 V78 S80 F103 L109 K110 Q111	F61-W101 HydrophobicContact CB-CH2 4.25Å; F61-W101 AromaticContact CD1-CH2 3.66Å; F61-W101 HydrophobicContact CD1-CH2 3.66Å; F61-W101 HydrophobicContact CD1-CZ2 4.4Å; F61-W101 AromaticContact CD2-CH2 3.54Å; F61-W101 HydrophobicContact CD2-CH2 3.54Å; F61-W101 AromaticContact CD2-CZ3 3.8Å; F61-W101 HydrophobicContact CD2-CZ3 3.8Å; F61-W101 AromaticContact CE1-CH2 3.79Å; F61-W101 HydrophobicContact CE1-CH2 3.79Å; F61-W101 HydrophobicContact CE1-CZ3 4.48Å; F61-W101 AromaticContact CE2-CH2 3.67Å; F61-W101 HydrophobicContact CE2-CH2 3.67Å; F61-W101 AromaticContact CE2-CZ3 3.67Å; F61-W101 HydrophobicContact CE2-CZ3 3.67Å; F61-W101 AromaticContact CG-CH2 3.54Å; F61-W101 HydrophobicContact CG-CH2 3.54Å; F61-W101 HydrophobicContact CG-CZ2 4.26Å; F61-W101 HydrophobicContact CG-CZ3 4.29Å; F61-W101 AromaticContact CZ-CH2 3.8Å; F61-W101 HydrophobicContact CZ-CH2 3.8Å; F61-W101 HydrophobicContact CZ-CZ3 4.04Å; H66-W101 AromaticContact CE1-CZ2 3.69Å; H66-W101 AromaticContact ND1-CZ2 3.78Å; F68-W101 AromaticContact CE1-CD1 3.96Å; F68-W101 HydrophobicContact CE1-CG 4.48Å; F68-W101 AromaticContact CE1-NE1 3.95Å; Y77-W101 CarbonylContact C-O 3.01Å; Y77-W101 WeakPolarHBondContact CA-O 2.91Å; V78-W101 HydrophobicContact CB-CB 4.38Å; V78-W101 PolarHBondContact N-O 3.3Å; V78-W101 WeakPolarHBondContact O-CB 3.49Å; V78-W101 PolarHBondContact O-N 2.86Å; S80-W101 PolarHBondContact OG-NE1 3.38Å; W101-F103 PolarHBondContact O-N 3.43Å; W101-L109 HydrophobicContact CB-CB 4.11Å; W101-L109 HydrophobicContact CB-CD1 3.87Å; W101-L109 HydrophobicContact CB-CD2 4.27Å; W101-L109 HydrophobicContact CB-CG 4.31Å; W101-L109 HydrophobicContact CD2-CB 4.29Å; W101-L109 HydrophobicContact CD2-CD1 4.36Å; W101-L109 HydrophobicContact CE3-CB 3.78Å; W101-L109 HydrophobicContact CG-CB 4.45Å; W101-L109 HydrophobicContact CG-CD1 4.02Å; W101-K110 CarbonylContact C-O 3.55Å; W101-K110 WeakPolarHBondContact CA-O 3.28Å; W101-Q111 HydrophobicContact CE3-CB 3.99Å; W101-Q111 HydrophobicContact CH2-CB 3.99Å; W101-Q111 HydrophobicContact CZ3-CB 3.64Å
102	E	94.7	Very high	91.5	Very high	72 Å²	72	52.4 Å²	52.4	34%	0.336	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	120.8	168.9	-179.9	177.1	-125.8	0	0	109.7	K110 V112	E102-K110 HydrophobicContact CB-CB 4.39Å; E102-K110 PolarHBondContact N-O 2.71Å; E102-K110 PolarHBondContact O-N 2.83Å; E102-V112 HydrophobicContact CB-CG1 3.74Å
103	F	94.4	Very high	92.3	Very high	23 Å²	23	50.6 Å²	50.6	10%	0.101	24%	0.239	C	C	.	.			trans	-100.4	124.6	178.9	174.8	-99.3	0	0	0	110.9	I56 F71 R76 V78 W101 L105 L109 T638 I640	I56-F103 HydrophobicContact CD1-CD2 4.22Å; I56-F103 HydrophobicContact CD1-CE2 3.99Å; F71-F103 HydrophobicContact CE1-CB 4.26Å; F71-F103 AromaticContact CE1-CD1 3.62Å; F71-F103 HydrophobicContact CE1-CD1 3.62Å; F71-F103 HydrophobicContact CE1-CD2 4.19Å; F71-F103 AromaticContact CE1-CE1 3.91Å; F71-F103 HydrophobicContact CE1-CE1 3.91Å; F71-F103 HydrophobicContact CE1-CE2 4.46Å; F71-F103 AromaticContact CE1-CG 3.75Å; F71-F103 HydrophobicContact CE1-CG 3.75Å; F71-F103 HydrophobicContact CE1-CZ 4.31Å; F71-F103 HydrophobicContact CZ-CD1 4.23Å; F71-F103 HydrophobicContact CZ-CD2 4.38Å; F71-F103 HydrophobicContact CZ-CE1 4.09Å; F71-F103 HydrophobicContact CZ-CE2 4.26Å; F71-F103 HydrophobicContact CZ-CG 4.35Å; F71-F103 HydrophobicContact CZ-CZ 4.1Å; R76-F103 PolarHBondContact O-N 3.12Å; V78-F103 HydrophobicContact CG2-CB 3.96Å; V78-F103 HydrophobicContact CG2-CD2 4.32Å; V78-F103 HydrophobicContact CG2-CG 4.29Å; W101-F103 PolarHBondContact O-N 3.43Å; F103-L105 HydrophobicContact CE1-CD2 4.02Å; F103-L105 HydrophobicContact CZ-CD2 4.28Å; F103-L109 HydrophobicContact CB-CD2 4.11Å; F103-L109 HydrophobicContact CD2-CD2 3.88Å; F103-T638 HydrophobicContact CE1-CG2 3.93Å; F103-T638 HydrophobicContact CZ-CG2 3.79Å; F103-I640 HydrophobicContact CD2-CD1 3.95Å; F103-I640 HydrophobicContact CE2-CD1 3.84Å; F103-I640 HydrophobicContact CE2-CG1 3.96Å
104	N	93.7	Very high	92.6	Very high	99 Å²	99	51.6 Å²	51.6	53%	0.529	24%	0.244	S	C	.	.			trans	-135.1	64.6	176.8	-172.7	11.9	0	0	0	111.2	H106 S107	N104-H106 PolarHBondContact O-N 2.71Å; N104-S107 PolarHBondContact ND2-OG 3Å; N104-S107 VanDerWaalsContact O-CB 3.24Å; N104-S107 WeakPolarHBondContact O-CB 3Å; N104-S107 PolarHBondContact O-N 2.86Å; N104-S107 PolarHBondContact O-OG 2.93Å
105	L	90.8	Very high	92.9	Very high	74 Å²	74	48.7 Å²	48.7	39%	0.387	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	-103.3	176.2	-61.1	172.8	0	0	0	113.3	V49 F103 T638	V49-L105 HydrophobicContact CG1-CD2 4.43Å; F103-L105 HydrophobicContact CE1-CD2 4.02Å; F103-L105 HydrophobicContact CZ-CD2 4.28Å; L105-T638 HydrophobicContact CD2-CG2 4.32Å
106	H	92.1	Very high	92.9	Very high	132 Å²	132	53.6 Å²	53.6	61%	0.611	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	-4.3	-178.9	-59.2	-64.2	0	0	0	113.5	N104	N104-H106 PolarHBondContact O-N 2.71Å
107	S	93.4	Very high	92.9	Very high	50 Å²	50	53.7 Å²	53.7	35%	0.35	25%	0.248	S	C	.	.	S	Bend	trans	-70.9	151	172.7	-44	0	0	0	0	110.1	I56 N104	I56-S107 VanDerWaalsContact CG2-O 3.32Å; I56-S107 WeakPolarHBondContact CG2-O 3.45Å; N104-S107 PolarHBondContact ND2-OG 3Å; N104-S107 VanDerWaalsContact O-CB 3.24Å; N104-S107 WeakPolarHBondContact O-CB 3Å; N104-S107 PolarHBondContact O-N 2.86Å; N104-S107 PolarHBondContact O-OG 2.93Å
108	R	93.3	Very high	92.9	Very high	159 Å²	159	51.9 Å²	51.9	60%	0.6	24%	0.24	S	C	*	.	P	Polyproline II helix	trans	-59.4	142.5	170.7	-67.7	-168	-177.7	-156.3	4.1	111.4	I56 S58	I56-R108 CarbonylContact O-C 3.59Å; I56-R108 WeakPolarHBondContact O-CA 3.32Å; S58-R108 PolarHBondContact OG-NH1 2.86Å
109	L	94.1	Very high	92.4	Very high	11 Å²	11	52.8 Å²	52.8	6%	0.058	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-59.4	137.4	171.1	-68.4	-168.8	0	0	0	109.9	I56 V57 F68 W101 F103	I56-L109 HydrophobicContact CB-CG 4.39Å; I56-L109 HydrophobicContact CD1-CD2 4.16Å; I56-L109 HydrophobicContact CD1-CG 4.21Å; I56-L109 HydrophobicContact CG1-CG 4.28Å; I56-L109 PolarHBondContact O-N 3.46Å; V57-L109 HydrophobicContact CG2-CD1 3.83Å; V57-L109 HydrophobicContact CG2-CG 4.43Å; F68-L109 HydrophobicContact CE1-CD1 3.75Å; F68-L109 HydrophobicContact CZ-CD1 4.35Å; W101-L109 HydrophobicContact CB-CB 4.11Å; W101-L109 HydrophobicContact CB-CD1 3.87Å; W101-L109 HydrophobicContact CB-CD2 4.27Å; W101-L109 HydrophobicContact CB-CG 4.31Å; W101-L109 HydrophobicContact CD2-CB 4.29Å; W101-L109 HydrophobicContact CD2-CD1 4.36Å; W101-L109 HydrophobicContact CE3-CB 3.78Å; W101-L109 HydrophobicContact CG-CB 4.45Å; W101-L109 HydrophobicContact CG-CD1 4.02Å; F103-L109 HydrophobicContact CB-CD2 4.11Å; F103-L109 HydrophobicContact CD2-CD2 3.88Å
110	K	91.8	Very high	91.8	Very high	123 Å²	123	55.1 Å²	55.1	54%	0.535	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	124.4	174.6	-60.1	178	-175.1	172.5	0	109.6	W101 E102 V112	W101-K110 CarbonylContact C-O 3.55Å; W101-K110 WeakPolarHBondContact CA-O 3.28Å; E102-K110 HydrophobicContact CB-CB 4.39Å; E102-K110 PolarHBondContact N-O 2.71Å; E102-K110 PolarHBondContact O-N 2.83Å; K110-V112 PolarHBondContact O-N 2.78Å
111	Q	91.5	Very high	91.4	Very high	53 Å²	53	58.1 Å²	58.1	25%	0.248	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	119	172.1	-174.4	179.8	-19.6	0	0	108.8	Y99 W101	Y99-Q111 HydrophobicContact CD1-CG 4.46Å; W101-Q111 HydrophobicContact CE3-CB 3.99Å; W101-Q111 HydrophobicContact CH2-CB 3.99Å; W101-Q111 HydrophobicContact CZ3-CB 3.64Å
112	V	89.3	Confident	90.9	Very high	31 Å²	31	63.5 Å²	63.5	19%	0.188	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	-22.7	178.8	-65.9	0	0	0	0	113.1	Y77 W100 E102 K110 P176	Y77-V112 HydrophobicContact CD1-CG2 3.92Å; Y77-V112 HydrophobicContact CE1-CG2 3.71Å; W100-V112 HydrophobicContact CB-CG2 3.73Å; W100-V112 WeakPolarHBondContact O-CG2 3.4Å; W100-V112 PolarHBondContact O-N 2.85Å; E102-V112 HydrophobicContact CB-CG1 3.74Å; K110-V112 PolarHBondContact O-N 2.78Å; V112-P176 HydrophobicContact CG2-CG 4.49Å
113	H	87.3	Confident	90.6	Very high	10 Å²	10	60.3 Å²	60.3	5%	0.046	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	152.4	-174.6	-159.8	48.3	0	0	0	110.5	W100 P176 L467	W100-H113 HydrophobicContact CB-CB 3.99Å; W100-H113 HydrophobicContact CD2-CB 4.17Å; W100-H113 HydrophobicContact CE3-CB 4.03Å; W100-H113 AromaticContact CE3-CD2 3.76Å; W100-H113 HydrophobicContact CG-CB 4.2Å; W100-H113 AromaticContact CZ3-CD2 3.83Å; W100-H113 PolarHBondContact N-O 2.91Å; H113-P176 HydrophobicContact CB-CB 4.09Å; H113-P176 HydrophobicContact CB-CG 4.24Å; H113-L467 VanDerWaalsContact CE1-CD2 3.44Å; H113-L467 WeakPolarHBondContact CE1-CD2 3.44Å; H113-L467 WeakPolarHBondContact NE2-CD2 3.32Å
114	H	90.8	Very high	90	Very high	83 Å²	83	63.5 Å²	63.5	38%	0.384	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	152.9	169.8	72.3	-61.1	0	0	0	109.9	L98 Y99	L98-H114 CarbonylContact O-C 3.52Å; L98-H114 WeakPolarHBondContact O-CA 3.32Å; Y99-H114 HydrophobicContact CD1-CB 3.62Å; Y99-H114 HydrophobicContact CE1-CB 3.9Å; Y99-H114 HydrophobicContact CG-CB 4.27Å
115	V	92.2	Very high	89.5	Confident	4 Å²	4	59.6 Å²	59.6	2%	0.024	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	134	-178.2	172.8	0	0	0	0	109.2	H97 L98 W100 A173 V206 L467	H97-V115 CarbonylContact C-O 3.6Å; H97-V115 WeakPolarHBondContact CA-O 3.06Å; L98-V115 PolarHBondContact N-O 3.24Å; L98-V115 PolarHBondContact O-N 3.1Å; W100-V115 HydrophobicContact CH2-CB 4.27Å; W100-V115 HydrophobicContact CH2-CG2 3.88Å; W100-V115 HydrophobicContact CZ3-CB 4.03Å; W100-V115 HydrophobicContact CZ3-CG2 3.75Å; V115-A173 HydrophobicContact CG1-CB 4.49Å; V115-V206 HydrophobicContact CG1-CG1 4.04Å; V115-V206 HydrophobicContact CG1-CG2 3.73Å; V115-V206 HydrophobicContact CG2-CG2 4.47Å; V115-L467 HydrophobicContact CG2-CD2 3.69Å
116	R	92.6	Very high	89.2	Confident	130 Å²	130	58.3 Å²	58.3	49%	0.491	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	123.8	166.1	-175.5	174.5	176.8	-169.1	-2.6	109.2	S95	S95-R116 PolarHBondContact OG-NE 3.12Å
117	L	94.5	Very high	89.1	Confident	4 Å²	4	52 Å²	52	2%	0.021	26%	0.261	C	S	.	.	S	Bend	trans	-82.4	153.8	177.1	-58.6	177.2	0	0	0	110.3	Y96 L98 A119 L129 I143 T171	Y96-L117 PolarHBondContact O-N 2.82Å; L98-L117 HydrophobicContact CB-CD1 4.15Å; L98-L117 HydrophobicContact CB-CD2 4Å; L98-L117 HydrophobicContact CB-CG 4.13Å; L117-A119 PolarHBondContact O-N 3.39Å; L117-A119 VanDerWaalsContact O-N 3.12Å; L117-L129 HydrophobicContact CD1-CD1 3.98Å; L117-I143 HydrophobicContact CD1-CG2 3.93Å; L117-I143 HydrophobicContact CD2-CB 4.27Å; L117-I143 HydrophobicContact CD2-CD1 3.94Å; L117-I143 HydrophobicContact CD2-CG1 3.93Å; L117-I143 HydrophobicContact CD2-CG2 4.39Å; L117-T171 HydrophobicContact CD2-CG2 3.84Å
118	F	92.4	Very high	88.9	Confident	3 Å²	3	50.4 Å²	50.4	1%	0.013	25%	0.248	C	C	.	.	S	Bend	trans	51.4	38	173.4	-36.8	-54.6	0	0	0	113.5	Y96 G120 E121 I123 L127 L129 I143 Y169 T171 N208	Y96-F118 HydrophobicContact CD2-CD2 4.25Å; Y96-F118 HydrophobicContact CD2-CE2 4.36Å; Y96-F118 HydrophobicContact CG-CE2 4.46Å; F118-G120 PolarHBondContact O-N 2.69Å; F118-E121 HydrophobicContact CB-CB 4.43Å; F118-E121 WeakPolarHBondContact O-CB 3.36Å; F118-E121 PolarHBondContact O-N 2.86Å; F118-E121 VanDerWaalsContact O-N 3.1Å; F118-I123 HydrophobicContact CB-CD1 4Å; F118-I123 HydrophobicContact CD2-CD1 3.76Å; F118-I123 HydrophobicContact CG-CD1 4.26Å; F118-L127 HydrophobicContact CD2-CD1 4.08Å; F118-L127 HydrophobicContact CE2-CD1 3.87Å; F118-L129 HydrophobicContact CE2-CD2 3.8Å; F118-L129 HydrophobicContact CZ-CD2 3.87Å; F118-I143 HydrophobicContact CZ-CG2 4.22Å; F118-Y169 HydrophobicContact CB-CD1 4.42Å; F118-Y169 VanDerWaalsContact CD1-CB 3.45Å; F118-Y169 HydrophobicContact CD1-CG 4.45Å; F118-Y169 HydrophobicContact CG-CD1 4.49Å; F118-Y169 HydrophobicContact CG-CG 4.46Å; F118-T171 WeakPolarHBondContact CD1-OG1 3.36Å; F118-T171 PolarHBondContact N-OG1 2.88Å; F118-N208 PolarHBondContact N-OD1 3.29Å
119	A	86.4	Confident	88.9	Confident	18 Å²	18	43 Å²	43	15%	0.149	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.9	127.3	-176.1	0	0	0	0	0	111.1	L117	L117-A119 PolarHBondContact O-N 3.39Å; L117-A119 VanDerWaalsContact O-N 3.12Å
120	G	82.1	Confident	88.9	Confident	79 Å²	79	42.4 Å²	42.4	81%	0.814	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	103.2	-12.9	-174.1	0	0	0	0	0	114.2	F118	F118-G120 PolarHBondContact O-N 2.69Å
121	E	86.8	Confident	89.2	Confident	62 Å²	62	36.6 Å²	36.6	29%	0.29	19%	0.191	S	C	.	.			trans	-99	142.1	179.9	-64.6	-66.4	158.2	0	0	112.8	F118 I123 Y169 R210	F118-E121 HydrophobicContact CB-CB 4.43Å; F118-E121 WeakPolarHBondContact O-CB 3.36Å; F118-E121 PolarHBondContact O-N 2.86Å; F118-E121 VanDerWaalsContact O-N 3.1Å; E121-I123 HydrophobicContact CB-CG1 4.47Å; E121-Y169 HydrophobicContact CB-CD1 4.28Å; E121-Y169 HydrophobicContact CB-CE1 3.94Å; E121-Y169 HydrophobicContact CG-CD1 4.08Å; E121-Y169 HydrophobicContact CG-CE1 4.03Å; E121-R210 VanDerWaalsContact CD-CD 3.47Å; E121-R210 WeakPolarHBondContact OE2-CD 3.47Å; E121-R210 IonicContact OE2-CZ 2.83Å; E121-R210 IonicContact OE2-NE 3.23Å; E121-R210 IonicContact OE2-NH1 3.64Å; E121-R210 PolarHBondContact OE2-NH1 3.37Å
122	E	85.5	Confident	89.4	Confident	113 Å²	113	34 Å²	34	53%	0.528	18%	0.18	S	C	.	.			trans	-94	120.5	168.1	-68.2	174.4	-177.6	0	0	109.3	F93 Y124	F93-E122 HydrophobicContact CD1-CB 4.25Å; F93-E122 HydrophobicContact CD1-CG 4.44Å; F93-E122 HydrophobicContact CE1-CB 4.2Å; F93-E122 HydrophobicContact CE1-CG 4.22Å; E122-Y124 HydrophobicContact CB-CE2 3.71Å; E122-Y124 PolarHBondContact OE2-OH 2.89Å
123	I	87.9	Confident	89.7	Confident	5 Å²	5	32.8 Å²	32.8	3%	0.026	17%	0.172	C	C	.	.			trans	-116.1	114.8	-175.3	-60	161.7	0	0	0	108.5	Y94 Y96 F118 E121 S125 L127 Y169	Y94-I123 PolarHBondContact N-O 3.14Å; Y96-I123 HydrophobicContact CD2-CD1 3.93Å; Y96-I123 HydrophobicContact CE2-CD1 4.16Å; Y96-I123 HydrophobicContact CE2-CG2 4.14Å; F118-I123 HydrophobicContact CB-CD1 4Å; F118-I123 HydrophobicContact CD2-CD1 3.76Å; F118-I123 HydrophobicContact CG-CD1 4.26Å; E121-I123 HydrophobicContact CB-CG1 4.47Å; I123-S125 VanDerWaalsContact CG2-O 3.31Å; I123-S125 WeakPolarHBondContact CG2-O 3.41Å; I123-L127 HydrophobicContact CD1-CD1 3.79Å; I123-L127 HydrophobicContact CG1-CD1 4.3Å; I123-L127 HydrophobicContact CG2-CD1 3.87Å; I123-L127 HydrophobicContact CG2-CD2 4.04Å; I123-L127 HydrophobicContact CG2-CG 3.72Å; I123-Y169 HydrophobicContact CG1-CE1 3.98Å
124	Y	82.1	Confident	90.1	Very high	91 Å²	91	32.3 Å²	32.3	36%	0.357	17%	0.169	S	C	.	.			trans	-95.4	0.8	-171.6	-66.2	-89.3	0	0	0	113.8	F93 E122	F93-Y124 HydrophobicContact CD1-CD1 4.43Å; F93-Y124 HydrophobicContact CD1-CE1 4.08Å; F93-Y124 HydrophobicContact CE1-CD1 4.18Å; F93-Y124 AromaticContact CE1-CE1 3.42Å; F93-Y124 HydrophobicContact CE1-CE1 3.42Å; F93-Y124 VanDerWaalsContact CE1-CE1 3.42Å; F93-Y124 HydrophobicContact CE1-CE2 4.44Å; F93-Y124 AromaticContact CE1-CZ 3.57Å; F93-Y124 AromaticContact CZ-CE1 3.96Å; F93-Y124 HydrophobicContact CZ-CE1 3.96Å; E122-Y124 HydrophobicContact CB-CE2 3.71Å; E122-Y124 PolarHBondContact OE2-OH 2.89Å
125	S	82.9	Confident	90.2	Very high	17 Å²	17	28.7 Å²	28.7	12%	0.119	15%	0.153	C	C	.	.	S	Bend	trans	-155.4	141.6	-165.3	55	0	0	0	0	111.6	I123 L127 N147	I123-S125 VanDerWaalsContact CG2-O 3.31Å; I123-S125 WeakPolarHBondContact CG2-O 3.41Å; S125-L127 PolarHBondContact O-N 2.89Å; S125-N147 WeakPolarHBondContact CB-OD1 3.37Å; S125-N147 PolarHBondContact OG-ND2 2.9Å; S125-N147 PolarHBondContact OG-OD1 2.89Å; S125-N147 VanDerWaalsContact OG-OD1 3.09Å
126	D	85.3	Confident	90.2	Very high	46 Å²	46	32.3 Å²	32.3	25%	0.246	17%	0.172	C	C	.	.			trans	-63.6	120.1	-177.4	-175.8	35.8	0	0	0	113	Y94 Y96 H623	Y94-D126 HydrophobicContact CE1-CB 4.07Å; Y96-D126 WeakPolarHBondContact OH-CA 3.39Å; Y96-D126 PolarHBondContact OH-OD1 2.89Å; D126-H623 IonicContact OD2-CE1 3.53Å; D126-H623 PolarHBondContact OD2-CE1 3.03Å; D126-H623 IonicContact OD2-ND1 2.85Å; D126-H623 PolarHBondContact OD2-ND1 2.78Å
127	L	89.3	Confident	90.2	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	135.7	-177.6	-60.1	-175.7	0	0	0	112.4	Y96 F118 I123 S125 L129 N147 Y169	Y96-L127 HydrophobicContact CD2-CD1 4.36Å; Y96-L127 HydrophobicContact CE2-CB 4.15Å; Y96-L127 HydrophobicContact CE2-CD1 3.97Å; Y96-L127 HydrophobicContact CE2-CG 3.95Å; Y96-L127 PolarHBondContact OH-N 3.26Å; F118-L127 HydrophobicContact CD2-CD1 4.08Å; F118-L127 HydrophobicContact CE2-CD1 3.87Å; I123-L127 HydrophobicContact CD1-CD1 3.79Å; I123-L127 HydrophobicContact CG1-CD1 4.3Å; I123-L127 HydrophobicContact CG2-CD1 3.87Å; I123-L127 HydrophobicContact CG2-CD2 4.04Å; I123-L127 HydrophobicContact CG2-CG 3.72Å; S125-L127 PolarHBondContact O-N 2.89Å; L127-L129 HydrophobicContact CB-CD2 4.01Å; L127-L129 PolarHBondContact O-N 3.08Å; L127-N147 HydrophobicContact CD2-CB 4.2Å; L127-Y169 HydrophobicContact CD1-CD2 3.67Å; L127-Y169 HydrophobicContact CD1-CE2 4.02Å; L127-Y169 HydrophobicContact CD1-CG 4.18Å; L127-Y169 HydrophobicContact CD2-CD2 4Å; L127-Y169 HydrophobicContact CD2-CE2 3.81Å
128	Y	88.4	Confident	90	Very high	17 Å²	17	31.8 Å²	31.8	7%	0.067	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	113.8	165	-170.3	-76.7	0	0	0	110.4	T130 G145 F146 T148 T618 E620 H623	Y128-T130 WeakPolarHBondContact CE1-OG1 3.22Å; Y128-G145 WeakPolarHBondContact O-CA 3.42Å; Y128-F146 WeakPolarHBondContact CB-O 3.42Å; Y128-F146 HydrophobicContact CD1-CD1 4.27Å; Y128-F146 AromaticContact CD1-CE1 3.41Å; Y128-F146 HydrophobicContact CD1-CE1 3.41Å; Y128-F146 VanDerWaalsContact CD1-CE1 3.41Å; Y128-F146 AromaticContact CD1-CE2 3.84Å; Y128-F146 HydrophobicContact CD1-CE2 3.84Å; Y128-F146 AromaticContact CD1-CZ 3.14Å; Y128-F146 HydrophobicContact CD1-CZ 3.14Å; Y128-F146 HydrophobicContact CD2-CE2 4.44Å; Y128-F146 HydrophobicContact CD2-CZ 4.35Å; Y128-F146 HydrophobicContact CE1-CE1 4.17Å; Y128-F146 AromaticContact CE1-CZ 3.88Å; Y128-F146 HydrophobicContact CE1-CZ 3.88Å; Y128-F146 HydrophobicContact CG-CD2 4.41Å; Y128-F146 HydrophobicContact CG-CE1 4.09Å; Y128-F146 AromaticContact CG-CE2 3.66Å; Y128-F146 HydrophobicContact CG-CE2 3.66Å; Y128-F146 AromaticContact CG-CZ 3.47Å; Y128-F146 HydrophobicContact CG-CZ 3.47Å; Y128-F146 VanDerWaalsContact CG-CZ 3.47Å; Y128-F146 PolarHBondContact N-O 2.71Å; Y128-F146 PolarHBondContact O-N 3.33Å; Y128-F146 VanDerWaalsContact O-N 3.14Å; Y128-T148 HydrophobicContact CD2-CG2 4.33Å; Y128-T618 VanDerWaalsContact CE1-OG1 3.32Å; Y128-T618 WeakPolarHBondContact CE1-OG1 3.41Å; Y128-T618 VanDerWaalsContact CZ-OG1 3.31Å; Y128-T618 PolarHBondContact OH-OG1 3.02Å; Y128-E620 HydrophobicContact CE2-CB 3.91Å; Y128-E620 VanDerWaalsContact OH-CA 3.28Å; Y128-E620 WeakPolarHBondContact OH-CA 3.41Å; Y128-E620 WeakPolarHBondContact OH-CB 3.5Å; Y128-E620 WeakPolarHBondContact OH-CG 3.4Å; Y128-E620 PolarHBondContact OH-OE1 2.78Å; Y128-E620 VanDerWaalsContact OH-OE1 3.1Å; Y128-H623 AromaticContact CD2-CD2 3.54Å; Y128-H623 AromaticContact CD2-NE2 3.71Å; Y128-H623 AromaticContact CE2-CD2 3.89Å
129	L	93.4	Very high	89.9	Confident	2 Å²	2	34.9 Å²	34.9	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	135.7	178.4	-58.9	-165.4	0	0	0	114.1	Y81 Y96 L117 F118 L127 F144 T618	Y81-L129 HydrophobicContact CD1-CD1 4.35Å; Y81-L129 HydrophobicContact CD2-CD1 3.57Å; Y81-L129 HydrophobicContact CD2-CG 4.46Å; Y81-L129 HydrophobicContact CE2-CD1 3.84Å; Y81-L129 HydrophobicContact CE2-CG 4.25Å; Y81-L129 HydrophobicContact CG-CD1 3.83Å; Y96-L129 HydrophobicContact CD1-CD1 3.81Å; Y96-L129 HydrophobicContact CD1-CG 4.44Å; Y96-L129 HydrophobicContact CE1-CD1 4.36Å; Y96-L129 HydrophobicContact CG-CD1 4.42Å; L117-L129 HydrophobicContact CD1-CD1 3.98Å; F118-L129 HydrophobicContact CE2-CD2 3.8Å; F118-L129 HydrophobicContact CZ-CD2 3.87Å; L127-L129 HydrophobicContact CB-CD2 4.01Å; L127-L129 PolarHBondContact O-N 3.08Å; L129-F144 WeakPolarHBondContact CA-O 3.24Å; L129-T618 PolarHBondContact O-OG1 3.37Å
130	T	95	Very high	90.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	125.4	165.6	-61.3	0	0	0	0	110.1	Y128 I143 F144 F220 R616	Y128-T130 WeakPolarHBondContact CE1-OG1 3.22Å; T130-I143 WeakPolarHBondContact O-CA 3.01Å; T130-F144 PolarHBondContact N-O 3.35Å; T130-F144 PolarHBondContact O-N 3.12Å; T130-F220 HydrophobicContact CG2-CE1 3.96Å; T130-F220 HydrophobicContact CG2-CZ 3.93Å; T130-R616 HydrophobicContact CG2-CG 3.46Å; T130-R616 VanDerWaalsContact CG2-CG 3.46Å; T130-R616 PolarHBondContact OG1-NH2 2.83Å
131	V	96.9	Very high	90.9	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	135	173.1	-176.7	0	0	0	0	109.8	L69 L79 L98 I141 V142 I143 M617	L69-V131 HydrophobicContact CD1-CB 4.35Å; L69-V131 HydrophobicContact CD1-CG2 3.56Å; L79-V131 HydrophobicContact CD1-CG1 3.84Å; L98-V131 HydrophobicContact CD1-CG2 4.11Å; L98-V131 HydrophobicContact CD2-CG2 4.49Å; V131-I141 HydrophobicContact CG1-CD1 3.84Å; V131-V142 CarbonylContact C-O 3.52Å; V131-V142 WeakPolarHBondContact CA-O 3.21Å; V131-I143 HydrophobicContact CG1-CG1 4.31Å; V131-I143 HydrophobicContact CG2-CG1 3.95Å; V131-I143 HydrophobicContact CG2-CG2 4.16Å; V131-M617 HydrophobicContact CB-CB 4.49Å; V131-M617 HydrophobicContact CB-CE 4.44Å; V131-M617 HydrophobicContact CG1-CE 4.01Å; V131-M617 PolarHBondContact N-O 3.19Å; V131-M617 PolarHBondContact O-N 3.06Å
132	C	97.1	Very high	91.4	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	137.6	-175	-69.3	0	0	0	0	112.7	V142 L226 N615	C132-V142 PolarHBondContact N-O 2.85Å; C132-V142 PolarHBondContact O-N 2.93Å; C132-L226 HydrophobicContact CB-CD1 3.26Å; C132-N615 CarbonylContact C-O 3.54Å; C132-N615 VanDerWaalsContact CA-O 3.27Å; C132-N615 WeakPolarHBondContact CA-O 3.15Å
133	E	95.8	Very high	92	Very high	4 Å²	4	22 Å²	22	2%	0.019	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	129.7	167.9	-65.3	167.7	99.8	0	0	110.9	T72 K73 I141 N615 M617	T72-E133 VanDerWaalsContact CA-OE2 3.29Å; T72-E133 WeakPolarHBondContact CA-OE2 3.35Å; T72-E133 WeakPolarHBondContact CB-OE1 3.41Å; K73-E133 HydrophobicContact CD-CB 4.18Å; K73-E133 HydrophobicContact CG-CB 4.44Å; K73-E133 VanDerWaalsContact N-CD 3.29Å; K73-E133 PolarHBondContact N-OE1 3.47Å; K73-E133 PolarHBondContact N-OE2 2.93Å; E133-I141 HydrophobicContact CG-CG2 3.72Å; E133-N615 HydrophobicContact CB-CB 4.18Å; E133-N615 PolarHBondContact N-O 3.02Å; E133-N615 PolarHBondContact O-N 2.87Å; E133-N615 WeakPolarHBondContact OE2-CB 3.41Å; E133-N615 PolarHBondContact OE2-ND2 3.45Å; E133-M617 HydrophobicContact CG-CE 4.15Å
134	W	95.4	Very high	92.4	Very high	0 Å²	0	22 Å²	22	0%	0	11%	0.111	C	C	.	.			trans	-56.9	156.7	173.3	-84.3	-78.5	0	0	0	113.3	K73 N136 D137 K140 V142 V172 L226 K228 V231	K73-W134 PolarHBondContact NZ-O 2.75Å; W134-N136 PolarHBondContact O-N 2.86Å; W134-D137 HydrophobicContact CB-CB 3.91Å; W134-D137 HydrophobicContact CG-CB 4.45Å; W134-K140 HydrophobicContact CE3-CD 4.3Å; W134-K140 HydrophobicContact CE3-CG 3.98Å; W134-K140 HydrophobicContact CH2-CD 3.59Å; W134-K140 HydrophobicContact CH2-CG 4.13Å; W134-K140 HydrophobicContact CZ3-CB 4.03Å; W134-K140 HydrophobicContact CZ3-CD 3.46Å; W134-K140 VanDerWaalsContact CZ3-CD 3.46Å; W134-K140 HydrophobicContact CZ3-CG 3.44Å; W134-K140 VanDerWaalsContact CZ3-CG 3.44Å; W134-V142 HydrophobicContact CD2-CG2 4.45Å; W134-V142 HydrophobicContact CE3-CG2 4.12Å; W134-V142 HydrophobicContact CH2-CG2 3.12Å; W134-V142 HydrophobicContact CZ2-CG2 3.5Å; W134-V142 HydrophobicContact CZ3-CG2 3.44Å; W134-V142 VanDerWaalsContact CZ3-CG2 3.44Å; W134-V172 HydrophobicContact CH2-CG1 3.92Å; W134-V172 HydrophobicContact CZ3-CG1 4.27Å; W134-L226 HydrophobicContact CZ2-CD2 4.11Å; W134-K228 PolarHBondContact NE1-O 2.68Å; W134-V231 PolarHBondContact NE1-O 3.02Å
135	P	92.6	Very high	92.9	Very high	7 Å²	7	17.7 Å²	17.7	5%	0.045	9%	0.094	C	C	.	.	S	Bend	trans	-44.2	-59.8	179.5	-33.3	37.9	0	0	0	115.2	K73 L226 D229 S611 R612 I614	K73-P135 VanDerWaalsContact NZ-C 3.32Å; K73-P135 VanDerWaalsContact NZ-CA 3.31Å; K73-P135 PolarHBondContact NZ-O 3.32Å; P135-L226 WeakPolarHBondContact CD-O 3.22Å; P135-D229 WeakPolarHBondContact CD-OD1 3.34Å; P135-S611 VanDerWaalsContact O-O 3.13Å; P135-R612 VanDerWaalsContact CB-O 3.3Å; P135-R612 WeakPolarHBondContact CB-O 3.38Å; P135-I614 HydrophobicContact CG-CG1 3.98Å
136	N	92.1	Very high	93.1	Very high	80 Å²	80	18.7 Å²	18.7	43%	0.428	10%	0.096	S	C	.	.	S	Bend	trans	-125.4	-16.4	-174.8	-43.8	-81.2	0	0	0	112.7	W134 D229	W134-N136 PolarHBondContact O-N 2.86Å; N136-D229 WeakPolarHBondContact CB-OD2 3.46Å; N136-D229 PolarHBondContact N-OD1 3.04Å; N136-D229 PolarHBondContact ND2-OD2 2.75Å
137	D	91.6	Very high	92.8	Very high	18 Å²	18	18.5 Å²	18.5	10%	0.096	10%	0.095	C	C	.	.			trans	-73.2	126.7	170	-171	3.7	0	0	0	110.9	W134 T139 K140 D229	W134-D137 HydrophobicContact CB-CB 3.91Å; W134-D137 HydrophobicContact CG-CB 4.45Å; D137-T139 WeakPolarHBondContact OD1-CB 3.47Å; D137-T139 WeakPolarHBondContact OD1-CG2 3.44Å; D137-T139 PolarHBondContact OD1-N 3.35Å; D137-T139 PolarHBondContact OD1-OG1 3.13Å; D137-T139 PolarHBondContact OD2-OG1 2.85Å; D137-K140 VanDerWaalsContact OD2-CE 3.25Å; D137-K140 WeakPolarHBondContact OD2-CE 3.37Å; D137-K140 WeakPolarHBondContact OD2-CG 3.44Å; D137-K140 IonicContact OD2-NZ 3.14Å; D137-K140 PolarHBondContact OD2-NZ 2.88Å; D137-D229 HydrophobicContact CB-CB 4.36Å; D137-D229 PolarHBondContact N-OD1 2.98Å
138	H	90.8	Very high	91.6	Very high	105 Å²	105	19.8 Å²	19.8	49%	0.486	10%	0.103	S	C	.	.			trans	-123.2	8.6	178.4	-57.4	-26.3	0	0	0	112.1	M175	H138-M175 WeakPolarHBondContact O-CB 3.49Å; H138-M175 WeakPolarHBondContact O-CG 3.45Å
139	T	91.4	Very high	90	Very high	68 Å²	68	25.8 Å²	25.8	42%	0.417	13%	0.125	S	C	.	.	S	Bend	trans	-84.5	-20.4	-179.3	65.3	0	0	0	0	112.8	D137 M175	D137-T139 WeakPolarHBondContact OD1-CB 3.47Å; D137-T139 WeakPolarHBondContact OD1-CG2 3.44Å; D137-T139 PolarHBondContact OD1-N 3.35Å; D137-T139 PolarHBondContact OD1-OG1 3.13Å; D137-T139 PolarHBondContact OD2-OG1 2.85Å; T139-M175 PolarHBondContact O-N 3.26Å
140	K	93.3	Very high	87.7	Confident	2 Å²	2	29.9 Å²	29.9	1%	0.009	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	163.5	-177.7	47.5	166.9	178	-62.9	0	111.7	W134 D137 V172 A173 I245	W134-K140 HydrophobicContact CE3-CD 4.3Å; W134-K140 HydrophobicContact CE3-CG 3.98Å; W134-K140 HydrophobicContact CH2-CD 3.59Å; W134-K140 HydrophobicContact CH2-CG 4.13Å; W134-K140 HydrophobicContact CZ3-CB 4.03Å; W134-K140 HydrophobicContact CZ3-CD 3.46Å; W134-K140 VanDerWaalsContact CZ3-CD 3.46Å; W134-K140 HydrophobicContact CZ3-CG 3.44Å; W134-K140 VanDerWaalsContact CZ3-CG 3.44Å; D137-K140 VanDerWaalsContact OD2-CE 3.25Å; D137-K140 WeakPolarHBondContact OD2-CE 3.37Å; D137-K140 WeakPolarHBondContact OD2-CG 3.44Å; D137-K140 IonicContact OD2-NZ 3.14Å; D137-K140 PolarHBondContact OD2-NZ 2.88Å; K140-V172 HydrophobicContact CB-CG1 4.24Å; K140-V172 HydrophobicContact CD-CG1 3.8Å; K140-A173 CarbonylContact C-O 3.56Å; K140-A173 WeakPolarHBondContact CA-O 3.3Å; K140-A173 WeakPolarHBondContact CB-O 3.44Å; K140-I245 HydrophobicContact CD-CG2 4.47Å; K140-I245 WeakPolarHBondContact CE-O 3.28Å; K140-I245 PolarHBondContact NZ-O 3.34Å
141	I	96.1	Very high	85.2	Confident	1 Å²	1	31.7 Å²	31.7	1%	0.005	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	157.7	173.7	57.6	172.7	0	0	0	110.9	L79 L98 W100 V131 E133 I143 V172 A173 M175	L79-I141 HydrophobicContact CD1-CD1 4.25Å; L98-I141 HydrophobicContact CD2-CD1 3.75Å; W100-I141 HydrophobicContact CH2-CD1 4.18Å; W100-I141 HydrophobicContact CZ2-CD1 3.46Å; W100-I141 VanDerWaalsContact CZ2-CD1 3.46Å; W100-I141 HydrophobicContact CZ2-CG1 4.17Å; V131-I141 HydrophobicContact CG1-CD1 3.84Å; E133-I141 HydrophobicContact CG-CG2 3.72Å; I141-I143 HydrophobicContact CD1-CD1 4.24Å; I141-I143 HydrophobicContact CG1-CD1 4.11Å; I141-V172 WeakPolarHBondContact O-CA 3.35Å; I141-A173 HydrophobicContact CG1-CB 4.4Å; I141-A173 PolarHBondContact N-O 3.18Å; I141-A173 PolarHBondContact O-N 2.88Å; I141-M175 HydrophobicContact CD1-SD 4.35Å; I141-M175 HydrophobicContact CG1-SD 4.4Å; I141-M175 HydrophobicContact CG2-CG 4.04Å; I141-M175 HydrophobicContact CG2-SD 3.63Å
142	V	97.1	Very high	82.4	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	135	174.3	-168.4	0	0	0	0	109.9	V131 C132 W134 F144 I170 V172 L226	V131-V142 CarbonylContact C-O 3.52Å; V131-V142 WeakPolarHBondContact CA-O 3.21Å; C132-V142 PolarHBondContact N-O 2.85Å; C132-V142 PolarHBondContact O-N 2.93Å; W134-V142 HydrophobicContact CD2-CG2 4.45Å; W134-V142 HydrophobicContact CE3-CG2 4.12Å; W134-V142 HydrophobicContact CH2-CG2 3.12Å; W134-V142 HydrophobicContact CZ2-CG2 3.5Å; W134-V142 HydrophobicContact CZ3-CG2 3.44Å; W134-V142 VanDerWaalsContact CZ3-CG2 3.44Å; V142-F144 HydrophobicContact CB-CE2 4.07Å; V142-F144 HydrophobicContact CG1-CD2 4.03Å; V142-F144 HydrophobicContact CG1-CE1 4.4Å; V142-F144 HydrophobicContact CG1-CE2 3.5Å; V142-F144 HydrophobicContact CG1-CZ 3.72Å; V142-I170 HydrophobicContact CG1-CG2 3.91Å; V142-V172 HydrophobicContact CG1-CG2 4.34Å; V142-V172 HydrophobicContact CG2-CG2 4.24Å; V142-L226 HydrophobicContact CB-CD1 4.47Å; V142-L226 HydrophobicContact CB-CD2 4.44Å; V142-L226 HydrophobicContact CG2-CD1 4.45Å; V142-L226 HydrophobicContact CG2-CD2 3.77Å
143	I	97.1	Very high	79.9	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	126	172.5	-53.8	86.4	0	0	0	107.7	L98 L117 F118 T130 V131 I141 I170 T171 A173	L98-I143 HydrophobicContact CD2-CD1 4.01Å; L98-I143 HydrophobicContact CD2-CG1 3.92Å; L117-I143 HydrophobicContact CD1-CG2 3.93Å; L117-I143 HydrophobicContact CD2-CB 4.27Å; L117-I143 HydrophobicContact CD2-CD1 3.94Å; L117-I143 HydrophobicContact CD2-CG1 3.93Å; L117-I143 HydrophobicContact CD2-CG2 4.39Å; F118-I143 HydrophobicContact CZ-CG2 4.22Å; T130-I143 WeakPolarHBondContact O-CA 3.01Å; V131-I143 HydrophobicContact CG1-CG1 4.31Å; V131-I143 HydrophobicContact CG2-CG1 3.95Å; V131-I143 HydrophobicContact CG2-CG2 4.16Å; I141-I143 HydrophobicContact CD1-CD1 4.24Å; I141-I143 HydrophobicContact CG1-CD1 4.11Å; I143-I170 WeakPolarHBondContact O-CA 3.22Å; I143-T171 HydrophobicContact CD1-CG2 4.28Å; I143-T171 VanDerWaalsContact CD1-O 3.28Å; I143-T171 WeakPolarHBondContact CD1-O 3.44Å; I143-T171 PolarHBondContact N-O 2.68Å; I143-T171 PolarHBondContact O-N 2.81Å; I143-A173 HydrophobicContact CD1-CB 4.21Å
144	F	95.8	Very high	77.6	Confident	4 Å²	4	45.2 Å²	45.2	2%	0.018	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	127.1	170.7	-61.6	-94	0	0	0	108.7	L129 T130 V142 I170 F220 L226 V232 L234	L129-F144 WeakPolarHBondContact CA-O 3.24Å; T130-F144 PolarHBondContact N-O 3.35Å; T130-F144 PolarHBondContact O-N 3.12Å; V142-F144 HydrophobicContact CB-CE2 4.07Å; V142-F144 HydrophobicContact CG1-CD2 4.03Å; V142-F144 HydrophobicContact CG1-CE1 4.4Å; V142-F144 HydrophobicContact CG1-CE2 3.5Å; V142-F144 HydrophobicContact CG1-CZ 3.72Å; F144-I170 HydrophobicContact CD1-CD1 3.74Å; F144-I170 HydrophobicContact CD1-CG1 3.88Å; F144-I170 HydrophobicContact CE1-CD1 3.6Å; F144-I170 HydrophobicContact CE1-CG1 4.22Å; F144-F220 HydrophobicContact CB-CE2 4.14Å; F144-F220 HydrophobicContact CB-CZ 4.21Å; F144-F220 AromaticContact CD1-CE2 3.89Å; F144-F220 HydrophobicContact CD1-CE2 3.89Å; F144-F220 AromaticContact CD2-CE2 3.83Å; F144-F220 HydrophobicContact CD2-CE2 3.83Å; F144-F220 AromaticContact CD2-CZ 3.89Å; F144-F220 HydrophobicContact CD2-CZ 3.89Å; F144-F220 HydrophobicContact CE1-CE2 4.2Å; F144-F220 HydrophobicContact CE2-CE2 4.16Å; F144-F220 HydrophobicContact CE2-CZ 4.42Å; F144-F220 AromaticContact CG-CE2 3.69Å; F144-F220 HydrophobicContact CG-CE2 3.69Å; F144-F220 HydrophobicContact CG-CZ 4.02Å; F144-F220 HydrophobicContact CZ-CE2 4.33Å; F144-L226 HydrophobicContact CE2-CD1 4.22Å; F144-V232 HydrophobicContact CE1-CG2 4.34Å; F144-V232 HydrophobicContact CZ-CG2 3.87Å; F144-L234 HydrophobicContact CE1-CD2 4.14Å
145	G	93.3	Very high	75.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	133.9	165.3	0	0	0	0	0	109.8	Y128 Y169	Y128-G145 WeakPolarHBondContact O-CA 3.42Å; G145-Y169 PolarHBondContact N-O 2.96Å; G145-Y169 PolarHBondContact O-N 3.19Å
146	F	87.4	Confident	73.4	Confident	38 Å²	38	53.8 Å²	53.8	17%	0.167	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	144.9	170.5	58.8	-97.4	0	0	0	110.8	Y128 I168	Y128-F146 WeakPolarHBondContact CB-O 3.42Å; Y128-F146 HydrophobicContact CD1-CD1 4.27Å; Y128-F146 AromaticContact CD1-CE1 3.41Å; Y128-F146 HydrophobicContact CD1-CE1 3.41Å; Y128-F146 VanDerWaalsContact CD1-CE1 3.41Å; Y128-F146 AromaticContact CD1-CE2 3.84Å; Y128-F146 HydrophobicContact CD1-CE2 3.84Å; Y128-F146 AromaticContact CD1-CZ 3.14Å; Y128-F146 HydrophobicContact CD1-CZ 3.14Å; Y128-F146 HydrophobicContact CD2-CE2 4.44Å; Y128-F146 HydrophobicContact CD2-CZ 4.35Å; Y128-F146 HydrophobicContact CE1-CE1 4.17Å; Y128-F146 AromaticContact CE1-CZ 3.88Å; Y128-F146 HydrophobicContact CE1-CZ 3.88Å; Y128-F146 HydrophobicContact CG-CD2 4.41Å; Y128-F146 HydrophobicContact CG-CE1 4.09Å; Y128-F146 AromaticContact CG-CE2 3.66Å; Y128-F146 HydrophobicContact CG-CE2 3.66Å; Y128-F146 AromaticContact CG-CZ 3.47Å; Y128-F146 HydrophobicContact CG-CZ 3.47Å; Y128-F146 VanDerWaalsContact CG-CZ 3.47Å; Y128-F146 PolarHBondContact N-O 2.71Å; Y128-F146 PolarHBondContact O-N 3.33Å; Y128-F146 VanDerWaalsContact O-N 3.14Å; F146-I168 HydrophobicContact CB-CG1 4.46Å
147	N	79.6	Confident	71.2	Confident	43 Å²	43	53.5 Å²	53.5	23%	0.23	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	139.9	-176.9	-163.5	1.1	0	0	0	111.4	S125 L127	S125-N147 WeakPolarHBondContact CB-OD1 3.37Å; S125-N147 PolarHBondContact OG-ND2 2.9Å; S125-N147 PolarHBondContact OG-OD1 2.89Å; S125-N147 VanDerWaalsContact OG-OD1 3.09Å; L127-N147 HydrophobicContact CD2-CB 4.2Å
148	T	62.3	Low	69	Low	27 Å²	27	59.6 Å²	59.6	17%	0.166	33%	0.33	C	S	.	.			trans	-97.2	139.2	167.9	73.7	0	0	0	0	108.9	Y128 S150	Y128-T148 HydrophobicContact CD2-CG2 4.33Å; T148-S150 PolarHBondContact O-N 3.28Å
149	R	56.3	Low	67	Low	142 Å²	142	61.8 Å²	61.8	54%	0.536	34%	0.343	S	S	.	.	S	Bend	trans	-68.1	28.5	177.2	-75.1	-177.1	158.2	-142.6	1.7	113.5	E163	R149-E163 IonicContact CZ-OE1 3.24Å; R149-E163 IonicContact NH1-OE1 3.12Å; R149-E163 PolarHBondContact NH1-OE1 2.77Å; R149-E163 PolarHBondContact NH2-O 2.95Å; R149-E163 IonicContact NH2-OE1 2.82Å; R149-E163 PolarHBondContact NH2-OE1 2.94Å
150	S	44.9	Very low	65	Low	88 Å²	88	65.7 Å²	65.7	62%	0.615	36%	0.358	S	S	*	.			trans	-111.1	22.3	-168.9	-53.2	0	0	0	0	113.1	T148 S152	T148-S150 PolarHBondContact O-N 3.28Å; S150-S152 PolarHBondContact O-N 3.4Å
151	S	41.4	Very low	62.9	Low	39 Å²	39	68.3 Å²	68.3	27%	0.273	38%	0.377	S	S	.	.			trans	-63.1	102.7	163.6	36.3	0	0	0	0	109.2	S153 N157	S151-S153 PolarHBondContact O-N 2.84Å; S151-N157 PolarHBondContact O-ND2 2.85Å; S151-N157 PolarHBondContact O-OD1 2.79Å; S151-N157 PolarHBondContact OG-OD1 2.75Å
152	S	39.9	Very low	61	Low	118 Å²	118	72.7 Å²	72.7	83%	0.825	40%	0.4	S	S	*	.			trans	-74.2	-4.8	176.4	58	0	0	0	0	113.5	S150 V154	S150-S152 PolarHBondContact O-N 3.4Å; S152-V154 PolarHBondContact O-N 3.1Å
153	S	43.8	Very low	59.3	Low	47 Å²	47	78.2 Å²	78.2	33%	0.329	43%	0.426	S	S	.	.			trans	-71.9	104.2	172.9	175.9	0	0	0	0	110.4	S151 L155 M156 N157	S151-S153 PolarHBondContact O-N 2.84Å; S153-L155 PolarHBondContact O-N 2.87Å; S153-M156 PolarHBondContact O-N 3.5Å; S153-M156 VanDerWaalsContact O-N 3.15Å; S153-M156 PolarHBondContact OG-N 3.14Å; S153-M156 VanDerWaalsContact OG-N 3.15Å; S153-N157 PolarHBondContact O-N 3.28Å; S153-N157 VanDerWaalsContact O-N 3.14Å
154	V	48.1	Very low	58	Low	122 Å²	122	83.4 Å²	83.4	74%	0.739	45%	0.453	S	S	*	.	H	α-helix	trans	-56.2	-28.7	173	-179.3	0	0	0	0	111.4	S152 L158	S152-V154 PolarHBondContact O-N 3.1Å; V154-L158 WeakPolarHBondContact O-CB 3.31Å; V154-L158 PolarHBondContact O-N 2.71Å
155	L	50.4	Low	57.3	Low	130 Å²	130	85.6 Å²	85.6	68%	0.681	47%	0.466	S	S	*	.	H	α-helix	trans	-74.5	-42.9	176.2	-72	165.9	0	0	0	112.6	S153 L158 M159	S153-L155 PolarHBondContact O-N 2.87Å; L155-L158 PolarHBondContact O-N 2.97Å; L155-M159 PolarHBondContact O-N 2.96Å; L155-M159 VanDerWaalsContact O-N 3.08Å
156	M	48.1	Very low	57	Low	58 Å²	58	89.4 Å²	89.4	29%	0.286	48%	0.48	S	S	.	.	H	α-helix	trans	-67.4	-39.7	178.1	-77.4	178.9	161.5	0	0	112.4	S153 L158 M159 M160	S153-M156 PolarHBondContact O-N 3.5Å; S153-M156 VanDerWaalsContact O-N 3.15Å; S153-M156 PolarHBondContact OG-N 3.14Å; S153-M156 VanDerWaalsContact OG-N 3.15Å; M156-L158 PolarHBondContact O-N 2.82Å; M156-M159 PolarHBondContact O-N 2.72Å; M156-M160 PolarHBondContact O-N 3.1Å
157	N	47.1	Very low	57.1	Low	73 Å²	73	89 Å²	89	39%	0.39	48%	0.479	S	S	.	.	H	α-helix	trans	-67.1	-24.2	176.1	-62.5	-16.8	0	0	0	112.3	S151 S153 S161	S151-N157 PolarHBondContact O-ND2 2.85Å; S151-N157 PolarHBondContact O-OD1 2.79Å; S151-N157 PolarHBondContact OG-OD1 2.75Å; S153-N157 PolarHBondContact O-N 3.28Å; S153-N157 VanDerWaalsContact O-N 3.14Å; N157-S161 WeakPolarHBondContact CA-OG 3.49Å; N157-S161 PolarHBondContact O-OG 3.5Å
158	L	45.8	Very low	57.7	Low	147 Å²	147	88.3 Å²	88.3	77%	0.77	48%	0.476	S	S	*	.	H	α-helix	trans	-84.6	-22.6	176.6	-165.1	69.1	0	0	0	113	V154 L155 M156	V154-L158 WeakPolarHBondContact O-CB 3.31Å; V154-L158 PolarHBondContact O-N 2.71Å; L155-L158 PolarHBondContact O-N 2.97Å; M156-L158 PolarHBondContact O-N 2.82Å
159	M	46.8	Very low	59.2	Low	151 Å²	151	87.4 Å²	87.4	74%	0.744	47%	0.469	S	S	*	.	H	α-helix	trans	-106.8	-31.1	-175.9	-79	-174.4	136	0	0	115.7	L155 M156	L155-M159 PolarHBondContact O-N 2.96Å; L155-M159 VanDerWaalsContact O-N 3.08Å; M156-M159 PolarHBondContact O-N 2.72Å
160	M	50.5	Low	61.1	Low	149 Å²	149	80.7 Å²	80.7	73%	0.734	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137.4	-9	-164.1	-69.2	-62.2	-179.9	0	0	117.3	M156 D162	M156-M160 PolarHBondContact O-N 3.1Å; M160-D162 PolarHBondContact O-N 3.36Å
161	S	50	Low	63.6	Low	58 Å²	58	76.5 Å²	76.5	41%	0.406	42%	0.415	S	S	.	.			trans	-90.2	96.3	176.9	62.6	0	0	0	0	112	N157 E163	N157-S161 WeakPolarHBondContact CA-OG 3.49Å; N157-S161 PolarHBondContact O-OG 3.5Å; S161-E163 PolarHBondContact O-N 3.27Å
162	D	54.4	Low	66.2	Low	92 Å²	92	74.7 Å²	74.7	49%	0.492	40%	0.402	S	S	.	.			trans	-64.3	101.8	155.2	-174.8	-14.8	0	0	0	107.5	M160 N164 N165	M160-D162 PolarHBondContact O-N 3.36Å; D162-N164 PolarHBondContact O-N 3.3Å; D162-N164 WeakPolarHBondContact OD1-CB 3.24Å; D162-N164 PolarHBondContact OD1-N 2.88Å; D162-N164 VanDerWaalsContact OD1-N 3.08Å; D162-N165 HydrophobicContact CB-CB 4.48Å; D162-N165 PolarHBondContact O-N 2.88Å; D162-N165 VanDerWaalsContact O-N 3.12Å; D162-N165 PolarHBondContact OD2-ND2 2.83Å
163	E	62.4	Low	68.8	Low	117 Å²	117	69.1 Å²	69.1	55%	0.547	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-24.2	-176.4	-83.3	-151.6	89.2	0	0	113.1	R149 S161	R149-E163 IonicContact CZ-OE1 3.24Å; R149-E163 IonicContact NH1-OE1 3.12Å; R149-E163 PolarHBondContact NH1-OE1 2.77Å; R149-E163 PolarHBondContact NH2-O 2.95Å; R149-E163 IonicContact NH2-OE1 2.82Å; R149-E163 PolarHBondContact NH2-OE1 2.94Å; S161-E163 PolarHBondContact O-N 3.27Å
164	N	70.1	Confident	71.1	Confident	108 Å²	108	66.9 Å²	66.9	58%	0.578	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-18.3	-174.9	-65.6	-3.3	0	0	0	112.9	D162 V214 Y215 F217	D162-N164 PolarHBondContact O-N 3.3Å; D162-N164 WeakPolarHBondContact OD1-CB 3.24Å; D162-N164 PolarHBondContact OD1-N 2.88Å; D162-N164 VanDerWaalsContact OD1-N 3.08Å; N164-V214 WeakPolarHBondContact O-CA 3.34Å; N164-Y215 PolarHBondContact O-N 2.9Å; N164-F217 VanDerWaalsContact O-CE1 3.24Å; N164-F217 WeakPolarHBondContact O-CE1 3.37Å; N164-F217 WeakPolarHBondContact O-CZ 3.48Å
165	N	81.8	Confident	73.2	Confident	51 Å²	51	61.6 Å²	61.6	27%	0.273	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	156.2	-173.7	-59.8	-21.5	0	0	0	111.9	D162 V213	D162-N165 HydrophobicContact CB-CB 4.48Å; D162-N165 PolarHBondContact O-N 2.88Å; D162-N165 VanDerWaalsContact O-N 3.12Å; D162-N165 PolarHBondContact OD2-ND2 2.83Å; N165-V213 CarbonylContact C-O 3.5Å; N165-V213 WeakPolarHBondContact CA-O 3.48Å
166	R	85.6	Confident	75	Confident	80 Å²	80	55.7 Å²	55.7	30%	0.302	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	131.9	165.9	-65.3	178.6	-167	-163.8	-0.5	110.7	Q212 V213 F217	R166-Q212 WeakPolarHBondContact O-CA 3.24Å; R166-V213 HydrophobicContact CB-CG2 3.98Å; R166-V213 PolarHBondContact N-O 2.85Å; R166-V213 WeakPolarHBondContact O-CG2 3.31Å; R166-V213 PolarHBondContact O-N 3.28Å; R166-F217 HydrophobicContact CB-CD1 4.35Å; R166-F217 HydrophobicContact CB-CE1 4.24Å; R166-F217 HydrophobicContact CG-CD1 3.88Å; R166-F217 HydrophobicContact CG-CE1 3.58Å; R166-F217 HydrophobicContact CG-CZ 3.98Å; R166-F217 VanDerWaalsContact NE-CD2 3.31Å; R166-F217 VanDerWaalsContact NE-CE2 3.3Å; R166-F217 VanDerWaalsContact NH2-CD2 3.3Å
167	D	89.4	Confident	76.8	Confident	28 Å²	28	53.6 Å²	53.6	15%	0.15	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	134	168.3	-57.8	-83.3	0	0	0	111.4	Y169 R210 Q212	D167-Y169 HydrophobicContact CB-CD2 4.24Å; D167-Y169 HydrophobicContact CB-CE2 3.49Å; D167-Y169 VanDerWaalsContact CB-CE2 3.49Å; D167-R210 IonicContact OD1-CZ 3.27Å; D167-R210 VanDerWaalsContact OD1-CZ 3.23Å; D167-R210 IonicContact OD1-NE 2.72Å; D167-R210 PolarHBondContact OD1-NE 2.79Å; D167-R210 IonicContact OD1-NH2 3.39Å; D167-R210 PolarHBondContact OD1-NH2 3.39Å; D167-R210 IonicContact OD2-NH2 3.41Å; D167-Q212 VanDerWaalsContact OD1-CG 3.24Å; D167-Q212 WeakPolarHBondContact OD1-CG 3.24Å; D167-Q212 PolarHBondContact OD1-NE2 2.96Å
168	I	92.5	Very high	78.2	Confident	30 Å²	30	53.9 Å²	53.9	15%	0.154	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	123.1	166.9	-58.4	-176.1	0	0	0	107.4	F146 I170 R210 Y211 V213	F146-I168 HydrophobicContact CB-CG1 4.46Å; I168-I170 HydrophobicContact CG2-CD1 4.48Å; I168-I170 HydrophobicContact CG2-CG1 4.22Å; I168-R210 WeakPolarHBondContact O-CA 3.47Å; I168-Y211 HydrophobicContact CB-CD1 4.48Å; I168-Y211 HydrophobicContact CB-CD2 4.48Å; I168-Y211 HydrophobicContact CB-CE1 4.06Å; I168-Y211 HydrophobicContact CB-CE2 4.07Å; I168-Y211 HydrophobicContact CD1-CE2 3.88Å; I168-Y211 HydrophobicContact CG1-CE2 4.37Å; I168-Y211 HydrophobicContact CG2-CE1 3.89Å; I168-Y211 HydrophobicContact CG2-CE2 4.49Å; I168-Y211 PolarHBondContact N-O 3.25Å; I168-Y211 PolarHBondContact O-N 2.97Å; I168-V213 HydrophobicContact CD1-CB 4.45Å; I168-V213 HydrophobicContact CD1-CG1 3.73Å; I168-V213 HydrophobicContact CD1-CG2 3.8Å; I168-V213 HydrophobicContact CG1-CG1 4.41Å; I168-V213 HydrophobicContact CG1-CG2 4.09Å
169	Y	94.8	Very high	79.8	Confident	7 Å²	7	56.6 Å²	56.6	3%	0.027	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	137.7	178.6	-57.1	-96.1	0	0	0	109.4	F118 E121 I123 L127 G145 D167 R210	F118-Y169 HydrophobicContact CB-CD1 4.42Å; F118-Y169 VanDerWaalsContact CD1-CB 3.45Å; F118-Y169 HydrophobicContact CD1-CG 4.45Å; F118-Y169 HydrophobicContact CG-CD1 4.49Å; F118-Y169 HydrophobicContact CG-CG 4.46Å; E121-Y169 HydrophobicContact CB-CD1 4.28Å; E121-Y169 HydrophobicContact CB-CE1 3.94Å; E121-Y169 HydrophobicContact CG-CD1 4.08Å; E121-Y169 HydrophobicContact CG-CE1 4.03Å; I123-Y169 HydrophobicContact CG1-CE1 3.98Å; L127-Y169 HydrophobicContact CD1-CD2 3.67Å; L127-Y169 HydrophobicContact CD1-CE2 4.02Å; L127-Y169 HydrophobicContact CD1-CG 4.18Å; L127-Y169 HydrophobicContact CD2-CD2 4Å; L127-Y169 HydrophobicContact CD2-CE2 3.81Å; G145-Y169 PolarHBondContact N-O 2.96Å; G145-Y169 PolarHBondContact O-N 3.19Å; D167-Y169 HydrophobicContact CB-CD2 4.24Å; D167-Y169 HydrophobicContact CB-CE2 3.49Å; D167-Y169 VanDerWaalsContact CB-CE2 3.49Å; Y169-R210 HydrophobicContact CD1-CB 4.21Å; Y169-R210 HydrophobicContact CD1-CG 4.09Å; Y169-R210 HydrophobicContact CE1-CG 4.03Å
170	I	95.9	Very high	81.3	Confident	2 Å²	2	55.4 Å²	55.4	1%	0.01	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	131.1	-179.6	-58.9	-171.9	0	0	0	109.9	V142 I143 F144 I168 N208 S209 Y211 L234	V142-I170 HydrophobicContact CG1-CG2 3.91Å; I143-I170 WeakPolarHBondContact O-CA 3.22Å; F144-I170 HydrophobicContact CD1-CD1 3.74Å; F144-I170 HydrophobicContact CD1-CG1 3.88Å; F144-I170 HydrophobicContact CE1-CD1 3.6Å; F144-I170 HydrophobicContact CE1-CG1 4.22Å; I168-I170 HydrophobicContact CG2-CD1 4.48Å; I168-I170 HydrophobicContact CG2-CG1 4.22Å; I170-N208 CarbonylContact O-C 3.52Å; I170-N208 WeakPolarHBondContact O-CA 3.43Å; I170-S209 PolarHBondContact N-O 3.11Å; I170-S209 PolarHBondContact O-N 2.9Å; I170-Y211 HydrophobicContact CD1-CE1 3.78Å; I170-Y211 HydrophobicContact CG1-CE1 4.38Å; I170-L234 HydrophobicContact CD1-CD1 3.86Å; I170-L234 HydrophobicContact CD1-CD2 3.23Å; I170-L234 HydrophobicContact CD1-CG 4.19Å
171	T	96.7	Very high	82.7	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	127	168.2	-62.6	0	0	0	0	109.4	L117 F118 I143 V206 L207 N208	L117-T171 HydrophobicContact CD2-CG2 3.84Å; F118-T171 WeakPolarHBondContact CD1-OG1 3.36Å; F118-T171 PolarHBondContact N-OG1 2.88Å; I143-T171 HydrophobicContact CD1-CG2 4.28Å; I143-T171 VanDerWaalsContact CD1-O 3.28Å; I143-T171 WeakPolarHBondContact CD1-O 3.44Å; I143-T171 PolarHBondContact N-O 2.68Å; I143-T171 PolarHBondContact O-N 2.81Å; T171-V206 HydrophobicContact CG2-CG1 3.5Å; T171-V206 VanDerWaalsContact CG2-CG1 3.5Å; T171-L207 CarbonylContact C-O 3.6Å; T171-L207 VanDerWaalsContact CA-O 3.28Å; T171-L207 WeakPolarHBondContact CA-O 3.28Å; T171-N208 WeakPolarHBondContact CB-OD1 3.21Å; T171-N208 WeakPolarHBondContact CG2-OD1 3.42Å; T171-N208 PolarHBondContact OG1-OD1 2.96Å
172	V	96.6	Very high	84	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.006	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	120	165.8	-177.7	0	0	0	0	107.8	W134 K140 I141 V142 V206 L207 I245	W134-V172 HydrophobicContact CH2-CG1 3.92Å; W134-V172 HydrophobicContact CZ3-CG1 4.27Å; K140-V172 HydrophobicContact CB-CG1 4.24Å; K140-V172 HydrophobicContact CD-CG1 3.8Å; I141-V172 WeakPolarHBondContact O-CA 3.35Å; V142-V172 HydrophobicContact CG1-CG2 4.34Å; V142-V172 HydrophobicContact CG2-CG2 4.24Å; V172-V206 CarbonylContact O-C 3.49Å; V172-V206 WeakPolarHBondContact O-CA 3.49Å; V172-L207 HydrophobicContact CB-CB 4.33Å; V172-L207 HydrophobicContact CB-CD2 4.04Å; V172-L207 HydrophobicContact CG2-CD2 3.86Å; V172-L207 PolarHBondContact N-O 3.22Å; V172-L207 PolarHBondContact O-N 2.86Å; V172-I245 HydrophobicContact CG2-CD1 4.47Å
173	A	94.7	Very high	85	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	137.1	-176	0	0	0	0	0	111.5	W100 V115 K140 I141 I143	W100-A173 HydrophobicContact CH2-CB 4.24Å; V115-A173 HydrophobicContact CG1-CB 4.49Å; K140-A173 CarbonylContact C-O 3.56Å; K140-A173 WeakPolarHBondContact CA-O 3.3Å; K140-A173 WeakPolarHBondContact CB-O 3.44Å; I141-A173 HydrophobicContact CG1-CB 4.4Å; I141-A173 PolarHBondContact N-O 3.18Å; I141-A173 PolarHBondContact O-N 2.88Å; I143-A173 HydrophobicContact CD1-CB 4.21Å
174	S	92.7	Very high	85.5	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	144.3	167.4	-71.9	0	0	0	0	111.8	E202 H203 G204 Y205	S174-E202 PolarHBondContact OG-O 3.4Å; S174-H203 VanDerWaalsContact CB-C 3.41Å; S174-G204 PolarHBondContact OG-N 2.91Å; S174-Y205 PolarHBondContact N-O 2.78Å; S174-Y205 VanDerWaalsContact N-O 3.09Å; S174-Y205 WeakPolarHBondContact OG-CD1 3.24Å; S174-Y205 WeakPolarHBondContact OG-CE1 3.29Å; S174-Y205 PolarHBondContact OG-N 2.83Å; S174-Y205 PolarHBondContact OG-O 3.18Å
175	M	91	Very high	85.2	Confident	12 Å²	12	45 Å²	45	6%	0.059	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-85.5	145.8	172.4	-77.2	-71.7	-75.3	0	0	111.3	T72 Y77 W100 H138 T139 I141	T72-M175 HydrophobicContact CG2-CE 4.12Å; Y77-M175 HydrophobicContact CD2-CE 4.15Å; W100-M175 HydrophobicContact CZ2-SD 4.26Å; W100-M175 PolarHBondContact NE1-SD 3.39Å; H138-M175 WeakPolarHBondContact O-CB 3.49Å; H138-M175 WeakPolarHBondContact O-CG 3.45Å; T139-M175 PolarHBondContact O-N 3.26Å; I141-M175 HydrophobicContact CD1-SD 4.35Å; I141-M175 HydrophobicContact CG1-SD 4.4Å; I141-M175 HydrophobicContact CG2-CG 4.04Å; I141-M175 HydrophobicContact CG2-SD 3.63Å
176	P	89.1	Confident	83.8	Confident	6 Å²	6	47.6 Å²	47.6	4%	0.039	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-61.7	141.1	174.7	25.1	-33.4	0	0	0	111	Y77 W100 V112 H113 S178	Y77-P176 HydrophobicContact CD2-CG 4.41Å; Y77-P176 HydrophobicContact CE2-CG 3.92Å; W100-P176 HydrophobicContact CB-CG 4.47Å; W100-P176 HydrophobicContact CG-CG 4.09Å; V112-P176 HydrophobicContact CG2-CG 4.49Å; H113-P176 HydrophobicContact CB-CB 4.09Å; H113-P176 HydrophobicContact CB-CG 4.24Å; P176-S178 PolarHBondContact O-N 2.87Å
177	P	84.4	Confident	81.9	Confident	14 Å²	14	48.5 Å²	48.5	9%	0.091	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-61.3	127.8	-169.3	22.9	-34.4	0	0	0	111.9	R179 C181 R194 H203	P177-R179 WeakPolarHBondContact CB-O 3.41Å; P177-R179 PolarHBondContact O-N 2.89Å; P177-C181 HydrophobicContact CB-CB 4.14Å; P177-R194 VanDerWaalsContact CG-NH1 3.31Å; P177-H203 VanDerWaalsContact CA-CD2 3.48Å; P177-H203 WeakPolarHBondContact CA-CD2 3.33Å; P177-H203 VanDerWaalsContact CB-CD2 3.47Å; P177-H203 WeakPolarHBondContact CB-CD2 3.29Å; P177-H203 WeakPolarHBondContact CB-NE2 3.41Å
178	S	77.4	Confident	79.7	Confident	79 Å²	79	53.3 Å²	53.3	55%	0.552	31%	0.308	S	S	*	.	S	Bend	trans	-70.1	-14.3	-175.3	70.9	0	0	0	0	114.2	R76 P176	R76-S178 PolarHBondContact NH1-O 3.2Å; R76-S178 PolarHBondContact NH2-O 2.71Å; P176-S178 PolarHBondContact O-N 2.87Å
179	R	79.1	Confident	77.2	Confident	204 Å²	204	56.2 Å²	56.2	77%	0.77	33%	0.331	S	S	*	.	S	Bend	trans	-138.3	162.3	174.6	-61.4	-175.6	-177.9	-163.7	0.6	108.5	P177 C181	P177-R179 WeakPolarHBondContact CB-O 3.41Å; P177-R179 PolarHBondContact O-N 2.89Å; R179-C181 PolarHBondContact O-N 2.82Å
180	P	78.4	Confident	74.6	Confident	125 Å²	125	61 Å²	61	81%	0.812	37%	0.372	S	S	*	.			trans	-55.7	116.1	171	-23.7	34.6	0	0	0	110.7
181	C	80.7	Confident	72	Confident	19 Å²	19	66.3 Å²	66.3	13%	0.128	41%	0.405	C	S	.	.			trans	-91.3	122.2	178.4	178.6	0	0	0	0	109.1	P177 R179 K183 C184 C185	P177-C181 HydrophobicContact CB-CB 4.14Å; R179-C181 PolarHBondContact O-N 2.82Å; C181-K183 PolarHBondContact O-N 2.84Å; C181-C184 HydrophobicContact CB-CB 3.95Å; C181-C184 CarbonylContact O-C 3.57Å; C181-C184 PolarHBondContact O-N 2.83Å; C181-C185 PolarHBondContact O-N 3.2Å
182	S	76.6	Confident	69.5	Low	103 Å²	103	72.5 Å²	72.5	72%	0.72	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-34.4	178.8	51.4	0	0	0	0	112.9	C184 C185	S182-C184 VanDerWaalsContact C-N 3.34Å; S182-C185 CarbonylContact O-C 3.58Å
183	K	74.2	Confident	67.2	Low	110 Å²	110	76.2 Å²	76.2	48%	0.478	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-22.6	174.8	-58.2	177.7	175	172.7	0	113.6	C181 C200	C181-K183 PolarHBondContact O-N 2.84Å; K183-C200 HydrophobicContact CB-CB 3.4Å; K183-C200 VanDerWaalsContact CB-CB 3.4Å; K183-C200 HydrophobicContact CD-CB 3.96Å; K183-C200 HydrophobicContact CG-CB 4.36Å
184	C	74.4	Confident	65.1	Low	15 Å²	15	80.6 Å²	80.6	10%	0.101	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-12.5	177.9	-58	0	0	0	0	113.9	C181 S182 G198 C200	C181-C184 HydrophobicContact CB-CB 3.95Å; C181-C184 CarbonylContact O-C 3.57Å; C181-C184 PolarHBondContact O-N 2.83Å; S182-C184 VanDerWaalsContact C-N 3.34Å; C184-G198 CarbonylContact C-O 3.55Å; C184-G198 VanDerWaalsContact C-O 3.26Å; C184-G198 WeakPolarHBondContact CA-O 3.47Å; C184-C200 PolarHBondContact SG-N 2.95Å; C184-C200 VanDerWaalsContact SG-N 3.39Å; C184-C200 PolarHBondContact SG-SG 2.77Å
185	C	62.4	Low	62.6	Low	58 Å²	58	86 Å²	86	39%	0.392	52%	0.515	S	S	.	.			trans	-140.9	73.7	178	-67.8	0	0	0	0	109.1	C181 S182 V187	C181-C185 PolarHBondContact O-N 3.2Å; S182-C185 CarbonylContact O-C 3.58Å; C185-V187 PolarHBondContact O-N 3.31Å
186	P	52.3	Low	60.5	Low	107 Å²	107	86.2 Å²	86.2	70%	0.695	52%	0.52	S	S	*	.	S	Bend	trans	-66.9	-19.6	174	27.5	-34.3	0	0	0	112.7
187	V	46.9	Very low	58.3	Low	99 Å²	99	92.1 Å²	92.1	60%	0.6	56%	0.562	S	S	*	*	S	Bend	trans	-136.5	133.1	174.9	-174.3	0	0	0	0	109.4	C185 S189	C185-V187 PolarHBondContact O-N 3.31Å; V187-S189 PolarHBondContact O-N 2.78Å; V187-S189 VanDerWaalsContact O-N 3.12Å
188	P	42	Very low	56.7	Low	128 Å²	128	92.6 Å²	92.6	83%	0.831	57%	0.569	S	S	*	*			trans	-79.4	90.7	177.3	31.7	-34	0	0	0	111.5
189	S	41.8	Very low	56.1	Low	91 Å²	91	91.3 Å²	91.3	64%	0.636	55%	0.554	S	S	*	*			trans	-90	141.2	171.1	-66	0	0	0	0	111.7	V187 T191	V187-S189 PolarHBondContact O-N 2.78Å; V187-S189 VanDerWaalsContact O-N 3.12Å; S189-T191 VanDerWaalsContact C-N 3.27Å; S189-T191 PolarHBondContact O-N 3.02Å
190	A	39.9	Very low	56.3	Low	108 Å²	108	82.2 Å²	82.2	89%	0.893	52%	0.522	S	S	*	.			trans	-79.9	8.3	-168.2	0	0	0	0	0	116
191	T	41.5	Very low	56.5	Low	114 Å²	114	76.8 Å²	76.8	70%	0.699	49%	0.486	S	S	*	.			trans	-84.7	123.1	-179.2	24.4	0	0	0	0	111.9	S189 V193	S189-T191 VanDerWaalsContact C-N 3.27Å; S189-T191 PolarHBondContact O-N 3.02Å; T191-V193 PolarHBondContact O-N 2.83Å
192	T	44.4	Very low	56.7	Low	129 Å²	129	79.1 Å²	79.1	79%	0.791	50%	0.495	S	S	*	.	S	Bend	trans	-77.6	1.1	-174.9	47.5	0	0	0	0	115.2
193	V	46.5	Very low	57.2	Low	80 Å²	80	75.6 Å²	75.6	49%	0.485	47%	0.467	S	S	.	.	S	Bend	trans	-112	120.1	176.7	-176	0	0	0	0	108.3	T191 T195	T191-V193 PolarHBondContact O-N 2.83Å; V193-T195 VanDerWaalsContact C-N 3.35Å; V193-T195 HydrophobicContact CG1-CG2 4.16Å; V193-T195 PolarHBondContact O-N 2.89Å
194	R	51.3	Low	57.8	Low	92 Å²	92	70.6 Å²	70.6	35%	0.347	45%	0.447	S	S	.	.			trans	-79.2	82.4	174.9	-76	-176.6	172.5	151.3	-3.3	110.6	P177 G196	P177-R194 VanDerWaalsContact CG-NH1 3.31Å; R194-G196 PolarHBondContact O-N 2.85Å
195	T	41	Very low	58.6	Low	114 Å²	114	70 Å²	70	70%	0.699	44%	0.443	S	S	*	.			trans	-92.7	77.2	167	31.9	0	0	0	0	110.6	V193 S197	V193-T195 VanDerWaalsContact C-N 3.35Å; V193-T195 HydrophobicContact CG1-CG2 4.16Å; V193-T195 PolarHBondContact O-N 2.89Å; T195-S197 PolarHBondContact O-N 2.78Å
196	G	45.2	Very low	60.1	Low	16 Å²	16	67.4 Å²	67.4	17%	0.165	43%	0.425	C	S	.	.	S	Bend	trans	27	80.8	157.7	0	0	0	0	0	119.8	R194 E199 K468	R194-G196 PolarHBondContact O-N 2.85Å; G196-E199 WeakPolarHBondContact CA-OE2 3.4Å; G196-K468 WeakPolarHBondContact O-CE 3.33Å; G196-K468 PolarHBondContact O-NZ 2.86Å
197	S	43.1	Very low	62.1	Low	130 Å²	130	62.4 Å²	62.4	91%	0.909	39%	0.392	S	S	*	.	S	Bend	trans	-123.6	-9.2	160	63.2	0	0	0	0	114.3	T195	T195-S197 PolarHBondContact O-N 2.78Å
198	G	52	Low	64.4	Low	24 Å²	24	57.9 Å²	57.9	25%	0.247	37%	0.365	C	S	.	.	S	Bend	trans	-161.8	93.8	172.8	0	0	0	0	0	109.6	C184	C184-G198 CarbonylContact C-O 3.55Å; C184-G198 VanDerWaalsContact C-O 3.26Å; C184-G198 WeakPolarHBondContact CA-O 3.47Å
199	E	65.2	Low	66.8	Low	51 Å²	51	52.2 Å²	52.2	24%	0.238	33%	0.328	C	S	.	.			trans	-123.1	121	176.2	-75.3	162.2	153.5	0	0	106.8	G196 L467	G196-E199 WeakPolarHBondContact CA-OE2 3.4Å; E199-L467 HydrophobicContact CB-CD1 4.1Å; E199-L467 HydrophobicContact CG-CD1 4.1Å; E199-L467 WeakPolarHBondContact OE2-CD1 3.19Å
200	C	81.8	Confident	69.2	Low	13 Å²	13	51.3 Å²	51.3	9%	0.088	31%	0.31	C	S	.	.			trans	-78.5	155.3	-179.1	76.8	0	0	0	0	110.2	K183 C184 E202 H203 G204	K183-C200 HydrophobicContact CB-CB 3.4Å; K183-C200 VanDerWaalsContact CB-CB 3.4Å; K183-C200 HydrophobicContact CD-CB 3.96Å; K183-C200 HydrophobicContact CG-CB 4.36Å; C184-C200 PolarHBondContact SG-N 2.95Å; C184-C200 VanDerWaalsContact SG-N 3.39Å; C184-C200 PolarHBondContact SG-SG 2.77Å; C200-E202 PolarHBondContact O-N 2.82Å; C200-E202 VanDerWaalsContact O-N 3.11Å; C200-H203 PolarHBondContact O-N 3.09Å; C200-H203 PolarHBondContact SG-ND1 3.21Å; C200-G204 PolarHBondContact O-N 2.84Å
201	L	83.8	Confident	71.7	Confident	11 Å²	11	47.1 Å²	47.1	6%	0.058	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-49.8	-44.9	-175.3	-171.1	59	0	0	0	112.3	H203 G204 Y205 L247 L472 Q482 V484	L201-H203 PolarHBondContact O-N 3.06Å; L201-H203 VanDerWaalsContact O-N 3.12Å; L201-G204 PolarHBondContact O-N 2.8Å; L201-Y205 WeakPolarHBondContact O-CD1 3.4Å; L201-Y205 PolarHBondContact O-N 3.21Å; L201-L247 HydrophobicContact CB-CD1 4.47Å; L201-L247 HydrophobicContact CD2-CD1 4.07Å; L201-L247 HydrophobicContact CG-CD1 3.91Å; L201-L472 HydrophobicContact CD1-CD2 3.53Å; L201-Q482 HydrophobicContact CD2-CG 4.28Å; L201-Q482 VanDerWaalsContact CD2-O 3.29Å; L201-Q482 WeakPolarHBondContact CD2-O 3.35Å; L201-V484 HydrophobicContact CD1-CG2 3.87Å; L201-V484 HydrophobicContact CD2-CG2 4.05Å; L201-V484 HydrophobicContact CG-CG2 3.86Å
202	E	85.1	Confident	74	Confident	69 Å²	69	46.4 Å²	46.4	32%	0.322	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	-48.1	-38.3	176.6	-170.8	179.5	176	0	0	115.5	S174 C200 L247	S174-E202 PolarHBondContact OG-O 3.4Å; C200-E202 PolarHBondContact O-N 2.82Å; C200-E202 VanDerWaalsContact O-N 3.11Å; E202-L247 VanDerWaalsContact CA-CD2 3.49Å; E202-L247 HydrophobicContact CB-CD2 3.53Å; E202-L247 HydrophobicContact CG-CD2 3.62Å
203	H	86.3	Confident	76.2	Confident	29 Å²	29	40.4 Å²	40.4	13%	0.134	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-113.6	12.3	-172	-60.8	104.2	0	0	0	112.8	S174 P177 C200 L201	S174-H203 VanDerWaalsContact CB-C 3.41Å; P177-H203 VanDerWaalsContact CA-CD2 3.48Å; P177-H203 WeakPolarHBondContact CA-CD2 3.33Å; P177-H203 VanDerWaalsContact CB-CD2 3.47Å; P177-H203 WeakPolarHBondContact CB-CD2 3.29Å; P177-H203 WeakPolarHBondContact CB-NE2 3.41Å; C200-H203 PolarHBondContact O-N 3.09Å; C200-H203 PolarHBondContact SG-ND1 3.21Å; L201-H203 PolarHBondContact O-N 3.06Å; L201-H203 VanDerWaalsContact O-N 3.12Å
204	G	87.1	Confident	78.4	Confident	5 Å²	5	38.1 Å²	38.1	5%	0.052	21%	0.21	C	C	.	.	S	Bend	trans	-157.3	32.1	-169.9	0	0	0	0	0	116.3	S174 C200 L201 D466 L467	S174-G204 PolarHBondContact OG-N 2.91Å; C200-G204 PolarHBondContact O-N 2.84Å; L201-G204 PolarHBondContact O-N 2.8Å; G204-D466 WeakPolarHBondContact O-CA 3.28Å; G204-L467 VanDerWaalsContact CA-CG 3.48Å; G204-L467 PolarHBondContact O-N 2.91Å
205	Y	91	Very high	80.1	Confident	3 Å²	3	38.8 Å²	38.8	1%	0.012	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	151.6	160.7	69.3	-99.7	0	0	0	111.1	S174 L201 I245 L247 T465 V484	S174-Y205 PolarHBondContact N-O 2.78Å; S174-Y205 VanDerWaalsContact N-O 3.09Å; S174-Y205 WeakPolarHBondContact OG-CD1 3.24Å; S174-Y205 WeakPolarHBondContact OG-CE1 3.29Å; S174-Y205 PolarHBondContact OG-N 2.83Å; S174-Y205 PolarHBondContact OG-O 3.18Å; L201-Y205 WeakPolarHBondContact O-CD1 3.4Å; L201-Y205 PolarHBondContact O-N 3.21Å; Y205-I245 HydrophobicContact CE2-CG2 4.1Å; Y205-L247 HydrophobicContact CE1-CD1 4.43Å; Y205-T465 WeakPolarHBondContact CA-O 3.46Å; Y205-V484 HydrophobicContact CD1-CG2 3.48Å; Y205-V484 VanDerWaalsContact CD1-CG2 3.48Å; Y205-V484 HydrophobicContact CD2-CG2 4.43Å; Y205-V484 HydrophobicContact CE1-CG2 3.99Å; Y205-V484 HydrophobicContact CG-CG2 3.77Å
206	V	93.9	Very high	82.5	Confident	3 Å²	3	33.8 Å²	33.8	2%	0.018	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	134.2	170.6	-173.9	0	0	0	0	106.6	V115 T171 V172 V464 T465 L467	V115-V206 HydrophobicContact CG1-CG1 4.04Å; V115-V206 HydrophobicContact CG1-CG2 3.73Å; V115-V206 HydrophobicContact CG2-CG2 4.47Å; T171-V206 HydrophobicContact CG2-CG1 3.5Å; T171-V206 VanDerWaalsContact CG2-CG1 3.5Å; V172-V206 CarbonylContact O-C 3.49Å; V172-V206 WeakPolarHBondContact O-CA 3.49Å; V206-V464 CarbonylContact O-C 3.54Å; V206-V464 WeakPolarHBondContact O-CA 3.34Å; V206-T465 PolarHBondContact N-O 3.4Å; V206-T465 PolarHBondContact O-N 3.33Å; V206-L467 HydrophobicContact CG2-CD2 4.08Å
207	L	94.5	Very high	84.7	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.005	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	122.3	178.2	167.5	154	0	0	0	107.9	T171 V172 I245 F462 T463 V464 V486	T171-L207 CarbonylContact C-O 3.6Å; T171-L207 VanDerWaalsContact CA-O 3.28Å; T171-L207 WeakPolarHBondContact CA-O 3.28Å; V172-L207 HydrophobicContact CB-CB 4.33Å; V172-L207 HydrophobicContact CB-CD2 4.04Å; V172-L207 HydrophobicContact CG2-CD2 3.86Å; V172-L207 PolarHBondContact N-O 3.22Å; V172-L207 PolarHBondContact O-N 2.86Å; L207-I245 HydrophobicContact CD1-CG1 4.16Å; L207-F462 HydrophobicContact CD1-CD1 4.02Å; L207-F462 HydrophobicContact CD1-CG 4.48Å; L207-F462 HydrophobicContact CD2-CD1 3.39Å; L207-F462 HydrophobicContact CD2-CE1 3.61Å; L207-F462 HydrophobicContact CG-CD1 3.73Å; L207-F462 HydrophobicContact CG-CE1 4.41Å; L207-F462 HydrophobicContact CG-CG 4.49Å; L207-T463 WeakPolarHBondContact CA-O 3.33Å; L207-V464 HydrophobicContact CB-CG2 4.45Å; L207-V464 HydrophobicContact CD1-CG2 4.06Å; L207-V464 HydrophobicContact CG-CG2 4.34Å; L207-V486 HydrophobicContact CD1-CG1 4.16Å; L207-V486 HydrophobicContact CD1-CG2 3.58Å
208	N	94.5	Very high	87	Confident	5 Å²	5	29.3 Å²	29.3	3%	0.027	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	146.5	-179.7	-62.2	-59.3	0	0	0	110.1	F118 I170 T171 F462 T463	F118-N208 PolarHBondContact N-OD1 3.29Å; I170-N208 CarbonylContact O-C 3.52Å; I170-N208 WeakPolarHBondContact O-CA 3.43Å; T171-N208 WeakPolarHBondContact CB-OD1 3.21Å; T171-N208 WeakPolarHBondContact CG2-OD1 3.42Å; T171-N208 PolarHBondContact OG1-OD1 2.96Å; N208-F462 WeakPolarHBondContact O-CA 3.43Å; N208-T463 PolarHBondContact N-O 3.42Å; N208-T463 PolarHBondContact O-N 3.23Å
209	S	93.4	Very high	88.8	Confident	8 Å²	8	28.9 Å²	28.9	6%	0.056	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	152.6	172.6	-172.4	0	0	0	0	110.4	I170 P461 F462	I170-S209 PolarHBondContact N-O 3.11Å; I170-S209 PolarHBondContact O-N 2.9Å; S209-P461 VanDerWaalsContact CB-O 3.31Å; S209-P461 WeakPolarHBondContact CB-O 3.46Å; S209-P461 PolarHBondContact OG-O 2.69Å; S209-F462 VanDerWaalsContact CB-CE1 3.41Å
210	R	92.1	Very high	90.1	Very high	72 Å²	72	28.3 Å²	28.3	27%	0.272	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	140.9	173	175	-177.8	175.7	-179.5	-1.3	108.5	E121 D167 I168 Y169	E121-R210 VanDerWaalsContact CD-CD 3.47Å; E121-R210 WeakPolarHBondContact OE2-CD 3.47Å; E121-R210 IonicContact OE2-CZ 2.83Å; E121-R210 IonicContact OE2-NE 3.23Å; E121-R210 IonicContact OE2-NH1 3.64Å; E121-R210 PolarHBondContact OE2-NH1 3.37Å; D167-R210 IonicContact OD1-CZ 3.27Å; D167-R210 VanDerWaalsContact OD1-CZ 3.23Å; D167-R210 IonicContact OD1-NE 2.72Å; D167-R210 PolarHBondContact OD1-NE 2.79Å; D167-R210 IonicContact OD1-NH2 3.39Å; D167-R210 PolarHBondContact OD1-NH2 3.39Å; D167-R210 IonicContact OD2-NH2 3.41Å; I168-R210 WeakPolarHBondContact O-CA 3.47Å; Y169-R210 HydrophobicContact CD1-CB 4.21Å; Y169-R210 HydrophobicContact CD1-CG 4.09Å; Y169-R210 HydrophobicContact CE1-CG 4.03Å
211	Y	91.9	Very high	90.6	Very high	21 Å²	21	27.9 Å²	27.9	8%	0.082	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	160.2	167.4	63.8	-85.6	0	0	0	110.5	I168 I170 V213 L234 N235 T236 L460	I168-Y211 HydrophobicContact CB-CD1 4.48Å; I168-Y211 HydrophobicContact CB-CD2 4.48Å; I168-Y211 HydrophobicContact CB-CE1 4.06Å; I168-Y211 HydrophobicContact CB-CE2 4.07Å; I168-Y211 HydrophobicContact CD1-CE2 3.88Å; I168-Y211 HydrophobicContact CG1-CE2 4.37Å; I168-Y211 HydrophobicContact CG2-CE1 3.89Å; I168-Y211 HydrophobicContact CG2-CE2 4.49Å; I168-Y211 PolarHBondContact N-O 3.25Å; I168-Y211 PolarHBondContact O-N 2.97Å; I170-Y211 HydrophobicContact CD1-CE1 3.78Å; I170-Y211 HydrophobicContact CG1-CE1 4.38Å; Y211-V213 HydrophobicContact CD2-CG1 3.86Å; Y211-V213 HydrophobicContact CE2-CG1 3.56Å; Y211-L234 HydrophobicContact CE1-CB 4.46Å; Y211-L234 HydrophobicContact CE1-CD1 4.25Å; Y211-L234 HydrophobicContact CE1-CD2 4.49Å; Y211-N235 WeakPolarHBondContact CE2-O 3.11Å; Y211-T236 HydrophobicContact CD2-CG2 4.11Å; Y211-T236 HydrophobicContact CE2-CG2 4.34Å; Y211-L460 HydrophobicContact CD1-CD2 4.05Å; Y211-L460 HydrophobicContact CG-CD2 3.95Å
212	Q	90.3	Very high	91	Very high	98 Å²	98	27.8 Å²	27.8	46%	0.458	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	147.4	177.7	-71.3	-178.8	-22.4	0	0	110.7	R166 D167	R166-Q212 WeakPolarHBondContact O-CA 3.24Å; D167-Q212 VanDerWaalsContact OD1-CG 3.24Å; D167-Q212 WeakPolarHBondContact OD1-CG 3.24Å; D167-Q212 PolarHBondContact OD1-NE2 2.96Å
213	V	91.2	Very high	91.3	Very high	4 Å²	4	26.7 Å²	26.7	2%	0.024	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	146.8	173.3	-63.8	0	0	0	0	111.2	N165 R166 I168 Y211 F217 P218 S237	N165-V213 CarbonylContact C-O 3.5Å; N165-V213 WeakPolarHBondContact CA-O 3.48Å; R166-V213 HydrophobicContact CB-CG2 3.98Å; R166-V213 PolarHBondContact N-O 2.85Å; R166-V213 WeakPolarHBondContact O-CG2 3.31Å; R166-V213 PolarHBondContact O-N 3.28Å; I168-V213 HydrophobicContact CD1-CB 4.45Å; I168-V213 HydrophobicContact CD1-CG1 3.73Å; I168-V213 HydrophobicContact CD1-CG2 3.8Å; I168-V213 HydrophobicContact CG1-CG1 4.41Å; I168-V213 HydrophobicContact CG1-CG2 4.09Å; Y211-V213 HydrophobicContact CD2-CG1 3.86Å; Y211-V213 HydrophobicContact CE2-CG1 3.56Å; V213-F217 HydrophobicContact CG2-CD1 4.14Å; V213-P218 HydrophobicContact CB-CG 4.32Å; V213-P218 HydrophobicContact CG1-CG 4.22Å; V213-S237 WeakPolarHBondContact CA-OG 3.44Å; V213-S237 VanDerWaalsContact CB-OG 3.25Å; V213-S237 WeakPolarHBondContact CB-OG 3.45Å
214	V	90.9	Very high	91.7	Very high	31 Å²	31	26.1 Å²	26.1	19%	0.188	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	170.1	-177.3	-61.3	0	0	0	0	112.1	N164 P216 F217 S237 Y238	N164-V214 WeakPolarHBondContact O-CA 3.34Å; V214-P216 CarbonylContact O-C 3.58Å; V214-F217 VanDerWaalsContact O-CA 3.25Å; V214-F217 WeakPolarHBondContact O-CA 3.4Å; V214-F217 VanDerWaalsContact O-CD1 3.29Å; V214-F217 WeakPolarHBondContact O-CD1 3.45Å; V214-F217 PolarHBondContact O-N 3.46Å; V214-F217 VanDerWaalsContact O-N 3.16Å; V214-S237 PolarHBondContact N-OG 3.46Å; V214-Y238 HydrophobicContact CG1-CE2 4.44Å; V214-Y238 VanDerWaalsContact CG1-OH 3.28Å; V214-Y238 WeakPolarHBondContact CG1-OH 3.45Å; V214-Y238 HydrophobicContact CG2-CE1 4.39Å; V214-Y238 HydrophobicContact CG2-CE2 4.44Å
215	Y	88.6	Confident	92.1	Very high	106 Å²	106	26.5 Å²	26.5	42%	0.416	13%	0.131	S	C	.	.	S	Bend	trans	-68.3	135.8	168.5	-174.4	-86	0	0	0	110.8	N164 F217 G587 W590	N164-Y215 PolarHBondContact O-N 2.9Å; Y215-F217 HydrophobicContact CD2-CD2 4.2Å; Y215-F217 HydrophobicContact CD2-CE2 4.12Å; Y215-G587 WeakPolarHBondContact OH-CA 3.42Å; Y215-G587 PolarHBondContact OH-N 2.81Å; Y215-W590 AromaticContact CE1-CD1 3.95Å
216	P	91.1	Very high	92.4	Very high	10 Å²	10	26.3 Å²	26.3	7%	0.065	13%	0.131	C	C	.	.	S	Bend	cis	-79.5	109.9	1.2	31.2	-35.6	0	0	0	112.7	V214 P218 D516 D518 W590 R594	V214-P216 CarbonylContact O-C 3.58Å; P216-P218 VanDerWaalsContact O-N 3.16Å; P216-D516 WeakPolarHBondContact CD-OD1 3.45Å; P216-D518 HydrophobicContact CG-CB 3.94Å; P216-W590 HydrophobicContact CB-CG 4.05Å; P216-W590 HydrophobicContact CG-CD2 4.28Å; P216-W590 HydrophobicContact CG-CG 4.33Å; P216-W590 HydrophobicContact CG-CZ2 4.5Å; P216-R594 PolarHBondContact O-NH2 3.07Å
217	F	90	Very high	92.4	Very high	25 Å²	25	27.2 Å²	27.2	11%	0.11	14%	0.135	C	C	.	.	P	Polyproline II helix	trans	-48.8	121.4	-171.3	-58.4	-64.8	0	0	0	112.5	N164 R166 V213 V214 Y215 R594	N164-F217 VanDerWaalsContact O-CE1 3.24Å; N164-F217 WeakPolarHBondContact O-CE1 3.37Å; N164-F217 WeakPolarHBondContact O-CZ 3.48Å; R166-F217 HydrophobicContact CB-CD1 4.35Å; R166-F217 HydrophobicContact CB-CE1 4.24Å; R166-F217 HydrophobicContact CG-CD1 3.88Å; R166-F217 HydrophobicContact CG-CE1 3.58Å; R166-F217 HydrophobicContact CG-CZ 3.98Å; R166-F217 VanDerWaalsContact NE-CD2 3.31Å; R166-F217 VanDerWaalsContact NE-CE2 3.3Å; R166-F217 VanDerWaalsContact NH2-CD2 3.3Å; V213-F217 HydrophobicContact CG2-CD1 4.14Å; V214-F217 VanDerWaalsContact O-CA 3.25Å; V214-F217 WeakPolarHBondContact O-CA 3.4Å; V214-F217 VanDerWaalsContact O-CD1 3.29Å; V214-F217 WeakPolarHBondContact O-CD1 3.45Å; V214-F217 PolarHBondContact O-N 3.46Å; V214-F217 VanDerWaalsContact O-N 3.16Å; Y215-F217 HydrophobicContact CD2-CD2 4.2Å; Y215-F217 HydrophobicContact CD2-CE2 4.12Å; F217-R594 PolarHBondContact O-NH1 2.73Å; F217-R594 PolarHBondContact O-NH2 2.78Å
218	P	92.1	Very high	92.5	Very high	27 Å²	27	28.5 Å²	28.5	18%	0.175	14%	0.14	C	C	.	.	P	Polyproline II helix	trans	-51.9	146.7	-174.9	-32.8	37	0	0	0	114.1	V213 P216 F220 N235	V213-P218 HydrophobicContact CB-CG 4.32Å; V213-P218 HydrophobicContact CG1-CG 4.22Å; P216-P218 VanDerWaalsContact O-N 3.16Å; P218-F220 PolarHBondContact O-N 3.21Å; P218-N235 HydrophobicContact CB-CB 4.1Å; P218-N235 HydrophobicContact CG-CB 4.49Å
219	T	90.9	Very high	92.5	Very high	15 Å²	15	30.4 Å²	30.4	9%	0.092	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-72.9	131.5	177.7	65.8	0	0	0	0	111	Q221 L323 V520 R594	T219-Q221 PolarHBondContact O-N 2.82Å; T219-Q221 VanDerWaalsContact OG1-CG 3.32Å; T219-Q221 WeakPolarHBondContact OG1-CG 3.36Å; T219-Q221 PolarHBondContact OG1-OE1 3.28Å; T219-L323 HydrophobicContact CG2-CD1 3.82Å; T219-L323 HydrophobicContact CG2-CD2 4.5Å; T219-V520 HydrophobicContact CG2-CG2 4.33Å; T219-R594 HydrophobicContact CG2-CG 4.21Å
220	F	90.8	Very high	92.5	Very high	38 Å²	38	33.2 Å²	33.2	17%	0.167	16%	0.162	C	C	.	.			trans	-77.2	116	172.5	-179.2	-125.6	0	0	0	109.9	T130 F144 P218 P222	T130-F220 HydrophobicContact CG2-CE1 3.96Å; T130-F220 HydrophobicContact CG2-CZ 3.93Å; F144-F220 HydrophobicContact CB-CE2 4.14Å; F144-F220 HydrophobicContact CB-CZ 4.21Å; F144-F220 AromaticContact CD1-CE2 3.89Å; F144-F220 HydrophobicContact CD1-CE2 3.89Å; F144-F220 AromaticContact CD2-CE2 3.83Å; F144-F220 HydrophobicContact CD2-CE2 3.83Å; F144-F220 AromaticContact CD2-CZ 3.89Å; F144-F220 HydrophobicContact CD2-CZ 3.89Å; F144-F220 HydrophobicContact CE1-CE2 4.2Å; F144-F220 HydrophobicContact CE2-CE2 4.16Å; F144-F220 HydrophobicContact CE2-CZ 4.42Å; F144-F220 AromaticContact CG-CE2 3.69Å; F144-F220 HydrophobicContact CG-CE2 3.69Å; F144-F220 HydrophobicContact CG-CZ 4.02Å; F144-F220 HydrophobicContact CZ-CE2 4.33Å; P218-F220 PolarHBondContact O-N 3.21Å; F220-P222 VanDerWaalsContact C-CD 3.49Å; F220-P222 HydrophobicContact CD1-CG 4.18Å; F220-P222 HydrophobicContact CE1-CB 4.33Å; F220-P222 HydrophobicContact CE1-CG 3.7Å; F220-P222 HydrophobicContact CE2-CB 4.28Å; F220-P222 HydrophobicContact CE2-CG 4.37Å; F220-P222 HydrophobicContact CZ-CB 3.91Å; F220-P222 HydrophobicContact CZ-CG 3.8Å
221	Q	92	Very high	92.7	Very high	5 Å²	5	29.9 Å²	29.9	2%	0.023	15%	0.15	C	C	.	.			trans	-129	57.1	-170.1	-59.9	-171.7	-89.3	0	0	112.3	T219 A223 F224 Q225 F319 I521	T219-Q221 PolarHBondContact O-N 2.82Å; T219-Q221 VanDerWaalsContact OG1-CG 3.32Å; T219-Q221 WeakPolarHBondContact OG1-CG 3.36Å; T219-Q221 PolarHBondContact OG1-OE1 3.28Å; Q221-A223 PolarHBondContact O-N 3.09Å; Q221-F224 HydrophobicContact CB-CD2 4.26Å; Q221-F224 PolarHBondContact O-N 3.19Å; Q221-Q225 HydrophobicContact CB-CG 4.3Å; Q221-Q225 WeakPolarHBondContact O-CG 3.3Å; Q221-Q225 PolarHBondContact O-N 2.92Å; Q221-F319 HydrophobicContact CB-CE2 4.42Å; Q221-F319 HydrophobicContact CB-CZ 4.41Å; Q221-F319 HydrophobicContact CG-CE2 4.22Å; Q221-F319 HydrophobicContact CG-CZ 3.98Å; Q221-I521 PolarHBondContact NE2-O 3.01Å
222	P	93	Very high	93	Very high	8 Å²	8	29 Å²	29	5%	0.052	15%	0.147	C	C	.	.	H	α-helix	trans	-57.6	-27.8	-171.6	22.7	-34.5	0	0	0	113.7	F220 F224 L226	F220-P222 VanDerWaalsContact C-CD 3.49Å; F220-P222 HydrophobicContact CD1-CG 4.18Å; F220-P222 HydrophobicContact CE1-CB 4.33Å; F220-P222 HydrophobicContact CE1-CG 3.7Å; F220-P222 HydrophobicContact CE2-CB 4.28Å; F220-P222 HydrophobicContact CE2-CG 4.37Å; F220-P222 HydrophobicContact CZ-CB 3.91Å; F220-P222 HydrophobicContact CZ-CG 3.8Å; P222-F224 VanDerWaalsContact C-N 3.27Å; P222-F224 PolarHBondContact O-N 3.01Å; P222-L226 PolarHBondContact O-N 3.21Å
223	A	91	Very high	93.3	Very high	47 Å²	47	24.5 Å²	24.5	39%	0.388	13%	0.126	S	C	.	.	H	α-helix	trans	-67.6	-19.6	176.3	0	0	0	0	0	114.7	Q221 I614	Q221-A223 PolarHBondContact O-N 3.09Å; A223-I614 WeakPolarHBondContact O-CD1 3.13Å
224	F	94.9	Very high	93.6	Very high	17 Å²	17	24.4 Å²	24.4	8%	0.075	13%	0.125	C	C	.	.	H	α-helix	trans	-107.6	-41.9	173	-62.3	-63.5	0	0	0	111.2	Q221 P222 L226 K227 F319 I521 E523 V524 V601	Q221-F224 HydrophobicContact CB-CD2 4.26Å; Q221-F224 PolarHBondContact O-N 3.19Å; P222-F224 VanDerWaalsContact C-N 3.27Å; P222-F224 PolarHBondContact O-N 3.01Å; F224-L226 PolarHBondContact O-N 3.49Å; F224-L226 VanDerWaalsContact O-N 3.07Å; F224-K227 HydrophobicContact CD1-CD 4.4Å; F224-K227 WeakPolarHBondContact O-CB 3.45Å; F224-K227 PolarHBondContact O-N 2.83Å; F224-K227 VanDerWaalsContact O-N 3.08Å; F224-F319 HydrophobicContact CE2-CE1 4.23Å; F224-I521 HydrophobicContact CB-CB 4.24Å; F224-I521 HydrophobicContact CB-CG2 3.78Å; F224-I521 HydrophobicContact CG-CG2 4.27Å; F224-E523 WeakPolarHBondContact CE1-OE2 3.46Å; F224-V524 HydrophobicContact CB-CG2 4.29Å; F224-V601 HydrophobicContact CE2-CG1 4.17Å; F224-V601 HydrophobicContact CE2-CG2 4.41Å; F224-V601 HydrophobicContact CZ-CG1 3.74Å; F224-V601 HydrophobicContact CZ-CG2 4.32Å
225	Q	96.4	Very high	93.8	Very high	12 Å²	12	23.8 Å²	23.8	6%	0.056	12%	0.121	C	C	.	.	H	α-helix	trans	-58	-25.5	-178.5	-66.9	177.1	-89.9	0	0	113.8	Q221 V232 L233 I521	Q221-Q225 HydrophobicContact CB-CG 4.3Å; Q221-Q225 WeakPolarHBondContact O-CG 3.3Å; Q221-Q225 PolarHBondContact O-N 2.92Å; Q225-V232 CarbonylContact O-C 3.51Å; Q225-V232 WeakPolarHBondContact O-CA 3.4Å; Q225-L233 HydrophobicContact CB-CB 4.46Å; Q225-L233 VanDerWaalsContact CG-O 3.28Å; Q225-L233 WeakPolarHBondContact CG-O 3.44Å; Q225-L233 PolarHBondContact NE2-O 2.91Å; Q225-L233 PolarHBondContact O-N 3.45Å; Q225-I521 HydrophobicContact CG-CD1 4.05Å
226	L	96.3	Very high	94	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.9	17.7	179.8	-60.3	172	0	0	0	113.2	C132 W134 P135 V142 F144 P222 F224 K228 V232 I614	C132-L226 HydrophobicContact CB-CD1 3.26Å; W134-L226 HydrophobicContact CZ2-CD2 4.11Å; P135-L226 WeakPolarHBondContact CD-O 3.22Å; V142-L226 HydrophobicContact CB-CD1 4.47Å; V142-L226 HydrophobicContact CB-CD2 4.44Å; V142-L226 HydrophobicContact CG2-CD1 4.45Å; V142-L226 HydrophobicContact CG2-CD2 3.77Å; F144-L226 HydrophobicContact CE2-CD1 4.22Å; P222-L226 PolarHBondContact O-N 3.21Å; F224-L226 PolarHBondContact O-N 3.49Å; F224-L226 VanDerWaalsContact O-N 3.07Å; L226-K228 VanDerWaalsContact C-N 3.32Å; L226-K228 PolarHBondContact O-N 2.93Å; L226-V232 HydrophobicContact CD2-CB 3.75Å; L226-V232 HydrophobicContact CD2-CG2 3.67Å; L226-I614 HydrophobicContact CB-CD1 4.15Å; L226-I614 HydrophobicContact CB-CG1 4.23Å; L226-I614 HydrophobicContact CB-CG2 4.35Å; L226-I614 HydrophobicContact CD1-CG2 4.26Å
227	K	95.1	Very high	94.1	Very high	22 Å²	22	19.6 Å²	19.6	10%	0.096	11%	0.107	C	C	.	.	S	Bend	trans	-73	-21.6	-174.1	-174	159.9	173.5	172.4	0	113.8	F224 E523 V524 P526 E608 I614	F224-K227 HydrophobicContact CD1-CD 4.4Å; F224-K227 WeakPolarHBondContact O-CB 3.45Å; F224-K227 PolarHBondContact O-N 2.83Å; F224-K227 VanDerWaalsContact O-N 3.08Å; K227-E523 IonicContact NZ-OE1 2.7Å; K227-E523 PolarHBondContact NZ-OE1 3.22Å; K227-E523 IonicContact NZ-OE2 2.73Å; K227-E523 PolarHBondContact NZ-OE2 3.12Å; K227-V524 HydrophobicContact CB-CB 4.01Å; K227-V524 HydrophobicContact CB-CG1 4.22Å; K227-V524 HydrophobicContact CD-CB 4.25Å; K227-V524 VanDerWaalsContact CD-O 3.3Å; K227-V524 WeakPolarHBondContact CD-O 3.3Å; K227-V524 WeakPolarHBondContact CE-O 3.49Å; K227-V524 HydrophobicContact CG-CB 4.28Å; K227-P526 WeakPolarHBondContact O-CB 3.42Å; K227-E608 VanDerWaalsContact CE-OE1 3.25Å; K227-E608 WeakPolarHBondContact CE-OE1 3.39Å; K227-E608 IonicContact NZ-OE1 2.81Å; K227-E608 PolarHBondContact NZ-OE1 3.23Å; K227-I614 HydrophobicContact CB-CD1 4.27Å
228	K	95	Very high	94.2	Very high	28 Å²	28	24.2 Å²	24.2	12%	0.122	13%	0.125	C	C	.	.	S	Bend	trans	-94.8	123.5	166	177.9	174.8	166.2	68.7	0	109	W134 L226 V231 P526 N529 L565	W134-K228 PolarHBondContact NE1-O 2.68Å; L226-K228 VanDerWaalsContact C-N 3.32Å; L226-K228 PolarHBondContact O-N 2.93Å; K228-V231 HydrophobicContact CB-CB 4.21Å; K228-V231 HydrophobicContact CD-CB 4.14Å; K228-V231 HydrophobicContact CD-CG2 3.73Å; K228-V231 HydrophobicContact CG-CB 4.07Å; K228-V231 HydrophobicContact CG-CG2 3.91Å; K228-V231 PolarHBondContact O-N 3.13Å; K228-P526 HydrophobicContact CB-CB 4.07Å; K228-P526 HydrophobicContact CG-CB 4.49Å; K228-N529 WeakPolarHBondContact CD-OD1 3.24Å; K228-N529 WeakPolarHBondContact CE-OD1 3.35Å; K228-N529 PolarHBondContact NZ-OD1 2.89Å; K228-L565 HydrophobicContact CD-CD1 4.05Å
229	D	94.7	Very high	94.3	Very high	44 Å²	44	23.7 Å²	23.7	24%	0.235	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	142.9	175.2	-74	-56.4	0	0	0	111	P135 N136 D137 V231	P135-D229 WeakPolarHBondContact CD-OD1 3.34Å; N136-D229 WeakPolarHBondContact CB-OD2 3.46Å; N136-D229 PolarHBondContact N-OD1 3.04Å; N136-D229 PolarHBondContact ND2-OD2 2.75Å; D137-D229 HydrophobicContact CB-CB 4.36Å; D137-D229 PolarHBondContact N-OD1 2.98Å; D229-V231 PolarHBondContact O-N 2.94Å; D229-V231 VanDerWaalsContact O-N 3.1Å
230	Q	94.6	Very high	94.5	Very high	67 Å²	67	23 Å²	23	31%	0.313	12%	0.117	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.5	-4.2	-177.4	-47.3	-171.2	83.1	0	0	116.6	I245 I260	Q230-I245 PolarHBondContact O-N 2.82Å; Q230-I245 PolarHBondContact OE1-O 3.34Å; Q230-I260 HydrophobicContact CB-CD1 3.68Å; Q230-I260 HydrophobicContact CG-CD1 4.49Å
231	V	96.6	Very high	94.7	Very high	2 Å²	2	21.2 Å²	21.2	1%	0.012	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	142.9	179.1	-179.8	0	0	0	0	110.9	W134 K228 D229 L233 A242 C243 I260 L261	W134-V231 PolarHBondContact NE1-O 3.02Å; K228-V231 HydrophobicContact CB-CB 4.21Å; K228-V231 HydrophobicContact CD-CB 4.14Å; K228-V231 HydrophobicContact CD-CG2 3.73Å; K228-V231 HydrophobicContact CG-CB 4.07Å; K228-V231 HydrophobicContact CG-CG2 3.91Å; K228-V231 PolarHBondContact O-N 3.13Å; D229-V231 PolarHBondContact O-N 2.94Å; D229-V231 VanDerWaalsContact O-N 3.1Å; V231-L233 HydrophobicContact CG1-CD2 4.22Å; V231-A242 HydrophobicContact CG1-CB 4.2Å; V231-C243 CarbonylContact C-O 3.56Å; V231-C243 VanDerWaalsContact CA-O 3.29Å; V231-C243 WeakPolarHBondContact CA-O 3.25Å; V231-I260 HydrophobicContact CG2-CG2 3.48Å; V231-I260 VanDerWaalsContact CG2-CG2 3.48Å; V231-L261 HydrophobicContact CG1-CD2 4.44Å; V231-L261 HydrophobicContact CG2-CD2 4.04Å
232	V	97.1	Very high	94.9	Very high	3 Å²	3	21 Å²	21	2%	0.018	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	131.9	165.6	62.4	0	0	0	0	110.2	F144 Q225 L226 L234 C243 I245	F144-V232 HydrophobicContact CE1-CG2 4.34Å; F144-V232 HydrophobicContact CZ-CG2 3.87Å; Q225-V232 CarbonylContact O-C 3.51Å; Q225-V232 WeakPolarHBondContact O-CA 3.4Å; L226-V232 HydrophobicContact CD2-CB 3.75Å; L226-V232 HydrophobicContact CD2-CG2 3.67Å; V232-L234 HydrophobicContact CG1-CD1 4.48Å; V232-L234 HydrophobicContact CG1-CD2 4.38Å; V232-L234 HydrophobicContact CG1-CG 4.33Å; V232-L234 HydrophobicContact CG2-CD2 3.63Å; V232-L234 HydrophobicContact CG2-CG 4.3Å; V232-C243 HydrophobicContact CG1-CB 3.83Å; V232-C243 PolarHBondContact N-O 3.03Å; V232-C243 PolarHBondContact O-N 2.79Å; V232-I245 HydrophobicContact CG1-CD1 4.46Å
233	L	97.4	Very high	95.1	Very high	4 Å²	4	20.6 Å²	20.6	2%	0.021	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	122.5	173.7	-54.5	177	0	0	0	110	Q225 V231 L240 V241 A242 I521 V524 V531 W563	Q225-L233 HydrophobicContact CB-CB 4.46Å; Q225-L233 VanDerWaalsContact CG-O 3.28Å; Q225-L233 WeakPolarHBondContact CG-O 3.44Å; Q225-L233 PolarHBondContact NE2-O 2.91Å; Q225-L233 PolarHBondContact O-N 3.45Å; V231-L233 HydrophobicContact CG1-CD2 4.22Å; L233-L240 HydrophobicContact CB-CD1 4.27Å; L233-V241 CarbonylContact C-O 3.58Å; L233-V241 WeakPolarHBondContact CA-O 3.42Å; L233-A242 HydrophobicContact CD2-CB 3.57Å; L233-I521 HydrophobicContact CB-CD1 4.17Å; L233-I521 HydrophobicContact CD1-CD1 4.02Å; L233-V524 HydrophobicContact CD1-CG2 3.75Å; L233-V531 HydrophobicContact CD1-CG1 3.95Å; L233-V531 HydrophobicContact CD1-CG2 3.85Å; L233-V531 HydrophobicContact CD2-CG2 4.35Å; L233-W563 HydrophobicContact CD2-CZ3 4.38Å
234	L	96.3	Very high	95.2	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.005	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	114.5	-175.2	-57.7	-177.2	0	0	0	110	F144 I170 Y211 V232 V241 L460	F144-L234 HydrophobicContact CE1-CD2 4.14Å; I170-L234 HydrophobicContact CD1-CD1 3.86Å; I170-L234 HydrophobicContact CD1-CD2 3.23Å; I170-L234 HydrophobicContact CD1-CG 4.19Å; Y211-L234 HydrophobicContact CE1-CB 4.46Å; Y211-L234 HydrophobicContact CE1-CD1 4.25Å; Y211-L234 HydrophobicContact CE1-CD2 4.49Å; V232-L234 HydrophobicContact CG1-CD1 4.48Å; V232-L234 HydrophobicContact CG1-CD2 4.38Å; V232-L234 HydrophobicContact CG1-CG 4.33Å; V232-L234 HydrophobicContact CG2-CD2 3.63Å; V232-L234 HydrophobicContact CG2-CG 4.3Å; L234-V241 PolarHBondContact N-O 3.36Å; L234-V241 PolarHBondContact O-N 2.84Å; L234-L460 HydrophobicContact CB-CD1 4.22Å; L234-L460 HydrophobicContact CD1-CD1 3.69Å
235	N	95.4	Very high	95.2	Very high	18 Å²	18	17.6 Å²	17.6	10%	0.096	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	115.9	171.3	-178	-20.2	0	0	0	108.1	Y211 P218 S237 L240 V519	Y211-N235 WeakPolarHBondContact CE2-O 3.11Å; P218-N235 HydrophobicContact CB-CB 4.1Å; P218-N235 HydrophobicContact CG-CB 4.49Å; N235-S237 WeakPolarHBondContact OD1-CA 3.43Å; N235-S237 PolarHBondContact OD1-N 2.84Å; N235-L240 HydrophobicContact CB-CD1 4.27Å; N235-V519 PolarHBondContact ND2-O 3.48Å; N235-V519 VanDerWaalsContact ND2-O 3.07Å
236	T	93.9	Very high	94.9	Very high	14 Å²	14	17.3 Å²	17.3	9%	0.086	8%	0.083	C	C	.	.			trans	-94.1	9.6	-178.5	64.5	0	0	0	0	112.7	Y211 Y238 S239 V241 L460	Y211-T236 HydrophobicContact CD2-CG2 4.11Å; Y211-T236 HydrophobicContact CE2-CG2 4.34Å; T236-Y238 PolarHBondContact O-N 3.47Å; T236-Y238 PolarHBondContact OG1-N 3.44Å; T236-S239 PolarHBondContact N-O 3.16Å; T236-S239 PolarHBondContact OG1-N 3.44Å; T236-S239 PolarHBondContact OG1-O 3.12Å; T236-S239 PolarHBondContact OG1-OG 2.8Å; T236-V241 HydrophobicContact CG2-CG2 4.13Å; T236-L460 HydrophobicContact CG2-CD1 4.3Å; T236-L460 HydrophobicContact CG2-CD2 4.11Å; T236-L460 HydrophobicContact CG2-CG 4.46Å
237	S	92.5	Very high	94.6	Very high	15 Å²	15	19.6 Å²	19.6	11%	0.105	10%	0.095	C	C	.	.	S	Bend	trans	73.4	-39	-162.3	-20	0	0	0	0	114.2	V213 V214 N235 F493 Y517	V213-S237 WeakPolarHBondContact CA-OG 3.44Å; V213-S237 VanDerWaalsContact CB-OG 3.25Å; V213-S237 WeakPolarHBondContact CB-OG 3.45Å; V214-S237 PolarHBondContact N-OG 3.46Å; N235-S237 WeakPolarHBondContact OD1-CA 3.43Å; N235-S237 PolarHBondContact OD1-N 2.84Å; S237-F493 WeakPolarHBondContact O-CD2 3.41Å; S237-Y517 VanDerWaalsContact O-CE2 3.23Å; S237-Y517 WeakPolarHBondContact O-CE2 3.27Å
238	Y	92.5	Very high	94	Very high	122 Å²	122	19.1 Å²	19.1	48%	0.478	9%	0.094	S	C	.	.	S	Bend	trans	-99.1	-24.7	-177.1	-52.9	-74.1	0	0	0	113.8	V214 T236 F493	V214-Y238 HydrophobicContact CG1-CE2 4.44Å; V214-Y238 VanDerWaalsContact CG1-OH 3.28Å; V214-Y238 WeakPolarHBondContact CG1-OH 3.45Å; V214-Y238 HydrophobicContact CG2-CE1 4.39Å; V214-Y238 HydrophobicContact CG2-CE2 4.44Å; T236-Y238 PolarHBondContact O-N 3.47Å; T236-Y238 PolarHBondContact OG1-N 3.44Å; Y238-F493 WeakPolarHBondContact O-CB 3.23Å; Y238-F493 VanDerWaalsContact O-CD2 3.24Å; Y238-F493 WeakPolarHBondContact O-CD2 3.48Å; Y238-F493 WeakPolarHBondContact O-CG 3.2Å; Y238-F493 PolarHBondContact O-N 3.4Å
239	S	93.8	Very high	93	Very high	15 Å²	15	20.8 Å²	20.8	11%	0.105	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	159.9	-179.7	63.6	0	0	0	0	112.6	T236 L491 F493	T236-S239 PolarHBondContact N-O 3.16Å; T236-S239 PolarHBondContact OG1-N 3.44Å; T236-S239 PolarHBondContact OG1-O 3.12Å; T236-S239 PolarHBondContact OG1-OG 2.8Å; S239-L491 CarbonylContact C-O 3.55Å; S239-L491 WeakPolarHBondContact CA-O 3.16Å; S239-L491 VanDerWaalsContact CB-O 3.23Å; S239-L491 WeakPolarHBondContact CB-O 3.2Å; S239-F493 WeakPolarHBondContact O-CE2 3.26Å
240	L	95.1	Very high	91.6	Very high	1 Å²	1	22.7 Å²	22.7	1%	0.005	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	115.3	164.6	-171.1	63.4	0	0	0	108.7	L233 N235 L491 F493 I521 V531 I533 W563	L233-L240 HydrophobicContact CB-CD1 4.27Å; N235-L240 HydrophobicContact CB-CD1 4.27Å; L240-L491 HydrophobicContact CB-CB 4.48Å; L240-L491 PolarHBondContact N-O 3.32Å; L240-L491 PolarHBondContact O-N 2.93Å; L240-F493 HydrophobicContact CB-CE1 3.64Å; L240-F493 HydrophobicContact CB-CZ 3.65Å; L240-I521 HydrophobicContact CD1-CD1 4.49Å; L240-V531 HydrophobicContact CD2-CG1 4.23Å; L240-I533 HydrophobicContact CD2-CG2 3.91Å; L240-W563 HydrophobicContact CB-CZ3 4.3Å; L240-W563 HydrophobicContact CD2-CE3 3.8Å; L240-W563 HydrophobicContact CD2-CZ3 3.61Å; L240-W563 HydrophobicContact CG-CE3 4.44Å; L240-W563 HydrophobicContact CG-CH2 4.46Å; L240-W563 HydrophobicContact CG-CZ3 3.77Å; L240-W563 WeakPolarHBondContact O-CH2 3.19Å
241	V	95.4	Very high	89.6	Confident	0 Å²	0	25 Å²	25	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	123.1	177.5	-167.7	0	0	0	0	109.3	L233 L234 T236 L460 Q488 L489 T490	L233-V241 CarbonylContact C-O 3.58Å; L233-V241 WeakPolarHBondContact CA-O 3.42Å; L234-V241 PolarHBondContact N-O 3.36Å; L234-V241 PolarHBondContact O-N 2.84Å; T236-V241 HydrophobicContact CG2-CG2 4.13Å; V241-L460 HydrophobicContact CB-CD1 3.75Å; V241-L460 HydrophobicContact CG1-CD1 3.97Å; V241-L460 HydrophobicContact CG2-CD1 3.75Å; V241-L460 HydrophobicContact CG2-CG 4.18Å; V241-Q488 HydrophobicContact CG1-CB 4.24Å; V241-L489 WeakPolarHBondContact CA-O 3.2Å; V241-T490 HydrophobicContact CG2-CG2 4.08Å
242	A	96.3	Very high	87.3	Confident	0 Å²	0	30 Å²	30	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	112.7	167.7	0	0	0	0	0	108.8	V231 L233 L261 Q488 L489 W563 L565	V231-A242 HydrophobicContact CG1-CB 4.2Å; L233-A242 HydrophobicContact CD2-CB 3.57Å; A242-L261 HydrophobicContact CB-CD1 4.18Å; A242-L261 HydrophobicContact CB-CD2 4.41Å; A242-L261 WeakPolarHBondContact O-CD1 3.27Å; A242-Q488 WeakPolarHBondContact O-CA 3.44Å; A242-L489 HydrophobicContact CB-CB 4.39Å; A242-L489 PolarHBondContact N-O 2.8Å; A242-L489 PolarHBondContact O-N 3.4Å; A242-W563 HydrophobicContact CB-CH2 3.79Å; A242-W563 HydrophobicContact CB-CZ3 4.15Å; A242-L565 HydrophobicContact CB-CD2 3.83Å
243	C	95.8	Very high	84.9	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	114.7	178.4	-53.4	0	0	0	0	109.8	V231 V232 I245 F462 E487	V231-C243 CarbonylContact C-O 3.56Å; V231-C243 VanDerWaalsContact CA-O 3.29Å; V231-C243 WeakPolarHBondContact CA-O 3.25Å; V232-C243 HydrophobicContact CG1-CB 3.83Å; V232-C243 PolarHBondContact N-O 3.03Å; V232-C243 PolarHBondContact O-N 2.79Å; C243-I245 HydrophobicContact CB-CD1 4.47Å; C243-F462 HydrophobicContact CB-CZ 4.25Å; C243-E487 CarbonylContact C-O 3.59Å; C243-E487 VanDerWaalsContact CA-O 3.26Å; C243-E487 WeakPolarHBondContact CA-O 3.01Å
244	G	94.4	Very high	82.6	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	130.8	174.7	0	0	0	0	0	111.2	V486 E487	G244-V486 WeakPolarHBondContact O-CA 3.23Å; G244-E487 PolarHBondContact N-O 3.41Å; G244-E487 PolarHBondContact O-N 2.88Å
245	I	93.8	Very high	80.3	Confident	1 Å²	1	49 Å²	49	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	107.2	178.6	-53.9	90.9	0	0	0	109.6	K140 V172 Y205 L207 Q230 V232 C243 V484 C485	K140-I245 HydrophobicContact CD-CG2 4.47Å; K140-I245 WeakPolarHBondContact CE-O 3.28Å; K140-I245 PolarHBondContact NZ-O 3.34Å; V172-I245 HydrophobicContact CG2-CD1 4.47Å; Y205-I245 HydrophobicContact CE2-CG2 4.1Å; L207-I245 HydrophobicContact CD1-CG1 4.16Å; Q230-I245 PolarHBondContact O-N 2.82Å; Q230-I245 PolarHBondContact OE1-O 3.34Å; V232-I245 HydrophobicContact CG1-CD1 4.46Å; C243-I245 HydrophobicContact CB-CD1 4.47Å; I245-V484 HydrophobicContact CG2-CG1 4.15Å; I245-C485 WeakPolarHBondContact CA-O 3.3Å
246	S	91.9	Very high	78	Confident	7 Å²	7	56.5 Å²	56.5	5%	0.049	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	166.5	176.3	63.2	0	0	0	0	112.4	S258 V484 C485	S246-S258 PolarHBondContact OG-O 3.26Å; S246-V484 WeakPolarHBondContact O-CA 3.25Å; S246-C485 PolarHBondContact N-O 3.01Å; S246-C485 PolarHBondContact O-N 3.5Å; S246-C485 WeakPolarHBondContact OG-CB 3.19Å
247	L	88.4	Confident	75.9	Confident	48 Å²	48	59.1 Å²	59.1	25%	0.251	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	109.3	175.7	-174.9	75.8	0	0	0	108.7	L201 E202 Y205 P249 Q482 S483 V484	L201-L247 HydrophobicContact CB-CD1 4.47Å; L201-L247 HydrophobicContact CD2-CD1 4.07Å; L201-L247 HydrophobicContact CG-CD1 3.91Å; E202-L247 VanDerWaalsContact CA-CD2 3.49Å; E202-L247 HydrophobicContact CB-CD2 3.53Å; E202-L247 HydrophobicContact CG-CD2 3.62Å; Y205-L247 HydrophobicContact CE1-CD1 4.43Å; L247-P249 WeakPolarHBondContact O-CD 3.34Å; L247-Q482 HydrophobicContact CD1-CG 4.23Å; L247-Q482 VanDerWaalsContact CD2-NE2 3.29Å; L247-Q482 HydrophobicContact CG-CG 4.37Å; L247-S483 CarbonylContact C-O 3.56Å; L247-V484 HydrophobicContact CD1-CG2 3.89Å
248	C	82.7	Confident	74.4	Confident	11 Å²	11	59.5 Å²	59.5	7%	0.074	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	123.2	-179.2	-63.3	0	0	0	0	110.4	Q482 S483	C248-Q482 WeakPolarHBondContact O-CA 3.34Å; C248-S483 PolarHBondContact N-O 3.37Å; C248-S483 PolarHBondContact O-N 2.72Å
249	P	75.1	Confident	73.8	Confident	64 Å²	64	56.1 Å²	56.1	42%	0.416	30%	0.302	S	S	.	.			trans	-77.8	164.8	175.2	33.1	-35.3	0	0	0	112.1	L247 S251 E252	L247-P249 WeakPolarHBondContact O-CD 3.34Å; P249-S251 PolarHBondContact O-N 3.49Å; P249-S251 VanDerWaalsContact O-N 3.13Å; P249-E252 HydrophobicContact CG-CG 4.12Å
250	V	65	Low	73.4	Confident	84 Å²	84	56.6 Å²	56.6	51%	0.509	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-9.9	-171	-174.4	0	0	0	0	114.2	Q482	V250-Q482 HydrophobicContact CG2-CB 4.07Å
251	S	53.1	Low	73	Confident	115 Å²	115	56.6 Å²	56.6	80%	0.804	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.1	11.3	-157.7	-55.2	0	0	0	0	116.2	P249	P249-S251 PolarHBondContact O-N 3.49Å; P249-S251 VanDerWaalsContact O-N 3.13Å
252	E	48.3	Very low	72.6	Confident	106 Å²	106	57.9 Å²	57.9	50%	0.495	31%	0.308	S	S	.	.	S	Bend	trans	-106	145.8	179.1	-65.3	-174.8	168.4	0	0	112.2	P249 Q254 S257	P249-E252 HydrophobicContact CG-CG 4.12Å; E252-Q254 PolarHBondContact O-N 3.16Å; E252-S257 WeakPolarHBondContact CB-OG 3.44Å; E252-S257 WeakPolarHBondContact OE2-CB 3.47Å; E252-S257 PolarHBondContact OE2-OG 2.85Å
253	K	45.6	Very low	71.8	Confident	195 Å²	195	61.3 Å²	61.3	85%	0.848	33%	0.329	S	S	*	.			trans	-63.7	127.4	177.7	-69.2	-177.9	177.4	-179.7	0	109.3	D255	K253-D255 VanDerWaalsContact C-N 3.28Å; K253-D255 PolarHBondContact O-N 3.17Å
254	Q	48.8	Very low	70.3	Confident	83 Å²	83	68.1 Å²	68.1	39%	0.388	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-15.6	-147.5	-151.3	139.3	17.8	0	0	116	E252 H479	E252-Q254 PolarHBondContact O-N 3.16Å; Q254-H479 PolarHBondContact NE2-O 2.67Å
255	D	47.8	Very low	68.3	Low	129 Å²	129	70.3 Å²	70.3	69%	0.69	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-21	-166.8	-75.2	-36	0	0	0	116.9	K253	K253-D255 VanDerWaalsContact C-N 3.28Å; K253-D255 PolarHBondContact O-N 3.17Å
256	Q	47.9	Very low	65.9	Low	177 Å²	177	71.8 Å²	71.8	83%	0.827	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.7	-21.5	-164.2	-68.7	-177.4	0	0	0	117.9
257	S	50.2	Low	63.5	Low	68 Å²	68	73.9 Å²	73.9	48%	0.476	41%	0.412	S	S	.	.	S	Bend	trans	-88.5	-20.4	-169.8	62.4	0	0	0	0	115.8	E252	E252-S257 WeakPolarHBondContact CB-OG 3.44Å; E252-S257 WeakPolarHBondContact OE2-CB 3.47Å; E252-S257 PolarHBondContact OE2-OG 2.85Å
258	S	61.3	Low	61	Low	23 Å²	23	78.3 Å²	78.3	16%	0.161	43%	0.431	C	S	.	.	S	Bend	trans	-117.3	3.9	-168.5	52.6	0	0	0	0	114.9	S246 R432	S246-S258 PolarHBondContact OG-O 3.26Å; S258-R432 PolarHBondContact OG-NH2 3.27Å
259	Q	79.9	Confident	58.8	Low	51 Å²	51	82 Å²	82	24%	0.238	46%	0.457	C	S	.	.			trans	-79.4	119.7	178.9	-171.6	172.6	30.4	0	0	110.1	L261 Y262 Y430 E487	Q259-L261 WeakPolarHBondContact CG-O 3.2Å; Q259-L261 PolarHBondContact NE2-O 3.29Å; Q259-Y262 PolarHBondContact NE2-O 2.9Å; Q259-Y430 PolarHBondContact NE2-OH 2.91Å; Q259-E487 WeakPolarHBondContact CG-OE2 3.46Å
260	I	85.3	Confident	56.8	Low	26 Å²	26	82.3 Å²	82.3	13%	0.133	46%	0.458	C	S	.	.			trans	-90.9	-29.2	179.6	-59.1	164	0	0	0	111.6	Q230 V231 E487	Q230-I260 HydrophobicContact CB-CD1 3.68Å; Q230-I260 HydrophobicContact CG-CD1 4.49Å; V231-I260 HydrophobicContact CG2-CG2 3.48Å; V231-I260 VanDerWaalsContact CG2-CG2 3.48Å; I260-E487 PolarHBondContact N-OE1 3.06Å; I260-E487 PolarHBondContact N-OE2 2.7Å; I260-E487 VanDerWaalsContact N-OE2 3.13Å
261	L	86.1	Confident	55.4	Low	1 Å²	1	86.3 Å²	86.3	1%	0.005	47%	0.471	C	S	.	.	S	Bend	trans	-127.2	144.9	-172	-59.7	176.6	0	0	0	111	V231 A242 Q259 Y430 E487 L489 L565	V231-L261 HydrophobicContact CG1-CD2 4.44Å; V231-L261 HydrophobicContact CG2-CD2 4.04Å; A242-L261 HydrophobicContact CB-CD1 4.18Å; A242-L261 HydrophobicContact CB-CD2 4.41Å; A242-L261 WeakPolarHBondContact O-CD1 3.27Å; Q259-L261 WeakPolarHBondContact CG-O 3.2Å; Q259-L261 PolarHBondContact NE2-O 3.29Å; L261-Y430 HydrophobicContact CB-CE2 4.08Å; L261-Y430 PolarHBondContact O-OH 2.97Å; L261-E487 HydrophobicContact CB-CB 4.4Å; L261-E487 HydrophobicContact CD1-CB 4Å; L261-E487 HydrophobicContact CG-CB 4.45Å; L261-E487 PolarHBondContact N-OE2 2.69Å; L261-L489 HydrophobicContact CD1-CB 4.31Å; L261-L565 HydrophobicContact CD2-CB 4.05Å; L261-L565 HydrophobicContact CD2-CD1 4.21Å
262	Y	86.1	Confident	54.2	Low	26 Å²	26	85.9 Å²	85.9	10%	0.102	46%	0.464	C	S	.	.			trans	55.4	83.8	168	-169.3	-98.1	0	0	0	116.6	Q259 K264 E424 V428 Y430 L489 L565 N566 T567	Q259-Y262 PolarHBondContact NE2-O 2.9Å; Y262-K264 HydrophobicContact CE1-CB 4.3Å; Y262-K264 PolarHBondContact O-N 2.91Å; Y262-E424 PolarHBondContact OH-OE1 3.27Å; Y262-V428 HydrophobicContact CD2-CG1 4.13Å; Y262-V428 HydrophobicContact CE2-CG1 3.87Å; Y262-Y430 AromaticContact CD1-CD1 3.62Å; Y262-Y430 HydrophobicContact CD1-CD1 3.62Å; Y262-Y430 HydrophobicContact CD1-CD2 4.31Å; Y262-Y430 HydrophobicContact CD1-CE1 4.15Å; Y262-Y430 AromaticContact CD1-CG 3.7Å; Y262-Y430 HydrophobicContact CD1-CG 3.7Å; Y262-Y430 HydrophobicContact CE1-CD1 4.38Å; Y262-Y430 HydrophobicContact CG-CD1 4.31Å; Y262-Y430 HydrophobicContact CG-CD2 4.19Å; Y262-Y430 AromaticContact CG-CG 3.98Å; Y262-Y430 HydrophobicContact CG-CG 3.98Å; Y262-L489 HydrophobicContact CD2-CD1 3.87Å; Y262-L489 HydrophobicContact CG-CD1 4.04Å; Y262-L565 PolarHBondContact N-O 3.29Å; Y262-N566 CarbonylContact C-O 3.54Å; Y262-N566 WeakPolarHBondContact CA-O 3.22Å; Y262-T567 VanDerWaalsContact CE2-O 3.31Å; Y262-T567 WeakPolarHBondContact CE2-O 3.22Å
263	T	81.1	Confident	53.4	Low	72 Å²	72	85.8 Å²	85.8	44%	0.442	48%	0.475	S	S	.	.			trans	-85.6	101.1	174.1	-49.5	0	0	0	0	111.1	G265 A266 N566	T263-G265 PolarHBondContact O-N 2.82Å; T263-A266 WeakPolarHBondContact O-CB 2.74Å; T263-A266 PolarHBondContact O-N 3.4Å; T263-N566 PolarHBondContact N-O 3.39Å
264	K	63.9	Low	52.8	Low	143 Å²	143	81.7 Å²	81.7	62%	0.622	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	112.1	177.6	-162.5	178	-176.2	83.7	0	110.3	Y262 E424	Y262-K264 HydrophobicContact CE1-CB 4.3Å; Y262-K264 PolarHBondContact O-N 2.91Å; K264-E424 WeakPolarHBondContact CE-OE1 3.29Å; K264-E424 IonicContact NZ-OE1 2.63Å; K264-E424 PolarHBondContact NZ-OE1 2.87Å; K264-E424 IonicContact NZ-OE2 2.82Å; K264-E424 PolarHBondContact NZ-OE2 2.86Å
265	G	52.8	Low	52	Low	46 Å²	46	82.1 Å²	82.1	47%	0.474	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	117.2	-18.3	-177.3	0	0	0	0	0	115.7	T263 A267 Q268	T263-G265 PolarHBondContact O-N 2.82Å; G265-A267 PolarHBondContact O-N 2.93Å; G265-Q268 PolarHBondContact O-N 3.38Å
266	A	42.2	Very low	51.1	Low	32 Å²	32	83.9 Å²	83.9	26%	0.264	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-64.3	-25.8	-177.7	0	0	0	0	0	114.1	T263 Q268 S269 T567	T263-A266 WeakPolarHBondContact O-CB 2.74Å; T263-A266 PolarHBondContact O-N 3.4Å; A266-Q268 PolarHBondContact O-N 2.83Å; A266-Q268 VanDerWaalsContact O-N 3.15Å; A266-S269 WeakPolarHBondContact O-CB 3.5Å; A266-S269 PolarHBondContact O-N 2.94Å; A266-S269 VanDerWaalsContact O-N 3.15Å; A266-T567 HydrophobicContact CB-CG2 3.83Å
267	A	40.9	Very low	50.1	Low	52 Å²	52	79.8 Å²	79.8	43%	0.43	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-61.2	-21.3	178.3	0	0	0	0	0	114.2	G265 T567	G265-A267 PolarHBondContact O-N 2.93Å; A267-T567 HydrophobicContact CB-CG2 4.32Å
268	Q	37.4	Very low	49.1	Very low	140 Å²	140	81.9 Å²	81.9	65%	0.654	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-78.6	-21.6	178.9	-63.9	178	-7.1	0	0	113.1	G265 A266	G265-Q268 PolarHBondContact O-N 3.38Å; A266-Q268 PolarHBondContact O-N 2.83Å; A266-Q268 VanDerWaalsContact O-N 3.15Å
269	S	35.2	Very low	47.5	Very low	88 Å²	88	87.8 Å²	87.8	62%	0.615	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-77.7	-26.7	-174.9	175.5	0	0	0	0	113.5	A266 Q271 T272	A266-S269 WeakPolarHBondContact O-CB 3.5Å; A266-S269 PolarHBondContact O-N 2.94Å; A266-S269 VanDerWaalsContact O-N 3.15Å; S269-Q271 PolarHBondContact O-N 2.72Å; S269-T272 PolarHBondContact O-OG1 3.36Å
270	T	34.4	Very low	45	Very low	72 Å²	72	90.6 Å²	90.6	44%	0.442	56%	0.558	S	S	.	*	G	3₁₀ helix	trans	-85.1	-5.2	-170.6	-11.6	0	0	0	0	115
271	Q	35.3	Very low	42.4	Very low	167 Å²	167	95.4 Å²	95.4	78%	0.78	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-101.2	-9.4	179.9	-65.3	-170.5	0.3	0	0	114	S269	S269-Q271 PolarHBondContact O-N 2.72Å
272	T	27.8	Very low	39.4	Very low	106 Å²	106	103 Å²	103	65%	0.65	63%	0.631	S	S	*	*	S	Bend	trans	-103.2	0.8	-174.1	45.4	0	0	0	0	114.7	S269	S269-T272 PolarHBondContact O-OG1 3.36Å
273	S	31	Very low	36.6	Very low	105 Å²	105	106.9 Å²	106.9	73%	0.734	66%	0.662	S	S	*	*	S	Bend	trans	-89.4	4.1	178.9	53.1	0	0	0	0	114.8
274	S	33.3	Very low	34.1	Very low	108 Å²	108	109.3 Å²	109.3	76%	0.755	68%	0.682	S	S	*	*	S	Bend	trans	-103.7	35.2	179	66.1	0	0	0	0	114.5
275	S	32.6	Very low	32.4	Very low	92 Å²	92	107.9 Å²	107.9	64%	0.643	69%	0.69	S	S	*	*			trans	-162.3	114.5	164.2	46.1	0	0	0	0	112.4
276	L	28.3	Very low	31.2	Very low	167 Å²	167	113.4 Å²	113.4	87%	0.874	71%	0.708	S	S	*	*			trans	174.8	89.2	138.4	-93.2	159.2	0	0	0	111.6
277	S	26.9	Very low	30.8	Very low	90 Å²	90	117.3 Å²	117.3	63%	0.629	73%	0.731	S	S	*	*			trans	17	116.6	140	55.3	0	0	0	0	121
278	S	30.3	Very low	30.2	Very low	112 Å²	112	124.1 Å²	124.1	78%	0.783	75%	0.753	S	S	*	*				36.6	116.3	127.2	63.5	0	0	0	0	120.5
279	T	25.7	Very low	29.5	Very low	147 Å²	147	121.3 Å²	121.3	90%	0.902	76%	0.762	S	S	*	*			trans	-140.7	120.9	147.1	17.9	0	0	0	0	110.1
280	S	27.8	Very low	29.1	Very low	111 Å²	111	122.7 Å²	122.7	78%	0.776	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-98.1	143	172.2	45.6	0	0	0	0	110.4
281	P	30.8	Very low	28.7	Very low	127 Å²	127	125.4 Å²	125.4	83%	0.825	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-101.8	137.2	164.7	33.9	-26.9	0	0	0	112.1
282	D	23.5	Very low	28.2	Very low	161 Å²	161	126.8 Å²	126.8	86%	0.861	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-77.5	168.1	-178.4	-85	-52.7	0	0	0	115.1
283	S	27.2	Very low	28.2	Very low	107 Å²	107	126.8 Å²	126.8	75%	0.748	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-83.6	139.2	-176.7	56.2	0	0	0	0	115.8
284	S	28.7	Very low	27.9	Very low	122 Å²	122	132.1 Å²	132.1	85%	0.853	81%	0.809	S	S	*	*			trans	166.3	153.9	146.4	42.7	0	0	0	0	109
285	S	27.7	Very low	27.5	Very low	114 Å²	114	135.4 Å²	135.4	80%	0.797	82%	0.817	S	S	*	*			cis	-155.5	153.8	-10.4	45.3	0	0	0	0	108.9
286	L	29.1	Very low	27.3	Very low	162 Å²	162	139.6 Å²	139.6	85%	0.848	82%	0.824	S	S	*	*			trans	-92.7	158	170.1	-91.8	160.4	0	0	0	110.6
287	P	32.6	Very low	27.3	Very low	114 Å²	114	137.6 Å²	137.6	74%	0.74	82%	0.821	S	S	*	*				-140.9	137.1	105.2	35.2	-21.4	0	0	0	116.5
288	Q	27.7	Very low	27.2	Very low	194 Å²	194	139.8 Å²	139.8	91%	0.907	83%	0.834	S	S	*	*			trans	37.9	123.4	140.6	-68.3	175.3	-40.1	0	0	122.3
289	G	24.4	Very low	27.2	Very low	82 Å²	82	145.4 Å²	145.4	85%	0.845	84%	0.838	S	S	*	*			trans	-167.2	94.4	155	0	0	0	0	0	110.1
290	S	25.9	Very low	27.5	Very low	116 Å²	116	143.4 Å²	143.4	81%	0.811	83%	0.828	S	S	*	*			trans	-89.6	144.5	-170.6	50.9	0	0	0	0	114.1
291	S	26.5	Very low	27.7	Very low	130 Å²	130	143.7 Å²	143.7	91%	0.909	83%	0.827	S	S	*	*			trans	-160.4	134.9	145.7	-82.3	0	0	0	0	110.1
292	E	24.4	Very low	27.7	Very low	196 Å²	196	143.5 Å²	143.5	92%	0.916	83%	0.826	S	S	*	*			trans	-105.1	131.5	-161.5	-166	-176.2	150.9	0	0	111.6
293	S	27.2	Very low	28.1	Very low	105 Å²	105	142.2 Å²	142.2	73%	0.734	82%	0.824	S	S	*	*			trans	-156.6	92.2	170.2	175.4	0	0	0	0	114.3
294	R	25.5	Very low	28.2	Very low	218 Å²	218	142.9 Å²	142.9	82%	0.823	83%	0.825	S	S	*	*			trans	59	106.5	143.1	-57.9	-176.5	-177.1	-171.6	0.7	118.6
295	L	25.3	Very low	28.2	Very low	177 Å²	177	142.4 Å²	142.4	93%	0.927	82%	0.822	S	S	*	*			trans	-60.7	134.7	163.8	-66.5	160.4	0	0	0	112.3
296	F	27.4	Very low	28.2	Very low	179 Å²	179	143.7 Å²	143.7	79%	0.785	82%	0.819	S	S	*	*			trans	-131.5	138.3	156.2	-79.9	-80.4	0	0	0	109	C298	F296-C298 PolarHBondContact O-N 2.82Å
297	P	29.2	Very low	28.5	Very low	126 Å²	126	141.4 Å²	141.4	82%	0.818	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-73.8	120.4	-176.5	27.9	-33.3	0	0	0	111.8	R299	P297-R299 PolarHBondContact O-N 3.26Å
298	C	25.1	Very low	28.6	Very low	135 Å²	135	137.9 Å²	137.9	91%	0.912	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-68.3	118.3	175	-81.8	0	0	0	0	111.6	F296	F296-C298 PolarHBondContact O-N 2.82Å
299	R	28.7	Very low	29.4	Very low	230 Å²	230	135.5 Å²	135.5	87%	0.868	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-64.1	142.2	175.5	-172.5	-177.8	-172.6	-176.5	3.7	111.1	P297	P297-R299 PolarHBondContact O-N 3.26Å
300	P	33.2	Very low	30.2	Very low	106 Å²	106	132.5 Å²	132.5	69%	0.688	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-62.7	149.9	176.3	26	-35.1	0	0	0	112.1
301	P	32	Very low	31.2	Very low	117 Å²	117	129.6 Å²	129.6	76%	0.76	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-65.6	147.5	179.4	27.9	-34.7	0	0	0	111.5	V303	P301-V303 PolarHBondContact O-N 3.25Å
302	P	31.2	Very low	31.8	Very low	123 Å²	123	124.4 Å²	124.4	80%	0.799	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-70	132.1	-177.1	28	-34	0	0	0	111.9	P304	P302-P304 WeakPolarHBondContact O-CD 3.47Å
303	V	30.2	Very low	32.4	Very low	134 Å²	134	115.3 Å²	115.3	81%	0.812	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-56	125.1	173.2	179.2	0	0	0	0	110.4	P301 S305	P301-V303 PolarHBondContact O-N 3.25Å; V303-S305 PolarHBondContact O-N 3.06Å
304	P	30.7	Very low	33.6	Very low	120 Å²	120	113.8 Å²	113.8	78%	0.779	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-64.8	127.3	173.7	-21.2	33.4	0	0	0	111.4	P302	P302-P304 WeakPolarHBondContact O-CD 3.47Å
305	S	28.6	Very low	34.9	Very low	113 Å²	113	108 Å²	108	79%	0.79	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-72	131.9	179.3	48.9	0	0	0	0	112.5	V303	V303-S305 PolarHBondContact O-N 3.06Å
306	L	28.2	Very low	35.7	Very low	140 Å²	140	100.3 Å²	100.3	73%	0.733	57%	0.568	S	S	*	*			trans	12.7	119.2	174.8	-78.2	86.6	0	0	0	118.4	S308	L306-S308 PolarHBondContact O-N 3.5Å
307	P	35.5	Very low	36.7	Very low	114 Å²	114	97.4 Å²	97.4	74%	0.74	55%	0.551	S	S	*	*			trans	-74.8	23.5	178.4	33.5	-37.5	0	0	0	114.7	Q309	P307-Q309 PolarHBondContact O-N 3.39Å
308	S	34.8	Very low	37.8	Very low	41 Å²	41	96.8 Å²	96.8	29%	0.287	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	1	-153.7	63.9	0	0	0	0	117.2	L306 R317	L306-S308 PolarHBondContact O-N 3.5Å; S308-R317 PolarHBondContact O-NH1 2.91Å; S308-R317 PolarHBondContact O-NH2 2.69Å; S308-R317 VanDerWaalsContact O-NH2 3.17Å
309	Q	42.4	Very low	39	Very low	143 Å²	143	92.3 Å²	92.3	67%	0.668	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-146	40.5	-166.9	-59.1	-172.8	-10.1	0	0	116.1	P307	P307-Q309 PolarHBondContact O-N 3.39Å
310	S	43.3	Very low	39.5	Very low	19 Å²	19	81.6 Å²	81.6	13%	0.133	46%	0.463	C	S	.	.			trans	-82.1	152.6	167.1	81.6	0	0	0	0	111.3	A312 A313 I314 P607	S310-A312 VanDerWaalsContact C-N 3.32Å; S310-A312 PolarHBondContact O-N 3.21Å; S310-A313 CarbonylContact O-C 3.48Å; S310-A313 PolarHBondContact O-N 2.97Å; S310-A313 VanDerWaalsContact O-N 3.16Å; S310-A313 WeakPolarHBondContact OG-CB 3.48Å; S310-A313 PolarHBondContact OG-N 2.74Å; S310-I314 WeakPolarHBondContact O-CG1 3.25Å; S310-I314 PolarHBondContact O-N 2.88Å; S310-P607 WeakPolarHBondContact OG-CB 3.21Å
311	Q	45.2	Very low	39.9	Very low	55 Å²	55	78.3 Å²	78.3	26%	0.257	45%	0.445	S	S	.	.	H	α-helix	trans	-64	-36.4	175.8	-83.1	168.5	-54.8	0	0	112.2	R43 A313 I314 R315 S634	R43-Q311 VanDerWaalsContact NE-OE1 3.14Å; Q311-A313 VanDerWaalsContact C-N 3.35Å; Q311-I314 PolarHBondContact O-N 2.91Å; Q311-R315 PolarHBondContact O-N 3.32Å; Q311-S634 PolarHBondContact NE2-OG 2.56Å
312	A	39.7	Very low	40.4	Very low	21 Å²	21	73.7 Å²	73.7	17%	0.174	41%	0.414	C	S	.	.	H	α-helix	trans	-60	-43.9	170.7	0	0	0	0	0	111.3	S310 I314 R315 A316 E608	S310-A312 VanDerWaalsContact C-N 3.32Å; S310-A312 PolarHBondContact O-N 3.21Å; A312-I314 VanDerWaalsContact C-N 3.35Å; A312-I314 PolarHBondContact O-N 2.71Å; A312-R315 PolarHBondContact O-N 3.41Å; A312-A316 WeakPolarHBondContact O-CB 3.35Å; A312-A316 PolarHBondContact O-N 3Å; A312-E608 HydrophobicContact CB-CB 4.33Å
313	A	36.7	Very low	41	Very low	6 Å²	6	68.5 Å²	68.5	5%	0.05	38%	0.38	C	S	.	.	H	α-helix	trans	-70.5	-26.8	176.1	0	0	0	0	0	113.6	S310 Q311 R317 L605	S310-A313 CarbonylContact O-C 3.48Å; S310-A313 PolarHBondContact O-N 2.97Å; S310-A313 VanDerWaalsContact O-N 3.16Å; S310-A313 WeakPolarHBondContact OG-CB 3.48Å; S310-A313 PolarHBondContact OG-N 2.74Å; Q311-A313 VanDerWaalsContact C-N 3.35Å; A313-R317 VanDerWaalsContact O-CB 3.29Å; A313-R317 WeakPolarHBondContact O-CB 3.46Å; A313-R317 WeakPolarHBondContact O-CD 3.3Å; A313-R317 WeakPolarHBondContact O-CG 3.46Å; A313-R317 PolarHBondContact O-N 2.82Å; A313-L605 HydrophobicContact CB-CD2 4.32Å
314	I	52.2	Low	41.5	Very low	73 Å²	73	65.1 Å²	65.1	37%	0.374	35%	0.354	S	S	.	.	H	α-helix	trans	-71.8	-50.7	172.1	-68.4	163.3	0	0	0	109.7	S310 Q311 A312 A316 R317 E318	S310-I314 WeakPolarHBondContact O-CG1 3.25Å; S310-I314 PolarHBondContact O-N 2.88Å; Q311-I314 PolarHBondContact O-N 2.91Å; A312-I314 VanDerWaalsContact C-N 3.35Å; A312-I314 PolarHBondContact O-N 2.71Å; I314-A316 VanDerWaalsContact C-N 3.33Å; I314-A316 PolarHBondContact O-N 3.16Å; I314-R317 CarbonylContact O-C 3.56Å; I314-R317 WeakPolarHBondContact O-CA 3.29Å; I314-R317 WeakPolarHBondContact O-CB 3.38Å; I314-R317 PolarHBondContact O-N 3.2Å; I314-R317 VanDerWaalsContact O-N 3.1Å; I314-E318 WeakPolarHBondContact O-CG 3.48Å; I314-E318 PolarHBondContact O-N 3.12Å
315	R	52.7	Low	42.4	Very low	96 Å²	96	65.8 Å²	65.8	36%	0.362	34%	0.341	S	S	.	.	H	α-helix	trans	-65.1	-34.2	177.1	-70.7	-168.4	-175.5	-128.6	18.8	112.7	Q311 A312 E318 F319 N615 R616	Q311-R315 PolarHBondContact O-N 3.32Å; A312-R315 PolarHBondContact O-N 3.41Å; R315-E318 PolarHBondContact O-N 3.28Å; R315-F319 WeakPolarHBondContact O-CB 3.4Å; R315-F319 PolarHBondContact O-N 3.45Å; R315-N615 PolarHBondContact NH2-OD1 2.99Å; R315-R616 PolarHBondContact NH1-O 3Å
316	A	42.4	Very low	43.2	Very low	16 Å²	16	65.7 Å²	65.7	13%	0.132	32%	0.323	C	S	.	.	H	α-helix	trans	-69.1	-33.8	172	0	0	0	0	0	112.5	A312 I314 A320 L605	A312-A316 WeakPolarHBondContact O-CB 3.35Å; A312-A316 PolarHBondContact O-N 3Å; I314-A316 VanDerWaalsContact C-N 3.33Å; I314-A316 PolarHBondContact O-N 3.16Å; A316-A320 VanDerWaalsContact O-CB 3.27Å; A316-A320 WeakPolarHBondContact O-CB 3.36Å; A316-A320 PolarHBondContact O-N 2.96Å; A316-L605 HydrophobicContact CB-CD1 3.91Å; A316-L605 HydrophobicContact CB-CD2 3.49Å; A316-L605 VanDerWaalsContact CB-CD2 3.49Å; A316-L605 HydrophobicContact CB-CG 4.37Å
317	R	49.1	Very low	43.7	Very low	117 Å²	117	59.9 Å²	59.9	44%	0.442	30%	0.296	S	S	.	.	H	α-helix	trans	-69.3	-36.9	169.2	-78.3	169	-170.3	164.8	8.5	112.6	S308 A313 I314 A321 M602	S308-R317 PolarHBondContact O-NH1 2.91Å; S308-R317 PolarHBondContact O-NH2 2.69Å; S308-R317 VanDerWaalsContact O-NH2 3.17Å; A313-R317 VanDerWaalsContact O-CB 3.29Å; A313-R317 WeakPolarHBondContact O-CB 3.46Å; A313-R317 WeakPolarHBondContact O-CD 3.3Å; A313-R317 WeakPolarHBondContact O-CG 3.46Å; A313-R317 PolarHBondContact O-N 2.82Å; I314-R317 CarbonylContact O-C 3.56Å; I314-R317 WeakPolarHBondContact O-CA 3.29Å; I314-R317 WeakPolarHBondContact O-CB 3.38Å; I314-R317 PolarHBondContact O-N 3.2Å; I314-R317 VanDerWaalsContact O-N 3.1Å; R317-A321 WeakPolarHBondContact O-CB 3.34Å; R317-A321 PolarHBondContact O-N 2.93Å; R317-M602 HydrophobicContact CB-CE 4.35Å; R317-M602 HydrophobicContact CG-CE 3.57Å
318	E	52.5	Low	43.6	Very low	113 Å²	113	61.2 Å²	61.2	53%	0.528	29%	0.292	S	S	.	.	H	α-helix	trans	-66.8	-41.1	173.7	-72.7	166.7	170.4	0	0	111.1	I314 R315 A321 D322	I314-E318 WeakPolarHBondContact O-CG 3.48Å; I314-E318 PolarHBondContact O-N 3.12Å; R315-E318 PolarHBondContact O-N 3.28Å; E318-A321 PolarHBondContact O-N 2.8Å; E318-D322 WeakPolarHBondContact O-CB 3.32Å; E318-D322 PolarHBondContact O-N 2.85Å
319	F	48.9	Very low	43.4	Very low	42 Å²	42	62.4 Å²	62.4	18%	0.184	31%	0.31	C	S	.	.	H	α-helix	trans	-61.6	-50.5	171.5	167.2	-102.5	0	0	0	111.8	Q221 F224 R315 A321 D322 L323	Q221-F319 HydrophobicContact CB-CE2 4.42Å; Q221-F319 HydrophobicContact CB-CZ 4.41Å; Q221-F319 HydrophobicContact CG-CE2 4.22Å; Q221-F319 HydrophobicContact CG-CZ 3.98Å; F224-F319 HydrophobicContact CE2-CE1 4.23Å; R315-F319 WeakPolarHBondContact O-CB 3.4Å; R315-F319 PolarHBondContact O-N 3.45Å; F319-A321 VanDerWaalsContact C-N 3.31Å; F319-A321 PolarHBondContact O-N 2.9Å; F319-D322 PolarHBondContact O-N 3.37Å; F319-D322 VanDerWaalsContact O-N 3.12Å; F319-L323 HydrophobicContact CZ-CD2 4.29Å; F319-L323 PolarHBondContact O-N 2.76Å
320	A	40.9	Very low	42.9	Very low	4 Å²	4	58.5 Å²	58.5	3%	0.033	31%	0.309	C	S	.	.	H	α-helix	trans	-58.4	-44.8	174.8	0	0	0	0	0	111.1	A316 D322 L323 F324 V598 M602	A316-A320 VanDerWaalsContact O-CB 3.27Å; A316-A320 WeakPolarHBondContact O-CB 3.36Å; A316-A320 PolarHBondContact O-N 2.96Å; A320-D322 VanDerWaalsContact C-N 3.31Å; A320-D322 PolarHBondContact O-N 3.29Å; A320-L323 PolarHBondContact O-N 2.84Å; A320-F324 WeakPolarHBondContact O-CB 3.43Å; A320-F324 WeakPolarHBondContact O-CD2 3.48Å; A320-F324 PolarHBondContact O-N 3.24Å; A320-V598 HydrophobicContact CB-CG1 3.66Å; A320-M602 HydrophobicContact CB-CE 3.81Å; A320-M602 HydrophobicContact CB-CG 4Å; A320-M602 HydrophobicContact CB-SD 3.76Å
321	A	41.3	Very low	42.2	Very low	38 Å²	38	63.8 Å²	63.8	31%	0.314	33%	0.33	S	S	.	.	H	α-helix	trans	-63.7	-34.3	176.1	0	0	0	0	0	112.4	R317 E318 F319 F324 R325	R317-A321 WeakPolarHBondContact O-CB 3.34Å; R317-A321 PolarHBondContact O-N 2.93Å; E318-A321 PolarHBondContact O-N 2.8Å; F319-A321 VanDerWaalsContact C-N 3.31Å; F319-A321 PolarHBondContact O-N 2.9Å; A321-F324 PolarHBondContact O-N 3.44Å; A321-R325 WeakPolarHBondContact O-CB 3.46Å; A321-R325 VanDerWaalsContact O-CG 3.31Å; A321-R325 WeakPolarHBondContact O-CG 3.3Å; A321-R325 PolarHBondContact O-N 2.98Å
322	D	42.8	Very low	41.5	Very low	19 Å²	19	64.8 Å²	64.8	10%	0.102	35%	0.354	C	S	.	.	H	α-helix	trans	-72.7	-41.1	175.9	-159	55.4	0	0	0	112.2	E318 F319 A320 F324 R325 R326	E318-D322 WeakPolarHBondContact O-CB 3.32Å; E318-D322 PolarHBondContact O-N 2.85Å; F319-D322 PolarHBondContact O-N 3.37Å; F319-D322 VanDerWaalsContact O-N 3.12Å; A320-D322 VanDerWaalsContact C-N 3.31Å; A320-D322 PolarHBondContact O-N 3.29Å; D322-F324 VanDerWaalsContact C-N 3.3Å; D322-F324 PolarHBondContact O-N 2.88Å; D322-R325 PolarHBondContact O-N 3.49Å; D322-R325 VanDerWaalsContact O-N 3.16Å; D322-R325 IonicContact OD1-CZ 2.75Å; D322-R325 IonicContact OD1-NE 3.67Å; D322-R325 PolarHBondContact OD1-NE 3.49Å; D322-R325 VanDerWaalsContact OD1-NE 3.14Å; D322-R325 IonicContact OD1-NH2 2.86Å; D322-R325 PolarHBondContact OD1-NH2 3.24Å; D322-R326 WeakPolarHBondContact O-CG 3.11Å; D322-R326 PolarHBondContact O-N 3.14Å; D322-R326 IonicContact OD2-CZ 3.26Å; D322-R326 IonicContact OD2-NE 2.7Å; D322-R326 PolarHBondContact OD2-NE 3.35Å; D322-R326 IonicContact OD2-NH2 3.45Å; D322-R326 PolarHBondContact OD2-NH2 2.9Å
323	L	42.9	Very low	40.9	Very low	15 Å²	15	69.2 Å²	69.2	8%	0.079	39%	0.391	C	S	.	.	H	α-helix	trans	-63.2	-37.3	171.8	-173.5	45	0	0	0	111.1	T219 F319 A320 R326 A327 R594 V598	T219-L323 HydrophobicContact CG2-CD1 3.82Å; T219-L323 HydrophobicContact CG2-CD2 4.5Å; F319-L323 HydrophobicContact CZ-CD2 4.29Å; F319-L323 PolarHBondContact O-N 2.76Å; A320-L323 PolarHBondContact O-N 2.84Å; L323-R326 PolarHBondContact O-N 2.94Å; L323-A327 WeakPolarHBondContact O-CB 3.27Å; L323-A327 PolarHBondContact O-N 2.89Å; L323-R594 HydrophobicContact CD1-CB 4.48Å; L323-V598 HydrophobicContact CB-CG2 4.04Å; L323-V598 HydrophobicContact CD2-CG2 3.37Å; L323-V598 HydrophobicContact CG-CG2 3.65Å
324	F	40.4	Very low	40.5	Very low	63 Å²	63	73.3 Å²	73.3	28%	0.276	43%	0.425	S	S	.	.	H	α-helix	trans	-62.6	-44.1	169.2	-87.2	-64	0	0	0	113.1	A320 A321 D322 A327 Q328 K595 V598	A320-F324 WeakPolarHBondContact O-CB 3.43Å; A320-F324 WeakPolarHBondContact O-CD2 3.48Å; A320-F324 PolarHBondContact O-N 3.24Å; A321-F324 PolarHBondContact O-N 3.44Å; D322-F324 VanDerWaalsContact C-N 3.3Å; D322-F324 PolarHBondContact O-N 2.88Å; F324-A327 PolarHBondContact O-N 3.32Å; F324-Q328 WeakPolarHBondContact O-CG 3.12Å; F324-Q328 PolarHBondContact O-N 3.16Å; F324-K595 HydrophobicContact CE1-CB 4.36Å; F324-K595 HydrophobicContact CE1-CD 3.82Å; F324-K595 HydrophobicContact CE1-CG 3.68Å; F324-K595 HydrophobicContact CZ-CG 4.11Å; F324-V598 HydrophobicContact CD2-CG1 4.2Å; F324-V598 HydrophobicContact CE2-CB 4.46Å; F324-V598 HydrophobicContact CE2-CG1 3.58Å; F324-V598 HydrophobicContact CZ-CG1 4.16Å
325	R	49.3	Very low	39.2	Very low	133 Å²	133	80.9 Å²	80.9	50%	0.502	45%	0.449	S	S	.	.	H	α-helix	trans	-62.5	-44.2	176.2	-77.4	-174.9	-58.8	-123.5	6.8	111.6	A321 D322 Q328 G329	A321-R325 WeakPolarHBondContact O-CB 3.46Å; A321-R325 VanDerWaalsContact O-CG 3.31Å; A321-R325 WeakPolarHBondContact O-CG 3.3Å; A321-R325 PolarHBondContact O-N 2.98Å; D322-R325 PolarHBondContact O-N 3.49Å; D322-R325 VanDerWaalsContact O-N 3.16Å; D322-R325 IonicContact OD1-CZ 2.75Å; D322-R325 IonicContact OD1-NE 3.67Å; D322-R325 PolarHBondContact OD1-NE 3.49Å; D322-R325 VanDerWaalsContact OD1-NE 3.14Å; D322-R325 IonicContact OD1-NH2 2.86Å; D322-R325 PolarHBondContact OD1-NH2 3.24Å; R325-Q328 PolarHBondContact O-N 2.91Å; R325-G329 PolarHBondContact O-N 3.33Å
326	R	45.8	Very low	38	Very low	112 Å²	112	85.4 Å²	85.4	42%	0.423	47%	0.474	S	S	.	.	H	α-helix	trans	-65.5	-38.1	176.7	-67.5	178.8	-162.7	-138.5	0.4	111.8	D322 L323 Q328 G329	D322-R326 WeakPolarHBondContact O-CG 3.11Å; D322-R326 PolarHBondContact O-N 3.14Å; D322-R326 IonicContact OD2-CZ 3.26Å; D322-R326 IonicContact OD2-NE 2.7Å; D322-R326 PolarHBondContact OD2-NE 3.35Å; D322-R326 IonicContact OD2-NH2 3.45Å; D322-R326 PolarHBondContact OD2-NH2 2.9Å; L323-R326 PolarHBondContact O-N 2.94Å; R326-Q328 VanDerWaalsContact C-N 3.3Å; R326-Q328 PolarHBondContact O-N 2.95Å; R326-G329 PolarHBondContact O-N 3.12Å
327	A	38.2	Very low	37.2	Very low	18 Å²	18	91 Å²	91	15%	0.149	51%	0.506	C	S	.	.	H	α-helix	trans	-67.7	-26.3	175.4	0	0	0	0	0	113.7	L323 F324 S591	L323-A327 WeakPolarHBondContact O-CB 3.27Å; L323-A327 PolarHBondContact O-N 2.89Å; F324-A327 PolarHBondContact O-N 3.32Å; A327-S591 PolarHBondContact O-OG 2.76Å
328	Q	33.2	Very low	35.9	Very low	142 Å²	142	93.7 Å²	93.7	66%	0.664	52%	0.524	S	S	*	.	H	α-helix	trans	-89.1	-33.6	174.7	-71.6	178.5	-9.8	0	0	113	F324 R325 R326 G330 F331	F324-Q328 WeakPolarHBondContact O-CG 3.12Å; F324-Q328 PolarHBondContact O-N 3.16Å; R325-Q328 PolarHBondContact O-N 2.91Å; R326-Q328 VanDerWaalsContact C-N 3.3Å; R326-Q328 PolarHBondContact O-N 2.95Å; Q328-G330 PolarHBondContact O-N 2.96Å; Q328-G330 VanDerWaalsContact O-N 3.1Å; Q328-F331 PolarHBondContact O-N 3.37Å
329	G	32.1	Very low	34.5	Very low	65 Å²	65	99.7 Å²	99.7	67%	0.67	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-6.7	-179.1	0	0	0	0	0	115.5	R325 R326 F331	R325-G329 PolarHBondContact O-N 3.33Å; R326-G329 PolarHBondContact O-N 3.12Å; G329-F331 PolarHBondContact O-N 3.1Å
330	G	31.7	Very low	33.4	Very low	62 Å²	62	103.8 Å²	103.8	64%	0.639	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.8	-5.5	172.2	0	0	0	0	0	114.8	Q328	Q328-G330 PolarHBondContact O-N 2.96Å; Q328-G330 VanDerWaalsContact O-N 3.1Å
331	F	29.1	Very low	32.7	Very low	130 Å²	130	107.1 Å²	107.1	57%	0.57	61%	0.608	S	S	*	*	S	Bend	trans	-131.8	114.7	-179.5	-69.6	-83.4	0	0	0	112	Q328 G329	Q328-F331 PolarHBondContact O-N 3.37Å; G329-F331 PolarHBondContact O-N 3.1Å
332	G	29	Very low	31.9	Very low	75 Å²	75	113.6 Å²	113.6	77%	0.773	63%	0.631	S	S	*	*			trans	95.8	45.5	154.8	0	0	0	0	0	118.4	A334	G332-A334 PolarHBondContact O-N 3.02Å; G332-A334 VanDerWaalsContact O-N 3.11Å
333	A	27.7	Very low	31.1	Very low	114 Å²	114	124.3 Å²	124.3	94%	0.942	67%	0.67	S	S	*	*	S	Bend	trans	-80.8	45.5	160.9	0	0	0	0	0	112.3
334	A	29.2	Very low	30.2	Very low	92 Å²	92	134.3 Å²	134.3	76%	0.76	71%	0.707	S	S	*	*			trans	-158.6	68.5	178.5	0	0	0	0	0	110.9	G332	G332-A334 PolarHBondContact O-N 3.02Å; G332-A334 VanDerWaalsContact O-N 3.11Å
335	R	24.3	Very low	29.5	Very low	232 Å²	232	137.8 Å²	137.8	88%	0.875	73%	0.733	S	S	*	*			trans	-151	108.7	156.7	-122.6	177.5	-176.9	-171	-1	110.3	T337	R335-T337 PolarHBondContact O-N 2.84Å
336	E	27.6	Very low	28.4	Very low	192 Å²	192	136.1 Å²	136.1	90%	0.897	75%	0.748	S	S	*	*			trans	-49.7	128.7	164.8	-63.3	173.4	125.8	0	0	108.5
337	T	24.9	Very low	27.4	Very low	132 Å²	132	139 Å²	139	81%	0.81	77%	0.772	S	S	*	*			trans	-116.9	105.7	168.6	-53	0	0	0	0	106.8	R335	R335-T337 PolarHBondContact O-N 2.84Å
338	E	23	Very low	26.7	Very low	174 Å²	174	141.4 Å²	141.4	81%	0.813	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-52.6	144	179.3	-60.1	169	113.9	0	0	111.1	P340	E338-P340 VanDerWaalsContact O-CD 3.27Å; E338-P340 WeakPolarHBondContact O-CD 3.41Å
339	R	23.5	Very low	26.4	Very low	240 Å²	240	142.3 Å²	142.3	91%	0.906	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-66.2	121.7	176.2	-69.1	-179.6	175.8	-176.2	-0.9	110	G341	R339-G341 PolarHBondContact O-N 3.45Å
340	P	25.6	Very low	26.2	Very low	128 Å²	128	146.9 Å²	146.9	83%	0.831	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-64.5	131.2	168.6	-19.6	33.8	0	0	0	110	E338 E342	E338-P340 VanDerWaalsContact O-CD 3.27Å; E338-P340 WeakPolarHBondContact O-CD 3.41Å; P340-E342 PolarHBondContact O-N 2.89Å
341	G	25.4	Very low	26.1	Very low	74 Å²	74	151.8 Å²	151.8	76%	0.763	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-59.2	129.7	-168.8	0	0	0	0	0	114.8	R339 R343	R339-G341 PolarHBondContact O-N 3.45Å; G341-R343 PolarHBondContact O-N 3.41Å; G341-R343 VanDerWaalsContact O-N 3.11Å
342	E	25.1	Very low	25.9	Very low	174 Å²	174	154.1 Å²	154.1	81%	0.813	83%	0.829	S	S	*	*			trans	-73.7	96.9	174.8	-160.4	172.9	-145.8	0	0	109.7	P340 R344	P340-E342 PolarHBondContact O-N 2.89Å; E342-R344 PolarHBondContact O-N 3.47Å
343	R	25.1	Very low	25.9	Very low	244 Å²	244	154.8 Å²	154.8	92%	0.921	83%	0.827	S	S	*	*			trans	-67.6	95.4	171.6	-87.8	-173.6	175.1	172.6	-0.6	109.9	G341 T345	G341-R343 PolarHBondContact O-N 3.41Å; G341-R343 VanDerWaalsContact O-N 3.11Å; R343-T345 PolarHBondContact O-N 3.25Å
344	R	24.9	Very low	26.5	Very low	224 Å²	224	154.2 Å²	154.2	85%	0.845	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-63.8	121.7	163.8	-67.1	-178	177.5	-177.3	-2.4	109.5	E342	E342-R344 PolarHBondContact O-N 3.47Å
345	T	25.7	Very low	26.5	Very low	136 Å²	136	157.8 Å²	157.8	83%	0.834	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-73.8	145.8	158.5	41.7	0	0	0	0	109.3	R343	R343-T345 PolarHBondContact O-N 3.25Å
346	A	25	Very low	26.6	Very low	99 Å²	99	156.1 Å²	156.1	82%	0.818	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-72	147.7	-171.4	0	0	0	0	0	113.6
347	D	24.8	Very low	26.5	Very low	171 Å²	171	151.5 Å²	151.5	91%	0.914	81%	0.808	S	S	*	*			trans	-112.2	151	149.9	-103.4	-37.9	0	0	0	108.1
348	G	25.1	Very low	26.6	Very low	70 Å²	70	150.2 Å²	150.2	72%	0.722	81%	0.811	S	S	*	*			trans	-92.3	174.8	-173.7	0	0	0	0	0	115.2
349	D	25.9	Very low	26.8	Very low	160 Å²	160	148.1 Å²	148.1	86%	0.856	81%	0.805	S	S	*	*			trans	-17.2	141.9	171.1	-69.3	-59.5	0	0	0	117.5
350	E	28.1	Very low	27.1	Very low	162 Å²	162	145.1 Å²	145.1	76%	0.757	80%	0.799	S	S	*	*				-154.4	163	60.7	-77.9	-170.8	106	0	0	115.4
351	K	28.7	Very low	27.1	Very low	164 Å²	164	142.7 Å²	142.7	71%	0.713	80%	0.797	S	S	*	*			trans	5.2	151.9	148.1	-62.8	170.9	-177.2	163	0	119.8
352	E	25.6	Very low	27.3	Very low	179 Å²	179	146 Å²	146	84%	0.836	80%	0.796	S	S	*	*			cis	-155.6	178.2	17	-135	157.9	-149.3	0	0	111.1
353	A	28.3	Very low	27.3	Very low	89 Å²	89	145 Å²	145	74%	0.736	80%	0.795	S	S	*	*			trans	-102.2	-161.2	-168.6	0	0	0	0	0	113.2
354	P	41.7	Very low	27.4	Very low	103 Å²	103	137.4 Å²	137.4	67%	0.669	79%	0.785	S	S	*	*			cis	-132.8	-176.5	-25.9	35	-16.2	0	0	0	113.4
355	H	27.8	Very low	27.5	Very low	166 Å²	166	134.3 Å²	134.3	77%	0.769	79%	0.785	S	S	*	*			trans	160.2	112	136.9	-89.6	-76.9	0	0	0	108.8
356	K	26.8	Very low	28.7	Very low	198 Å²	198	132.9 Å²	132.9	86%	0.861	78%	0.779	S	S	*	*				52.9	131.2	81.2	-76.2	-170.5	177.9	-178.6	0	113.5
357	A	25.6	Very low	28.7	Very low	94 Å²	94	133.2 Å²	133.2	78%	0.777	78%	0.775	S	S	*	*			cis	-166.6	-178.3	-0.9	0	0	0	0	0	110.8
358	A	27.5	Very low	28.9	Very low	105 Å²	105	136.6 Å²	136.6	87%	0.868	78%	0.775	S	S	*	*			trans	116.9	145.3	163.8	0	0	0	0	0	114.9
359	D	26.9	Very low	28.9	Very low	131 Å²	131	137.1 Å²	137.1	70%	0.701	77%	0.772	S	S	*	*				-166.4	150.3	-58	-175	26.1	0	0	0	105.6
360	K	28.7	Very low	29	Very low	177 Å²	177	137.6 Å²	137.6	77%	0.77	77%	0.769	S	S	*	*			trans	5.4	138.9	172	-71.1	154.2	-168	162	0	123.3
361	G	26.5	Very low	29	Very low	77 Å²	77	138.6 Å²	138.6	79%	0.794	77%	0.774	S	S	*	*			trans	-155.9	126	137.9	0	0	0	0	0	110.3
362	I	29.3	Very low	28.9	Very low	144 Å²	144	137.2 Å²	137.2	74%	0.738	77%	0.774	S	S	*	*			trans	-128.9	135.2	-176.1	-64.2	172.5	0	0	0	110
363	N	25.8	Very low	28.9	Very low	151 Å²	151	133.1 Å²	133.1	81%	0.807	77%	0.765	S	S	*	*			trans	161.6	130.2	145.7	-81.5	-23.6	0	0	0	107.4
364	A	26.6	Very low	28.8	Very low	86 Å²	86	137.5 Å²	137.5	71%	0.711	77%	0.767	S	S	*	*			cis	74.8	83.7	35.5	0	0	0	0	0	113.1
365	D	26.3	Very low	28	Very low	158 Å²	158	139.5 Å²	139.5	85%	0.845	77%	0.772	S	S	*	*				105	-176.6	77.3	-146.7	27.8	0	0	0	110.7
366	P	51.4	Low	27.9	Very low	106 Å²	106	143.5 Å²	143.5	69%	0.688	78%	0.78	S	S	*	*				-131	179.6	-111.5	43	-25	0	0	0	117.2
367	S	25.6	Very low	27.9	Very low	106 Å²	106	145.9 Å²	145.9	74%	0.741	78%	0.784	S	S	*	*			trans	-161.5	121.2	163.8	56.2	0	0	0	0	111.3
368	R	28.3	Very low	27.9	Very low	243 Å²	243	145.9 Å²	145.9	92%	0.917	78%	0.784	S	S	*	*				67.7	143.9	82.9	-69.2	-177.6	172.5	-165.7	-4.3	114.1
369	A	26.4	Very low	27.9	Very low	80 Å²	80	150 Å²	150	66%	0.661	79%	0.785	S	S	*	*			cis	-151.1	152	9.8	0	0	0	0	0	109.8
370	E	27.3	Very low	27.8	Very low	170 Å²	170	150.3 Å²	150.3	79%	0.794	79%	0.787	S	S	*	*				74.4	125.7	83.8	-64.7	179.1	150.2	0	0	118.8
371	E	27.9	Very low	27.9	Very low	184 Å²	184	151.8 Å²	151.8	86%	0.86	79%	0.788	S	S	*	*			trans	56.9	165.9	143.8	-63.8	-172.1	156.5	0	0	122.5
372	D	26.6	Very low	27.9	Very low	135 Å²	135	158.8 Å²	158.8	72%	0.722	79%	0.79	S	S	*	*			cis	-166.3	157.7	-39.1	179.4	37	0	0	0	109.6
373	C	24.9	Very low	27.8	Very low	93 Å²	93	158.1 Å²	158.1	63%	0.628	79%	0.793	S	S	*	*			trans	57.4	138.9	154.3	-93.5	0	0	0	0	126.7
374	K	26.6	Very low	27.9	Very low	181 Å²	181	155.7 Å²	155.7	79%	0.787	79%	0.788	S	S	*	*			trans	101	118.9	135.8	-83.3	172.8	179.8	167.4	0	124.7
375	D	24.8	Very low	28	Very low	144 Å²	144	155.8 Å²	155.8	77%	0.77	78%	0.783	S	S	*	*			trans	32.5	125.5	131.8	-73.1	-37.2	0	0	0	122.7
376	R	26.2	Very low	28	Very low	251 Å²	251	156.1 Å²	156.1	95%	0.947	78%	0.78	S	S	*	*				-179.5	164	105.5	-99.2	177.4	173.9	-165.7	-3.9	115.4
377	R	26.1	Very low	26.9	Very low	247 Å²	247	159.7 Å²	159.7	93%	0.932	79%	0.787	S	S	*	*			trans	-90.9	152.8	-178	-59.1	175.6	174.3	-168.2	-1.8	114.3
378	A	25.9	Very low	27	Very low	94 Å²	94	158.9 Å²	158.9	78%	0.777	79%	0.787	S	S	*	*				171.1	123.9	127.9	0	0	0	0	0	108.5
379	E	27.4	Very low	27	Very low	192 Å²	192	152.9 Å²	152.9	90%	0.897	78%	0.782	S	S	*	*				95	150.3	61.1	-120.6	175.2	-174.7	0	0	115
380	D	25.3	Very low	27.1	Very low	138 Å²	138	153.7 Å²	153.7	74%	0.738	79%	0.789	S	S	*	*			trans	73.9	142	179.5	-83.2	-9.9	0	0	0	120.9
381	R	29.8	Very low	27	Very low	208 Å²	208	151.6 Å²	151.6	79%	0.785	79%	0.793	S	S	*	*			cis	-171.5	165.3	-23.9	-160	164.6	169.1	177.2	-0.7	111.6
382	R	28.1	Very low	27	Very low	223 Å²	223	149.4 Å²	149.4	84%	0.842	80%	0.797	S	S	*	*			trans	95.6	134.2	162.8	-54.2	176.3	-173.1	-163.4	1	114.5
383	T	27.5	Very low	27	Very low	131 Å²	131	146.7 Å²	146.7	80%	0.804	80%	0.801	S	S	*	*			cis	-149.7	163.7	12.5	-14.1	0	0	0	0	113.7
384	S	27	Very low	27.3	Very low	99 Å²	99	148 Å²	148	69%	0.692	81%	0.81	S	S	*	*			trans	-25.2	143.5	178.8	47.2	0	0	0	0	120.4
385	S	27.9	Very low	28	Very low	89 Å²	89	145.6 Å²	145.6	62%	0.622	81%	0.814	S	S	*	*				75.6	145.9	51.3	-156.3	0	0	0	0	113.5
386	Q	26.6	Very low	28.3	Very low	165 Å²	165	149.8 Å²	149.8	77%	0.771	82%	0.818	S	S	*	*			cis	-118	172.3	-5.1	-73.2	88.5	64.9	0	0	110.8
387	Q	28.1	Very low	28.5	Very low	181 Å²	181	145.8 Å²	145.8	85%	0.846	82%	0.815	S	S	*	*			cis	91.1	87.9	-2	-161.4	-179.4	0.8	0	0	121.1
388	A	27.3	Very low	28.6	Very low	89 Å²	89	138.2 Å²	138.2	74%	0.736	81%	0.805	S	S	*	*			trans	-164.6	115	156.4	0	0	0	0	0	110.4
389	S	28.5	Very low	28.8	Very low	116 Å²	116	138.7 Å²	138.7	81%	0.811	81%	0.809	S	S	*	*				66.1	140.4	67.7	74.2	0	0	0	0	114.5
390	A	29.6	Very low	28.9	Very low	97 Å²	97	135 Å²	135	80%	0.802	81%	0.805	S	S	*	*			cis	165	141.4	-12.1	0	0	0	0	0	105.4
391	S	25.5	Very low	29.5	Very low	126 Å²	126	134.3 Å²	134.3	88%	0.881	81%	0.807	S	S	*	*			trans	-166.7	140.9	156.6	58.1	0	0	0	0	113.3
392	C	28.2	Very low	29.3	Very low	139 Å²	139	128.7 Å²	128.7	94%	0.939	81%	0.806	S	S	*	*			trans	-96.8	156.4	167.7	-58.9	0	0	0	0	110.3
393	G	25.2	Very low	29.3	Very low	78 Å²	78	123.6 Å²	123.6	80%	0.804	80%	0.804	S	S	*	*			trans	-177.9	120.1	168.3	0	0	0	0	0	113.8
394	S	31.8	Very low	29.8	Very low	119 Å²	119	123 Å²	123	83%	0.832	80%	0.802	S	S	*	*			trans	-109.4	157.1	162.6	-54.2	0	0	0	0	109.3
395	P	41.9	Very low	30.3	Very low	132 Å²	132	123.7 Å²	123.7	86%	0.857	81%	0.805	S	S	*	*				-142.1	176.6	114.8	32.2	-15	0	0	0	114.9
396	R	29.8	Very low	30.5	Very low	231 Å²	231	125.8 Å²	125.8	87%	0.872	82%	0.816	S	S	*	*			trans	-94.3	176.5	-175.5	-79.9	177.3	156.2	-161.6	-3.7	113.6
397	L	31.7	Very low	30.6	Very low	168 Å²	168	123.5 Å²	123.5	88%	0.88	82%	0.819	S	S	*	*			trans	95.2	139.4	158.9	-53.6	174.3	0	0	0	115.3
398	A	28.2	Very low	30.6	Very low	88 Å²	88	122.6 Å²	122.6	73%	0.727	82%	0.819	S	S	*	*			cis	-167.4	176.6	-14.4	0	0	0	0	0	110.8
399	A	29.8	Very low	30.7	Very low	103 Å²	103	124.5 Å²	124.5	85%	0.851	82%	0.823	S	S	*	*			trans	85.9	122.7	162.4	0	0	0	0	0	120.7
400	S	28.8	Very low	30.6	Very low	116 Å²	116	124.1 Å²	124.1	81%	0.811	82%	0.821	S	S	*	*			trans	-95.6	178.8	165.9	-29.3	0	0	0	0	109.8
401	P	37.3	Very low	30.5	Very low	122 Å²	122	126.6 Å²	126.6	79%	0.792	83%	0.826	S	S	*	*				-153.3	176.8	50.3	41.9	-19.5	0	0	0	119.7
402	A	27.4	Very low	30.5	Very low	90 Å²	90	125.7 Å²	125.7	74%	0.744	82%	0.82	S	S	*	*			trans	72.8	113.2	147.6	0	0	0	0	0	123.5
403	S	28	Very low	30.4	Very low	117 Å²	117	123.8 Å²	123.8	82%	0.818	81%	0.814	S	S	*	*				17.8	160.3	127.9	-46.7	0	0	0	0	122.6
404	P	36.8	Very low	30.5	Very low	117 Å²	117	125.6 Å²	125.6	76%	0.76	81%	0.812	S	S	*	*			cis	-134.9	177.6	14.8	39.7	-20.5	0	0	0	116.3
405	P	38	Very low	30.5	Very low	114 Å²	114	125.9 Å²	125.9	74%	0.74	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-82.4	154.3	174.3	33.9	-36.2	0	0	0	113.7
406	P	32.8	Very low	29.8	Very low	133 Å²	133	124.1 Å²	124.1	86%	0.864	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-80.2	144.4	178	32.3	-34.3	0	0	0	113.2
407	S	27.8	Very low	29.7	Very low	118 Å²	118	119 Å²	119	83%	0.825	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-97.3	163.3	-177.4	50.2	0	0	0	0	114.6
408	L	28.3	Very low	29.5	Very low	162 Å²	162	119.4 Å²	119.4	85%	0.848	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-49.2	151.9	179.8	-63.5	145.7	0	0	0	115.9
409	P	28.6	Very low	29.3	Very low	128 Å²	128	122.3 Å²	122.3	83%	0.831	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-87.1	145.4	146.3	33.9	-27.9	0	0	0	111.4
410	S	26.2	Very low	29.3	Very low	109 Å²	109	123.1 Å²	123.1	76%	0.762	80%	0.802	S	S	*	*			trans	-127.7	112.5	-171.6	58.4	0	0	0	0	113.9
411	T	27.6	Very low	29.2	Very low	149 Å²	149	122.5 Å²	122.5	91%	0.914	80%	0.797	S	S	*	*			trans	179.4	146.5	156.8	20.5	0	0	0	0	107.1
412	S	27.3	Very low	29.3	Very low	106 Å²	106	121.7 Å²	121.7	74%	0.741	79%	0.792	S	S	*	*			cis	-152.4	152.1	-3.6	44.5	0	0	0	0	108.3
413	A	26.1	Very low	30.1	Very low	100 Å²	100	122.7 Å²	122.7	83%	0.826	79%	0.793	S	S	*	*			trans	-79	139.5	179.7	0	0	0	0	0	112.6
414	P	27.4	Very low	31.5	Very low	116 Å²	116	122.2 Å²	122.2	75%	0.753	78%	0.778	S	S	*	*			trans	-99.2	127.1	142.1	32.9	-26.1	0	0	0	109.4	S416	P414-S416 PolarHBondContact O-N 2.86Å
415	S	31.8	Very low	32.5	Very low	124 Å²	124	118.5 Å²	118.5	87%	0.867	75%	0.754	S	S	*	*			trans	-73.2	112.2	174.4	51.8	0	0	0	0	111.3
416	S	25.6	Very low	33.6	Very low	96 Å²	96	116.6 Å²	116.6	67%	0.671	76%	0.755	S	S	*	*			trans	-143.4	101	157.7	61.6	0	0	0	0	110.1	P414 Q418	P414-S416 PolarHBondContact O-N 2.86Å; S416-Q418 PolarHBondContact O-N 3.47Å; S416-Q418 VanDerWaalsContact O-N 3.08Å
417	S	28.6	Very low	35.4	Very low	124 Å²	124	111.3 Å²	111.3	87%	0.867	72%	0.718	S	S	*	*			trans	-64.2	103.1	164.3	49.8	0	0	0	0	109.1
418	Q	27.2	Very low	37.5	Very low	175 Å²	175	107.1 Å²	107.1	82%	0.818	69%	0.688	S	S	*	*			trans	-113.9	119.8	158.5	-71.7	-168.5	-17	0	0	107	S416	S416-Q418 PolarHBondContact O-N 3.47Å; S416-Q418 VanDerWaalsContact O-N 3.08Å
419	D	24.4	Very low	40.2	Very low	149 Å²	149	101.5 Å²	101.5	80%	0.797	66%	0.659	S	S	*	*			trans	-58.1	145.2	170.2	-63.6	-63.4	0	0	0	109.6	S421	D419-S421 PolarHBondContact O-N 3.16Å
420	P	29.8	Very low	43.2	Very low	121 Å²	121	98 Å²	98	79%	0.786	63%	0.629	S	S	*	*			trans	-64.2	111.7	174.8	27.2	-33	0	0	0	108.9
421	S	26.6	Very low	46.2	Very low	103 Å²	103	93.3 Å²	93.3	72%	0.72	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-57	132.2	166.4	48.1	0	0	0	0	108.6	D419 S423	D419-S421 PolarHBondContact O-N 3.16Å; S421-S423 PolarHBondContact O-N 3.34Å
422	P	39.7	Very low	49.1	Very low	105 Å²	105	89.1 Å²	89.1	68%	0.682	56%	0.564	S	S	*	*	P	Polyproline II helix	trans	-62.1	116.7	176.1	24.5	-32.1	0	0	0	108.3	E424	P422-E424 PolarHBondContact O-N 3.08Å
423	S	44.3	Very low	52.1	Low	110 Å²	110	86.5 Å²	86.5	77%	0.769	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-56.9	134.9	178.5	49.4	0	0	0	0	110.3	S421	S421-S423 PolarHBondContact O-N 3.34Å
424	E	56.1	Low	55.1	Low	107 Å²	107	83.1 Å²	83.1	50%	0.5	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-56.4	137.4	173.5	-62.1	-172.8	129	0	0	109.4	Y262 K264 P422 G426	Y262-E424 PolarHBondContact OH-OE1 3.27Å; K264-E424 WeakPolarHBondContact CE-OE1 3.29Å; K264-E424 IonicContact NZ-OE1 2.63Å; K264-E424 PolarHBondContact NZ-OE1 2.87Å; K264-E424 IonicContact NZ-OE2 2.82Å; K264-E424 PolarHBondContact NZ-OE2 2.86Å; P422-E424 PolarHBondContact O-N 3.08Å; E424-G426 PolarHBondContact O-N 3.11Å
425	P	59.2	Low	58.1	Low	40 Å²	40	78.7 Å²	78.7	26%	0.26	48%	0.477	S	S	.	.			trans	-59.5	113.8	179.8	21.2	-31.5	0	0	0	109.9	Y427 V428 V569	P425-Y427 HydrophobicContact CB-CD1 3.76Å; P425-Y427 HydrophobicContact CB-CE1 3.41Å; P425-Y427 VanDerWaalsContact CB-CE1 3.41Å; P425-Y427 HydrophobicContact CB-CE2 4.18Å; P425-Y427 HydrophobicContact CB-CG 4.37Å; P425-Y427 PolarHBondContact O-N 3.38Å; P425-V428 HydrophobicContact CB-CG2 4.24Å; P425-V428 HydrophobicContact CG-CG2 3.76Å; P425-V428 PolarHBondContact O-N 3.01Å; P425-V428 VanDerWaalsContact O-N 3.07Å; P425-V569 HydrophobicContact CG-CG2 4.44Å
426	G	60.8	Low	60.7	Low	74 Å²	74	76.1 Å²	76.1	76%	0.763	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	10.3	-172	0	0	0	0	0	116.2	E424	E424-G426 PolarHBondContact O-N 3.11Å
427	Y	69.1	Low	63.5	Low	21 Å²	21	75.1 Å²	75.1	8%	0.082	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-6.4	175.5	59.9	-102.5	0	0	0	113.8	P425 L491 Y495 E499 C570	P425-Y427 HydrophobicContact CB-CD1 3.76Å; P425-Y427 HydrophobicContact CB-CE1 3.41Å; P425-Y427 VanDerWaalsContact CB-CE1 3.41Å; P425-Y427 HydrophobicContact CB-CE2 4.18Å; P425-Y427 HydrophobicContact CB-CG 4.37Å; P425-Y427 PolarHBondContact O-N 3.38Å; Y427-L491 HydrophobicContact CD2-CD1 4.18Å; Y427-L491 HydrophobicContact CE2-CD1 4.46Å; Y427-Y495 VanDerWaalsContact CB-CD1 3.42Å; Y427-Y495 AromaticContact CD1-CD1 3.75Å; Y427-Y495 HydrophobicContact CD1-CD1 3.75Å; Y427-Y495 AromaticContact CD1-CE1 3.26Å; Y427-Y495 HydrophobicContact CD1-CE1 3.26Å; Y427-Y495 AromaticContact CD1-CZ 3.87Å; Y427-Y495 HydrophobicContact CE1-CE1 4.11Å; Y427-Y495 AromaticContact CG-CD1 3.86Å; Y427-Y495 HydrophobicContact CG-CD1 3.86Å; Y427-Y495 AromaticContact CG-CE1 3.84Å; Y427-Y495 HydrophobicContact CG-CE1 3.84Å; Y427-E499 VanDerWaalsContact CE1-OE2 3.22Å; Y427-E499 WeakPolarHBondContact CE1-OE2 3.43Å; Y427-C570 HydrophobicContact CE2-CB 4.35Å; Y427-C570 PolarHBondContact OH-N 3.12Å
428	V	72.7	Confident	65.6	Low	30 Å²	30	73.9 Å²	73.9	18%	0.182	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	105.2	-179.8	-177.6	0	0	0	0	109.2	Y262 P425 L489 G568	Y262-V428 HydrophobicContact CD2-CG1 4.13Å; Y262-V428 HydrophobicContact CE2-CG1 3.87Å; P425-V428 HydrophobicContact CB-CG2 4.24Å; P425-V428 HydrophobicContact CG-CG2 3.76Å; P425-V428 PolarHBondContact O-N 3.01Å; P425-V428 VanDerWaalsContact O-N 3.07Å; V428-L489 HydrophobicContact CG1-CD1 3.5Å; V428-L489 VanDerWaalsContact CG1-CD1 3.5Å; V428-G568 WeakPolarHBondContact CG2-O 3.44Å
429	N	86.1	Confident	67.3	Low	45 Å²	45	71.4 Å²	71.4	24%	0.241	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	125.6	167.1	-169.8	-22	0	0	0	109	T490	N429-T490 PolarHBondContact N-O 2.79Å; N429-T490 PolarHBondContact O-N 3.27Å
430	Y	90.1	Very high	68.3	Low	54 Å²	54	74.2 Å²	74.2	21%	0.212	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	124.7	177.3	176.5	-109.9	0	0	0	110.7	Q259 L261 Y262 R432 E487 Q488 L489	Q259-Y430 PolarHBondContact NE2-OH 2.91Å; L261-Y430 HydrophobicContact CB-CE2 4.08Å; L261-Y430 PolarHBondContact O-OH 2.97Å; Y262-Y430 AromaticContact CD1-CD1 3.62Å; Y262-Y430 HydrophobicContact CD1-CD1 3.62Å; Y262-Y430 HydrophobicContact CD1-CD2 4.31Å; Y262-Y430 HydrophobicContact CD1-CE1 4.15Å; Y262-Y430 AromaticContact CD1-CG 3.7Å; Y262-Y430 HydrophobicContact CD1-CG 3.7Å; Y262-Y430 HydrophobicContact CE1-CD1 4.38Å; Y262-Y430 HydrophobicContact CG-CD1 4.31Å; Y262-Y430 HydrophobicContact CG-CD2 4.19Å; Y262-Y430 AromaticContact CG-CG 3.98Å; Y262-Y430 HydrophobicContact CG-CG 3.98Å; Y430-R432 HydrophobicContact CE1-CB 4.14Å; Y430-E487 HydrophobicContact CE2-CB 4.19Å; Y430-E487 PolarHBondContact OH-OE2 2.86Å; Y430-Q488 CarbonylContact C-O 3.54Å; Y430-Q488 VanDerWaalsContact CA-O 3.3Å; Y430-Q488 WeakPolarHBondContact CA-O 3.34Å; Y430-Q488 WeakPolarHBondContact CD2-O 3.34Å; Y430-L489 HydrophobicContact CD2-CB 4.27Å; Y430-L489 HydrophobicContact CD2-CD1 3.97Å; Y430-L489 HydrophobicContact CG-CD1 4.35Å
431	S	89.2	Confident	69	Low	10 Å²	10	72.4 Å²	72.4	7%	0.07	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	148.8	173.2	82.7	0	0	0	0	111.9	Q459 E487 Q488	S431-Q459 VanDerWaalsContact CB-CD 3.47Å; S431-Q459 PolarHBondContact OG-OE1 3.07Å; S431-E487 CarbonylContact O-C 3.55Å; S431-E487 WeakPolarHBondContact O-CA 3.36Å; S431-Q488 PolarHBondContact N-O 2.83Å; S431-Q488 PolarHBondContact O-N 2.85Å
432	R	89.6	Confident	69.8	Low	61 Å²	61	69.8 Å²	69.8	23%	0.23	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	114.5	-179.5	-176.1	175.5	-174	-170.4	1.8	110	S258 Y430 H434 C485 V486 E487	S258-R432 PolarHBondContact OG-NH2 3.27Å; Y430-R432 HydrophobicContact CE1-CB 4.14Å; R432-H434 PolarHBondContact NE-NE2 3.08Å; R432-C485 PolarHBondContact NE-SG 3.49Å; R432-V486 WeakPolarHBondContact CA-O 3.36Å; R432-E487 HydrophobicContact CG-CG 4.06Å
433	L	89.6	Confident	69.6	Low	52 Å²	52	68.9 Å²	68.9	27%	0.272	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	137.8	-174	-58.6	179.1	0	0	0	110.5	Y435 L474 C485 V486	L433-Y435 HydrophobicContact CB-CE2 3.67Å; L433-Y435 WeakPolarHBondContact CD1-OH 3.43Å; L433-L474 HydrophobicContact CB-CD1 3.91Å; L433-L474 HydrophobicContact CD2-CD1 4.17Å; L433-L474 HydrophobicContact CG-CD1 4.47Å; L433-C485 WeakPolarHBondContact O-CA 3.49Å; L433-V486 PolarHBondContact N-O 2.74Å; L433-V486 PolarHBondContact O-N 2.87Å
434	H	89.5	Confident	69.4	Low	29 Å²	29	71.8 Å²	71.8	13%	0.134	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	126.8	-180	-74.5	-98.7	0	0	0	111.3	R432 V475 H479 S483 V484	R432-H434 PolarHBondContact NE-NE2 3.08Å; H434-V475 HydrophobicContact CB-CB 4.48Å; H434-V475 PolarHBondContact O-N 2.92Å; H434-H479 AromaticContact CG-CE1 3.72Å; H434-H479 AromaticContact ND1-CE1 3.8Å; H434-H479 AromaticContact ND1-NE2 3.88Å; H434-S483 PolarHBondContact ND1-OG 3.32Å; H434-V484 CarbonylContact C-O 3.58Å; H434-V484 WeakPolarHBondContact CA-O 3.41Å
435	Y	89.2	Confident	68.6	Low	23 Å²	23	74.9 Å²	74.9	9%	0.09	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	137.6	-177	-62.3	-93.8	0	0	0	111.1	L433 V464 L472 Q473 L474 S483 V484 V486	L433-Y435 HydrophobicContact CB-CE2 3.67Å; L433-Y435 WeakPolarHBondContact CD1-OH 3.43Å; Y435-V464 HydrophobicContact CD1-CB 3.87Å; Y435-V464 HydrophobicContact CD1-CG2 3.9Å; Y435-V464 HydrophobicContact CD2-CB 4.42Å; Y435-V464 HydrophobicContact CD2-CG2 3.81Å; Y435-V464 HydrophobicContact CE1-CB 4.19Å; Y435-V464 HydrophobicContact CE1-CG2 3.83Å; Y435-V464 HydrophobicContact CE2-CG2 3.76Å; Y435-V464 HydrophobicContact CG-CB 3.99Å; Y435-V464 HydrophobicContact CG-CG1 4.33Å; Y435-V464 HydrophobicContact CG-CG2 3.87Å; Y435-L472 HydrophobicContact CD1-CB 4.42Å; Y435-Q473 WeakPolarHBondContact CA-O 3.28Å; Y435-L474 HydrophobicContact CD1-CD1 4.42Å; Y435-L474 HydrophobicContact CE1-CB 4.42Å; Y435-L474 HydrophobicContact CE1-CD1 4.05Å; Y435-L474 HydrophobicContact CE2-CD1 4.42Å; Y435-S483 CarbonylContact O-C 3.48Å; Y435-S483 VanDerWaalsContact O-CA 3.25Å; Y435-S483 WeakPolarHBondContact O-CA 3.42Å; Y435-S483 WeakPolarHBondContact O-CB 3.45Å; Y435-V484 PolarHBondContact N-O 2.86Å; Y435-V484 PolarHBondContact O-N 3.3Å; Y435-V486 HydrophobicContact CD2-CG2 3.92Å; Y435-V486 HydrophobicContact CE2-CB 4.11Å; Y435-V486 HydrophobicContact CE2-CG2 3.74Å
436	R	87.3	Confident	67.3	Low	70 Å²	70	77.1 Å²	77.1	26%	0.264	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	158.2	178.2	73	176.2	-176.3	176.1	4.7	112.7	L472 Q473 V475	R436-L472 CarbonylContact O-C 3.59Å; R436-L472 WeakPolarHBondContact O-CA 2.95Å; R436-L472 VanDerWaalsContact O-CB 3.3Å; R436-L472 WeakPolarHBondContact O-CB 3.38Å; R436-L472 WeakPolarHBondContact O-CG 3.2Å; R436-Q473 HydrophobicContact CG-CB 4.11Å; R436-Q473 VanDerWaalsContact CZ-OE1 3.29Å; R436-Q473 PolarHBondContact N-O 3.04Å; R436-Q473 PolarHBondContact O-N 2.88Å; R436-V475 HydrophobicContact CB-CG2 3.94Å; R436-V475 HydrophobicContact CG-CG2 3.51Å
437	L	83.7	Confident	66.1	Low	74 Å²	74	80.1 Å²	80.1	39%	0.387	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-64.5	134.8	169.4	-149.7	76	0	0	0	110.1	Q439 D466	L437-Q439 PolarHBondContact O-N 2.97Å; L437-D466 HydrophobicContact CD1-CB 4.25Å
438	Q	72.7	Confident	64.4	Low	98 Å²	98	82.2 Å²	82.2	46%	0.458	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-64.8	130.5	-179.4	-166.2	-179.3	19.3	0	0	110.8
439	Q	64.3	Low	62.1	Low	123 Å²	123	84 Å²	84	58%	0.575	50%	0.495	S	S	*	.	P	Polyproline II helix	trans	-82	129.1	177.3	-69.2	179.4	-19.1	0	0	110.3	L437 G441 A442	L437-Q439 PolarHBondContact O-N 2.97Å; Q439-G441 PolarHBondContact O-N 2.8Å; Q439-A442 PolarHBondContact O-N 2.88Å
440	Q	44.8	Very low	59.5	Low	209 Å²	209	87.5 Å²	87.5	98%	0.977	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	120.2	173.9	-84.4	177.6	-36.9	0	0	110.1
441	G	45.6	Very low	56.6	Low	83 Å²	83	87.7 Å²	87.7	86%	0.856	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.1	-10.7	179.3	0	0	0	0	0	115.2	Q439	Q439-G441 PolarHBondContact O-N 2.8Å
442	A	42.5	Very low	53.7	Low	47 Å²	47	90.8 Å²	90.8	39%	0.388	58%	0.582	S	S	.	*	S	Bend	trans	-73.6	126	163.1	0	0	0	0	0	108.8	Q439	Q439-A442 PolarHBondContact O-N 2.88Å
443	A	35.8	Very low	51	Low	86 Å²	86	98.8 Å²	98.8	71%	0.711	61%	0.614	S	S	*	*			trans	-55	145.9	173.4	0	0	0	0	0	110.3	Q445	A443-Q445 PolarHBondContact O-N 2.7Å
444	E	40.1	Very low	48.4	Very low	172 Å²	172	105 Å²	105	80%	0.804	64%	0.642	S	S	*	*			trans	-57.7	105.3	165.5	-68.5	178.9	157.5	0	0	107.6	S446	E444-S446 PolarHBondContact O-N 2.81Å
445	Q	39.8	Very low	46	Very low	172 Å²	172	108.9 Å²	108.9	80%	0.804	66%	0.664	S	S	*	*			trans	-67.8	94.5	159	-78.1	-178.4	-19.5	0	0	105.3	A443 S447	A443-Q445 PolarHBondContact O-N 2.7Å; Q445-S447 PolarHBondContact O-N 3.35Å
446	S	31.7	Very low	44.1	Very low	87 Å²	87	111.6 Å²	111.6	61%	0.608	68%	0.68	S	S	*	*			trans	-43.4	130.3	172.3	48	0	0	0	0	109.6	E444 G448	E444-S446 PolarHBondContact O-N 2.81Å; S446-G448 CarbonylContact O-C 3.59Å; S446-G448 PolarHBondContact O-N 2.88Å
447	S	36	Very low	42.4	Very low	137 Å²	137	116.3 Å²	116.3	96%	0.958	70%	0.702	S	S	*	*	S	Bend	trans	-62.3	72.7	169.6	52	0	0	0	0	110.1	Q445	Q445-S447 PolarHBondContact O-N 3.35Å
448	G	32	Very low	41.2	Very low	65 Å²	65	116.2 Å²	116.2	67%	0.67	70%	0.704	S	S	*	*			trans	164.6	44.7	-155.1	0	0	0	0	0	112	S446	S446-G448 CarbonylContact O-C 3.59Å; S446-G448 PolarHBondContact O-N 2.88Å
449	G	25.2	Very low	41.3	Very low	66 Å²	66	114.2 Å²	114.2	68%	0.68	70%	0.695	S	S	*	*			trans	-130.2	117.7	170.4	0	0	0	0	0	108.3	G451	G449-G451 VanDerWaalsContact C-N 3.34Å; G449-G451 PolarHBondContact O-N 3.38Å
450	A	32	Very low	42.3	Very low	119 Å²	119	109.1 Å²	109.1	98%	0.983	67%	0.671	S	S	*	*			trans	-69.4	83.6	-170.1	0	0	0	0	0	113
451	G	27.8	Very low	44.3	Very low	58 Å²	58	103.3 Å²	103.3	60%	0.598	65%	0.652	S	S	*	*			trans	-96.5	142.6	148.3	0	0	0	0	0	107.9	G449 Y453	G449-G451 VanDerWaalsContact C-N 3.34Å; G449-G451 PolarHBondContact O-N 3.38Å; G451-Y453 PolarHBondContact O-N 2.99Å
452	G	27.9	Very low	46.2	Very low	76 Å²	76	100.6 Å²	100.6	78%	0.784	62%	0.617	S	S	*	*			trans	-53.5	133.5	-169.6	0	0	0	0	0	113	E454	G452-E454 PolarHBondContact O-N 2.66Å
453	Y	33.3	Very low	48.4	Very low	228 Å²	228	101.3 Å²	101.3	89%	0.894	62%	0.616	S	S	*	*			trans	-66.4	83	157.3	-58.4	-86.4	0	0	0	107.3	G451 D455	G451-Y453 PolarHBondContact O-N 2.99Å; Y453-D455 PolarHBondContact O-N 3.48Å
454	E	36.4	Very low	51	Low	184 Å²	184	97.4 Å²	97.4	86%	0.86	58%	0.584	S	S	*	*			trans	-65.3	92.1	149	-73	-170.3	129.1	0	0	105.3	G452 D456	G452-E454 PolarHBondContact O-N 2.66Å; E454-D456 PolarHBondContact O-N 2.97Å
455	D	38.5	Very low	53.3	Low	110 Å²	110	89.6 Å²	89.6	59%	0.588	55%	0.547	S	S	*	.			trans	-65.6	72.9	172.1	-175.3	10.4	0	0	0	107.3	Y453 K457	Y453-D455 PolarHBondContact O-N 3.48Å; D455-K457 WeakPolarHBondContact O-CG 3.44Å; D455-K457 PolarHBondContact O-N 2.82Å; D455-K457 WeakPolarHBondContact OD1-CE 3.27Å; D455-K457 WeakPolarHBondContact OD1-CG 3.38Å; D455-K457 WeakPolarHBondContact OD2-CE 3.37Å; D455-K457 IonicContact OD2-NZ 2.68Å; D455-K457 PolarHBondContact OD2-NZ 2.91Å
456	D	47.9	Very low	55.6	Low	80 Å²	80	82 Å²	82	43%	0.428	51%	0.512	S	S	.	.			trans	-81.1	64.6	-175	-153.5	24.2	0	0	0	108.4	E454 V458 Q459	E454-D456 PolarHBondContact O-N 2.97Å; D456-V458 PolarHBondContact O-N 3.43Å; D456-Q459 PolarHBondContact O-N 3.07Å; D456-Q459 PolarHBondContact OD2-NE2 3.3Å
457	K	52.8	Low	58.1	Low	169 Å²	169	79.4 Å²	79.4	74%	0.735	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	-7.2	-168.8	-71.3	-178.5	-175.1	-173.9	0	116.7	D455	D455-K457 WeakPolarHBondContact O-CG 3.44Å; D455-K457 PolarHBondContact O-N 2.82Å; D455-K457 WeakPolarHBondContact OD1-CE 3.27Å; D455-K457 WeakPolarHBondContact OD1-CG 3.38Å; D455-K457 WeakPolarHBondContact OD2-CE 3.37Å; D455-K457 IonicContact OD2-NZ 2.68Å; D455-K457 PolarHBondContact OD2-NZ 2.91Å
458	V	58.8	Low	60.3	Low	71 Å²	71	78.8 Å²	78.8	43%	0.43	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-12.8	-171.8	-168	0	0	0	0	111.8	D456 T490	D456-V458 PolarHBondContact O-N 3.43Å; V458-T490 HydrophobicContact CG1-CG2 4.06Å
459	Q	73.8	Confident	62.6	Low	57 Å²	57	77.7 Å²	77.7	27%	0.266	46%	0.461	S	S	.	.	S	Bend	trans	-85.5	140.2	176.6	-60.4	-160.3	35.2	0	0	112.1	S431 D456	S431-Q459 VanDerWaalsContact CB-CD 3.47Å; S431-Q459 PolarHBondContact OG-OE1 3.07Å; D456-Q459 PolarHBondContact O-N 3.07Å; D456-Q459 PolarHBondContact OD2-NE2 3.3Å
460	L	84.9	Confident	65.5	Low	15 Å²	15	80.9 Å²	80.9	8%	0.079	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-71.6	130.4	170.5	-80.8	170.1	0	0	0	109.5	Y211 L234 T236 V241 F462 Q488	Y211-L460 HydrophobicContact CD1-CD2 4.05Å; Y211-L460 HydrophobicContact CG-CD2 3.95Å; L234-L460 HydrophobicContact CB-CD1 4.22Å; L234-L460 HydrophobicContact CD1-CD1 3.69Å; T236-L460 HydrophobicContact CG2-CD1 4.3Å; T236-L460 HydrophobicContact CG2-CD2 4.11Å; T236-L460 HydrophobicContact CG2-CG 4.46Å; V241-L460 HydrophobicContact CB-CD1 3.75Å; V241-L460 HydrophobicContact CG1-CD1 3.97Å; V241-L460 HydrophobicContact CG2-CD1 3.75Å; V241-L460 HydrophobicContact CG2-CG 4.18Å; L460-F462 HydrophobicContact CB-CD2 4.42Å; L460-F462 HydrophobicContact CB-CE2 3.69Å; L460-F462 HydrophobicContact CB-CZ 4.17Å; L460-F462 WeakPolarHBondContact O-CD2 3.44Å; L460-Q488 PolarHBondContact O-NE2 2.74Å
461	P	86.8	Confident	68.2	Low	87 Å²	87	80.1 Å²	80.1	57%	0.565	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-71.2	133.2	176.9	28.5	-33.3	0	0	0	110.4	S209	S209-P461 VanDerWaalsContact CB-O 3.31Å; S209-P461 WeakPolarHBondContact CB-O 3.46Å; S209-P461 PolarHBondContact OG-O 2.69Å
462	F	85.7	Confident	71	Confident	27 Å²	27	78.1 Å²	78.1	12%	0.118	41%	0.407	C	S	.	.			trans	-127.5	129.8	175.3	-72.7	-78.9	0	0	0	111.2	L207 N208 S209 C243 L460 V486 Q488	L207-F462 HydrophobicContact CD1-CD1 4.02Å; L207-F462 HydrophobicContact CD1-CG 4.48Å; L207-F462 HydrophobicContact CD2-CD1 3.39Å; L207-F462 HydrophobicContact CD2-CE1 3.61Å; L207-F462 HydrophobicContact CG-CD1 3.73Å; L207-F462 HydrophobicContact CG-CE1 4.41Å; L207-F462 HydrophobicContact CG-CG 4.49Å; N208-F462 WeakPolarHBondContact O-CA 3.43Å; S209-F462 VanDerWaalsContact CB-CE1 3.41Å; C243-F462 HydrophobicContact CB-CZ 4.25Å; L460-F462 HydrophobicContact CB-CD2 4.42Å; L460-F462 HydrophobicContact CB-CE2 3.69Å; L460-F462 HydrophobicContact CB-CZ 4.17Å; L460-F462 WeakPolarHBondContact O-CD2 3.44Å; F462-V486 HydrophobicContact CD2-CG1 4.39Å; F462-Q488 HydrophobicContact CE2-CG 4.11Å
463	T	88.9	Confident	73.8	Confident	62 Å²	62	77.1 Å²	77.1	38%	0.38	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	119.3	169.6	-49.7	0	0	0	0	108.5	L207 N208 T465 N471	L207-T463 WeakPolarHBondContact CA-O 3.33Å; N208-T463 PolarHBondContact N-O 3.42Å; N208-T463 PolarHBondContact O-N 3.23Å; T463-T465 HydrophobicContact CG2-CG2 4.02Å; T463-N471 WeakPolarHBondContact CG2-OD1 3.32Å
464	V	90.2	Very high	76.4	Confident	4 Å²	4	70 Å²	70	2%	0.024	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	116.5	179	-167.8	0	0	0	0	109	V206 L207 Y435 L472 V486	V206-V464 CarbonylContact O-C 3.54Å; V206-V464 WeakPolarHBondContact O-CA 3.34Å; L207-V464 HydrophobicContact CB-CG2 4.45Å; L207-V464 HydrophobicContact CD1-CG2 4.06Å; L207-V464 HydrophobicContact CG-CG2 4.34Å; Y435-V464 HydrophobicContact CD1-CB 3.87Å; Y435-V464 HydrophobicContact CD1-CG2 3.9Å; Y435-V464 HydrophobicContact CD2-CB 4.42Å; Y435-V464 HydrophobicContact CD2-CG2 3.81Å; Y435-V464 HydrophobicContact CE1-CB 4.19Å; Y435-V464 HydrophobicContact CE1-CG2 3.83Å; Y435-V464 HydrophobicContact CE2-CG2 3.76Å; Y435-V464 HydrophobicContact CG-CB 3.99Å; Y435-V464 HydrophobicContact CG-CG1 4.33Å; Y435-V464 HydrophobicContact CG-CG2 3.87Å; V464-L472 HydrophobicContact CG1-CB 4.48Å; V464-L472 HydrophobicContact CG1-CD1 4.39Å; V464-L472 HydrophobicContact CG1-CD2 3.92Å; V464-L472 PolarHBondContact O-N 3.13Å; V464-V486 HydrophobicContact CG2-CG2 4.4Å
465	T	90	Very high	78.7	Confident	7 Å²	7	62.4 Å²	62.4	4%	0.043	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	162.7	-178.3	71.8	0	0	0	0	112	Y205 V206 T463 R470 L472	Y205-T465 WeakPolarHBondContact CA-O 3.46Å; V206-T465 PolarHBondContact N-O 3.4Å; V206-T465 PolarHBondContact O-N 3.33Å; T463-T465 HydrophobicContact CG2-CG2 4.02Å; T465-R470 CarbonylContact C-O 3.51Å; T465-R470 WeakPolarHBondContact CA-O 3.38Å; T465-L472 WeakPolarHBondContact O-CD1 3.36Å
466	D	87.3	Confident	80.5	Confident	13 Å²	13	63.6 Å²	63.6	7%	0.07	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	177.7	160.8	77.3	-1.5	0	0	0	110.8	G204 L437 K468 G469 R470 L472	G204-D466 WeakPolarHBondContact O-CA 3.28Å; L437-D466 HydrophobicContact CD1-CB 4.25Å; D466-K468 PolarHBondContact O-N 2.85Å; D466-K468 VanDerWaalsContact O-N 3.13Å; D466-K468 VanDerWaalsContact OD1-CA 3.31Å; D466-K468 WeakPolarHBondContact OD1-CA 3.22Å; D466-K468 VanDerWaalsContact OD1-CB 3.32Å; D466-K468 WeakPolarHBondContact OD1-CB 3.35Å; D466-K468 PolarHBondContact OD1-N 2.87Å; D466-G469 PolarHBondContact O-N 2.98Å; D466-G469 PolarHBondContact OD1-N 3.42Å; D466-R470 PolarHBondContact N-O 2.95Å; D466-R470 WeakPolarHBondContact OD1-CB 3.15Å; D466-R470 PolarHBondContact OD1-N 2.63Å; D466-R470 IonicContact OD1-NE 3.01Å; D466-R470 IonicContact OD2-CZ 3.59Å; D466-R470 IonicContact OD2-NE 2.72Å; D466-R470 PolarHBondContact OD2-NE 2.8Å; D466-R470 IonicContact OD2-NH2 3.4Å; D466-R470 PolarHBondContact OD2-NH2 2.93Å; D466-L472 HydrophobicContact CB-CD1 4.34Å
467	L	83.6	Confident	81.5	Confident	33 Å²	33	61.7 Å²	61.7	17%	0.173	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-14.5	176.9	-66	164.4	0	0	0	114.5	H113 V115 E199 G204 V206	H113-L467 VanDerWaalsContact CE1-CD2 3.44Å; H113-L467 WeakPolarHBondContact CE1-CD2 3.44Å; H113-L467 WeakPolarHBondContact NE2-CD2 3.32Å; V115-L467 HydrophobicContact CG2-CD2 3.69Å; E199-L467 HydrophobicContact CB-CD1 4.1Å; E199-L467 HydrophobicContact CG-CD1 4.1Å; E199-L467 WeakPolarHBondContact OE2-CD1 3.19Å; G204-L467 VanDerWaalsContact CA-CG 3.48Å; G204-L467 PolarHBondContact O-N 2.91Å; V206-L467 HydrophobicContact CG2-CD2 4.08Å
468	K	81.6	Confident	82.2	Confident	123 Å²	123	59.7 Å²	59.7	54%	0.535	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	2	175.2	-56.8	-175.2	175.8	-170.5	0	112.4	G196 D466 R470	G196-K468 WeakPolarHBondContact O-CE 3.33Å; G196-K468 PolarHBondContact O-NZ 2.86Å; D466-K468 PolarHBondContact O-N 2.85Å; D466-K468 VanDerWaalsContact O-N 3.13Å; D466-K468 VanDerWaalsContact OD1-CA 3.31Å; D466-K468 WeakPolarHBondContact OD1-CA 3.22Å; D466-K468 VanDerWaalsContact OD1-CB 3.32Å; D466-K468 WeakPolarHBondContact OD1-CB 3.35Å; D466-K468 PolarHBondContact OD1-N 2.87Å; K468-R470 VanDerWaalsContact C-N 3.33Å; K468-R470 HydrophobicContact CB-CG 4.34Å
469	G	81.8	Confident	82.4	Confident	43 Å²	43	57.6 Å²	57.6	44%	0.443	33%	0.326	S	S	.	.	S	Bend	trans	77.4	13.4	-175.2	0	0	0	0	0	114.2	D466	D466-G469 PolarHBondContact O-N 2.98Å; D466-G469 PolarHBondContact OD1-N 3.42Å
470	R	85.5	Confident	81.8	Confident	132 Å²	132	62.6 Å²	62.6	50%	0.498	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-82.3	128.3	175.9	-59	-179.1	-63.4	165.7	5	109.7	T465 D466 K468	T465-R470 CarbonylContact C-O 3.51Å; T465-R470 WeakPolarHBondContact CA-O 3.38Å; D466-R470 PolarHBondContact N-O 2.95Å; D466-R470 WeakPolarHBondContact OD1-CB 3.15Å; D466-R470 PolarHBondContact OD1-N 2.63Å; D466-R470 IonicContact OD1-NE 3.01Å; D466-R470 IonicContact OD2-CZ 3.59Å; D466-R470 IonicContact OD2-NE 2.72Å; D466-R470 PolarHBondContact OD2-NE 2.8Å; D466-R470 IonicContact OD2-NH2 3.4Å; D466-R470 PolarHBondContact OD2-NH2 2.93Å; K468-R470 VanDerWaalsContact C-N 3.33Å; K468-R470 HydrophobicContact CB-CG 4.34Å
471	N	88.6	Confident	81.2	Confident	104 Å²	104	63.2 Å²	63.2	56%	0.556	36%	0.364	S	S	*	.	B	Isolated β-bridge	trans	-59.7	137	178.8	-69.6	-39.8	0	0	0	111.9	T463	T463-N471 WeakPolarHBondContact CG2-OD1 3.32Å
472	L	87.7	Confident	81	Confident	15 Å²	15	61 Å²	61	8%	0.079	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-77.3	148.2	169.5	-83.9	68.1	0	0	0	109.9	L201 Y435 R436 V464 T465 D466 L474	L201-L472 HydrophobicContact CD1-CD2 3.53Å; Y435-L472 HydrophobicContact CD1-CB 4.42Å; R436-L472 CarbonylContact O-C 3.59Å; R436-L472 WeakPolarHBondContact O-CA 2.95Å; R436-L472 VanDerWaalsContact O-CB 3.3Å; R436-L472 WeakPolarHBondContact O-CB 3.38Å; R436-L472 WeakPolarHBondContact O-CG 3.2Å; V464-L472 HydrophobicContact CG1-CB 4.48Å; V464-L472 HydrophobicContact CG1-CD1 4.39Å; V464-L472 HydrophobicContact CG1-CD2 3.92Å; V464-L472 PolarHBondContact O-N 3.13Å; T465-L472 WeakPolarHBondContact O-CD1 3.36Å; D466-L472 HydrophobicContact CB-CD1 4.34Å; L472-L474 PolarHBondContact O-N 3.46Å
473	Q	86.7	Confident	81.2	Confident	56 Å²	56	59.7 Å²	59.7	26%	0.262	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	124.2	176.5	-170.9	178.3	27.9	0	0	109.9	Y435 R436	Y435-Q473 WeakPolarHBondContact CA-O 3.28Å; R436-Q473 HydrophobicContact CG-CB 4.11Å; R436-Q473 VanDerWaalsContact CZ-OE1 3.29Å; R436-Q473 PolarHBondContact N-O 3.04Å; R436-Q473 PolarHBondContact O-N 2.88Å
474	L	86.9	Confident	81.2	Confident	79 Å²	79	56.8 Å²	56.8	41%	0.414	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	136.8	167.5	-178.7	66.7	0	0	0	109.9	L433 Y435 L472 T476	L433-L474 HydrophobicContact CB-CD1 3.91Å; L433-L474 HydrophobicContact CD2-CD1 4.17Å; L433-L474 HydrophobicContact CG-CD1 4.47Å; Y435-L474 HydrophobicContact CD1-CD1 4.42Å; Y435-L474 HydrophobicContact CE1-CB 4.42Å; Y435-L474 HydrophobicContact CE1-CD1 4.05Å; Y435-L474 HydrophobicContact CE2-CD1 4.42Å; L472-L474 PolarHBondContact O-N 3.46Å; L474-T476 HydrophobicContact CD2-CG2 4.45Å; L474-T476 HydrophobicContact CG-CG2 4.49Å
475	V	85.2	Confident	81.2	Confident	24 Å²	24	56.6 Å²	56.6	15%	0.145	32%	0.321	C	S	.	.			trans	-116.8	104	-175.9	-169.4	0	0	0	0	110.4	H434 R436 G477 H479	H434-V475 HydrophobicContact CB-CB 4.48Å; H434-V475 PolarHBondContact O-N 2.92Å; R436-V475 HydrophobicContact CB-CG2 3.94Å; R436-V475 HydrophobicContact CG-CG2 3.51Å; V475-G477 PolarHBondContact O-N 2.86Å; V475-H479 HydrophobicContact CG1-CB 3.71Å; V475-H479 WeakPolarHBondContact CG1-ND1 3.11Å
476	T	75.4	Confident	81.4	Confident	135 Å²	135	56.3 Å²	56.3	83%	0.828	32%	0.32	S	S	*	.			trans	-95.2	76.1	176.9	46.9	0	0	0	0	110.7	L474	L474-T476 HydrophobicContact CD2-CG2 4.45Å; L474-T476 HydrophobicContact CG-CG2 4.49Å
477	G	69.6	Low	81.7	Confident	40 Å²	40	55.7 Å²	55.7	41%	0.412	32%	0.316	S	S	.	.	S	Bend	trans	153.9	176.9	174.7	0	0	0	0	0	115.1	V475 H479	V475-G477 PolarHBondContact O-N 2.86Å; G477-H479 PolarHBondContact O-N 2.93Å; G477-H479 PolarHBondContact O-ND1 2.81Å
478	P	66.1	Low	82.1	Confident	127 Å²	127	54.3 Å²	54.3	83%	0.825	31%	0.309	S	S	*	.			trans	-62.9	128.6	175.5	27.3	-34.2	0	0	0	110.1
479	H	63.1	Low	82.7	Confident	27 Å²	27	48.5 Å²	48.5	13%	0.125	28%	0.284	C	S	.	.			trans	-141	131	-171.3	57	-90	0	0	0	112.7	Q254 H434 V475 G477 G481 S483	Q254-H479 PolarHBondContact NE2-O 2.67Å; H434-H479 AromaticContact CG-CE1 3.72Å; H434-H479 AromaticContact ND1-CE1 3.8Å; H434-H479 AromaticContact ND1-NE2 3.88Å; V475-H479 HydrophobicContact CG1-CB 3.71Å; V475-H479 WeakPolarHBondContact CG1-ND1 3.11Å; G477-H479 PolarHBondContact O-N 2.93Å; G477-H479 PolarHBondContact O-ND1 2.81Å; H479-G481 PolarHBondContact O-N 3.47Å; H479-S483 PolarHBondContact NE2-OG 2.84Å
480	N	62.2	Low	83.3	Confident	162 Å²	162	46.6 Å²	46.6	87%	0.866	26%	0.264	S	S	*	.			trans	-88.1	104.5	170.6	-72.6	-21.6	0	0	0	109.2
481	G	72.4	Confident	83.6	Confident	28 Å²	28	40.4 Å²	40.4	29%	0.289	24%	0.24	S	C	.	.	S	Bend	trans	166.7	169	177.9	0	0	0	0	0	113.2	H479	H479-G481 PolarHBondContact O-N 3.47Å
482	Q	83.3	Confident	83.8	Confident	39 Å²	39	38.2 Å²	38.2	18%	0.182	23%	0.229	C	C	.	.			trans	-79.3	127.1	172.8	-168.6	172.5	3.7	0	0	108.4	L201 L247 C248 V250	L201-Q482 HydrophobicContact CD2-CG 4.28Å; L201-Q482 VanDerWaalsContact CD2-O 3.29Å; L201-Q482 WeakPolarHBondContact CD2-O 3.35Å; L247-Q482 HydrophobicContact CD1-CG 4.23Å; L247-Q482 VanDerWaalsContact CD2-NE2 3.29Å; L247-Q482 HydrophobicContact CG-CG 4.37Å; C248-Q482 WeakPolarHBondContact O-CA 3.34Å; V250-Q482 HydrophobicContact CG2-CB 4.07Å
483	S	88	Confident	84.1	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.007	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	153	179.9	58.1	0	0	0	0	111.8	L247 C248 H434 Y435 H479	L247-S483 CarbonylContact C-O 3.56Å; C248-S483 PolarHBondContact N-O 3.37Å; C248-S483 PolarHBondContact O-N 2.72Å; H434-S483 PolarHBondContact ND1-OG 3.32Å; Y435-S483 CarbonylContact O-C 3.48Å; Y435-S483 VanDerWaalsContact O-CA 3.25Å; Y435-S483 WeakPolarHBondContact O-CA 3.42Å; Y435-S483 WeakPolarHBondContact O-CB 3.45Å; H479-S483 PolarHBondContact NE2-OG 2.84Å
484	V	89.8	Confident	84.4	Confident	0 Å²	0	39 Å²	39	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	124.1	167.1	177.1	0	0	0	0	107.1	L201 Y205 I245 S246 L247 H434 Y435 V486	L201-V484 HydrophobicContact CD1-CG2 3.87Å; L201-V484 HydrophobicContact CD2-CG2 4.05Å; L201-V484 HydrophobicContact CG-CG2 3.86Å; Y205-V484 HydrophobicContact CD1-CG2 3.48Å; Y205-V484 VanDerWaalsContact CD1-CG2 3.48Å; Y205-V484 HydrophobicContact CD2-CG2 4.43Å; Y205-V484 HydrophobicContact CE1-CG2 3.99Å; Y205-V484 HydrophobicContact CG-CG2 3.77Å; I245-V484 HydrophobicContact CG2-CG1 4.15Å; S246-V484 WeakPolarHBondContact O-CA 3.25Å; L247-V484 HydrophobicContact CD1-CG2 3.89Å; H434-V484 CarbonylContact C-O 3.58Å; H434-V484 WeakPolarHBondContact CA-O 3.41Å; Y435-V484 PolarHBondContact N-O 2.86Å; Y435-V484 PolarHBondContact O-N 3.3Å; V484-V486 HydrophobicContact CG1-CG2 4.29Å
485	C	91.2	Very high	84.6	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	126	175.4	-179.3	0	0	0	0	108.7	I245 S246 R432 L433	I245-C485 WeakPolarHBondContact CA-O 3.3Å; S246-C485 PolarHBondContact N-O 3.01Å; S246-C485 PolarHBondContact O-N 3.5Å; S246-C485 WeakPolarHBondContact OG-CB 3.19Å; R432-C485 PolarHBondContact NE-SG 3.49Å; L433-C485 WeakPolarHBondContact O-CA 3.49Å
486	V	92.8	Very high	84.9	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.006	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	116.1	174.4	-175.6	0	0	0	0	107.2	L207 G244 R432 L433 Y435 F462 V464 V484	L207-V486 HydrophobicContact CD1-CG1 4.16Å; L207-V486 HydrophobicContact CD1-CG2 3.58Å; G244-V486 WeakPolarHBondContact O-CA 3.23Å; R432-V486 WeakPolarHBondContact CA-O 3.36Å; L433-V486 PolarHBondContact N-O 2.74Å; L433-V486 PolarHBondContact O-N 2.87Å; Y435-V486 HydrophobicContact CD2-CG2 3.92Å; Y435-V486 HydrophobicContact CE2-CB 4.11Å; Y435-V486 HydrophobicContact CE2-CG2 3.74Å; F462-V486 HydrophobicContact CD2-CG1 4.39Å; V464-V486 HydrophobicContact CG2-CG2 4.4Å; V484-V486 HydrophobicContact CG1-CG2 4.29Å
487	E	93.3	Very high	85.9	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	134.4	177.9	-64.2	173.5	-112.4	0	0	108.6	C243 G244 Q259 I260 L261 Y430 S431 R432	C243-E487 CarbonylContact C-O 3.59Å; C243-E487 VanDerWaalsContact CA-O 3.26Å; C243-E487 WeakPolarHBondContact CA-O 3.01Å; G244-E487 PolarHBondContact N-O 3.41Å; G244-E487 PolarHBondContact O-N 2.88Å; Q259-E487 WeakPolarHBondContact CG-OE2 3.46Å; I260-E487 PolarHBondContact N-OE1 3.06Å; I260-E487 PolarHBondContact N-OE2 2.7Å; I260-E487 VanDerWaalsContact N-OE2 3.13Å; L261-E487 HydrophobicContact CB-CB 4.4Å; L261-E487 HydrophobicContact CD1-CB 4Å; L261-E487 HydrophobicContact CG-CB 4.45Å; L261-E487 PolarHBondContact N-OE2 2.69Å; Y430-E487 HydrophobicContact CE2-CB 4.19Å; Y430-E487 PolarHBondContact OH-OE2 2.86Å; S431-E487 CarbonylContact O-C 3.55Å; S431-E487 WeakPolarHBondContact O-CA 3.36Å; R432-E487 HydrophobicContact CG-CG 4.06Å
488	Q	93.9	Very high	87	Confident	5 Å²	5	33.1 Å²	33.1	2%	0.023	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	129.1	170.3	-55.6	-170.5	45.7	0	0	109.2	V241 A242 Y430 S431 L460 F462	V241-Q488 HydrophobicContact CG1-CB 4.24Å; A242-Q488 WeakPolarHBondContact O-CA 3.44Å; Y430-Q488 CarbonylContact C-O 3.54Å; Y430-Q488 VanDerWaalsContact CA-O 3.3Å; Y430-Q488 WeakPolarHBondContact CA-O 3.34Å; Y430-Q488 WeakPolarHBondContact CD2-O 3.34Å; S431-Q488 PolarHBondContact N-O 2.83Å; S431-Q488 PolarHBondContact O-N 2.85Å; L460-Q488 PolarHBondContact O-NE2 2.74Å; F462-Q488 HydrophobicContact CE2-CG 4.11Å
489	L	93.7	Very high	88.3	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	114.7	168.6	-174.1	69.2	0	0	0	108.1	V241 A242 L261 Y262 V428 Y430 W563 L565	V241-L489 WeakPolarHBondContact CA-O 3.2Å; A242-L489 HydrophobicContact CB-CB 4.39Å; A242-L489 PolarHBondContact N-O 2.8Å; A242-L489 PolarHBondContact O-N 3.4Å; L261-L489 HydrophobicContact CD1-CB 4.31Å; Y262-L489 HydrophobicContact CD2-CD1 3.87Å; Y262-L489 HydrophobicContact CG-CD1 4.04Å; V428-L489 HydrophobicContact CG1-CD1 3.5Å; V428-L489 VanDerWaalsContact CG1-CD1 3.5Å; Y430-L489 HydrophobicContact CD2-CB 4.27Å; Y430-L489 HydrophobicContact CD2-CD1 3.97Å; Y430-L489 HydrophobicContact CG-CD1 4.35Å; L489-W563 HydrophobicContact CB-CZ2 4.44Å; L489-W563 HydrophobicContact CD2-CZ2 3.86Å; L489-W563 HydrophobicContact CG-CZ2 3.84Å; L489-W563 WeakPolarHBondContact O-CH2 3.3Å; L489-L565 HydrophobicContact CD2-CB 4.36Å; L489-L565 HydrophobicContact CD2-CD2 4.14Å
490	T	93.2	Very high	89.8	Confident	4 Å²	4	28.4 Å²	28.4	3%	0.025	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	131.6	-174.7	-60.7	0	0	0	0	110.9	V241 N429 V458	V241-T490 HydrophobicContact CG2-CG2 4.08Å; N429-T490 PolarHBondContact N-O 2.79Å; N429-T490 PolarHBondContact O-N 3.27Å; V458-T490 HydrophobicContact CG1-CG2 4.06Å
491	L	92.2	Very high	91.3	Very high	1 Å²	1	20.8 Å²	20.8	1%	0.005	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	113.8	170.9	173.1	60.7	0	0	0	109.5	S239 L240 Y427 L496 I533 W563 C570	S239-L491 CarbonylContact C-O 3.55Å; S239-L491 WeakPolarHBondContact CA-O 3.16Å; S239-L491 VanDerWaalsContact CB-O 3.23Å; S239-L491 WeakPolarHBondContact CB-O 3.2Å; L240-L491 HydrophobicContact CB-CB 4.48Å; L240-L491 PolarHBondContact N-O 3.32Å; L240-L491 PolarHBondContact O-N 2.93Å; Y427-L491 HydrophobicContact CD2-CD1 4.18Å; Y427-L491 HydrophobicContact CE2-CD1 4.46Å; L491-L496 HydrophobicContact CD1-CB 4.47Å; L491-L496 HydrophobicContact CD1-CD2 4.24Å; L491-L496 HydrophobicContact CD2-CD2 4.06Å; L491-L496 HydrophobicContact CG-CD2 4.36Å; L491-I533 HydrophobicContact CD2-CD1 4.14Å; L491-W563 HydrophobicContact CB-CD2 4.29Å; L491-W563 HydrophobicContact CB-CH2 4.11Å; L491-W563 HydrophobicContact CB-CZ2 3.68Å; L491-W563 HydrophobicContact CD2-CB 4.17Å; L491-W563 HydrophobicContact CD2-CD2 3.82Å; L491-W563 HydrophobicContact CD2-CE3 4.22Å; L491-W563 HydrophobicContact CD2-CG 3.83Å; L491-C570 WeakPolarHBondContact CD1-SG 3.16Å
492	D	92.8	Very high	92.3	Very high	58 Å²	58	27.2 Å²	27.2	31%	0.31	12%	0.121	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	127.7	174.7	-173.2	-77.1	0	0	0	111.2	E494 Y495 L496	D492-E494 PolarHBondContact OD1-N 3.27Å; D492-Y495 WeakPolarHBondContact OD1-CB 3.5Å; D492-Y495 PolarHBondContact OD1-N 3.48Å; D492-L496 WeakPolarHBondContact O-CB 3.29Å; D492-L496 PolarHBondContact O-N 3.07Å
493	F	93.5	Very high	92.8	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-76.6	-38.8	-177.6	-64.5	-40.3	0	0	0	112.9	S237 Y238 S239 L240 L496 I497 Y517 V519 I533	S237-F493 WeakPolarHBondContact O-CD2 3.41Å; Y238-F493 WeakPolarHBondContact O-CB 3.23Å; Y238-F493 VanDerWaalsContact O-CD2 3.24Å; Y238-F493 WeakPolarHBondContact O-CD2 3.48Å; Y238-F493 WeakPolarHBondContact O-CG 3.2Å; Y238-F493 PolarHBondContact O-N 3.4Å; S239-F493 WeakPolarHBondContact O-CE2 3.26Å; L240-F493 HydrophobicContact CB-CE1 3.64Å; L240-F493 HydrophobicContact CB-CZ 3.65Å; F493-L496 PolarHBondContact O-N 2.88Å; F493-I497 HydrophobicContact CB-CD1 4.4Å; F493-I497 WeakPolarHBondContact O-CB 3.25Å; F493-I497 VanDerWaalsContact O-CD1 3.3Å; F493-I497 WeakPolarHBondContact O-CD1 3.49Å; F493-I497 WeakPolarHBondContact O-CG1 3.5Å; F493-I497 PolarHBondContact O-N 3.23Å; F493-Y517 HydrophobicContact CB-CD2 4.38Å; F493-Y517 HydrophobicContact CB-CE2 3.73Å; F493-Y517 AromaticContact CD2-CE2 3.87Å; F493-Y517 HydrophobicContact CD2-CE2 3.87Å; F493-Y517 HydrophobicContact CG-CE2 4.24Å; F493-V519 HydrophobicContact CD1-CG2 3.99Å; F493-V519 HydrophobicContact CD2-CG2 3.84Å; F493-V519 HydrophobicContact CE1-CB 4.16Å; F493-V519 HydrophobicContact CE1-CG1 3.76Å; F493-V519 HydrophobicContact CE1-CG2 3.89Å; F493-V519 HydrophobicContact CE2-CB 4.07Å; F493-V519 HydrophobicContact CE2-CG2 3.73Å; F493-V519 HydrophobicContact CG-CG2 3.97Å; F493-V519 HydrophobicContact CZ-CB 3.78Å; F493-V519 HydrophobicContact CZ-CG1 3.75Å; F493-V519 HydrophobicContact CZ-CG2 3.75Å; F493-I533 HydrophobicContact CE1-CD1 4.49Å
494	E	93.4	Very high	93.1	Very high	88 Å²	88	34.6 Å²	34.6	41%	0.411	16%	0.162	S	C	.	.	H	α-helix	trans	-69.6	-39.6	-176.3	-62.9	-162.8	-177.8	0	0	111.7	D492 N498 F514 Y517	D492-E494 PolarHBondContact OD1-N 3.27Å; E494-N498 WeakPolarHBondContact O-CB 3.47Å; E494-N498 PolarHBondContact O-N 3.17Å; E494-N498 PolarHBondContact O-ND2 2.94Å; E494-F514 HydrophobicContact CB-CZ 4Å; E494-F514 HydrophobicContact CG-CE2 4.12Å; E494-F514 HydrophobicContact CG-CZ 3.89Å; E494-Y517 HydrophobicContact CG-CE1 3.85Å; E494-Y517 VanDerWaalsContact CG-OH 3.3Å; E494-Y517 WeakPolarHBondContact CG-OH 3.41Å; E494-Y517 PolarHBondContact OE1-OH 2.95Å; E494-Y517 VanDerWaalsContact OE1-OH 3.13Å
495	Y	91.2	Very high	93.3	Very high	94 Å²	94	35 Å²	35	37%	0.369	17%	0.166	S	C	.	.	H	α-helix	trans	-58.2	-52.3	171.1	-170.7	-71.6	0	0	0	110.4	Y427 D492 I497 N498 E499	Y427-Y495 VanDerWaalsContact CB-CD1 3.42Å; Y427-Y495 AromaticContact CD1-CD1 3.75Å; Y427-Y495 HydrophobicContact CD1-CD1 3.75Å; Y427-Y495 AromaticContact CD1-CE1 3.26Å; Y427-Y495 HydrophobicContact CD1-CE1 3.26Å; Y427-Y495 AromaticContact CD1-CZ 3.87Å; Y427-Y495 HydrophobicContact CE1-CE1 4.11Å; Y427-Y495 AromaticContact CG-CD1 3.86Å; Y427-Y495 HydrophobicContact CG-CD1 3.86Å; Y427-Y495 AromaticContact CG-CE1 3.84Å; Y427-Y495 HydrophobicContact CG-CE1 3.84Å; D492-Y495 WeakPolarHBondContact OD1-CB 3.5Å; D492-Y495 PolarHBondContact OD1-N 3.48Å; Y495-I497 PolarHBondContact O-N 3Å; Y495-N498 PolarHBondContact O-N 3.17Å; Y495-E499 HydrophobicContact CD1-CB 4.42Å; Y495-E499 HydrophobicContact CE1-CB 4.26Å; Y495-E499 WeakPolarHBondContact CE1-OE2 3.49Å; Y495-E499 PolarHBondContact O-N 3.41Å
496	L	92.4	Very high	93.4	Very high	3 Å²	3	39.9 Å²	39.9	2%	0.016	21%	0.205	C	C	.	.	H	α-helix	trans	-60.1	-45.4	-177.7	175.6	62.5	0	0	0	111.7	L491 D492 F493 N498 E499 V500 I533 I535 V561 C570	L491-L496 HydrophobicContact CD1-CB 4.47Å; L491-L496 HydrophobicContact CD1-CD2 4.24Å; L491-L496 HydrophobicContact CD2-CD2 4.06Å; L491-L496 HydrophobicContact CG-CD2 4.36Å; D492-L496 WeakPolarHBondContact O-CB 3.29Å; D492-L496 PolarHBondContact O-N 3.07Å; F493-L496 PolarHBondContact O-N 2.88Å; L496-N498 VanDerWaalsContact C-N 3.33Å; L496-N498 PolarHBondContact O-N 3.18Å; L496-E499 PolarHBondContact O-N 2.91Å; L496-V500 HydrophobicContact CD1-CG2 3.84Å; L496-V500 HydrophobicContact CG-CG2 4.36Å; L496-V500 VanDerWaalsContact O-CG2 3.28Å; L496-V500 WeakPolarHBondContact O-CG2 3.16Å; L496-V500 PolarHBondContact O-N 3.48Å; L496-I533 HydrophobicContact CD2-CD1 4.06Å; L496-I535 HydrophobicContact CD2-CD1 3.79Å; L496-I535 HydrophobicContact CG-CD1 4.34Å; L496-V561 HydrophobicContact CD1-CG1 4.05Å; L496-V561 HydrophobicContact CD1-CG2 4.31Å; L496-V561 HydrophobicContact CD2-CB 4.35Å; L496-V561 HydrophobicContact CD2-CG1 4.04Å; L496-V561 HydrophobicContact CD2-CG2 4.2Å; L496-V561 HydrophobicContact CG-CG2 4.43Å; L496-C570 HydrophobicContact CD1-CB 3.7Å
497	I	94.9	Very high	93.4	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-58.4	-47.3	176.8	-68.7	160.8	0	0	0	110.1	F493 Y495 E499 I501 F514 Y517 I535 L537 L559	F493-I497 HydrophobicContact CB-CD1 4.4Å; F493-I497 WeakPolarHBondContact O-CB 3.25Å; F493-I497 VanDerWaalsContact O-CD1 3.3Å; F493-I497 WeakPolarHBondContact O-CD1 3.49Å; F493-I497 WeakPolarHBondContact O-CG1 3.5Å; F493-I497 PolarHBondContact O-N 3.23Å; Y495-I497 PolarHBondContact O-N 3Å; I497-E499 PolarHBondContact O-N 3.27Å; I497-I501 HydrophobicContact CG2-CD1 3.64Å; I497-I501 HydrophobicContact CG2-CG1 4.4Å; I497-I501 WeakPolarHBondContact O-CB 3.44Å; I497-I501 WeakPolarHBondContact O-CG1 3.49Å; I497-I501 PolarHBondContact O-N 3.45Å; I497-F514 HydrophobicContact CB-CE1 4.13Å; I497-F514 HydrophobicContact CG2-CD1 3.52Å; I497-F514 HydrophobicContact CG2-CE1 3.56Å; I497-F514 HydrophobicContact CG2-CG 4.38Å; I497-F514 HydrophobicContact CG2-CZ 4.44Å; I497-Y517 HydrophobicContact CD1-CD1 4Å; I497-Y517 HydrophobicContact CD1-CD2 4.17Å; I497-Y517 HydrophobicContact CD1-CE1 4.44Å; I497-Y517 HydrophobicContact CD1-CG 3.87Å; I497-I535 HydrophobicContact CD1-CG2 3.9Å; I497-I535 HydrophobicContact CG1-CD1 4.24Å; I497-I535 HydrophobicContact CG1-CG2 3.95Å; I497-L537 HydrophobicContact CD1-CD2 3.67Å; I497-L537 HydrophobicContact CG1-CD2 3.94Å; I497-L537 HydrophobicContact CG2-CD1 3.99Å; I497-L537 HydrophobicContact CG2-CD2 3.9Å; I497-L559 HydrophobicContact CG1-CD1 4.39Å; I497-L559 HydrophobicContact CG2-CD1 4.33Å
498	N	94.2	Very high	93.5	Very high	58 Å²	58	42 Å²	42	31%	0.31	22%	0.219	S	C	.	.	H	α-helix	trans	-68	-31.5	178.8	-77.7	-64.6	0	0	0	113.3	E494 Y495 L496 R502	E494-N498 WeakPolarHBondContact O-CB 3.47Å; E494-N498 PolarHBondContact O-N 3.17Å; E494-N498 PolarHBondContact O-ND2 2.94Å; Y495-N498 PolarHBondContact O-N 3.17Å; L496-N498 VanDerWaalsContact C-N 3.33Å; L496-N498 PolarHBondContact O-N 3.18Å; N498-R502 WeakPolarHBondContact O-CB 3.25Å; N498-R502 VanDerWaalsContact O-CG 3.25Å; N498-R502 WeakPolarHBondContact O-CG 3.32Å; N498-R502 PolarHBondContact O-N 3.09Å; N498-R502 PolarHBondContact O-NE 3.4Å
499	E	92.4	Very high	93.4	Very high	51 Å²	51	47.5 Å²	47.5	24%	0.238	26%	0.255	C	S	.	.	H	α-helix	trans	-67.9	-53	173.3	-171.4	179.5	177.7	0	0	111.3	Y427 Y495 L496 I497 I501 R502 N503	Y427-E499 VanDerWaalsContact CE1-OE2 3.22Å; Y427-E499 WeakPolarHBondContact CE1-OE2 3.43Å; Y495-E499 HydrophobicContact CD1-CB 4.42Å; Y495-E499 HydrophobicContact CE1-CB 4.26Å; Y495-E499 WeakPolarHBondContact CE1-OE2 3.49Å; Y495-E499 PolarHBondContact O-N 3.41Å; L496-E499 PolarHBondContact O-N 2.91Å; I497-E499 PolarHBondContact O-N 3.27Å; E499-I501 PolarHBondContact O-N 3.04Å; E499-R502 PolarHBondContact O-N 3.35Å; E499-N503 WeakPolarHBondContact CG-ND2 3.41Å; E499-N503 WeakPolarHBondContact O-CB 3.46Å; E499-N503 PolarHBondContact O-N 3.35Å; E499-N503 PolarHBondContact O-ND2 2.97Å
500	V	94.8	Very high	93.4	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.018	27%	0.267	C	S	.	.	H	α-helix	trans	-62	-41.6	-179.1	176.6	0	0	0	0	111.4	L496 D504 A505 L559 V561 T572 V575	L496-V500 HydrophobicContact CD1-CG2 3.84Å; L496-V500 HydrophobicContact CG-CG2 4.36Å; L496-V500 VanDerWaalsContact O-CG2 3.28Å; L496-V500 WeakPolarHBondContact O-CG2 3.16Å; L496-V500 PolarHBondContact O-N 3.48Å; V500-D504 HydrophobicContact CG1-CB 4.43Å; V500-D504 PolarHBondContact O-N 3.23Å; V500-A505 PolarHBondContact O-N 2.87Å; V500-L559 HydrophobicContact CB-CD1 4Å; V500-L559 HydrophobicContact CG1-CB 4.39Å; V500-L559 HydrophobicContact CG1-CD1 3.88Å; V500-L559 HydrophobicContact CG1-CD2 3.96Å; V500-L559 HydrophobicContact CG1-CG 4.31Å; V500-V561 HydrophobicContact CG2-CG2 4.08Å; V500-T572 HydrophobicContact CG1-CG2 3.83Å; V500-V575 HydrophobicContact CG1-CG2 3.95Å
501	I	94.8	Very high	93.4	Very high	3 Å²	3	51.6 Å²	51.6	2%	0.015	28%	0.275	C	S	.	.	H	α-helix	trans	-62.7	-47.1	176.6	-68.5	173	0	0	0	110.6	I497 E499 N503 A505 W507 A508 F511 L537 L559	I497-I501 HydrophobicContact CG2-CD1 3.64Å; I497-I501 HydrophobicContact CG2-CG1 4.4Å; I497-I501 WeakPolarHBondContact O-CB 3.44Å; I497-I501 WeakPolarHBondContact O-CG1 3.49Å; I497-I501 PolarHBondContact O-N 3.45Å; E499-I501 PolarHBondContact O-N 3.04Å; I501-N503 PolarHBondContact O-N 3.47Å; I501-A505 HydrophobicContact CG2-CB 4.46Å; I501-A505 WeakPolarHBondContact O-CB 3.34Å; I501-W507 HydrophobicContact CD1-CH2 3.86Å; I501-W507 HydrophobicContact CD1-CZ3 4.12Å; I501-W507 HydrophobicContact CG1-CH2 3.73Å; I501-W507 HydrophobicContact CG1-CZ3 4.09Å; I501-W507 HydrophobicContact CG2-CH2 4.42Å; I501-W507 HydrophobicContact CG2-CZ3 3.93Å; I501-A508 HydrophobicContact CG2-CB 4.27Å; I501-A508 WeakPolarHBondContact O-CB 3.35Å; I501-F511 HydrophobicContact CD1-CD2 4.11Å; I501-F511 HydrophobicContact CD1-CE1 4.4Å; I501-F511 HydrophobicContact CD1-CE2 3.7Å; I501-F511 HydrophobicContact CD1-CZ 3.86Å; I501-F511 HydrophobicContact CG2-CB 4.21Å; I501-F511 HydrophobicContact CG2-CD1 3.9Å; I501-F511 HydrophobicContact CG2-CD2 4.37Å; I501-F511 HydrophobicContact CG2-CE1 4.32Å; I501-F511 HydrophobicContact CG2-CG 3.91Å; I501-L537 HydrophobicContact CD1-CD1 4.13Å; I501-L559 HydrophobicContact CG1-CD1 4.42Å
502	R	93.2	Very high	93.5	Very high	163 Å²	163	54 Å²	54	62%	0.615	29%	0.291	S	S	*	.	H	α-helix	trans	-67.1	-33.4	-177.7	-74.8	178.6	-64.2	163.4	2.9	113.8	N498 E499	N498-R502 WeakPolarHBondContact O-CB 3.25Å; N498-R502 VanDerWaalsContact O-CG 3.25Å; N498-R502 WeakPolarHBondContact O-CG 3.32Å; N498-R502 PolarHBondContact O-N 3.09Å; N498-R502 PolarHBondContact O-NE 3.4Å; E499-R502 PolarHBondContact O-N 3.35Å
503	N	92.4	Very high	93.7	Very high	110 Å²	110	53.7 Å²	53.7	59%	0.588	29%	0.293	S	S	*	.	H	α-helix	trans	-98	-37.8	-170.8	-65	-21.8	0	0	0	113.7	E499 I501	E499-N503 WeakPolarHBondContact CG-ND2 3.41Å; E499-N503 WeakPolarHBondContact O-CB 3.46Å; E499-N503 PolarHBondContact O-N 3.35Å; E499-N503 PolarHBondContact O-ND2 2.97Å; I501-N503 PolarHBondContact O-N 3.47Å
504	D	94.2	Very high	93.8	Very high	85 Å²	85	55.3 Å²	55.3	46%	0.455	30%	0.301	S	S	.	.	H	α-helix	trans	-120.5	-17.3	-166.3	-58.7	-64.4	0	0	0	114.7	V500 A506 T572 V575	V500-D504 HydrophobicContact CG1-CB 4.43Å; V500-D504 PolarHBondContact O-N 3.23Å; D504-A506 PolarHBondContact O-N 3.29Å; D504-T572 HydrophobicContact CB-CG2 3.92Å; D504-T572 WeakPolarHBondContact OD2-CB 3.09Å; D504-T572 PolarHBondContact OD2-OG1 3.16Å; D504-V575 HydrophobicContact CB-CG2 4.03Å
505	A	93.9	Very high	93.7	Very high	9 Å²	9	54.9 Å²	54.9	7%	0.074	31%	0.307	C	S	.	.			trans	-82.4	116.7	-176.3	0	0	0	0	0	112.5	V500 I501 W507 A508 V575	V500-A505 PolarHBondContact O-N 2.87Å; I501-A505 HydrophobicContact CG2-CB 4.46Å; I501-A505 WeakPolarHBondContact O-CB 3.34Å; A505-W507 HydrophobicContact CB-CD2 4.06Å; A505-W507 HydrophobicContact CB-CE3 4.32Å; A505-W507 HydrophobicContact CB-CH2 4.35Å; A505-W507 HydrophobicContact CB-CZ2 4.1Å; A505-W507 HydrophobicContact CB-CZ3 4.45Å; A505-W507 PolarHBondContact O-N 2.92Å; A505-W507 VanDerWaalsContact O-N 3.07Å; A505-A508 HydrophobicContact CB-CB 4.39Å; A505-A508 WeakPolarHBondContact O-CB 3.36Å; A505-A508 PolarHBondContact O-N 3.21Å; A505-V575 HydrophobicContact CB-CG1 3.92Å
506	A	93.8	Very high	93.9	Very high	101 Å²	101	52 Å²	52	84%	0.835	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-24.3	176.6	0	0	0	0	0	113.9	D504	D504-A506 PolarHBondContact O-N 3.29Å
507	W	94.3	Very high	94.1	Very high	20 Å²	20	53 Å²	53	8%	0.076	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	5.8	177.5	48.8	-103	0	0	0	114.1	I501 A505 P509 L510 F511 L539 V575 G576 L578	I501-W507 HydrophobicContact CD1-CH2 3.86Å; I501-W507 HydrophobicContact CD1-CZ3 4.12Å; I501-W507 HydrophobicContact CG1-CH2 3.73Å; I501-W507 HydrophobicContact CG1-CZ3 4.09Å; I501-W507 HydrophobicContact CG2-CH2 4.42Å; I501-W507 HydrophobicContact CG2-CZ3 3.93Å; A505-W507 HydrophobicContact CB-CD2 4.06Å; A505-W507 HydrophobicContact CB-CE3 4.32Å; A505-W507 HydrophobicContact CB-CH2 4.35Å; A505-W507 HydrophobicContact CB-CZ2 4.1Å; A505-W507 HydrophobicContact CB-CZ3 4.45Å; A505-W507 PolarHBondContact O-N 2.92Å; A505-W507 VanDerWaalsContact O-N 3.07Å; W507-P509 VanDerWaalsContact C-N 3.33Å; W507-L510 HydrophobicContact CB-CD1 4.36Å; W507-L510 WeakPolarHBondContact O-CB 2.88Å; W507-L510 PolarHBondContact O-N 2.92Å; W507-F511 HydrophobicContact CE3-CB 4.22Å; W507-F511 HydrophobicContact CZ3-CB 4.1Å; W507-F511 AromaticContact CZ3-CD2 3.89Å; W507-F511 HydrophobicContact CZ3-CD2 3.89Å; W507-F511 HydrophobicContact CZ3-CG 4.27Å; W507-F511 PolarHBondContact O-N 2.98Å; W507-L539 HydrophobicContact CH2-CD2 3.5Å; W507-L539 VanDerWaalsContact CH2-CD2 3.5Å; W507-L539 HydrophobicContact CZ2-CD2 4.27Å; W507-L539 HydrophobicContact CZ3-CD2 3.79Å; W507-V575 HydrophobicContact CZ2-CG1 4.15Å; W507-G576 PolarHBondContact NE1-O 2.88Å; W507-L578 HydrophobicContact CB-CD1 3.86Å; W507-L578 HydrophobicContact CB-CG 4.11Å; W507-L578 HydrophobicContact CD2-CD1 4.14Å; W507-L578 HydrophobicContact CD2-CD2 3.62Å; W507-L578 HydrophobicContact CD2-CG 3.85Å; W507-L578 HydrophobicContact CE3-CD1 4.39Å; W507-L578 HydrophobicContact CE3-CD2 3.97Å; W507-L578 HydrophobicContact CE3-CG 4.45Å; W507-L578 HydrophobicContact CG-CD1 3.92Å; W507-L578 HydrophobicContact CG-CD2 4.02Å; W507-L578 HydrophobicContact CG-CG 3.68Å; W507-L578 HydrophobicContact CH2-CD2 4.32Å; W507-L578 HydrophobicContact CZ2-CD2 3.99Å; W507-L578 HydrophobicContact CZ3-CD2 4.31Å
508	A	93.6	Very high	94.2	Very high	27 Å²	27	53.1 Å²	53.1	22%	0.223	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-51.5	-37.9	179.9	0	0	0	0	0	115.4	I501 A505 L510 F511	I501-A508 HydrophobicContact CG2-CB 4.27Å; I501-A508 WeakPolarHBondContact O-CB 3.35Å; A505-A508 HydrophobicContact CB-CB 4.39Å; A505-A508 WeakPolarHBondContact O-CB 3.36Å; A505-A508 PolarHBondContact O-N 3.21Å; A508-L510 PolarHBondContact O-N 3.45Å; A508-L510 VanDerWaalsContact O-N 3.13Å; A508-F511 WeakPolarHBondContact O-CB 2.87Å; A508-F511 PolarHBondContact O-N 3.01Å; A508-F511 VanDerWaalsContact O-N 3.15Å
509	P	93.1	Very high	94.3	Very high	120 Å²	120	50.6 Å²	50.6	78%	0.779	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-64.4	-16.4	177.2	-23.3	35.6	0	0	0	114.6	W507	W507-P509 VanDerWaalsContact C-N 3.33Å
510	L	92.3	Very high	94.5	Very high	45 Å²	45	48.2 Å²	48.2	24%	0.236	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-96.3	-16.6	179.6	-53.2	169.8	0	0	0	112.2	W507 A508 A541 F542 V544	W507-L510 HydrophobicContact CB-CD1 4.36Å; W507-L510 WeakPolarHBondContact O-CB 2.88Å; W507-L510 PolarHBondContact O-N 2.92Å; A508-L510 PolarHBondContact O-N 3.45Å; A508-L510 VanDerWaalsContact O-N 3.13Å; L510-A541 HydrophobicContact CB-CB 4.34Å; L510-A541 CarbonylContact O-C 3.57Å; L510-A541 WeakPolarHBondContact O-CA 3.46Å; L510-A541 WeakPolarHBondContact O-CB 3.38Å; L510-F542 HydrophobicContact CD2-CB 4.36Å; L510-F542 PolarHBondContact O-N 3.08Å; L510-V544 HydrophobicContact CD1-CG2 3.48Å; L510-V544 VanDerWaalsContact CD1-CG2 3.48Å
511	F	94.7	Very high	94.6	Very high	44 Å²	44	48.5 Å²	48.5	19%	0.193	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	135.1	-174.4	172.5	-103.3	0	0	0	111.8	I501 W507 A508 S513 F514 L539	I501-F511 HydrophobicContact CD1-CD2 4.11Å; I501-F511 HydrophobicContact CD1-CE1 4.4Å; I501-F511 HydrophobicContact CD1-CE2 3.7Å; I501-F511 HydrophobicContact CD1-CZ 3.86Å; I501-F511 HydrophobicContact CG2-CB 4.21Å; I501-F511 HydrophobicContact CG2-CD1 3.9Å; I501-F511 HydrophobicContact CG2-CD2 4.37Å; I501-F511 HydrophobicContact CG2-CE1 4.32Å; I501-F511 HydrophobicContact CG2-CG 3.91Å; W507-F511 HydrophobicContact CE3-CB 4.22Å; W507-F511 HydrophobicContact CZ3-CB 4.1Å; W507-F511 AromaticContact CZ3-CD2 3.89Å; W507-F511 HydrophobicContact CZ3-CD2 3.89Å; W507-F511 HydrophobicContact CZ3-CG 4.27Å; W507-F511 PolarHBondContact O-N 2.98Å; A508-F511 WeakPolarHBondContact O-CB 2.87Å; A508-F511 PolarHBondContact O-N 3.01Å; A508-F511 VanDerWaalsContact O-N 3.15Å; F511-S513 VanDerWaalsContact CZ-C 3.48Å; F511-S513 VanDerWaalsContact CZ-CA 3.47Å; F511-F514 HydrophobicContact CE2-CB 4.44Å; F511-F514 HydrophobicContact CE2-CD1 4.47Å; F511-F514 AromaticContact CZ-CD1 4Å; F511-F514 HydrophobicContact CZ-CD1 4Å; F511-L539 HydrophobicContact CD2-CD1 4.33Å; F511-L539 HydrophobicContact CD2-CD2 4.36Å; F511-L539 HydrophobicContact CE2-CB 4.21Å; F511-L539 HydrophobicContact CE2-CD2 4.44Å
512	C	94.3	Very high	94.7	Very high	53 Å²	53	49.2 Å²	49.2	36%	0.358	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	-55.7	175.7	-60.1	0	0	0	0	111.5	L540 F542	C512-L540 HydrophobicContact CB-CB 4.11Å; C512-L540 WeakPolarHBondContact CB-O 3.36Å; C512-L540 PolarHBondContact N-O 2.88Å; C512-F542 WeakPolarHBondContact SG-CE2 3.47Å
513	S	95.4	Very high	94.8	Very high	50 Å²	50	45.3 Å²	45.3	35%	0.35	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-166	160.4	179.4	58.1	0	0	0	0	109.8	F511 L539 L540	F511-S513 VanDerWaalsContact CZ-C 3.48Å; F511-S513 VanDerWaalsContact CZ-CA 3.47Å; S513-L539 WeakPolarHBondContact O-CA 3.3Å; S513-L539 WeakPolarHBondContact O-CB 3.45Å; S513-L540 PolarHBondContact O-N 2.92Å
514	F	95.5	Very high	95	Very high	35 Å²	35	40.2 Å²	40.2	15%	0.154	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	154.1	160.8	58.4	-98.8	0	0	0	110.1	E494 I497 F511 Y517 L539	E494-F514 HydrophobicContact CB-CZ 4Å; E494-F514 HydrophobicContact CG-CE2 4.12Å; E494-F514 HydrophobicContact CG-CZ 3.89Å; I497-F514 HydrophobicContact CB-CE1 4.13Å; I497-F514 HydrophobicContact CG2-CD1 3.52Å; I497-F514 HydrophobicContact CG2-CE1 3.56Å; I497-F514 HydrophobicContact CG2-CG 4.38Å; I497-F514 HydrophobicContact CG2-CZ 4.44Å; F511-F514 HydrophobicContact CE2-CB 4.44Å; F511-F514 HydrophobicContact CE2-CD1 4.47Å; F511-F514 AromaticContact CZ-CD1 4Å; F511-F514 HydrophobicContact CZ-CD1 4Å; F514-Y517 AromaticContact CD2-CD1 3.91Å; F514-Y517 HydrophobicContact CD2-CD1 3.91Å; F514-Y517 HydrophobicContact CD2-CE1 4.27Å; F514-Y517 AromaticContact CE2-CD1 3.86Å; F514-Y517 HydrophobicContact CE2-CD1 3.86Å; F514-Y517 AromaticContact CE2-CE1 3.76Å; F514-Y517 HydrophobicContact CE2-CE1 3.76Å; F514-L539 HydrophobicContact CB-CB 4.04Å
515	S	92.6	Very high	95	Very high	78 Å²	78	38.2 Å²	38.2	55%	0.545	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	-33.4	-179.6	-53.4	0	0	0	0	112.7	L538	S515-L538 PolarHBondContact N-O 2.82Å
516	D	94.8	Very high	94.9	Very high	34 Å²	34	39.6 Å²	39.6	18%	0.182	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	152.5	-171.6	-173.7	15.3	0	0	0	109.3	P216 L538 W590	P216-D516 WeakPolarHBondContact CD-OD1 3.45Å; D516-L538 HydrophobicContact CB-CB 4.31Å; D516-L538 HydrophobicContact CB-CD2 4.47Å; D516-L538 PolarHBondContact N-O 3.32Å; D516-L538 PolarHBondContact O-N 2.91Å; D516-W590 HydrophobicContact CB-CZ2 3.88Å; D516-W590 WeakPolarHBondContact OD2-CZ2 3.11Å; D516-W590 PolarHBondContact OD2-NE1 3.2Å
517	Y	96.6	Very high	94.8	Very high	23 Å²	23	40.6 Å²	40.6	9%	0.09	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	151	-177.7	55.8	-93.1	0	0	0	113.7	S237 F493 E494 I497 F514 V519 G536	S237-Y517 VanDerWaalsContact O-CE2 3.23Å; S237-Y517 WeakPolarHBondContact O-CE2 3.27Å; F493-Y517 HydrophobicContact CB-CD2 4.38Å; F493-Y517 HydrophobicContact CB-CE2 3.73Å; F493-Y517 AromaticContact CD2-CE2 3.87Å; F493-Y517 HydrophobicContact CD2-CE2 3.87Å; F493-Y517 HydrophobicContact CG-CE2 4.24Å; E494-Y517 HydrophobicContact CG-CE1 3.85Å; E494-Y517 VanDerWaalsContact CG-OH 3.3Å; E494-Y517 WeakPolarHBondContact CG-OH 3.41Å; E494-Y517 PolarHBondContact OE1-OH 2.95Å; E494-Y517 VanDerWaalsContact OE1-OH 3.13Å; I497-Y517 HydrophobicContact CD1-CD1 4Å; I497-Y517 HydrophobicContact CD1-CD2 4.17Å; I497-Y517 HydrophobicContact CD1-CE1 4.44Å; I497-Y517 HydrophobicContact CD1-CG 3.87Å; F514-Y517 AromaticContact CD2-CD1 3.91Å; F514-Y517 HydrophobicContact CD2-CD1 3.91Å; F514-Y517 HydrophobicContact CD2-CE1 4.27Å; F514-Y517 AromaticContact CE2-CD1 3.86Å; F514-Y517 HydrophobicContact CE2-CD1 3.86Å; F514-Y517 AromaticContact CE2-CE1 3.76Å; F514-Y517 HydrophobicContact CE2-CE1 3.76Å; Y517-V519 HydrophobicContact CD2-CG2 4.31Å; Y517-G536 CarbonylContact C-O 3.58Å; Y517-G536 WeakPolarHBondContact CA-O 3.12Å; Y517-G536 WeakPolarHBondContact CB-O 3.17Å
518	D	96.9	Very high	94.7	Very high	3 Å²	3	42.9 Å²	42.9	2%	0.016	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	122.5	-179.2	-178.1	32.2	0	0	0	110.2	P216 G536 W590 Y593 R594	P216-D518 HydrophobicContact CG-CB 3.94Å; D518-G536 PolarHBondContact N-O 3.38Å; D518-G536 PolarHBondContact O-N 2.81Å; D518-W590 HydrophobicContact CB-CD2 4.16Å; D518-W590 HydrophobicContact CB-CE3 3.65Å; D518-W590 HydrophobicContact CB-CH2 4.46Å; D518-W590 HydrophobicContact CB-CZ3 3.83Å; D518-Y593 HydrophobicContact CB-CD1 4.19Å; D518-Y593 HydrophobicContact CB-CE1 3.99Å; D518-Y593 WeakPolarHBondContact O-CE1 3.28Å; D518-Y593 PolarHBondContact O-OH 2.86Å; D518-Y593 WeakPolarHBondContact OD2-CD1 3.16Å; D518-Y593 WeakPolarHBondContact OD2-CE1 3.47Å; D518-R594 IonicContact OD1-CZ 3.74Å; D518-R594 IonicContact OD1-NE 2.81Å; D518-R594 IonicContact OD1-NH2 3.83Å; D518-R594 PolarHBondContact OD1-NH2 3.37Å; D518-R594 WeakPolarHBondContact OD2-CG 3.22Å; D518-R594 IonicContact OD2-CZ 2.75Å; D518-R594 IonicContact OD2-NE 3.43Å; D518-R594 PolarHBondContact OD2-NE 2.94Å; D518-R594 IonicContact OD2-NH2 3.16Å; D518-R594 PolarHBondContact OD2-NH2 2.85Å
519	V	96.7	Very high	94.8	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.03	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	123.1	-174.4	-172.8	0	0	0	0	111.6	N235 F493 Y517 I533 N534 I535	N235-V519 PolarHBondContact ND2-O 3.48Å; N235-V519 VanDerWaalsContact ND2-O 3.07Å; F493-V519 HydrophobicContact CD1-CG2 3.99Å; F493-V519 HydrophobicContact CD2-CG2 3.84Å; F493-V519 HydrophobicContact CE1-CB 4.16Å; F493-V519 HydrophobicContact CE1-CG1 3.76Å; F493-V519 HydrophobicContact CE1-CG2 3.89Å; F493-V519 HydrophobicContact CE2-CB 4.07Å; F493-V519 HydrophobicContact CE2-CG2 3.73Å; F493-V519 HydrophobicContact CG-CG2 3.97Å; F493-V519 HydrophobicContact CZ-CB 3.78Å; F493-V519 HydrophobicContact CZ-CG1 3.75Å; F493-V519 HydrophobicContact CZ-CG2 3.75Å; Y517-V519 HydrophobicContact CD2-CG2 4.31Å; V519-I533 HydrophobicContact CG1-CB 4.2Å; V519-I533 HydrophobicContact CG1-CD1 4.31Å; V519-I533 HydrophobicContact CG1-CG2 4.49Å; V519-N534 WeakPolarHBondContact CA-O 3.25Å; V519-I535 HydrophobicContact CG1-CG1 4.23Å; V519-I535 HydrophobicContact CG2-CB 4.46Å; V519-I535 HydrophobicContact CG2-CG1 4.08Å; V519-I535 HydrophobicContact CG2-CG2 4.14Å
520	V	97.3	Very high	94.9	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.012	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	128.2	-179	178.6	0	0	0	0	110	T219 L522 N534 Y593 C597	T219-V520 HydrophobicContact CG2-CG2 4.33Å; V520-L522 PolarHBondContact O-N 3.27Å; V520-N534 PolarHBondContact N-O 3.39Å; V520-N534 PolarHBondContact O-N 2.94Å; V520-Y593 HydrophobicContact CG2-CE1 3.8Å; V520-C597 HydrophobicContact CB-CB 4.3Å; V520-C597 HydrophobicContact CG1-CB 3.84Å
521	I	97.2	Very high	95.2	Very high	8 Å²	8	37.6 Å²	37.6	4%	0.041	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	125.2	173.2	-54.8	166.5	0	0	0	108.1	Q221 F224 Q225 L233 L240 V524 V531 I533	Q221-I521 PolarHBondContact NE2-O 3.01Å; F224-I521 HydrophobicContact CB-CB 4.24Å; F224-I521 HydrophobicContact CB-CG2 3.78Å; F224-I521 HydrophobicContact CG-CG2 4.27Å; Q225-I521 HydrophobicContact CG-CD1 4.05Å; L233-I521 HydrophobicContact CB-CD1 4.17Å; L233-I521 HydrophobicContact CD1-CD1 4.02Å; L240-I521 HydrophobicContact CD1-CD1 4.49Å; I521-V524 HydrophobicContact CG2-CG2 3.81Å; I521-V531 HydrophobicContact CG2-CG1 4.23Å; I521-I533 HydrophobicContact CG1-CG2 4.36Å
522	L	95.7	Very high	95.3	Very high	19 Å²	19	37.8 Å²	37.8	10%	0.099	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	-40	178.4	-65.4	-174	0	0	0	112.6	V520 M532 N534 C597 T600 V601	V520-L522 PolarHBondContact O-N 3.27Å; L522-M532 HydrophobicContact CB-CB 4.38Å; L522-M532 PolarHBondContact N-O 3.12Å; L522-N534 HydrophobicContact CD1-CB 3.87Å; L522-N534 HydrophobicContact CD2-CB 4.07Å; L522-N534 HydrophobicContact CG-CB 3.86Å; L522-C597 HydrophobicContact CD2-CB 4.1Å; L522-T600 HydrophobicContact CD1-CG2 4.31Å; L522-V601 HydrophobicContact CD2-CG2 4.2Å
523	E	95.3	Very high	95.4	Very high	80 Å²	80	35.3 Å²	35.3	37%	0.374	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	155.7	177.8	177.6	58.9	165.2	0	0	110.4	F224 K227 M532	F224-E523 WeakPolarHBondContact CE1-OE2 3.46Å; K227-E523 IonicContact NZ-OE1 2.7Å; K227-E523 PolarHBondContact NZ-OE1 3.22Å; K227-E523 IonicContact NZ-OE2 2.73Å; K227-E523 PolarHBondContact NZ-OE2 3.12Å; E523-M532 HydrophobicContact CB-CB 4.27Å; E523-M532 PolarHBondContact N-O 3.39Å; E523-M532 PolarHBondContact O-N 2.89Å
524	V	96.3	Very high	95.6	Very high	3 Å²	3	33.2 Å²	33.2	2%	0.018	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	123.4	169.8	176.4	0	0	0	0	108	F224 K227 L233 I521 P526 V531	F224-V524 HydrophobicContact CB-CG2 4.29Å; K227-V524 HydrophobicContact CB-CB 4.01Å; K227-V524 HydrophobicContact CB-CG1 4.22Å; K227-V524 HydrophobicContact CD-CB 4.25Å; K227-V524 VanDerWaalsContact CD-O 3.3Å; K227-V524 WeakPolarHBondContact CD-O 3.3Å; K227-V524 WeakPolarHBondContact CE-O 3.49Å; K227-V524 HydrophobicContact CG-CB 4.28Å; L233-V524 HydrophobicContact CD1-CG2 3.75Å; I521-V524 HydrophobicContact CG2-CG2 3.81Å; V524-P526 VanDerWaalsContact O-CD 3.3Å; V524-P526 WeakPolarHBondContact O-CD 3.4Å; V524-V531 HydrophobicContact CG1-CG2 4.39Å; V524-V531 HydrophobicContact CG2-CG1 4.22Å; V524-V531 HydrophobicContact CG2-CG2 4.35Å
525	C	94.8	Very high	95.7	Very high	43 Å²	43	31.6 Å²	31.6	29%	0.291	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	102.2	173.7	-173.6	0	0	0	0	109.3	E527 T528 N529 I530	C525-E527 VanDerWaalsContact C-N 3.28Å; C525-E527 PolarHBondContact O-N 2.85Å; C525-T528 WeakPolarHBondContact CB-OG1 3.38Å; C525-T528 PolarHBondContact SG-OG1 3.22Å; C525-N529 VanDerWaalsContact O-CA 3.3Å; C525-N529 WeakPolarHBondContact O-CA 3.39Å; C525-N529 PolarHBondContact O-N 2.79Å; C525-I530 PolarHBondContact N-O 2.82Å; C525-I530 PolarHBondContact O-N 3.34Å
526	P	92.6	Very high	95.9	Very high	39 Å²	39	27.9 Å²	27.9	25%	0.253	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-16.6	-175.3	31.8	-35.6	0	0	0	113.2	K227 K228 V524 N529	K227-P526 WeakPolarHBondContact O-CB 3.42Å; K228-P526 HydrophobicContact CB-CB 4.07Å; K228-P526 HydrophobicContact CG-CB 4.49Å; V524-P526 VanDerWaalsContact O-CD 3.3Å; V524-P526 WeakPolarHBondContact O-CD 3.4Å; P526-N529 PolarHBondContact O-OD1 3.21Å; P526-N529 VanDerWaalsContact O-OD1 3.07Å
527	E	90.9	Very high	96	Very high	122 Å²	122	26.2 Å²	26.2	57%	0.57	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-37.3	173.7	-70.2	83	-179.1	0	0	113.4	C525 R612	C525-E527 VanDerWaalsContact C-N 3.28Å; C525-E527 PolarHBondContact O-N 2.85Å; E527-R612 IonicContact OE1-CZ 3.62Å; E527-R612 IonicContact OE1-NH1 3.19Å; E527-R612 PolarHBondContact OE1-NH1 3.41Å; E527-R612 IonicContact OE1-NH2 3.69Å
528	T	93.1	Very high	96	Very high	68 Å²	68	25.9 Å²	25.9	42%	0.417	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-9.1	176.5	62.5	0	0	0	0	113.3	C525 I530 N566	C525-T528 WeakPolarHBondContact CB-OG1 3.38Å; C525-T528 PolarHBondContact SG-OG1 3.22Å; T528-I530 VanDerWaalsContact C-N 3.27Å; T528-I530 PolarHBondContact O-N 3.23Å; T528-I530 WeakPolarHBondContact OG1-CG1 3.43Å; T528-N566 PolarHBondContact O-ND2 3.07Å
529	N	94.8	Very high	95.9	Very high	24 Å²	24	25.8 Å²	25.8	13%	0.128	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	32.4	-172.2	-55.1	-42.5	0	0	0	114.2	K228 C525 P526 L565 N566	K228-N529 WeakPolarHBondContact CD-OD1 3.24Å; K228-N529 WeakPolarHBondContact CE-OD1 3.35Å; K228-N529 PolarHBondContact NZ-OD1 2.89Å; C525-N529 VanDerWaalsContact O-CA 3.3Å; C525-N529 WeakPolarHBondContact O-CA 3.39Å; C525-N529 PolarHBondContact O-N 2.79Å; P526-N529 PolarHBondContact O-OD1 3.21Å; P526-N529 VanDerWaalsContact O-OD1 3.07Å; N529-L565 HydrophobicContact CB-CB 4.15Å; N529-L565 WeakPolarHBondContact O-CB 3.18Å; N529-L565 WeakPolarHBondContact O-CG 3.42Å; N529-L565 PolarHBondContact O-N 3.48Å; N529-N566 PolarHBondContact ND2-OD1 2.86Å
530	I	96.2	Very high	95.9	Very high	57 Å²	57	27.9 Å²	27.9	29%	0.292	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	129	176	-61.2	173.1	0	0	0	110.3	C525 T528 M532 W563	C525-I530 PolarHBondContact N-O 2.82Å; C525-I530 PolarHBondContact O-N 3.34Å; T528-I530 VanDerWaalsContact C-N 3.27Å; T528-I530 PolarHBondContact O-N 3.23Å; T528-I530 WeakPolarHBondContact OG1-CG1 3.43Å; I530-M532 HydrophobicContact CG2-SD 4.43Å; I530-W563 CarbonylContact C-O 3.51Å; I530-W563 WeakPolarHBondContact CA-O 3.19Å
531	V	97.4	Very high	95.7	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	124.9	171.7	-178.9	0	0	0	0	108.6	L233 L240 I521 V524 I533 S562 W563 L565	L233-V531 HydrophobicContact CD1-CG1 3.95Å; L233-V531 HydrophobicContact CD1-CG2 3.85Å; L233-V531 HydrophobicContact CD2-CG2 4.35Å; L240-V531 HydrophobicContact CD2-CG1 4.23Å; I521-V531 HydrophobicContact CG2-CG1 4.23Å; V524-V531 HydrophobicContact CG1-CG2 4.39Å; V524-V531 HydrophobicContact CG2-CG1 4.22Å; V524-V531 HydrophobicContact CG2-CG2 4.35Å; V531-I533 HydrophobicContact CG1-CG2 3.92Å; V531-S562 WeakPolarHBondContact O-CA 3.47Å; V531-W563 HydrophobicContact CB-CB 4.45Å; V531-W563 HydrophobicContact CB-CE3 4.09Å; V531-W563 HydrophobicContact CG1-CE3 4.44Å; V531-W563 HydrophobicContact CG2-CE3 4.17Å; V531-W563 PolarHBondContact N-O 2.85Å; V531-W563 PolarHBondContact O-N 3.47Å; V531-L565 HydrophobicContact CG2-CD1 3.9Å; V531-L565 HydrophobicContact CG2-CD2 4.07Å; V531-L565 HydrophobicContact CG2-CG 4Å
532	M	97.3	Very high	95.4	Very high	48 Å²	48	31.7 Å²	31.7	24%	0.236	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	117.6	174.7	-69.2	-65.5	-55.1	0	0	109.3	L522 E523 I530 S562 V573	L522-M532 HydrophobicContact CB-CB 4.38Å; L522-M532 PolarHBondContact N-O 3.12Å; E523-M532 HydrophobicContact CB-CB 4.27Å; E523-M532 PolarHBondContact N-O 3.39Å; E523-M532 PolarHBondContact O-N 2.89Å; I530-M532 HydrophobicContact CG2-SD 4.43Å; M532-S562 VanDerWaalsContact SD-CB 3.55Å; M532-V573 HydrophobicContact CE-CB 4.29Å; M532-V573 HydrophobicContact CE-CG1 4.12Å; M532-V573 HydrophobicContact CE-CG2 3.98Å; M532-V573 HydrophobicContact SD-CG2 4.44Å
533	I	97.1	Very high	94.9	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	150.7	176.2	62.8	176	0	0	0	111.5	L240 L491 F493 L496 V519 I521 V531 I535 Q560 V561	L240-I533 HydrophobicContact CD2-CG2 3.91Å; L491-I533 HydrophobicContact CD2-CD1 4.14Å; F493-I533 HydrophobicContact CE1-CD1 4.49Å; L496-I533 HydrophobicContact CD2-CD1 4.06Å; V519-I533 HydrophobicContact CG1-CB 4.2Å; V519-I533 HydrophobicContact CG1-CD1 4.31Å; V519-I533 HydrophobicContact CG1-CG2 4.49Å; I521-I533 HydrophobicContact CG1-CG2 4.36Å; V531-I533 HydrophobicContact CG1-CG2 3.92Å; I533-I535 HydrophobicContact CD1-CD1 4.16Å; I533-I535 HydrophobicContact CD1-CG1 4.24Å; I533-Q560 WeakPolarHBondContact O-CA 3.33Å; I533-V561 HydrophobicContact CD1-CB 4.43Å; I533-V561 HydrophobicContact CG1-CB 3.99Å; I533-V561 PolarHBondContact N-O 2.95Å; I533-V561 PolarHBondContact O-N 3.19Å
534	N	97.8	Very high	93.7	Very high	7 Å²	7	35.2 Å²	35.2	4%	0.037	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	136.8	165.1	-163.7	28.9	0	0	0	107.7	V519 V520 L522 L559 Q560 Y593 C597	V519-N534 WeakPolarHBondContact CA-O 3.25Å; V520-N534 PolarHBondContact N-O 3.39Å; V520-N534 PolarHBondContact O-N 2.94Å; L522-N534 HydrophobicContact CD1-CB 3.87Å; L522-N534 HydrophobicContact CD2-CB 4.07Å; L522-N534 HydrophobicContact CG-CB 3.86Å; N534-L559 CarbonylContact C-O 3.48Å; N534-L559 WeakPolarHBondContact CA-O 3.43Å; N534-L559 PolarHBondContact OD1-O 2.8Å; N534-Q560 VanDerWaalsContact OD1-CG 3.3Å; N534-Q560 WeakPolarHBondContact OD1-CG 3.3Å; N534-Y593 VanDerWaalsContact C-OH 3.23Å; N534-Y593 WeakPolarHBondContact ND2-CE2 3.4Å; N534-Y593 PolarHBondContact ND2-OH 2.94Å; N534-Y593 PolarHBondContact O-OH 3.44Å; N534-C597 PolarHBondContact ND2-SG 3.05Å
535	I	97.6	Very high	92.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	108.9	179.4	-55.3	174.7	0	0	0	106.4	L496 I497 V519 I533 L537 N558 L559	L496-I535 HydrophobicContact CD2-CD1 3.79Å; L496-I535 HydrophobicContact CG-CD1 4.34Å; I497-I535 HydrophobicContact CD1-CG2 3.9Å; I497-I535 HydrophobicContact CG1-CD1 4.24Å; I497-I535 HydrophobicContact CG1-CG2 3.95Å; V519-I535 HydrophobicContact CG1-CG1 4.23Å; V519-I535 HydrophobicContact CG2-CB 4.46Å; V519-I535 HydrophobicContact CG2-CG1 4.08Å; V519-I535 HydrophobicContact CG2-CG2 4.14Å; I533-I535 HydrophobicContact CD1-CD1 4.16Å; I533-I535 HydrophobicContact CD1-CG1 4.24Å; I535-L537 HydrophobicContact CG2-CD2 3.7Å; I535-L537 HydrophobicContact CG2-CG 4.31Å; I535-N558 CarbonylContact O-C 3.5Å; I535-N558 WeakPolarHBondContact O-CA 3.49Å; I535-L559 HydrophobicContact CB-CB 4.31Å; I535-L559 PolarHBondContact N-O 2.9Å; I535-L559 PolarHBondContact O-N 2.85Å
536	G	97.4	Very high	90.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	133.9	169.6	0	0	0	0	0	109.2	Y517 D518 Y593	Y517-G536 CarbonylContact C-O 3.58Å; Y517-G536 WeakPolarHBondContact CA-O 3.12Å; Y517-G536 WeakPolarHBondContact CB-O 3.17Å; D518-G536 PolarHBondContact N-O 3.38Å; D518-G536 PolarHBondContact O-N 2.81Å; G536-Y593 VanDerWaalsContact N-CE2 3.34Å; G536-Y593 PolarHBondContact N-OH 3.25Å
537	L	97.2	Very high	88.7	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	136.9	-178.2	-63.2	-179	0	0	0	110.7	I497 I501 I535 L539 H556 S557 L559	I497-L537 HydrophobicContact CD1-CD2 3.67Å; I497-L537 HydrophobicContact CG1-CD2 3.94Å; I497-L537 HydrophobicContact CG2-CD1 3.99Å; I497-L537 HydrophobicContact CG2-CD2 3.9Å; I501-L537 HydrophobicContact CD1-CD1 4.13Å; I535-L537 HydrophobicContact CG2-CD2 3.7Å; I535-L537 HydrophobicContact CG2-CG 4.31Å; L537-L539 HydrophobicContact CB-CD2 4.22Å; L537-L539 HydrophobicContact CD1-CD2 4.23Å; L537-H556 VanDerWaalsContact O-CA 3.24Å; L537-H556 WeakPolarHBondContact O-CA 3.46Å; L537-H556 PolarHBondContact O-CD2 2.91Å; L537-S557 PolarHBondContact N-O 2.92Å; L537-S557 PolarHBondContact O-N 2.8Å; L537-S557 VanDerWaalsContact O-N 3.07Å; L537-L559 HydrophobicContact CD1-CD1 3.73Å; L537-L559 HydrophobicContact CD1-CD2 4.32Å; L537-L559 HydrophobicContact CD1-CG 3.78Å; L537-L559 HydrophobicContact CG-CG 4.45Å
538	L	96.5	Very high	86.9	Confident	16 Å²	16	53.3 Å²	53.3	8%	0.084	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	119.1	161	-169.1	71.1	0	0	0	107.4	S515 D516 T554 V581 W590	S515-L538 PolarHBondContact N-O 2.82Å; D516-L538 HydrophobicContact CB-CB 4.31Å; D516-L538 HydrophobicContact CB-CD2 4.47Å; D516-L538 PolarHBondContact N-O 3.32Å; D516-L538 PolarHBondContact O-N 2.91Å; L538-T554 HydrophobicContact CD1-CG2 3.64Å; L538-T554 HydrophobicContact CG-CG2 3.91Å; L538-V581 HydrophobicContact CD1-CG2 3.94Å; L538-W590 HydrophobicContact CB-CH2 3.96Å; L538-W590 HydrophobicContact CB-CZ2 3.87Å
539	L	95.9	Very high	85.1	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	162.4	-169	68.6	81.1	0	0	0	114	W507 F511 S513 F514 L537 A541 T554 Y555 L578	W507-L539 HydrophobicContact CH2-CD2 3.5Å; W507-L539 VanDerWaalsContact CH2-CD2 3.5Å; W507-L539 HydrophobicContact CZ2-CD2 4.27Å; W507-L539 HydrophobicContact CZ3-CD2 3.79Å; F511-L539 HydrophobicContact CD2-CD1 4.33Å; F511-L539 HydrophobicContact CD2-CD2 4.36Å; F511-L539 HydrophobicContact CE2-CB 4.21Å; F511-L539 HydrophobicContact CE2-CD2 4.44Å; S513-L539 WeakPolarHBondContact O-CA 3.3Å; S513-L539 WeakPolarHBondContact O-CB 3.45Å; F514-L539 HydrophobicContact CB-CB 4.04Å; L537-L539 HydrophobicContact CB-CD2 4.22Å; L537-L539 HydrophobicContact CD1-CD2 4.23Å; L539-A541 HydrophobicContact CD1-CB 3.86Å; L539-T554 CarbonylContact O-C 3.51Å; L539-T554 WeakPolarHBondContact O-CA 3.43Å; L539-Y555 PolarHBondContact N-O 2.93Å; L539-Y555 PolarHBondContact O-N 2.8Å; L539-L578 HydrophobicContact CD1-CD2 3.93Å; L539-L578 HydrophobicContact CD2-CD2 4.15Å; L539-L578 HydrophobicContact CG-CD2 4.44Å
540	L	95	Very high	83.9	Confident	49 Å²	49	62 Å²	62	26%	0.257	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	130	173.3	-68.4	174.8	0	0	0	109.8	C512 S513 P552 N553	C512-L540 HydrophobicContact CB-CB 4.11Å; C512-L540 WeakPolarHBondContact CB-O 3.36Å; C512-L540 PolarHBondContact N-O 2.88Å; S513-L540 PolarHBondContact O-N 2.92Å; L540-P552 HydrophobicContact CB-CB 4.34Å; L540-N553 WeakPolarHBondContact CA-O 3.44Å
541	A	93.7	Very high	83.3	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	158.9	175	0	0	0	0	0	111.9	L510 L539 P552 N553 Y555 L578	L510-A541 HydrophobicContact CB-CB 4.34Å; L510-A541 CarbonylContact O-C 3.57Å; L510-A541 WeakPolarHBondContact O-CA 3.46Å; L510-A541 WeakPolarHBondContact O-CB 3.38Å; L539-A541 HydrophobicContact CD1-CB 3.86Å; A541-P552 CarbonylContact O-C 3.59Å; A541-P552 VanDerWaalsContact O-CA 3.26Å; A541-P552 WeakPolarHBondContact O-CA 3.46Å; A541-N553 PolarHBondContact N-O 3.06Å; A541-N553 VanDerWaalsContact N-O 3.12Å; A541-N553 PolarHBondContact O-N 2.97Å; A541-Y555 HydrophobicContact CB-CD2 3.88Å; A541-Y555 HydrophobicContact CB-CE2 4.11Å; A541-Y555 WeakPolarHBondContact O-CE2 3.24Å; A541-L578 HydrophobicContact CB-CD1 3.86Å
542	F	91.4	Very high	82.9	Confident	91 Å²	91	71.2 Å²	71.2	40%	0.399	37%	0.369	S	S	.	.			trans	-77.4	145.8	171.3	-67.4	-74.5	0	0	0	111.7	L510 C512 P552	L510-F542 HydrophobicContact CD2-CB 4.36Å; L510-F542 PolarHBondContact O-N 3.08Å; C512-F542 WeakPolarHBondContact SG-CE2 3.47Å; F542-P552 HydrophobicContact CD1-CB 4.43Å; F542-P552 HydrophobicContact CE1-CB 4.37Å
543	S	84.1	Confident	82.6	Confident	53 Å²	53	72 Å²	72	37%	0.371	38%	0.375	S	S	.	.			trans	-72.2	151.1	171.6	-171.1	0	0	0	0	111.1	S545	S543-S545 PolarHBondContact OG-N 2.75Å; S543-S545 PolarHBondContact OG-OG 2.77Å
544	V	71.4	Confident	82.4	Confident	119 Å²	119	74.6 Å²	74.6	72%	0.721	39%	0.391	S	S	*	.	S	Bend	trans	-83.8	-13.7	175.8	-174.4	0	0	0	0	112.2	L510	L510-V544 HydrophobicContact CD1-CG2 3.48Å; L510-V544 VanDerWaalsContact CD1-CG2 3.48Å
545	S	64.9	Low	82.3	Confident	93 Å²	93	75.2 Å²	75.2	65%	0.65	39%	0.393	S	S	*	.	S	Bend	trans	-94	139.6	-179.2	66	0	0	0	0	113.1	S543	S543-S545 PolarHBondContact OG-N 2.75Å; S543-S545 PolarHBondContact OG-OG 2.77Å
546	D	55.7	Low	82.2	Confident	145 Å²	145	76.4 Å²	76.4	78%	0.775	40%	0.398	S	S	*	.			trans	-65.6	155.1	-154	-76.2	-53.5	0	0	0	121.5	E548	D546-E548 PolarHBondContact O-N 3.1Å
547	E	56.3	Low	82.2	Confident	181 Å²	181	76.5 Å²	76.5	85%	0.846	40%	0.399	S	S	*	.	S	Bend	trans	57	-32.7	146.5	-69.8	-169.7	161.2	0	0	123.5
548	E	54.1	Low	82.1	Confident	168 Å²	168	78.5 Å²	78.5	79%	0.785	41%	0.409	S	S	*	.	S	Bend	trans	-94.8	-15.9	-171	-74.1	-167.1	142.6	0	0	116.2	D546	D546-E548 PolarHBondContact O-N 3.1Å
549	H	55.7	Low	82.2	Confident	160 Å²	160	77.7 Å²	77.7	74%	0.741	41%	0.405	S	S	*	.			trans	-140.9	87.4	-174.9	-68	83.6	0	0	0	113.7	R551	H549-R551 PolarHBondContact O-N 3.25Å
550	C	68.3	Low	82.3	Confident	115 Å²	115	80.7 Å²	80.7	78%	0.777	42%	0.419	S	S	*	.			trans	-72	37.5	176	-48.9	0	0	0	0	114.7
551	R	83.6	Confident	82.3	Confident	200 Å²	200	78.3 Å²	78.3	76%	0.755	41%	0.407	S	S	*	.			trans	-111	133.1	177.8	-68.2	-171.2	178.1	-166.9	0.4	110.2	H549	H549-R551 PolarHBondContact O-N 3.25Å
552	P	89	Confident	82.5	Confident	50 Å²	50	79.3 Å²	79.3	33%	0.325	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-69.3	141	174.2	30.2	-34.2	0	0	0	110.2	L540 A541 F542	L540-P552 HydrophobicContact CB-CB 4.34Å; A541-P552 CarbonylContact O-C 3.59Å; A541-P552 VanDerWaalsContact O-CA 3.26Å; A541-P552 WeakPolarHBondContact O-CA 3.46Å; F542-P552 HydrophobicContact CD1-CB 4.43Å; F542-P552 HydrophobicContact CE1-CB 4.37Å
553	N	91.2	Very high	82.7	Confident	65 Å²	65	75 Å²	75	35%	0.348	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	160.8	176.3	-70.6	-34.3	0	0	0	110.4	L540 A541 Y555	L540-N553 WeakPolarHBondContact CA-O 3.44Å; A541-N553 PolarHBondContact N-O 3.06Å; A541-N553 VanDerWaalsContact N-O 3.12Å; A541-N553 PolarHBondContact O-N 2.97Å; N553-Y555 HydrophobicContact CB-CD2 4.45Å; N553-Y555 HydrophobicContact CB-CE2 3.69Å; N553-Y555 WeakPolarHBondContact O-CD2 3.3Å; N553-Y555 WeakPolarHBondContact O-CE2 3.39Å
554	T	93.7	Very high	83.2	Confident	55 Å²	55	74 Å²	74	34%	0.337	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	125.5	174.6	-49	0	0	0	0	111	L538 L539 V581	L538-T554 HydrophobicContact CD1-CG2 3.64Å; L538-T554 HydrophobicContact CG-CG2 3.91Å; L539-T554 CarbonylContact O-C 3.51Å; L539-T554 WeakPolarHBondContact O-CA 3.43Å; T554-V581 HydrophobicContact CG2-CB 4.26Å; T554-V581 HydrophobicContact CG2-CG2 4.34Å; T554-V581 PolarHBondContact O-N 2.91Å
555	Y	95.1	Very high	84.3	Confident	19 Å²	19	68.5 Å²	68.5	8%	0.075	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	155.2	175.5	-63.6	-92.4	0	0	0	110.7	L539 A541 N553 L578 T579 E580	L539-Y555 PolarHBondContact N-O 2.93Å; L539-Y555 PolarHBondContact O-N 2.8Å; A541-Y555 HydrophobicContact CB-CD2 3.88Å; A541-Y555 HydrophobicContact CB-CE2 4.11Å; A541-Y555 WeakPolarHBondContact O-CE2 3.24Å; N553-Y555 HydrophobicContact CB-CD2 4.45Å; N553-Y555 HydrophobicContact CB-CE2 3.69Å; N553-Y555 WeakPolarHBondContact O-CD2 3.3Å; N553-Y555 WeakPolarHBondContact O-CE2 3.39Å; Y555-L578 HydrophobicContact CD1-CB 3.73Å; Y555-L578 HydrophobicContact CE1-CB 4.41Å; Y555-L578 HydrophobicContact CG-CB 4.08Å; Y555-L578 HydrophobicContact CG-CD1 4.4Å; Y555-T579 CarbonylContact C-O 3.58Å; Y555-T579 VanDerWaalsContact CA-O 3.29Å; Y555-T579 WeakPolarHBondContact CA-O 3.26Å; Y555-E580 HydrophobicContact CD1-CB 3.9Å; Y555-E580 HydrophobicContact CD1-CG 4.26Å; Y555-E580 HydrophobicContact CE1-CB 3.67Å; Y555-E580 HydrophobicContact CE1-CG 3.8Å
556	H	96.4	Very high	85.6	Confident	26 Å²	26	66.2 Å²	66.2	12%	0.12	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	139.8	165.6	164.9	-89.2	0	0	0	109.6	L537 T579 V581 V589 Y593	L537-H556 VanDerWaalsContact O-CA 3.24Å; L537-H556 WeakPolarHBondContact O-CA 3.46Å; L537-H556 PolarHBondContact O-CD2 2.91Å; H556-T579 PolarHBondContact N-O 3.17Å; H556-T579 PolarHBondContact ND1-OG1 2.83Å; H556-T579 PolarHBondContact O-N 2.72Å; H556-T579 PolarHBondContact O-OG1 2.84Å; H556-V581 HydrophobicContact CB-CG2 3.89Å; H556-V589 HydrophobicContact CB-CG1 3.93Å; H556-V589 VanDerWaalsContact CD2-CG1 3.42Å; H556-V589 WeakPolarHBondContact CD2-CG1 3.22Å; H556-Y593 AromaticContact NE2-CD2 3.79Å
557	S	96.5	Very high	87.2	Confident	1 Å²	1	59.9 Å²	59.9	1%	0.007	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	177.5	172.9	-177.2	0	0	0	0	110.1	L537 G576 D577	L537-S557 PolarHBondContact N-O 2.92Å; L537-S557 PolarHBondContact O-N 2.8Å; L537-S557 VanDerWaalsContact O-N 3.07Å; S557-G576 PolarHBondContact OG-O 3.49Å; S557-D577 PolarHBondContact OG-O 2.87Å
558	N	96.4	Very high	88.7	Confident	42 Å²	42	51.3 Å²	51.3	23%	0.225	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	147.3	169.9	61.5	93.2	0	0	0	112.2	I535 G576 Y593	I535-N558 CarbonylContact O-C 3.5Å; I535-N558 WeakPolarHBondContact O-CA 3.49Å; N558-G576 PolarHBondContact O-N 2.92Å; N558-Y593 HydrophobicContact CB-CE2 4.22Å
559	L	97.4	Very high	90.3	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	131.2	173.7	-50.2	179.6	0	0	0	109.3	I497 V500 I501 N534 I535 L537 V575	I497-L559 HydrophobicContact CG1-CD1 4.39Å; I497-L559 HydrophobicContact CG2-CD1 4.33Å; V500-L559 HydrophobicContact CB-CD1 4Å; V500-L559 HydrophobicContact CG1-CB 4.39Å; V500-L559 HydrophobicContact CG1-CD1 3.88Å; V500-L559 HydrophobicContact CG1-CD2 3.96Å; V500-L559 HydrophobicContact CG1-CG 4.31Å; I501-L559 HydrophobicContact CG1-CD1 4.42Å; N534-L559 CarbonylContact C-O 3.48Å; N534-L559 WeakPolarHBondContact CA-O 3.43Å; N534-L559 PolarHBondContact OD1-O 2.8Å; I535-L559 HydrophobicContact CB-CB 4.31Å; I535-L559 PolarHBondContact N-O 2.9Å; I535-L559 PolarHBondContact O-N 2.85Å; L537-L559 HydrophobicContact CD1-CD1 3.73Å; L537-L559 HydrophobicContact CD1-CD2 4.32Å; L537-L559 HydrophobicContact CD1-CG 3.78Å; L537-L559 HydrophobicContact CG-CG 4.45Å; L559-V575 HydrophobicContact CD2-CB 4.37Å; L559-V575 HydrophobicContact CD2-CG1 3.81Å; L559-V575 HydrophobicContact CD2-CG2 4.16Å
560	Q	97.4	Very high	92	Very high	62 Å²	62	38 Å²	38	29%	0.29	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	124.3	175.6	-67.7	175.5	25.6	0	0	109.2	I533 N534 V573 G574	I533-Q560 WeakPolarHBondContact O-CA 3.33Å; N534-Q560 VanDerWaalsContact OD1-CG 3.3Å; N534-Q560 WeakPolarHBondContact OD1-CG 3.3Å; Q560-V573 HydrophobicContact CB-CB 4.34Å; Q560-V573 PolarHBondContact O-N 3.46Å; Q560-G574 PolarHBondContact N-O 2.79Å; Q560-G574 PolarHBondContact O-N 3.15Å
561	V	96.5	Very high	93.2	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	139.7	-173.5	-180	0	0	0	0	109.7	L496 V500 I533 C570 R571	L496-V561 HydrophobicContact CD1-CG1 4.05Å; L496-V561 HydrophobicContact CD1-CG2 4.31Å; L496-V561 HydrophobicContact CD2-CB 4.35Å; L496-V561 HydrophobicContact CD2-CG1 4.04Å; L496-V561 HydrophobicContact CD2-CG2 4.2Å; L496-V561 HydrophobicContact CG-CG2 4.43Å; V500-V561 HydrophobicContact CG2-CG2 4.08Å; I533-V561 HydrophobicContact CD1-CB 4.43Å; I533-V561 HydrophobicContact CG1-CB 3.99Å; I533-V561 PolarHBondContact N-O 2.95Å; I533-V561 PolarHBondContact O-N 3.19Å; V561-C570 HydrophobicContact CG1-CB 3.76Å; V561-R571 WeakPolarHBondContact CA-O 3.43Å; V561-R571 WeakPolarHBondContact CG1-O 3.3Å
562	S	96.7	Very high	93.8	Very high	21 Å²	21	32 Å²	32	15%	0.147	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	126.3	166.1	66.5	0	0	0	0	109.9	V531 M532 C570 R571	V531-S562 WeakPolarHBondContact O-CA 3.47Å; M532-S562 VanDerWaalsContact SD-CB 3.55Å; S562-C570 CarbonylContact O-C 3.5Å; S562-C570 WeakPolarHBondContact O-CA 3.47Å; S562-R571 PolarHBondContact N-O 3.13Å; S562-R571 PolarHBondContact O-N 2.99Å; S562-R571 PolarHBondContact OG-O 3.34Å
563	W	96.1	Very high	94.1	Very high	1 Å²	1	33.5 Å²	33.5	0%	0.004	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	122	176.9	177.7	42.2	0	0	0	110	L233 L240 A242 L489 L491 I530 V531 L565 G568 C570	L233-W563 HydrophobicContact CD2-CZ3 4.38Å; L240-W563 HydrophobicContact CB-CZ3 4.3Å; L240-W563 HydrophobicContact CD2-CE3 3.8Å; L240-W563 HydrophobicContact CD2-CZ3 3.61Å; L240-W563 HydrophobicContact CG-CE3 4.44Å; L240-W563 HydrophobicContact CG-CH2 4.46Å; L240-W563 HydrophobicContact CG-CZ3 3.77Å; L240-W563 WeakPolarHBondContact O-CH2 3.19Å; A242-W563 HydrophobicContact CB-CH2 3.79Å; A242-W563 HydrophobicContact CB-CZ3 4.15Å; L489-W563 HydrophobicContact CB-CZ2 4.44Å; L489-W563 HydrophobicContact CD2-CZ2 3.86Å; L489-W563 HydrophobicContact CG-CZ2 3.84Å; L489-W563 WeakPolarHBondContact O-CH2 3.3Å; L491-W563 HydrophobicContact CB-CD2 4.29Å; L491-W563 HydrophobicContact CB-CH2 4.11Å; L491-W563 HydrophobicContact CB-CZ2 3.68Å; L491-W563 HydrophobicContact CD2-CB 4.17Å; L491-W563 HydrophobicContact CD2-CD2 3.82Å; L491-W563 HydrophobicContact CD2-CE3 4.22Å; L491-W563 HydrophobicContact CD2-CG 3.83Å; I530-W563 CarbonylContact C-O 3.51Å; I530-W563 WeakPolarHBondContact CA-O 3.19Å; V531-W563 HydrophobicContact CB-CB 4.45Å; V531-W563 HydrophobicContact CB-CE3 4.09Å; V531-W563 HydrophobicContact CG1-CE3 4.44Å; V531-W563 HydrophobicContact CG2-CE3 4.17Å; V531-W563 PolarHBondContact N-O 2.85Å; V531-W563 PolarHBondContact O-N 3.47Å; W563-L565 HydrophobicContact CD2-CD2 3.77Å; W563-L565 HydrophobicContact CE3-CD2 3.55Å; W563-L565 HydrophobicContact CH2-CD2 3.73Å; W563-L565 HydrophobicContact CZ2-CD2 3.92Å; W563-L565 HydrophobicContact CZ3-CD2 3.52Å; W563-G568 PolarHBondContact NE1-O 3.42Å; W563-C570 VanDerWaalsContact CD1-SG 3.52Å
564	D	94.8	Very high	94.3	Very high	32 Å²	32	31.6 Å²	31.6	17%	0.171	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	111.6	178.6	172.1	16.6	0	0	0	110.7	N566 T567 G568 V569	D564-N566 PolarHBondContact O-N 3.13Å; D564-N566 VanDerWaalsContact OD1-CB 3.29Å; D564-N566 WeakPolarHBondContact OD1-CB 3.38Å; D564-N566 PolarHBondContact OD1-N 2.86Å; D564-N566 PolarHBondContact OD1-ND2 3.33Å; D564-T567 WeakPolarHBondContact CB-OG1 3.48Å; D564-T567 VanDerWaalsContact CG-OG1 3.24Å; D564-T567 PolarHBondContact O-N 3.27Å; D564-T567 WeakPolarHBondContact OD2-CB 3.45Å; D564-T567 VanDerWaalsContact OD2-CG2 3.25Å; D564-T567 WeakPolarHBondContact OD2-CG2 3.38Å; D564-T567 PolarHBondContact OD2-OG1 3.14Å; D564-G568 VanDerWaalsContact O-CA 3.31Å; D564-G568 WeakPolarHBondContact O-CA 3.29Å; D564-G568 PolarHBondContact O-N 2.74Å; D564-V569 PolarHBondContact N-O 3.43Å
565	L	94	Very high	94.5	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.01	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-11.2	-179.6	-52.7	173.6	0	0	0	113.3	K228 A242 L261 Y262 L489 N529 V531 W563	K228-L565 HydrophobicContact CD-CD1 4.05Å; A242-L565 HydrophobicContact CB-CD2 3.83Å; L261-L565 HydrophobicContact CD2-CB 4.05Å; L261-L565 HydrophobicContact CD2-CD1 4.21Å; Y262-L565 PolarHBondContact N-O 3.29Å; L489-L565 HydrophobicContact CD2-CB 4.36Å; L489-L565 HydrophobicContact CD2-CD2 4.14Å; N529-L565 HydrophobicContact CB-CB 4.15Å; N529-L565 WeakPolarHBondContact O-CB 3.18Å; N529-L565 WeakPolarHBondContact O-CG 3.42Å; N529-L565 PolarHBondContact O-N 3.48Å; V531-L565 HydrophobicContact CG2-CD1 3.9Å; V531-L565 HydrophobicContact CG2-CD2 4.07Å; V531-L565 HydrophobicContact CG2-CG 4Å; W563-L565 HydrophobicContact CD2-CD2 3.77Å; W563-L565 HydrophobicContact CE3-CD2 3.55Å; W563-L565 HydrophobicContact CH2-CD2 3.73Å; W563-L565 HydrophobicContact CZ2-CD2 3.92Å; W563-L565 HydrophobicContact CZ3-CD2 3.52Å
566	N	92.3	Very high	94.4	Very high	45 Å²	45	30.8 Å²	30.8	24%	0.241	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-33.9	173.9	-49.3	-69.1	0	0	0	112.1	Y262 T263 T528 N529 D564	Y262-N566 CarbonylContact C-O 3.54Å; Y262-N566 WeakPolarHBondContact CA-O 3.22Å; T263-N566 PolarHBondContact N-O 3.39Å; T528-N566 PolarHBondContact O-ND2 3.07Å; N529-N566 PolarHBondContact ND2-OD1 2.86Å; D564-N566 PolarHBondContact O-N 3.13Å; D564-N566 VanDerWaalsContact OD1-CB 3.29Å; D564-N566 WeakPolarHBondContact OD1-CB 3.38Å; D564-N566 PolarHBondContact OD1-N 2.86Å; D564-N566 PolarHBondContact OD1-ND2 3.33Å
567	T	89	Confident	94.4	Very high	13 Å²	13	36.2 Å²	36.2	8%	0.08	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.2	-12.3	-174.1	59.7	0	0	0	0	113.5	Y262 A266 A267 D564 V569	Y262-T567 VanDerWaalsContact CE2-O 3.31Å; Y262-T567 WeakPolarHBondContact CE2-O 3.22Å; A266-T567 HydrophobicContact CB-CG2 3.83Å; A267-T567 HydrophobicContact CB-CG2 4.32Å; D564-T567 WeakPolarHBondContact CB-OG1 3.48Å; D564-T567 VanDerWaalsContact CG-OG1 3.24Å; D564-T567 PolarHBondContact O-N 3.27Å; D564-T567 WeakPolarHBondContact OD2-CB 3.45Å; D564-T567 VanDerWaalsContact OD2-CG2 3.25Å; D564-T567 WeakPolarHBondContact OD2-CG2 3.38Å; D564-T567 PolarHBondContact OD2-OG1 3.14Å; T567-V569 PolarHBondContact O-N 3.43Å; T567-V569 PolarHBondContact OG1-N 2.92Å
568	G	88.1	Confident	94.3	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.21	C	C	.	.			trans	73	-11	-169.9	0	0	0	0	0	114.2	V428 W563 D564	V428-G568 WeakPolarHBondContact CG2-O 3.44Å; W563-G568 PolarHBondContact NE1-O 3.42Å; D564-G568 VanDerWaalsContact O-CA 3.31Å; D564-G568 WeakPolarHBondContact O-CA 3.29Å; D564-G568 PolarHBondContact O-N 2.74Å
569	V	88.9	Confident	94.1	Very high	36 Å²	36	39.7 Å²	39.7	22%	0.218	22%	0.221	C	C	.	.			trans	-70.4	134	-171.6	176.4	0	0	0	0	110.9	P425 D564 T567 R571	P425-V569 HydrophobicContact CG-CG2 4.44Å; D564-V569 PolarHBondContact N-O 3.43Å; T567-V569 PolarHBondContact O-N 3.43Å; T567-V569 PolarHBondContact OG1-N 2.92Å; V569-R571 HydrophobicContact CG1-CG 4.34Å
570	C	91.6	Very high	93.9	Very high	14 Å²	14	43.6 Å²	43.6	10%	0.095	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	147.4	166.4	-74.5	0	0	0	0	111.1	Y427 L491 L496 V561 S562 W563	Y427-C570 HydrophobicContact CE2-CB 4.35Å; Y427-C570 PolarHBondContact OH-N 3.12Å; L491-C570 WeakPolarHBondContact CD1-SG 3.16Å; L496-C570 HydrophobicContact CD1-CB 3.7Å; V561-C570 HydrophobicContact CG1-CB 3.76Å; S562-C570 CarbonylContact O-C 3.5Å; S562-C570 WeakPolarHBondContact O-CA 3.47Å; W563-C570 VanDerWaalsContact CD1-SG 3.52Å
571	R	92.9	Very high	93.6	Very high	144 Å²	144	41.9 Å²	41.9	54%	0.543	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	133.8	171.2	-59.2	-178.6	-177.9	173.5	1.3	110	V561 S562 V569	V561-R571 WeakPolarHBondContact CA-O 3.43Å; V561-R571 WeakPolarHBondContact CG1-O 3.3Å; S562-R571 PolarHBondContact N-O 3.13Å; S562-R571 PolarHBondContact O-N 2.99Å; S562-R571 PolarHBondContact OG-O 3.34Å; V569-R571 HydrophobicContact CG1-CG 4.34Å
572	T	95.8	Very high	93.1	Very high	45 Å²	45	48.9 Å²	48.9	28%	0.276	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	131.6	173.4	-51.5	0	0	0	0	110.2	V500 D504 V575	V500-T572 HydrophobicContact CG1-CG2 3.83Å; D504-T572 HydrophobicContact CB-CG2 3.92Å; D504-T572 WeakPolarHBondContact OD2-CB 3.09Å; D504-T572 PolarHBondContact OD2-OG1 3.16Å; T572-V575 HydrophobicContact CG2-CG2 3.86Å
573	V	96.1	Very high	92.4	Very high	80 Å²	80	52 Å²	52	49%	0.485	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	-30	177.7	179.7	0	0	0	0	110.9	M532 Q560	M532-V573 HydrophobicContact CE-CB 4.29Å; M532-V573 HydrophobicContact CE-CG1 4.12Å; M532-V573 HydrophobicContact CE-CG2 3.98Å; M532-V573 HydrophobicContact SD-CG2 4.44Å; Q560-V573 HydrophobicContact CB-CB 4.34Å; Q560-V573 PolarHBondContact O-N 3.46Å
574	G	94.7	Very high	92	Very high	25 Å²	25	57.3 Å²	57.3	26%	0.258	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.7	150	172.8	0	0	0	0	0	112.4	Q560	Q560-G574 PolarHBondContact N-O 2.79Å; Q560-G574 PolarHBondContact O-N 3.15Å
575	V	97.1	Very high	91.7	Very high	45 Å²	45	59.6 Å²	59.6	27%	0.273	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	131.9	174.6	178.3	0	0	0	0	108.2	V500 D504 A505 W507 L559 T572	V500-V575 HydrophobicContact CG1-CG2 3.95Å; D504-V575 HydrophobicContact CB-CG2 4.03Å; A505-V575 HydrophobicContact CB-CG1 3.92Å; W507-V575 HydrophobicContact CZ2-CG1 4.15Å; L559-V575 HydrophobicContact CD2-CB 4.37Å; L559-V575 HydrophobicContact CD2-CG1 3.81Å; L559-V575 HydrophobicContact CD2-CG2 4.16Å; T572-V575 HydrophobicContact CG2-CG2 3.86Å
576	G	94.8	Very high	91.3	Very high	13 Å²	13	62.1 Å²	62.1	13%	0.134	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-82.9	152.7	177.4	0	0	0	0	0	113.4	W507 S557 N558	W507-G576 PolarHBondContact NE1-O 2.88Å; S557-G576 PolarHBondContact OG-O 3.49Å; N558-G576 PolarHBondContact O-N 2.92Å
577	D	94.8	Very high	91.1	Very high	139 Å²	139	61 Å²	61	74%	0.743	36%	0.356	S	S	*	.	P	Polyproline II helix	trans	-65.9	157.3	171	-59.5	-52.6	0	0	0	112	S557	S557-D577 PolarHBondContact OG-O 2.87Å
578	L	94.3	Very high	91.2	Very high	41 Å²	41	62.1 Å²	62.1	22%	0.215	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-75.5	125.2	174.7	-64.1	-175.3	0	0	0	111.2	W507 L539 A541 Y555	W507-L578 HydrophobicContact CB-CD1 3.86Å; W507-L578 HydrophobicContact CB-CG 4.11Å; W507-L578 HydrophobicContact CD2-CD1 4.14Å; W507-L578 HydrophobicContact CD2-CD2 3.62Å; W507-L578 HydrophobicContact CD2-CG 3.85Å; W507-L578 HydrophobicContact CE3-CD1 4.39Å; W507-L578 HydrophobicContact CE3-CD2 3.97Å; W507-L578 HydrophobicContact CE3-CG 4.45Å; W507-L578 HydrophobicContact CG-CD1 3.92Å; W507-L578 HydrophobicContact CG-CD2 4.02Å; W507-L578 HydrophobicContact CG-CG 3.68Å; W507-L578 HydrophobicContact CH2-CD2 4.32Å; W507-L578 HydrophobicContact CZ2-CD2 3.99Å; W507-L578 HydrophobicContact CZ3-CD2 4.31Å; L539-L578 HydrophobicContact CD1-CD2 3.93Å; L539-L578 HydrophobicContact CD2-CD2 4.15Å; L539-L578 HydrophobicContact CG-CD2 4.44Å; A541-L578 HydrophobicContact CB-CD1 3.86Å; Y555-L578 HydrophobicContact CD1-CB 3.73Å; Y555-L578 HydrophobicContact CE1-CB 4.41Å; Y555-L578 HydrophobicContact CG-CB 4.08Å; Y555-L578 HydrophobicContact CG-CD1 4.4Å
579	T	93.8	Very high	91.5	Very high	75 Å²	75	62.4 Å²	62.4	46%	0.46	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	117.7	175.7	55.7	0	0	0	0	110.7	Y555 H556	Y555-T579 CarbonylContact C-O 3.58Å; Y555-T579 VanDerWaalsContact CA-O 3.29Å; Y555-T579 WeakPolarHBondContact CA-O 3.26Å; H556-T579 PolarHBondContact N-O 3.17Å; H556-T579 PolarHBondContact ND1-OG1 2.83Å; H556-T579 PolarHBondContact O-N 2.72Å; H556-T579 PolarHBondContact O-OG1 2.84Å
580	E	92.3	Very high	91.7	Very high	82 Å²	82	61 Å²	61	38%	0.383	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	129.2	-171.7	-160.7	-170.4	151.9	0	0	112.4	Y555 K582	Y555-E580 HydrophobicContact CD1-CB 3.9Å; Y555-E580 HydrophobicContact CD1-CG 4.26Å; Y555-E580 HydrophobicContact CE1-CB 3.67Å; Y555-E580 HydrophobicContact CE1-CG 3.8Å; E580-K582 HydrophobicContact CG-CG 4.4Å; E580-K582 PolarHBondContact O-N 3.5Å; E580-K582 WeakPolarHBondContact OE1-CE 3.4Å; E580-K582 IonicContact OE1-NZ 2.71Å; E580-K582 PolarHBondContact OE1-NZ 2.89Å; E580-K582 WeakPolarHBondContact OE2-CE 3.15Å; E580-K582 IonicContact OE2-NZ 3.35Å; E580-K582 PolarHBondContact OE2-NZ 2.81Å
581	V	91.9	Very high	91.8	Very high	26 Å²	26	61.9 Å²	61.9	16%	0.158	36%	0.363	C	S	.	.			trans	-90.6	84.8	-172.6	-175.4	0	0	0	0	110.5	L538 T554 H556 G583 Q584 V589	L538-V581 HydrophobicContact CD1-CG2 3.94Å; T554-V581 HydrophobicContact CG2-CB 4.26Å; T554-V581 HydrophobicContact CG2-CG2 4.34Å; T554-V581 PolarHBondContact O-N 2.91Å; H556-V581 HydrophobicContact CB-CG2 3.89Å; V581-G583 PolarHBondContact O-N 3.23Å; V581-Q584 HydrophobicContact CG1-CB 3.94Å; V581-V589 HydrophobicContact CG1-CG2 3.87Å
582	K	85.9	Confident	91.8	Very high	148 Å²	148	58.9 Å²	58.9	64%	0.643	36%	0.364	S	S	*	.			trans	-86.4	92.7	-176.3	-67.5	-174.7	178.8	172.8	0	112.8	E580 Q584	E580-K582 HydrophobicContact CG-CG 4.4Å; E580-K582 PolarHBondContact O-N 3.5Å; E580-K582 WeakPolarHBondContact OE1-CE 3.4Å; E580-K582 IonicContact OE1-NZ 2.71Å; E580-K582 PolarHBondContact OE1-NZ 2.89Å; E580-K582 WeakPolarHBondContact OE2-CE 3.15Å; E580-K582 IonicContact OE2-NZ 3.35Å; E580-K582 PolarHBondContact OE2-NZ 2.81Å; K582-Q584 PolarHBondContact O-N 2.8Å; K582-Q584 VanDerWaalsContact O-N 3.12Å
583	G	80.6	Confident	91.8	Very high	87 Å²	87	57 Å²	57	90%	0.897	35%	0.352	S	S	*	.	S	Bend	trans	66.3	12.8	173	0	0	0	0	0	115	V581	V581-G583 PolarHBondContact O-N 3.23Å
584	Q	87.9	Confident	91.8	Very high	112 Å²	112	55.2 Å²	55.2	52%	0.523	34%	0.337	S	S	.	.			trans	-78.2	141.5	173.9	-68.3	172.8	-39.6	0	0	109.9	V581 K582 V589	V581-Q584 HydrophobicContact CG1-CB 3.94Å; K582-Q584 PolarHBondContact O-N 2.8Å; K582-Q584 VanDerWaalsContact O-N 3.12Å; Q584-V589 HydrophobicContact CB-CG2 4.06Å
585	T	88.8	Confident	91.7	Very high	80 Å²	80	59.2 Å²	59.2	49%	0.491	35%	0.347	S	S	.	.			trans	-76.6	147.9	171.1	60.5	0	0	0	0	110.2	G587 S588 V589	T585-G587 PolarHBondContact O-N 3.42Å; T585-G587 VanDerWaalsContact O-N 3.17Å; T585-S588 PolarHBondContact N-OG 2.81Å; T585-S588 WeakPolarHBondContact O-CA 3.43Å; T585-S588 WeakPolarHBondContact O-CB 3.41Å; T585-S588 PolarHBondContact O-N 2.73Å; T585-S588 PolarHBondContact O-OG 2.7Å; T585-S588 PolarHBondContact OG1-N 2.9Å; T585-S588 PolarHBondContact OG1-OG 2.86Å; T585-V589 PolarHBondContact O-N 2.91Å; T585-V589 VanDerWaalsContact O-N 3.16Å
586	S	86.1	Confident	91.6	Very high	54 Å²	54	60 Å²	60	38%	0.378	36%	0.355	S	S	.	.	H	α-helix	trans	-53	-40.6	179.5	-41.4	0	0	0	0	112.1	S588 V589 W590	S586-S588 VanDerWaalsContact C-N 3.29Å; S586-S588 PolarHBondContact O-N 2.94Å; S586-V589 WeakPolarHBondContact O-CB 3.3Å; S586-V589 PolarHBondContact O-N 2.84Å; S586-V589 VanDerWaalsContact O-N 3.12Å; S586-W590 VanDerWaalsContact O-CD1 3.23Å; S586-W590 PolarHBondContact O-N 3.4Å
587	G	88.6	Confident	91.6	Very high	22 Å²	22	59.5 Å²	59.5	23%	0.227	35%	0.349	C	S	.	.	H	α-helix	trans	-61.6	-30.9	174.8	0	0	0	0	0	114.8	Y215 T585 S591	Y215-G587 WeakPolarHBondContact OH-CA 3.42Å; Y215-G587 PolarHBondContact OH-N 2.81Å; T585-G587 PolarHBondContact O-N 3.42Å; T585-G587 VanDerWaalsContact O-N 3.17Å; G587-S591 WeakPolarHBondContact O-CB 3.5Å; G587-S591 PolarHBondContact O-N 3.02Å
588	S	90.8	Very high	91.6	Very high	37 Å²	37	53.1 Å²	53.1	26%	0.259	32%	0.316	S	S	.	.	H	α-helix	trans	-74.4	-35.8	173.3	73.2	0	0	0	0	112.5	T585 S586 S592	T585-S588 PolarHBondContact N-OG 2.81Å; T585-S588 WeakPolarHBondContact O-CA 3.43Å; T585-S588 WeakPolarHBondContact O-CB 3.41Å; T585-S588 PolarHBondContact O-N 2.73Å; T585-S588 PolarHBondContact O-OG 2.7Å; T585-S588 PolarHBondContact OG1-N 2.9Å; T585-S588 PolarHBondContact OG1-OG 2.86Å; S586-S588 VanDerWaalsContact C-N 3.29Å; S586-S588 PolarHBondContact O-N 2.94Å; S588-S592 WeakPolarHBondContact O-CB 3.47Å; S588-S592 PolarHBondContact O-N 2.84Å
589	V	93.5	Very high	91.5	Very high	6 Å²	6	55.3 Å²	55.3	4%	0.036	33%	0.327	C	S	.	.	H	α-helix	trans	-63.2	-53.7	172.5	179.4	0	0	0	0	109.7	H556 V581 Q584 T585 S586 S591 S592 Y593	H556-V589 HydrophobicContact CB-CG1 3.93Å; H556-V589 VanDerWaalsContact CD2-CG1 3.42Å; H556-V589 WeakPolarHBondContact CD2-CG1 3.22Å; V581-V589 HydrophobicContact CG1-CG2 3.87Å; Q584-V589 HydrophobicContact CB-CG2 4.06Å; T585-V589 PolarHBondContact O-N 2.91Å; T585-V589 VanDerWaalsContact O-N 3.16Å; S586-V589 WeakPolarHBondContact O-CB 3.3Å; S586-V589 PolarHBondContact O-N 2.84Å; S586-V589 VanDerWaalsContact O-N 3.12Å; V589-S591 PolarHBondContact O-N 2.87Å; V589-S592 WeakPolarHBondContact O-CB 3.3Å; V589-S592 PolarHBondContact O-N 2.9Å; V589-S592 VanDerWaalsContact O-N 3.11Å; V589-Y593 WeakPolarHBondContact O-CB 3.35Å; V589-Y593 PolarHBondContact O-N 3.29Å
590	W	94.6	Very high	91.5	Very high	5 Å²	5	53.8 Å²	53.8	2%	0.019	32%	0.318	C	S	.	.	H	α-helix	trans	-61.9	-37.6	178.5	-61.5	139.8	0	0	0	113.3	Y215 P216 D516 D518 L538 S586 Y593 R594	Y215-W590 AromaticContact CE1-CD1 3.95Å; P216-W590 HydrophobicContact CB-CG 4.05Å; P216-W590 HydrophobicContact CG-CD2 4.28Å; P216-W590 HydrophobicContact CG-CG 4.33Å; P216-W590 HydrophobicContact CG-CZ2 4.5Å; D516-W590 HydrophobicContact CB-CZ2 3.88Å; D516-W590 WeakPolarHBondContact OD2-CZ2 3.11Å; D516-W590 PolarHBondContact OD2-NE1 3.2Å; D518-W590 HydrophobicContact CB-CD2 4.16Å; D518-W590 HydrophobicContact CB-CE3 3.65Å; D518-W590 HydrophobicContact CB-CH2 4.46Å; D518-W590 HydrophobicContact CB-CZ3 3.83Å; L538-W590 HydrophobicContact CB-CH2 3.96Å; L538-W590 HydrophobicContact CB-CZ2 3.87Å; S586-W590 VanDerWaalsContact O-CD1 3.23Å; S586-W590 PolarHBondContact O-N 3.4Å; W590-Y593 HydrophobicContact CE3-CD1 4.26Å; W590-Y593 HydrophobicContact CE3-CG 4.45Å; W590-Y593 PolarHBondContact O-N 3.03Å; W590-R594 WeakPolarHBondContact O-CB 3.38Å; W590-R594 VanDerWaalsContact O-CG 3.27Å; W590-R594 WeakPolarHBondContact O-CG 3.39Å; W590-R594 PolarHBondContact O-N 3.31Å
591	S	92.3	Very high	91.5	Very high	33 Å²	33	50.6 Å²	50.6	23%	0.231	30%	0.304	C	S	.	.	H	α-helix	trans	-63.7	-40.9	172.9	-176.7	0	0	0	0	112.5	A327 G587 V589 K595	A327-S591 PolarHBondContact O-OG 2.76Å; G587-S591 WeakPolarHBondContact O-CB 3.5Å; G587-S591 PolarHBondContact O-N 3.02Å; V589-S591 PolarHBondContact O-N 2.87Å; S591-K595 VanDerWaalsContact O-CB 3.3Å; S591-K595 WeakPolarHBondContact O-CB 3.49Å; S591-K595 PolarHBondContact O-N 3.45Å; S591-K595 VanDerWaalsContact O-N 3.08Å
592	S	94.1	Very high	91.4	Very high	81 Å²	81	52.3 Å²	52.3	57%	0.566	31%	0.311	S	S	*	.	H	α-helix	trans	-67.2	-44.9	176.1	-167.7	0	0	0	0	112	S588 V589 K595 S596	S588-S592 WeakPolarHBondContact O-CB 3.47Å; S588-S592 PolarHBondContact O-N 2.84Å; V589-S592 WeakPolarHBondContact O-CB 3.3Å; V589-S592 PolarHBondContact O-N 2.9Å; V589-S592 VanDerWaalsContact O-N 3.11Å; S592-K595 WeakPolarHBondContact O-CB 3.49Å; S592-K595 PolarHBondContact O-N 3.3Å; S592-S596 PolarHBondContact O-N 2.95Å
593	Y	95.6	Very high	91.8	Very high	5 Å²	5	52.8 Å²	52.8	2%	0.02	31%	0.313	C	S	.	.	H	α-helix	trans	-57.5	-54.1	174.8	166.6	-99.8	0	0	0	111.7	D518 V520 N534 G536 H556 N558 V589 W590 K595 S596 C597	D518-Y593 HydrophobicContact CB-CD1 4.19Å; D518-Y593 HydrophobicContact CB-CE1 3.99Å; D518-Y593 WeakPolarHBondContact O-CE1 3.28Å; D518-Y593 PolarHBondContact O-OH 2.86Å; D518-Y593 WeakPolarHBondContact OD2-CD1 3.16Å; D518-Y593 WeakPolarHBondContact OD2-CE1 3.47Å; V520-Y593 HydrophobicContact CG2-CE1 3.8Å; N534-Y593 VanDerWaalsContact C-OH 3.23Å; N534-Y593 WeakPolarHBondContact ND2-CE2 3.4Å; N534-Y593 PolarHBondContact ND2-OH 2.94Å; N534-Y593 PolarHBondContact O-OH 3.44Å; G536-Y593 VanDerWaalsContact N-CE2 3.34Å; G536-Y593 PolarHBondContact N-OH 3.25Å; H556-Y593 AromaticContact NE2-CD2 3.79Å; N558-Y593 HydrophobicContact CB-CE2 4.22Å; V589-Y593 WeakPolarHBondContact O-CB 3.35Å; V589-Y593 PolarHBondContact O-N 3.29Å; W590-Y593 HydrophobicContact CE3-CD1 4.26Å; W590-Y593 HydrophobicContact CE3-CG 4.45Å; W590-Y593 PolarHBondContact O-N 3.03Å; Y593-K595 VanDerWaalsContact C-N 3.27Å; Y593-K595 PolarHBondContact O-N 2.84Å; Y593-S596 WeakPolarHBondContact O-CA 3.42Å; Y593-S596 WeakPolarHBondContact O-CB 3.4Å; Y593-S596 PolarHBondContact O-N 2.82Å; Y593-C597 PolarHBondContact O-N 3.05Å; Y593-C597 PolarHBondContact O-SG 3.48Å
594	R	94.9	Very high	92.3	Very high	43 Å²	43	57.3 Å²	57.3	16%	0.162	30%	0.303	C	S	.	.	H	α-helix	trans	-58.4	-38.4	177.9	-71.8	172.1	-178.7	-161.2	-7.7	112.1	P216 F217 T219 L323 D518 W590 S596 C597 V598	P216-R594 PolarHBondContact O-NH2 3.07Å; F217-R594 PolarHBondContact O-NH1 2.73Å; F217-R594 PolarHBondContact O-NH2 2.78Å; T219-R594 HydrophobicContact CG2-CG 4.21Å; L323-R594 HydrophobicContact CD1-CB 4.48Å; D518-R594 IonicContact OD1-CZ 3.74Å; D518-R594 IonicContact OD1-NE 2.81Å; D518-R594 IonicContact OD1-NH2 3.83Å; D518-R594 PolarHBondContact OD1-NH2 3.37Å; D518-R594 WeakPolarHBondContact OD2-CG 3.22Å; D518-R594 IonicContact OD2-CZ 2.75Å; D518-R594 IonicContact OD2-NE 3.43Å; D518-R594 PolarHBondContact OD2-NE 2.94Å; D518-R594 IonicContact OD2-NH2 3.16Å; D518-R594 PolarHBondContact OD2-NH2 2.85Å; W590-R594 WeakPolarHBondContact O-CB 3.38Å; W590-R594 VanDerWaalsContact O-CG 3.27Å; W590-R594 WeakPolarHBondContact O-CG 3.39Å; W590-R594 PolarHBondContact O-N 3.31Å; R594-S596 VanDerWaalsContact C-N 3.35Å; R594-C597 PolarHBondContact O-N 2.83Å; R594-V598 WeakPolarHBondContact O-CG2 3.38Å; R594-V598 PolarHBondContact O-N 2.91Å
595	K	94.1	Very high	92.4	Very high	109 Å²	109	54.9 Å²	54.9	47%	0.474	29%	0.294	S	S	.	.	H	α-helix	trans	-63.4	-37.2	173.3	174.3	170.5	-177.9	-179.8	0	112.6	F324 S591 S592 Y593 N599	F324-K595 HydrophobicContact CE1-CB 4.36Å; F324-K595 HydrophobicContact CE1-CD 3.82Å; F324-K595 HydrophobicContact CE1-CG 3.68Å; F324-K595 HydrophobicContact CZ-CG 4.11Å; S591-K595 VanDerWaalsContact O-CB 3.3Å; S591-K595 WeakPolarHBondContact O-CB 3.49Å; S591-K595 PolarHBondContact O-N 3.45Å; S591-K595 VanDerWaalsContact O-N 3.08Å; S592-K595 WeakPolarHBondContact O-CB 3.49Å; S592-K595 PolarHBondContact O-N 3.3Å; Y593-K595 VanDerWaalsContact C-N 3.27Å; Y593-K595 PolarHBondContact O-N 2.84Å; K595-N599 PolarHBondContact O-N 3.07Å; K595-N599 PolarHBondContact O-ND2 3.15Å
596	S	94.6	Very high	92.3	Very high	63 Å²	63	56.4 Å²	56.4	44%	0.441	30%	0.302	S	S	.	.	H	α-helix	trans	-63.1	-47.1	172.2	-163.3	0	0	0	0	111.4	S592 Y593 R594 V598 N599 T600	S592-S596 PolarHBondContact O-N 2.95Å; Y593-S596 WeakPolarHBondContact O-CA 3.42Å; Y593-S596 WeakPolarHBondContact O-CB 3.4Å; Y593-S596 PolarHBondContact O-N 2.82Å; R594-S596 VanDerWaalsContact C-N 3.35Å; S596-V598 PolarHBondContact O-N 3.33Å; S596-N599 WeakPolarHBondContact O-CB 3.39Å; S596-N599 PolarHBondContact O-N 3.19Å; S596-N599 VanDerWaalsContact O-N 3.09Å; S596-T600 PolarHBondContact O-N 2.77Å; S596-T600 PolarHBondContact O-OG1 3.27Å
597	C	95.1	Very high	92.3	Very high	2 Å²	2	56.7 Å²	56.7	1%	0.014	30%	0.303	C	S	.	.	H	α-helix	trans	-57.5	-44.8	175.8	-61.2	0	0	0	0	112.2	V520 L522 N534 Y593 R594 N599 T600 V601	V520-C597 HydrophobicContact CB-CB 4.3Å; V520-C597 HydrophobicContact CG1-CB 3.84Å; L522-C597 HydrophobicContact CD2-CB 4.1Å; N534-C597 PolarHBondContact ND2-SG 3.05Å; Y593-C597 PolarHBondContact O-N 3.05Å; Y593-C597 PolarHBondContact O-SG 3.48Å; R594-C597 PolarHBondContact O-N 2.83Å; C597-N599 PolarHBondContact O-N 3.4Å; C597-T600 PolarHBondContact O-N 2.92Å; C597-V601 WeakPolarHBondContact O-CG2 3.12Å; C597-V601 PolarHBondContact O-N 2.57Å
598	V	93.3	Very high	91.9	Very high	5 Å²	5	59.2 Å²	59.2	3%	0.03	31%	0.309	C	S	.	.	H	α-helix	trans	-58.7	-46.3	173.6	172.8	0	0	0	0	111.5	A320 L323 F324 R594 S596 T600 V601 M602	A320-V598 HydrophobicContact CB-CG1 3.66Å; L323-V598 HydrophobicContact CB-CG2 4.04Å; L323-V598 HydrophobicContact CD2-CG2 3.37Å; L323-V598 HydrophobicContact CG-CG2 3.65Å; F324-V598 HydrophobicContact CD2-CG1 4.2Å; F324-V598 HydrophobicContact CE2-CB 4.46Å; F324-V598 HydrophobicContact CE2-CG1 3.58Å; F324-V598 HydrophobicContact CZ-CG1 4.16Å; R594-V598 WeakPolarHBondContact O-CG2 3.38Å; R594-V598 PolarHBondContact O-N 2.91Å; S596-V598 PolarHBondContact O-N 3.33Å; V598-T600 VanDerWaalsContact C-N 3.3Å; V598-T600 PolarHBondContact O-N 3.35Å; V598-V601 PolarHBondContact O-N 3.38Å; V598-M602 HydrophobicContact CG1-CG 3.97Å; V598-M602 VanDerWaalsContact O-CB 3.27Å; V598-M602 WeakPolarHBondContact O-CB 3.36Å; V598-M602 WeakPolarHBondContact O-CG 3.44Å; V598-M602 PolarHBondContact O-N 2.95Å
599	N	92.8	Very high	91.4	Very high	87 Å²	87	59.5 Å²	59.5	47%	0.465	31%	0.311	S	S	.	.	H	α-helix	trans	-61.3	-40.1	179.3	-68.9	-25.7	0	0	0	111.7	K595 S596 C597 K603	K595-N599 PolarHBondContact O-N 3.07Å; K595-N599 PolarHBondContact O-ND2 3.15Å; S596-N599 WeakPolarHBondContact O-CB 3.39Å; S596-N599 PolarHBondContact O-N 3.19Å; S596-N599 VanDerWaalsContact O-N 3.09Å; C597-N599 PolarHBondContact O-N 3.4Å; N599-K603 VanDerWaalsContact O-CB 3.22Å; N599-K603 WeakPolarHBondContact O-CB 3.43Å; N599-K603 PolarHBondContact O-N 2.92Å
600	T	93.1	Very high	90.4	Very high	43 Å²	43	60.7 Å²	60.7	26%	0.264	32%	0.32	S	S	.	.	H	α-helix	trans	-62.2	-54.2	174.4	-63.8	0	0	0	0	111.2	L522 S596 C597 V598 M602 K603 W604	L522-T600 HydrophobicContact CD1-CG2 4.31Å; S596-T600 PolarHBondContact O-N 2.77Å; S596-T600 PolarHBondContact O-OG1 3.27Å; C597-T600 PolarHBondContact O-N 2.92Å; V598-T600 VanDerWaalsContact C-N 3.3Å; V598-T600 PolarHBondContact O-N 3.35Å; T600-M602 VanDerWaalsContact C-N 3.28Å; T600-M602 PolarHBondContact O-N 3.47Å; T600-K603 WeakPolarHBondContact O-CB 3.21Å; T600-K603 PolarHBondContact O-N 3.13Å; T600-K603 VanDerWaalsContact O-N 3.15Å; T600-W604 PolarHBondContact O-N 2.83Å; T600-W604 VanDerWaalsContact O-N 3.16Å
601	V	93.1	Very high	89.5	Confident	15 Å²	15	64 Å²	64	9%	0.091	34%	0.343	C	S	.	.	H	α-helix	trans	-53.9	-46.3	177	169.2	0	0	0	0	111.2	F224 L522 C597 V598 K603 W604 L605	F224-V601 HydrophobicContact CE2-CG1 4.17Å; F224-V601 HydrophobicContact CE2-CG2 4.41Å; F224-V601 HydrophobicContact CZ-CG1 3.74Å; F224-V601 HydrophobicContact CZ-CG2 4.32Å; L522-V601 HydrophobicContact CD2-CG2 4.2Å; C597-V601 WeakPolarHBondContact O-CG2 3.12Å; C597-V601 PolarHBondContact O-N 2.57Å; V598-V601 PolarHBondContact O-N 3.38Å; V601-K603 PolarHBondContact O-N 2.96Å; V601-W604 PolarHBondContact O-N 3.24Å; V601-L605 WeakPolarHBondContact O-CB 3.5Å; V601-L605 PolarHBondContact O-N 2.9Å
602	M	90.7	Very high	89	Confident	62 Å²	62	68 Å²	68	31%	0.305	35%	0.354	S	S	.	.	H	α-helix	trans	-72.3	-26.8	-177.1	-66.5	-67.6	-83.1	0	0	113.6	R317 A320 V598 T600 L605	R317-M602 HydrophobicContact CB-CE 4.35Å; R317-M602 HydrophobicContact CG-CE 3.57Å; A320-M602 HydrophobicContact CB-CE 3.81Å; A320-M602 HydrophobicContact CB-CG 4Å; A320-M602 HydrophobicContact CB-SD 3.76Å; V598-M602 HydrophobicContact CG1-CG 3.97Å; V598-M602 VanDerWaalsContact O-CB 3.27Å; V598-M602 WeakPolarHBondContact O-CB 3.36Å; V598-M602 WeakPolarHBondContact O-CG 3.44Å; V598-M602 PolarHBondContact O-N 2.95Å; T600-M602 VanDerWaalsContact C-N 3.28Å; T600-M602 PolarHBondContact O-N 3.47Å; M602-L605 HydrophobicContact SD-CD2 4.27Å
603	K	93.5	Very high	88.7	Confident	158 Å²	158	66.2 Å²	66.2	69%	0.687	34%	0.335	S	S	*	.	H	α-helix	trans	-70	-37.2	173.2	177.7	-177.3	174.9	-174.7	0	111.9	N599 T600 V601	N599-K603 VanDerWaalsContact O-CB 3.22Å; N599-K603 WeakPolarHBondContact O-CB 3.43Å; N599-K603 PolarHBondContact O-N 2.92Å; T600-K603 WeakPolarHBondContact O-CB 3.21Å; T600-K603 PolarHBondContact O-N 3.13Å; T600-K603 VanDerWaalsContact O-N 3.15Å; V601-K603 PolarHBondContact O-N 2.96Å
604	W	90.8	Very high	88.5	Confident	181 Å²	181	66.9 Å²	66.9	69%	0.686	34%	0.339	S	S	*	.	H	α-helix	trans	-99.7	1.4	-176.2	-60.2	112.3	0	0	0	114.2	T600 V601 V606	T600-W604 PolarHBondContact O-N 2.83Å; T600-W604 VanDerWaalsContact O-N 3.16Å; V601-W604 PolarHBondContact O-N 3.24Å; W604-V606 PolarHBondContact O-N 2.81Å
605	L	90.4	Very high	88.4	Confident	61 Å²	61	65.2 Å²	65.2	32%	0.319	33%	0.333	S	S	.	.			trans	-62.9	113.3	-175.4	-177.9	70.9	0	0	0	113.3	A313 A316 V601 M602	A313-L605 HydrophobicContact CB-CD2 4.32Å; A316-L605 HydrophobicContact CB-CD1 3.91Å; A316-L605 HydrophobicContact CB-CD2 3.49Å; A316-L605 VanDerWaalsContact CB-CD2 3.49Å; A316-L605 HydrophobicContact CB-CG 4.37Å; V601-L605 WeakPolarHBondContact O-CB 3.5Å; V601-L605 PolarHBondContact O-N 2.9Å; M602-L605 HydrophobicContact SD-CD2 4.27Å
606	V	87.6	Confident	88.5	Confident	112 Å²	112	63.2 Å²	63.2	68%	0.679	32%	0.322	S	S	*	.			trans	-96.4	129.4	172.6	-177.4	0	0	0	0	110.8	W604 E608	W604-V606 PolarHBondContact O-N 2.81Å; V606-E608 PolarHBondContact O-N 3.27Å; V606-E608 VanDerWaalsContact O-N 3.12Å
607	P	84.3	Confident	88.4	Confident	60 Å²	60	60.5 Å²	60.5	39%	0.39	30%	0.303	S	S	.	.			trans	-60.5	107.8	174.3	-31.7	40.1	0	0	0	115.4	S310	S310-P607 WeakPolarHBondContact OG-CB 3.21Å
608	E	80.5	Confident	88.2	Confident	76 Å²	76	61.3 Å²	61.3	36%	0.355	31%	0.307	S	S	.	.			trans	-71.2	168.9	175.5	-63.7	178.3	176.7	0	0	113.9	K227 A312 V606	K227-E608 VanDerWaalsContact CE-OE1 3.25Å; K227-E608 WeakPolarHBondContact CE-OE1 3.39Å; K227-E608 IonicContact NZ-OE1 2.81Å; K227-E608 PolarHBondContact NZ-OE1 3.23Å; A312-E608 HydrophobicContact CB-CB 4.33Å; V606-E608 PolarHBondContact O-N 3.27Å; V606-E608 VanDerWaalsContact O-N 3.12Å
609	S	80.1	Confident	87.7	Confident	42 Å²	42	61.3 Å²	61.3	29%	0.294	31%	0.307	S	S	.	.			trans	-69.5	155.6	174.5	73.1	0	0	0	0	111.5	S611 R612	S609-S611 PolarHBondContact O-N 3.25Å; S609-S611 PolarHBondContact OG-N 2.92Å; S609-S611 PolarHBondContact OG-OG 3.41Å; S609-R612 PolarHBondContact O-N 3.43Å; S609-R612 PolarHBondContact OG-N 3.01Å
610	S	73.5	Confident	86.8	Confident	32 Å²	32	58.9 Å²	58.9	22%	0.224	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74	1.7	171.3	46.9	0	0	0	0	113.5	Y613	S610-Y613 WeakPolarHBondContact O-CD1 3.43Å; S610-Y613 WeakPolarHBondContact O-CE1 3.45Å
611	S	74.7	Confident	85.6	Confident	74 Å²	74	57.8 Å²	57.8	52%	0.517	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-34.2	169.6	54.1	0	0	0	0	112.8	P135 S609	P135-S611 VanDerWaalsContact O-O 3.13Å; S609-S611 PolarHBondContact O-N 3.25Å; S609-S611 PolarHBondContact OG-N 2.92Å; S609-S611 PolarHBondContact OG-OG 3.41Å
612	R	82.8	Confident	84.6	Confident	118 Å²	118	60 Å²	60	45%	0.445	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-7.3	-170.4	-70.5	-178.5	172.7	-155.5	-2.7	115.4	P135 E527 S609	P135-R612 VanDerWaalsContact CB-O 3.3Å; P135-R612 WeakPolarHBondContact CB-O 3.38Å; E527-R612 IonicContact OE1-CZ 3.62Å; E527-R612 IonicContact OE1-NH1 3.19Å; E527-R612 PolarHBondContact OE1-NH1 3.41Å; E527-R612 IonicContact OE1-NH2 3.69Å; S609-R612 PolarHBondContact O-N 3.43Å; S609-R612 PolarHBondContact OG-N 3.01Å
613	Y	87.1	Confident	83.5	Confident	42 Å²	42	59.8 Å²	59.8	17%	0.165	30%	0.298	C	S	.	.	S	Bend	trans	-58.7	142.6	178.8	76.9	-81.5	0	0	0	111.7	K73 S610 N615	K73-Y613 WeakPolarHBondContact CE-O 3.49Å; K73-Y613 PolarHBondContact NZ-O 3.38Å; S610-Y613 WeakPolarHBondContact O-CD1 3.43Å; S610-Y613 WeakPolarHBondContact O-CE1 3.45Å; Y613-N615 HydrophobicContact CD2-CB 4.38Å; Y613-N615 HydrophobicContact CE2-CB 3.71Å
614	I	92	Very high	82.3	Confident	20 Å²	20	59.3 Å²	59.3	10%	0.103	30%	0.295	C	S	.	.			trans	-76	124.9	169.2	-68.8	141.7	0	0	0	108.5	P135 A223 L226 K227 R616	P135-I614 HydrophobicContact CG-CG1 3.98Å; A223-I614 WeakPolarHBondContact O-CD1 3.13Å; L226-I614 HydrophobicContact CB-CD1 4.15Å; L226-I614 HydrophobicContact CB-CG1 4.23Å; L226-I614 HydrophobicContact CB-CG2 4.35Å; L226-I614 HydrophobicContact CD1-CG2 4.26Å; K227-I614 HydrophobicContact CB-CD1 4.27Å; I614-R616 PolarHBondContact O-N 3.03Å
615	N	93.6	Very high	81.5	Confident	8 Å²	8	54.5 Å²	54.5	4%	0.043	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	110.7	177.6	-171.1	31	0	0	0	108.9	F71 K73 C132 E133 R315 Y613	F71-N615 PolarHBondContact O-ND2 3.12Å; K73-N615 HydrophobicContact CD-CB 4.38Å; K73-N615 HydrophobicContact CG-CB 3.78Å; C132-N615 CarbonylContact C-O 3.54Å; C132-N615 VanDerWaalsContact CA-O 3.27Å; C132-N615 WeakPolarHBondContact CA-O 3.15Å; E133-N615 HydrophobicContact CB-CB 4.18Å; E133-N615 PolarHBondContact N-O 3.02Å; E133-N615 PolarHBondContact O-N 2.87Å; E133-N615 WeakPolarHBondContact OE2-CB 3.41Å; E133-N615 PolarHBondContact OE2-ND2 3.45Å; R315-N615 PolarHBondContact NH2-OD1 2.99Å; Y613-N615 HydrophobicContact CD2-CB 4.38Å; Y613-N615 HydrophobicContact CE2-CB 3.71Å
616	R	94.3	Very high	80.9	Confident	66 Å²	66	54.7 Å²	54.7	25%	0.249	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.9	173.5	-173.8	-169.8	176.9	-124.1	-4.7	109.4	T130 R315 I614 T618 E620	T130-R616 HydrophobicContact CG2-CG 3.46Å; T130-R616 VanDerWaalsContact CG2-CG 3.46Å; T130-R616 PolarHBondContact OG1-NH2 2.83Å; R315-R616 PolarHBondContact NH1-O 3Å; I614-R616 PolarHBondContact O-N 3.03Å; R616-T618 VanDerWaalsContact CZ-CG2 3.5Å; R616-E620 IonicContact CZ-OE1 3.63Å; R616-E620 VanDerWaalsContact CZ-OE1 3.24Å; R616-E620 IonicContact NH1-OE1 2.89Å; R616-E620 PolarHBondContact NH1-OE1 2.64Å; R616-E620 IonicContact NH2-OE1 2.72Å; R616-E620 PolarHBondContact NH2-OE1 3.28Å
617	M	94.1	Very high	80.7	Confident	7 Å²	7	52.4 Å²	52.4	3%	0.034	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	129.4	176.8	-63.5	170.5	-83.1	0	0	109.5	L69 L79 V131 E133	L69-M617 HydrophobicContact CB-CB 4.16Å; L79-M617 HydrophobicContact CD1-CE 3.72Å; L79-M617 HydrophobicContact CD1-SD 4.05Å; L79-M617 HydrophobicContact CG-SD 4.44Å; V131-M617 HydrophobicContact CB-CB 4.49Å; V131-M617 HydrophobicContact CB-CE 4.44Å; V131-M617 HydrophobicContact CG1-CE 4.01Å; V131-M617 PolarHBondContact N-O 3.19Å; V131-M617 PolarHBondContact O-N 3.06Å; E133-M617 HydrophobicContact CG-CE 4.15Å
618	T	89.8	Confident	80.7	Confident	18 Å²	18	52.2 Å²	52.2	11%	0.11	29%	0.293	C	S	.	.			trans	-167.2	151.8	-177.8	-175.1	0	0	0	0	109.4	Y128 L129 R616 E620	Y128-T618 VanDerWaalsContact CE1-OG1 3.32Å; Y128-T618 WeakPolarHBondContact CE1-OG1 3.41Å; Y128-T618 VanDerWaalsContact CZ-OG1 3.31Å; Y128-T618 PolarHBondContact OH-OG1 3.02Å; L129-T618 PolarHBondContact O-OG1 3.37Å; R616-T618 VanDerWaalsContact CZ-CG2 3.5Å; T618-E620 HydrophobicContact CG2-CG 3.88Å
619	N	84.1	Confident	81.2	Confident	5 Å²	5	56.2 Å²	56.2	3%	0.027	31%	0.312	C	S	.	.			trans	-113.4	67.6	175	-168.8	-8.7	0	0	0	110.4	I67 A621 L622 S627 L628	I67-N619 HydrophobicContact CG2-CB 4.05Å; N619-A621 PolarHBondContact O-N 2.88Å; N619-L622 WeakPolarHBondContact O-CB 3.4Å; N619-L622 PolarHBondContact O-N 3.22Å; N619-L622 VanDerWaalsContact O-N 3.14Å; N619-S627 PolarHBondContact ND2-OG 3.48Å; N619-S627 VanDerWaalsContact ND2-OG 3.15Å; N619-L628 HydrophobicContact CB-CD1 4.19Å; N619-L628 HydrophobicContact CB-CG 4.39Å; N619-L628 PolarHBondContact OD1-N 2.96Å
620	E	72.2	Confident	81.8	Confident	36 Å²	36	56.4 Å²	56.4	17%	0.168	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-16.6	-177.7	-10.2	-151.9	133.3	0	0	114.1	Y128 R616 T618 L622	Y128-E620 HydrophobicContact CE2-CB 3.91Å; Y128-E620 VanDerWaalsContact OH-CA 3.28Å; Y128-E620 WeakPolarHBondContact OH-CA 3.41Å; Y128-E620 WeakPolarHBondContact OH-CB 3.5Å; Y128-E620 WeakPolarHBondContact OH-CG 3.4Å; Y128-E620 PolarHBondContact OH-OE1 2.78Å; Y128-E620 VanDerWaalsContact OH-OE1 3.1Å; R616-E620 IonicContact CZ-OE1 3.63Å; R616-E620 VanDerWaalsContact CZ-OE1 3.24Å; R616-E620 IonicContact NH1-OE1 2.89Å; R616-E620 PolarHBondContact NH1-OE1 2.64Å; R616-E620 IonicContact NH2-OE1 2.72Å; R616-E620 PolarHBondContact NH2-OE1 3.28Å; T618-E620 HydrophobicContact CG2-CG 3.88Å; E620-L622 VanDerWaalsContact C-N 3.31Å
621	A	67.9	Low	82.7	Confident	20 Å²	20	55.1 Å²	55.1	17%	0.165	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-30.5	-179.7	0	0	0	0	0	111.8	N619 K624 G625 S626	N619-A621 PolarHBondContact O-N 2.88Å; A621-K624 CarbonylContact O-C 3.26Å; A621-K624 WeakPolarHBondContact O-CA 3.43Å; A621-K624 WeakPolarHBondContact O-CB 3.22Å; A621-K624 PolarHBondContact O-N 2.8Å; A621-G625 PolarHBondContact O-N 3.05Å; A621-S626 CarbonylContact C-O 3.6Å; A621-S626 WeakPolarHBondContact CA-OG 3.33Å; A621-S626 WeakPolarHBondContact CB-OG 3.31Å; A621-S626 CarbonylContact O-C 3.55Å; A621-S626 WeakPolarHBondContact O-CA 3.41Å; A621-S626 PolarHBondContact O-N 3.32Å; A621-S626 PolarHBondContact O-OG 2.63Å
622	L	73.6	Confident	83.5	Confident	62 Å²	62	54 Å²	54	33%	0.325	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-55.7	-56.2	-175.5	-162.1	87.4	0	0	0	112	I67 N619 E620 K624 G625 S626	I67-L622 HydrophobicContact CD1-CD2 3.65Å; I67-L622 HydrophobicContact CG1-CD1 4.36Å; I67-L622 HydrophobicContact CG1-CD2 4.33Å; I67-L622 HydrophobicContact CG2-CD1 4.49Å; N619-L622 WeakPolarHBondContact O-CB 3.4Å; N619-L622 PolarHBondContact O-N 3.22Å; N619-L622 VanDerWaalsContact O-N 3.14Å; E620-L622 VanDerWaalsContact C-N 3.31Å; L622-K624 PolarHBondContact O-N 3.07Å; L622-G625 PolarHBondContact O-N 2.82Å; L622-S626 WeakPolarHBondContact CA-O 3.25Å; L622-S626 PolarHBondContact N-O 2.74Å; L622-S626 VanDerWaalsContact N-O 3.15Å
623	H	67.4	Low	83.9	Confident	57 Å²	57	49 Å²	49	26%	0.264	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-68	-1.8	179.2	-47.7	-82.5	0	0	0	113.8	D126 Y128	D126-H623 IonicContact OD2-CE1 3.53Å; D126-H623 PolarHBondContact OD2-CE1 3.03Å; D126-H623 IonicContact OD2-ND1 2.85Å; D126-H623 PolarHBondContact OD2-ND1 2.78Å; Y128-H623 AromaticContact CD2-CD2 3.54Å; Y128-H623 AromaticContact CD2-NE2 3.71Å; Y128-H623 AromaticContact CE2-CD2 3.89Å
624	K	68.6	Low	83.8	Confident	148 Å²	148	49.6 Å²	49.6	64%	0.643	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-107.4	13	172.8	-63.1	172.3	-175.2	159.5	0	112.3	A621 L622	A621-K624 CarbonylContact O-C 3.26Å; A621-K624 WeakPolarHBondContact O-CA 3.43Å; A621-K624 WeakPolarHBondContact O-CB 3.22Å; A621-K624 PolarHBondContact O-N 2.8Å; L622-K624 PolarHBondContact O-N 3.07Å
625	G	72.6	Confident	83.4	Confident	81 Å²	81	50.6 Å²	50.6	84%	0.835	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	72	26.3	-178.4	0	0	0	0	0	113.9	A621 L622	A621-G625 PolarHBondContact O-N 3.05Å; L622-G625 PolarHBondContact O-N 2.82Å
626	S	78.4	Confident	83.2	Confident	65 Å²	65	56.6 Å²	56.6	46%	0.455	32%	0.317	S	S	.	.			trans	-137.9	179.5	-178.3	58.6	0	0	0	0	110.5	A621 L622	A621-S626 CarbonylContact C-O 3.6Å; A621-S626 WeakPolarHBondContact CA-OG 3.33Å; A621-S626 WeakPolarHBondContact CB-OG 3.31Å; A621-S626 CarbonylContact O-C 3.55Å; A621-S626 WeakPolarHBondContact O-CA 3.41Å; A621-S626 PolarHBondContact O-N 3.32Å; A621-S626 PolarHBondContact O-OG 2.63Å; L622-S626 WeakPolarHBondContact CA-O 3.25Å; L622-S626 PolarHBondContact N-O 2.74Å; L622-S626 VanDerWaalsContact N-O 3.15Å
627	S	83	Confident	82.9	Confident	64 Å²	64	55 Å²	55	45%	0.448	32%	0.316	S	S	.	.			trans	-138.9	163.4	171.5	-165.6	0	0	0	0	110.3	N619	N619-S627 PolarHBondContact ND2-OG 3.48Å; N619-S627 VanDerWaalsContact ND2-OG 3.15Å
628	L	85.4	Confident	82.9	Confident	55 Å²	55	55.1 Å²	55.1	29%	0.288	32%	0.317	S	S	.	.			trans	-53	141.8	163.8	-68.3	174.6	0	0	0	109.6	N619 L631 L642	N619-L628 HydrophobicContact CB-CD1 4.19Å; N619-L628 HydrophobicContact CB-CG 4.39Å; N619-L628 PolarHBondContact OD1-N 2.96Å; L628-L631 HydrophobicContact CD1-CD2 3.75Å; L628-L642 HydrophobicContact CB-CD1 3.54Å; L628-L642 WeakPolarHBondContact O-CD1 3.5Å
629	Q	90.1	Very high	83.1	Confident	160 Å²	160	59 Å²	59	75%	0.748	33%	0.33	S	S	*	.	S	Bend	trans	-93.4	-26.5	175.4	-64.7	179.1	-6.9	0	0	112.2	L642	Q629-L642 PolarHBondContact O-N 3.34Å
630	V	92.3	Very high	83.6	Confident	47 Å²	47	58.8 Å²	58.8	29%	0.285	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	133.9	-173.7	179.6	0	0	0	0	110.5	A632 W639 I640	V630-A632 HydrophobicContact CG1-CB 4.36Å; V630-W639 HydrophobicContact CG1-CB 3.75Å; V630-W639 HydrophobicContact CG1-CD2 3.74Å; V630-W639 HydrophobicContact CG1-CE3 3.93Å; V630-W639 HydrophobicContact CG1-CG 3.67Å; V630-W639 HydrophobicContact CG2-CE3 4.35Å; V630-I640 CarbonylContact C-O 3.38Å; V630-I640 VanDerWaalsContact CA-O 3.27Å; V630-I640 WeakPolarHBondContact CA-O 3.19Å
631	L	93.4	Very high	84.6	Confident	5 Å²	5	60 Å²	60	3%	0.026	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	121.8	161.9	-49.5	178.1	0	0	0	108.5	F68 F71 V78 L628 W639 I640 L642	F68-L631 HydrophobicContact CB-CD1 3.84Å; F71-L631 HydrophobicContact CD2-CB 4.33Å; F71-L631 HydrophobicContact CE2-CB 4.29Å; V78-L631 HydrophobicContact CG1-CD1 4.14Å; L628-L631 HydrophobicContact CD1-CD2 3.75Å; L631-W639 WeakPolarHBondContact O-CA 3.49Å; L631-I640 HydrophobicContact CB-CB 4.27Å; L631-I640 PolarHBondContact N-O 3.28Å; L631-I640 PolarHBondContact O-N 3.07Å; L631-L642 HydrophobicContact CD1-CD2 4.02Å; L631-L642 HydrophobicContact CD2-CD1 3.89Å; L631-L642 HydrophobicContact CG-CD1 3.98Å; L631-L642 HydrophobicContact CG-CD2 4.05Å; L631-L642 HydrophobicContact CG-CG 4.21Å
632	A	91.7	Very high	85.7	Confident	50 Å²	50	62.8 Å²	62.8	41%	0.413	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	112.5	-170.8	0	0	0	0	0	113.1	V630 S634 W639	V630-A632 HydrophobicContact CG1-CB 4.36Å; A632-S634 PolarHBondContact O-N 3.43Å; A632-W639 HydrophobicContact CB-CG 4.43Å
633	D	90.9	Very high	86.3	Confident	13 Å²	13	62.9 Å²	62.9	7%	0.07	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	102.4	158.3	-177.9	-24.1	0	0	0	108	F71 D635 R636 C637 T638	F71-D633 HydrophobicContact CB-CB 4.48Å; F71-D633 HydrophobicContact CD1-CB 4.4Å; F71-D633 HydrophobicContact CD2-CB 3.94Å; F71-D633 HydrophobicContact CE2-CB 4.2Å; F71-D633 HydrophobicContact CG-CB 4.03Å; D633-D635 VanDerWaalsContact C-N 3.34Å; D633-D635 PolarHBondContact OD1-N 3.21Å; D633-R636 PolarHBondContact OD1-N 3.15Å; D633-R636 WeakPolarHBondContact OD2-CB 3.43Å; D633-R636 VanDerWaalsContact OD2-CD 3.24Å; D633-R636 WeakPolarHBondContact OD2-CD 3.29Å; D633-R636 VanDerWaalsContact OD2-CG 3.24Å; D633-R636 WeakPolarHBondContact OD2-CG 3.25Å; D633-C637 CarbonylContact O-C 3.56Å; D633-C637 VanDerWaalsContact O-CA 3.24Å; D633-C637 WeakPolarHBondContact O-CA 3.31Å; D633-C637 PolarHBondContact O-N 3.33Å; D633-T638 PolarHBondContact N-O 3.4Å; D633-T638 PolarHBondContact O-N 3.45Å
634	S	83.9	Confident	87.2	Confident	55 Å²	55	63.2 Å²	63.2	39%	0.385	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-28	-179.8	-68.7	0	0	0	0	113.6	Q311 A632	Q311-S634 PolarHBondContact NE2-OG 2.56Å; A632-S634 PolarHBondContact O-N 3.43Å
635	D	84.4	Confident	88.3	Confident	40 Å²	40	58.4 Å²	58.4	21%	0.214	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-29.5	-171.5	-75.5	-16.2	0	0	0	111.3	Q39 D633	Q39-D635 VanDerWaalsContact NE2-CB 3.3Å; Q39-D635 PolarHBondContact NE2-O 3.15Å; D633-D635 VanDerWaalsContact C-N 3.34Å; D633-D635 PolarHBondContact OD1-N 3.21Å
636	R	88.5	Confident	89.2	Confident	134 Å²	134	57.1 Å²	57.1	51%	0.506	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-8.7	170.7	-57	-172.2	174.6	145.1	9.9	113.4	C74 G75 D633 T638	C74-R636 PolarHBondContact O-NH1 3.27Å; C74-R636 PolarHBondContact O-NH2 3.03Å; G75-R636 PolarHBondContact O-NH1 3.49Å; D633-R636 PolarHBondContact OD1-N 3.15Å; D633-R636 WeakPolarHBondContact OD2-CB 3.43Å; D633-R636 VanDerWaalsContact OD2-CD 3.24Å; D633-R636 WeakPolarHBondContact OD2-CD 3.29Å; D633-R636 VanDerWaalsContact OD2-CG 3.24Å; D633-R636 WeakPolarHBondContact OD2-CG 3.25Å; R636-T638 VanDerWaalsContact C-N 3.31Å
637	C	89	Confident	89.9	Confident	33 Å²	33	56.6 Å²	56.6	22%	0.223	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.9	42.1	-175.6	-60.2	0	0	0	0	112.2	P47 R48 D633	P47-C637 CarbonylContact C-O 3.34Å; P47-C637 WeakPolarHBondContact CA-O 3.11Å; P47-C637 WeakPolarHBondContact CB-O 3.5Å; R48-C637 HydrophobicContact CB-CB 4.45Å; R48-C637 HydrophobicContact CG-CB 3.83Å; R48-C637 PolarHBondContact N-O 3.33Å; D633-C637 CarbonylContact O-C 3.56Å; D633-C637 VanDerWaalsContact O-CA 3.24Å; D633-C637 WeakPolarHBondContact O-CA 3.31Å; D633-C637 PolarHBondContact O-N 3.33Å
638	T	92.7	Very high	90.3	Very high	9 Å²	9	56.1 Å²	56.1	6%	0.055	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	129.8	-177.9	-61.2	0	0	0	0	110	V49 F103 L105 D633 R636	V49-T638 HydrophobicContact CB-CG2 4.33Å; V49-T638 WeakPolarHBondContact O-CA 3.46Å; F103-T638 HydrophobicContact CE1-CG2 3.93Å; F103-T638 HydrophobicContact CZ-CG2 3.79Å; L105-T638 HydrophobicContact CD2-CG2 4.32Å; D633-T638 PolarHBondContact N-O 3.4Å; D633-T638 PolarHBondContact O-N 3.45Å; R636-T638 VanDerWaalsContact C-N 3.31Å
639	W	95	Very high	90.7	Very high	101 Å²	101	56.2 Å²	56.2	38%	0.383	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	134	179.3	-71.2	4.5	0	0	0	110.7	P47 V49 C50 V51 V630 L631 A632	P47-W639 HydrophobicContact CB-CB 4.49Å; P47-W639 HydrophobicContact CB-CD2 3.85Å; P47-W639 HydrophobicContact CB-CE3 4.45Å; P47-W639 HydrophobicContact CB-CG 3.85Å; P47-W639 HydrophobicContact CG-CD2 3.62Å; P47-W639 HydrophobicContact CG-CE3 3.74Å; P47-W639 HydrophobicContact CG-CG 4.11Å; P47-W639 HydrophobicContact CG-CH2 4.28Å; P47-W639 HydrophobicContact CG-CZ2 4.18Å; P47-W639 HydrophobicContact CG-CZ3 4.07Å; V49-W639 PolarHBondContact O-N 3.02Å; C50-W639 CarbonylContact C-O 3.57Å; C50-W639 WeakPolarHBondContact CA-O 3.42Å; V51-W639 PolarHBondContact N-O 3.15Å; V630-W639 HydrophobicContact CG1-CB 3.75Å; V630-W639 HydrophobicContact CG1-CD2 3.74Å; V630-W639 HydrophobicContact CG1-CE3 3.93Å; V630-W639 HydrophobicContact CG1-CG 3.67Å; V630-W639 HydrophobicContact CG2-CE3 4.35Å; L631-W639 WeakPolarHBondContact O-CA 3.49Å; A632-W639 HydrophobicContact CB-CG 4.43Å
640	I	94.5	Very high	90.7	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	123.4	159.2	-62.5	169.4	0	0	0	106.8	V51 L53 I56 F71 V78 F103 V630 L631 L642	V51-I640 CarbonylContact O-C 3.59Å; V51-I640 VanDerWaalsContact O-CA 3.25Å; V51-I640 WeakPolarHBondContact O-CA 3.45Å; L53-I640 HydrophobicContact CB-CG2 3.95Å; L53-I640 HydrophobicContact CD1-CG2 3.77Å; I56-I640 HydrophobicContact CD1-CD1 4.01Å; I56-I640 HydrophobicContact CD1-CG1 4.17Å; I56-I640 HydrophobicContact CD1-CG2 4.36Å; F71-I640 HydrophobicContact CE1-CD1 4.19Å; F71-I640 HydrophobicContact CE2-CD1 3.82Å; F71-I640 HydrophobicContact CE2-CG1 3.97Å; F71-I640 HydrophobicContact CZ-CD1 3.42Å; F71-I640 VanDerWaalsContact CZ-CD1 3.42Å; F71-I640 HydrophobicContact CZ-CG1 3.71Å; V78-I640 HydrophobicContact CG1-CD1 4.49Å; V78-I640 HydrophobicContact CG2-CD1 3.66Å; F103-I640 HydrophobicContact CD2-CD1 3.95Å; F103-I640 HydrophobicContact CE2-CD1 3.84Å; F103-I640 HydrophobicContact CE2-CG1 3.96Å; V630-I640 CarbonylContact C-O 3.38Å; V630-I640 VanDerWaalsContact CA-O 3.27Å; V630-I640 WeakPolarHBondContact CA-O 3.19Å; L631-I640 HydrophobicContact CB-CB 4.27Å; L631-I640 PolarHBondContact N-O 3.28Å; L631-I640 PolarHBondContact O-N 3.07Å; I640-L642 HydrophobicContact CG2-CD2 4.37Å
641	V	93.9	Very high	90.6	Very high	60 Å²	60	48.3 Å²	48.3	36%	0.364	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	122.5	174.2	-176.2	0	0	0	0	107.4	C50 V51 P52 L53	C50-V641 HydrophobicContact CB-CG2 4.48Å; V51-V641 PolarHBondContact O-N 3.08Å; P52-V641 CarbonylContact C-O 3.48Å; P52-V641 WeakPolarHBondContact CA-O 3.21Å; L53-V641 WeakPolarHBondContact CB-O 3.48Å; L53-V641 PolarHBondContact N-O 3.36Å
642	L	89.3	Confident	90.4	Very high	80 Å²	80	52.3 Å²	52.3	42%	0.419	28%	0.275	S	S	.	.			trans	-79.2	0	-174.6	-63.5	172.1	0	0	0	111.3	L53 F68 L628 Q629 L631 I640	L53-L642 HydrophobicContact CB-CD2 4.19Å; L53-L642 HydrophobicContact CD1-CD2 3.95Å; L53-L642 HydrophobicContact CD2-CD2 3.73Å; L53-L642 HydrophobicContact CG-CD2 4.16Å; F68-L642 HydrophobicContact CB-CD2 4.35Å; L628-L642 HydrophobicContact CB-CD1 3.54Å; L628-L642 WeakPolarHBondContact O-CD1 3.5Å; Q629-L642 PolarHBondContact O-N 3.34Å; L631-L642 HydrophobicContact CD1-CD2 4.02Å; L631-L642 HydrophobicContact CD2-CD1 3.89Å; L631-L642 HydrophobicContact CG-CD1 3.98Å; L631-L642 HydrophobicContact CG-CD2 4.05Å; L631-L642 HydrophobicContact CG-CG 4.21Å; I640-L642 HydrophobicContact CG2-CD2 4.37Å

Retrieved 642 of 642 residues in 365.9 ms (Link to these results)

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