A0A087XV13_POEFO Loading...

Rabphilin-3A-like

AlphaFold DB , UniProt , Accession A0A087XV13, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 582 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.8	Very low	44.4	Very low	239 Å²	239	126.6 Å²	126.6	100%	1.177	86%	0.855	S	S	*	*				0	161.5	0	-73.7	173.8	171.3	0	0	108.5
2	N	37.8	Very low	46.9	Very low	153 Å²	153	121.9 Å²	121.9	82%	0.818	82%	0.815	S	S	*	*			trans	56.7	97	-177.4	-67.1	12	0	0	0	116.2
3	V	35.9	Very low	49.7	Very low	149 Å²	149	117.5 Å²	117.5	90%	0.903	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-93.8	123.5	139.1	176.8	0	0	0	0	105.8
4	S	39.6	Very low	51.8	Low	109 Å²	109	112.3 Å²	112.3	76%	0.762	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-71.2	136.6	179.5	-59.1	0	0	0	0	110.7	G6	S4-G6 PolarHBondContact O-N 2.82Å
5	G	43.9	Very low	53.6	Low	84 Å²	84	113.3 Å²	113.3	87%	0.866	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-69.4	122.9	-176.4	0	0	0	0	0	112.9
6	G	33	Very low	55.2	Low	73 Å²	73	111.8 Å²	111.8	75%	0.753	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-81.2	128.6	164.1	0	0	0	0	0	110.4	S4 L8	S4-G6 PolarHBondContact O-N 2.82Å; G6-L8 PolarHBondContact O-N 3.27Å
7	A	42.3	Very low	56.8	Low	103 Å²	103	107.2 Å²	107.2	85%	0.851	68%	0.681	S	S	*	*			trans	-77.2	106.7	176.2	0	0	0	0	0	110.2	G9	A7-G9 PolarHBondContact O-N 3.11Å
8	L	42.9	Very low	58.1	Low	182 Å²	182	108.2 Å²	108.2	95%	0.953	68%	0.675	S	S	*	*			trans	-80.1	63.4	171.6	-71.6	172.5	0	0	0	111	G6 G10	G6-L8 PolarHBondContact O-N 3.27Å; L8-G10 PolarHBondContact O-N 2.73Å
9	G	48.7	Very low	59.3	Low	69 Å²	69	108.4 Å²	108.4	71%	0.711	67%	0.67	S	S	*	*			trans	-82.4	91.6	160.1	0	0	0	0	0	108.6	A7 D11	A7-G9 PolarHBondContact O-N 3.11Å; G9-D11 PolarHBondContact O-N 3.37Å
10	G	52.5	Low	60.4	Low	75 Å²	75	106 Å²	106	77%	0.773	65%	0.652	S	S	*	*			trans	-74.1	112.6	174.2	0	0	0	0	0	110.4	L8 L12	L8-G10 PolarHBondContact O-N 2.73Å; G10-L12 PolarHBondContact O-N 2.87Å
11	D	71.5	Confident	61.5	Low	157 Å²	157	102.3 Å²	102.3	84%	0.84	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-62.3	128.7	163	-94.1	-51.3	0	0	0	109	G9	G9-D11 PolarHBondContact O-N 3.37Å
12	L	73.6	Confident	63.4	Low	70 Å²	70	93.9 Å²	93.9	37%	0.366	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-58.6	138	175.2	-69.9	161.9	0	0	0	109.8	G10 E16 K17 I20 L132	G10-L12 PolarHBondContact O-N 2.87Å; L12-E16 WeakPolarHBondContact CA-OE2 3.3Å; L12-E16 HydrophobicContact CB-CB 4.33Å; L12-E16 HydrophobicContact CD2-CB 4.08Å; L12-K17 HydrophobicContact CB-CG 4.01Å; L12-K17 WeakPolarHBondContact O-CE 3.48Å; L12-K17 PolarHBondContact O-NZ 3.25Å; L12-K17 VanDerWaalsContact O-NZ 3.13Å; L12-I20 HydrophobicContact CD1-CD1 3.85Å; L12-I20 HydrophobicContact CD2-CD1 4.28Å; L12-L132 HydrophobicContact CD1-CD1 3.86Å
13	T	83.8	Confident	65.5	Low	64 Å²	64	90.1 Å²	90.1	39%	0.393	58%	0.575	S	S	.	*	P	Polyproline II helix	trans	-67.7	161.8	172.4	85.1	0	0	0	0	110.5	E15 E16 K17	T13-E15 VanDerWaalsContact C-N 3.26Å; T13-E15 WeakPolarHBondContact CB-OE2 3.35Å; T13-E15 PolarHBondContact O-N 3.45Å; T13-E15 PolarHBondContact OG1-N 3.43Å; T13-E15 PolarHBondContact OG1-OE2 3.44Å; T13-E16 PolarHBondContact N-OE2 3.48Å; T13-E16 PolarHBondContact O-N 2.98Å; T13-E16 PolarHBondContact OG1-N 3.35Å; T13-K17 WeakPolarHBondContact O-CG 3.42Å; T13-K17 PolarHBondContact O-N 2.95Å
14	D	78.4	Confident	67.8	Low	45 Å²	45	84.1 Å²	84.1	24%	0.241	54%	0.538	C	S	.	.	H	α-helix	trans	-67	-28.7	177.2	-81.6	6.9	0	0	0	111.9	K17 E18 L134 S135	D14-K17 PolarHBondContact O-N 3.12Å; D14-K17 IonicContact OD1-NZ 3.87Å; D14-K17 PolarHBondContact OD1-NZ 3.11Å; D14-E18 WeakPolarHBondContact O-CB 3.33Å; D14-E18 PolarHBondContact O-N 3.34Å; D14-L134 HydrophobicContact CB-CD2 4.5Å; D14-S135 VanDerWaalsContact CG-OG 3.29Å; D14-S135 PolarHBondContact OD1-OG 3.06Å; D14-S135 WeakPolarHBondContact OD2-CA 3.49Å; D14-S135 WeakPolarHBondContact OD2-CB 3.2Å; D14-S135 PolarHBondContact OD2-N 2.8Å; D14-S135 PolarHBondContact OD2-OG 2.86Å
15	E	79.5	Confident	69.7	Low	128 Å²	128	81.9 Å²	81.9	60%	0.598	53%	0.526	S	S	*	.	H	α-helix	trans	-65.6	-41.9	169.6	-54	87.9	171	0	0	112	T13 E18 I19	T13-E15 VanDerWaalsContact C-N 3.26Å; T13-E15 WeakPolarHBondContact CB-OE2 3.35Å; T13-E15 PolarHBondContact O-N 3.45Å; T13-E15 PolarHBondContact OG1-N 3.43Å; T13-E15 PolarHBondContact OG1-OE2 3.44Å; E15-E18 PolarHBondContact O-N 3.15Å; E15-I19 VanDerWaalsContact O-CG1 3.27Å; E15-I19 WeakPolarHBondContact O-CG1 3.28Å; E15-I19 PolarHBondContact O-N 3Å
16	E	78.9	Confident	71.4	Confident	89 Å²	89	82.7 Å²	82.7	42%	0.416	50%	0.503	S	S	.	.	H	α-helix	trans	-64.3	-41.4	175.9	-68.8	179.5	127.4	0	0	111.6	L12 T13 I19 I20	L12-E16 WeakPolarHBondContact CA-OE2 3.3Å; L12-E16 HydrophobicContact CB-CB 4.33Å; L12-E16 HydrophobicContact CD2-CB 4.08Å; T13-E16 PolarHBondContact N-OE2 3.48Å; T13-E16 PolarHBondContact O-N 2.98Å; T13-E16 PolarHBondContact OG1-N 3.35Å; E16-I19 PolarHBondContact O-N 2.73Å; E16-I20 WeakPolarHBondContact O-CD1 3.13Å; E16-I20 VanDerWaalsContact O-CG1 3.25Å; E16-I20 WeakPolarHBondContact O-CG1 3.47Å; E16-I20 PolarHBondContact O-N 2.8Å
17	K	81.7	Confident	73.4	Confident	34 Å²	34	80.5 Å²	80.5	15%	0.148	48%	0.477	C	S	.	.	H	α-helix	trans	-63.2	-39.6	173.3	-67	170.9	-158.9	146.8	0	111.9	L12 T13 D14 I20 N21 L132 P133 L134	L12-K17 HydrophobicContact CB-CG 4.01Å; L12-K17 WeakPolarHBondContact O-CE 3.48Å; L12-K17 PolarHBondContact O-NZ 3.25Å; L12-K17 VanDerWaalsContact O-NZ 3.13Å; T13-K17 WeakPolarHBondContact O-CG 3.42Å; T13-K17 PolarHBondContact O-N 2.95Å; D14-K17 PolarHBondContact O-N 3.12Å; D14-K17 IonicContact OD1-NZ 3.87Å; D14-K17 PolarHBondContact OD1-NZ 3.11Å; K17-I20 PolarHBondContact O-N 2.62Å; K17-N21 VanDerWaalsContact O-CB 3.32Å; K17-N21 WeakPolarHBondContact O-CB 3.11Å; K17-N21 PolarHBondContact O-N 2.95Å; K17-N21 PolarHBondContact O-ND2 3.02Å; K17-L132 HydrophobicContact CB-CB 4.22Å; K17-L132 HydrophobicContact CB-CD1 4.45Å; K17-L132 HydrophobicContact CG-CB 4.14Å; K17-L132 HydrophobicContact CG-CD1 4.06Å; K17-P133 WeakPolarHBondContact CD-O 3.15Å; K17-L134 HydrophobicContact CB-CD2 3.44Å; K17-L134 VanDerWaalsContact CB-CD2 3.44Å; K17-L134 HydrophobicContact CD-CD2 4.34Å
18	E	80.7	Confident	75.4	Confident	125 Å²	125	77.8 Å²	77.8	58%	0.584	46%	0.455	S	S	*	.	H	α-helix	trans	-65.7	-41.7	176.7	-175.3	169.5	-151.6	0	0	111.6	D14 E15 N21 S22 L134	D14-E18 WeakPolarHBondContact O-CB 3.33Å; D14-E18 PolarHBondContact O-N 3.34Å; E15-E18 PolarHBondContact O-N 3.15Å; E18-N21 PolarHBondContact O-N 2.96Å; E18-S22 WeakPolarHBondContact O-CB 3.48Å; E18-S22 PolarHBondContact O-N 3.08Å; E18-L134 HydrophobicContact CB-CD2 4.4Å
19	I	80.9	Confident	77.2	Confident	112 Å²	112	75.1 Å²	75.1	57%	0.574	44%	0.439	S	S	*	.	H	α-helix	trans	-60.4	-46.1	172.7	-68.8	163.7	0	0	0	110.8	E15 E16 S22 V23	E15-I19 VanDerWaalsContact O-CG1 3.27Å; E15-I19 WeakPolarHBondContact O-CG1 3.28Å; E15-I19 PolarHBondContact O-N 3Å; E16-I19 PolarHBondContact O-N 2.73Å; I19-S22 PolarHBondContact O-N 3.36Å; I19-V23 WeakPolarHBondContact O-CG2 3.4Å; I19-V23 PolarHBondContact O-N 2.83Å
20	I	81.7	Confident	78.3	Confident	59 Å²	59	77.2 Å²	77.2	30%	0.303	43%	0.432	S	S	.	.	H	α-helix	trans	-61.3	-46.1	176.5	-70.1	162.6	0	0	0	110.7	L12 E16 K17 S22 V23 L24 L132	L12-I20 HydrophobicContact CD1-CD1 3.85Å; L12-I20 HydrophobicContact CD2-CD1 4.28Å; E16-I20 WeakPolarHBondContact O-CD1 3.13Å; E16-I20 VanDerWaalsContact O-CG1 3.25Å; E16-I20 WeakPolarHBondContact O-CG1 3.47Å; E16-I20 PolarHBondContact O-N 2.8Å; K17-I20 PolarHBondContact O-N 2.62Å; I20-S22 VanDerWaalsContact C-N 3.33Å; I20-S22 PolarHBondContact O-N 3.07Å; I20-V23 WeakPolarHBondContact O-CB 3.28Å; I20-V23 PolarHBondContact O-N 2.92Å; I20-V23 VanDerWaalsContact O-N 3.14Å; I20-L24 HydrophobicContact CG2-CD1 4.02Å; I20-L24 HydrophobicContact CG2-CG 4.41Å; I20-L24 WeakPolarHBondContact O-CG 3.49Å; I20-L24 PolarHBondContact O-N 2.85Å; I20-L132 HydrophobicContact CB-CD1 4.2Å; I20-L132 HydrophobicContact CD1-CD1 3.8Å; I20-L132 HydrophobicContact CG2-CD1 3.82Å; I20-L132 HydrophobicContact CG2-CG 4.31Å
21	N	83.5	Confident	79.6	Confident	30 Å²	30	78.4 Å²	78.4	16%	0.16	42%	0.417	C	S	.	.	H	α-helix	trans	-63.4	-37.3	178	-72.9	-18.8	0	0	0	112.3	K17 E18 L24 A25 P131 L132	K17-N21 VanDerWaalsContact O-CB 3.32Å; K17-N21 WeakPolarHBondContact O-CB 3.11Å; K17-N21 PolarHBondContact O-N 2.95Å; K17-N21 PolarHBondContact O-ND2 3.02Å; E18-N21 PolarHBondContact O-N 2.96Å; N21-L24 PolarHBondContact O-N 2.84Å; N21-A25 WeakPolarHBondContact O-CB 3.25Å; N21-A25 PolarHBondContact O-N 2.81Å; N21-P131 WeakPolarHBondContact OD1-CA 3.19Å; N21-P131 WeakPolarHBondContact OD1-CB 3.43Å; N21-L132 PolarHBondContact ND2-O 2.76Å; N21-L132 PolarHBondContact OD1-N 2.89Å
22	S	80	Confident	80	Confident	61 Å²	61	73.9 Å²	73.9	43%	0.427	40%	0.402	S	S	.	.	H	α-helix	trans	-66.2	-33.5	173.4	177.7	0	0	0	0	112.9	E18 I19 I20 R26	E18-S22 WeakPolarHBondContact O-CB 3.48Å; E18-S22 PolarHBondContact O-N 3.08Å; I19-S22 PolarHBondContact O-N 3.36Å; I20-S22 VanDerWaalsContact C-N 3.33Å; I20-S22 PolarHBondContact O-N 3.07Å; S22-R26 WeakPolarHBondContact O-CG 3.36Å; S22-R26 PolarHBondContact O-N 3Å; S22-R26 PolarHBondContact O-NE 2.79Å
23	V	82.7	Confident	80.1	Confident	75 Å²	75	76.1 Å²	76.1	46%	0.455	41%	0.412	S	S	.	.	H	α-helix	trans	-69.8	-45.8	170.7	172.4	0	0	0	0	110.9	I19 I20 R26 A27	I19-V23 WeakPolarHBondContact O-CG2 3.4Å; I19-V23 PolarHBondContact O-N 2.83Å; I20-V23 WeakPolarHBondContact O-CB 3.28Å; I20-V23 PolarHBondContact O-N 2.92Å; I20-V23 VanDerWaalsContact O-N 3.14Å; V23-R26 PolarHBondContact O-N 3.26Å; V23-A27 WeakPolarHBondContact O-CB 3.11Å; V23-A27 PolarHBondContact O-N 2.85Å
24	L	83.1	Confident	79.8	Confident	23 Å²	23	76.4 Å²	76.4	12%	0.12	41%	0.409	C	S	.	.	H	α-helix	trans	-62.4	-42.4	178.3	-68.8	173	0	0	0	112.3	I20 N21 A27 A28 L128 P129	I20-L24 HydrophobicContact CG2-CD1 4.02Å; I20-L24 HydrophobicContact CG2-CG 4.41Å; I20-L24 WeakPolarHBondContact O-CG 3.49Å; I20-L24 PolarHBondContact O-N 2.85Å; N21-L24 PolarHBondContact O-N 2.84Å; L24-A27 PolarHBondContact O-N 2.89Å; L24-A28 WeakPolarHBondContact O-CB 3.49Å; L24-A28 PolarHBondContact O-N 3.25Å; L24-L128 HydrophobicContact CD2-CD2 4.27Å; L24-P129 HydrophobicContact CD1-CG 4.49Å; L24-P129 HydrophobicContact CD2-CG 3.75Å
25	A	79.5	Confident	79.7	Confident	62 Å²	62	80 Å²	80	51%	0.512	42%	0.424	S	S	.	.	H	α-helix	trans	-62.3	-43.5	176.9	0	0	0	0	0	112.3	N21 A28 M29	N21-A25 WeakPolarHBondContact O-CB 3.25Å; N21-A25 PolarHBondContact O-N 2.81Å; A25-A28 PolarHBondContact O-N 1.9Å; A25-M29 WeakPolarHBondContact O-CB 3.48Å; A25-M29 PolarHBondContact O-N 3.1Å
26	R	79.5	Confident	79.8	Confident	101 Å²	101	78.8 Å²	78.8	38%	0.381	42%	0.418	S	S	.	.	H	α-helix	trans	-67.3	-38.1	175	-73.2	-175.4	-66.2	141.8	-3.4	112.4	S22 V23 M29 M30	S22-R26 WeakPolarHBondContact O-CG 3.36Å; S22-R26 PolarHBondContact O-N 3Å; S22-R26 PolarHBondContact O-NE 2.79Å; V23-R26 PolarHBondContact O-N 3.26Å; R26-M29 PolarHBondContact O-N 2.86Å; R26-M30 WeakPolarHBondContact O-CG 3.22Å; R26-M30 PolarHBondContact O-N 2.96Å
27	A	76.9	Confident	80	Confident	26 Å²	26	79.1 Å²	79.1	22%	0.215	42%	0.416	C	S	.	.	H	α-helix	trans	-62.4	-45	174	0	0	0	0	0	111.6	V23 L24 M29 M30 E31 L128	V23-A27 WeakPolarHBondContact O-CB 3.11Å; V23-A27 PolarHBondContact O-N 2.85Å; L24-A27 PolarHBondContact O-N 2.89Å; A27-M29 VanDerWaalsContact C-N 3.34Å; A27-M29 PolarHBondContact O-N 3.3Å; A27-M30 PolarHBondContact O-N 3.33Å; A27-E31 WeakPolarHBondContact O-CB 3.44Å; A27-E31 PolarHBondContact O-N 2.81Å; A27-L128 HydrophobicContact CB-CD1 3.71Å; A27-L128 HydrophobicContact CB-CD2 3.74Å; A27-L128 HydrophobicContact CB-CG 4.41Å
28	A	83.5	Confident	79.8	Confident	47 Å²	47	79.7 Å²	79.7	39%	0.388	42%	0.42	S	S	.	.	H	α-helix	trans	-65	-36.5	177.9	0	0	0	0	0	112.2	L24 A25 E31 A32 L128	L24-A28 WeakPolarHBondContact O-CB 3.49Å; L24-A28 PolarHBondContact O-N 3.25Å; A25-A28 PolarHBondContact O-N 1.9Å; A28-E31 PolarHBondContact O-N 2.78Å; A28-A32 WeakPolarHBondContact O-CB 3.41Å; A28-A32 PolarHBondContact O-N 2.94Å; A28-L128 HydrophobicContact CB-CD1 3.9Å; A28-L128 VanDerWaalsContact N-CD1 3.33Å
29	M	79.9	Confident	79.6	Confident	125 Å²	125	79.7 Å²	79.7	62%	0.616	42%	0.42	S	S	*	.	H	α-helix	trans	-64.2	-42.4	173.5	-174.1	-179.8	179.7	0	0	112.2	A25 R26 A27 A32 M33	A25-M29 WeakPolarHBondContact O-CB 3.48Å; A25-M29 PolarHBondContact O-N 3.1Å; R26-M29 PolarHBondContact O-N 2.86Å; A27-M29 VanDerWaalsContact C-N 3.34Å; A27-M29 PolarHBondContact O-N 3.3Å; M29-A32 PolarHBondContact O-N 3Å; M29-M33 WeakPolarHBondContact O-CG 3.32Å; M29-M33 PolarHBondContact O-N 3.13Å
30	M	72.5	Confident	79.4	Confident	113 Å²	113	81.6 Å²	81.6	56%	0.557	42%	0.42	S	S	*	.	H	α-helix	trans	-66.4	-42.1	175.1	-71.4	-174.4	-68	0	0	112	R26 A27 A32 M33 E34	R26-M30 WeakPolarHBondContact O-CG 3.22Å; R26-M30 PolarHBondContact O-N 2.96Å; A27-M30 PolarHBondContact O-N 3.33Å; M30-A32 VanDerWaalsContact C-N 3.35Å; M30-A32 PolarHBondContact O-N 2.83Å; M30-M33 PolarHBondContact O-N 3.13Å; M30-E34 WeakPolarHBondContact O-CB 3.44Å; M30-E34 PolarHBondContact O-N 3.4Å
31	E	80.5	Confident	79.1	Confident	101 Å²	101	80.8 Å²	80.8	47%	0.472	42%	0.416	S	S	.	.	H	α-helix	trans	-61.9	-41.3	175.7	-173	167.7	-147.3	0	0	111.5	A27 A28 E34 Q35 L128	A27-E31 WeakPolarHBondContact O-CB 3.44Å; A27-E31 PolarHBondContact O-N 2.81Å; A28-E31 PolarHBondContact O-N 2.78Å; E31-E34 PolarHBondContact O-N 3.29Å; E31-Q35 VanDerWaalsContact O-CB 3.27Å; E31-Q35 WeakPolarHBondContact O-CB 3.35Å; E31-Q35 PolarHBondContact O-N 2.79Å; E31-L128 WeakPolarHBondContact OE2-CD1 3.29Å
32	A	79.4	Confident	79	Confident	62 Å²	62	80.7 Å²	80.7	51%	0.512	42%	0.418	S	S	.	.	H	α-helix	trans	-64	-42.3	174.8	0	0	0	0	0	113	A28 M29 M30 Q35 Q36	A28-A32 WeakPolarHBondContact O-CB 3.41Å; A28-A32 PolarHBondContact O-N 2.94Å; M29-A32 PolarHBondContact O-N 3Å; M30-A32 VanDerWaalsContact C-N 3.35Å; M30-A32 PolarHBondContact O-N 2.83Å; A32-Q35 PolarHBondContact O-N 2.89Å; A32-Q36 WeakPolarHBondContact O-CB 3.35Å; A32-Q36 PolarHBondContact O-N 2.97Å
33	M	75.4	Confident	79.1	Confident	117 Å²	117	81.2 Å²	81.2	58%	0.576	42%	0.422	S	S	*	.	H	α-helix	trans	-66.9	-40.8	176.5	-70.5	-140.1	-62.6	0	0	112.4	M29 M30 Q36 R37	M29-M33 WeakPolarHBondContact O-CG 3.32Å; M29-M33 PolarHBondContact O-N 3.13Å; M30-M33 PolarHBondContact O-N 3.13Å; M33-Q36 PolarHBondContact O-N 2.86Å; M33-R37 PolarHBondContact O-N 3.31Å
34	E	76.8	Confident	79.1	Confident	70 Å²	70	85 Å²	85	33%	0.327	43%	0.428	S	S	.	.	H	α-helix	trans	-65.9	-41.6	175.1	176.2	57.2	-168.5	0	0	111.3	M30 E31 Q36 R37 I38	M30-E34 WeakPolarHBondContact O-CB 3.44Å; M30-E34 PolarHBondContact O-N 3.4Å; E31-E34 PolarHBondContact O-N 3.29Å; E34-Q36 VanDerWaalsContact C-N 3.32Å; E34-Q36 PolarHBondContact O-N 3.18Å; E34-R37 CarbonylContact O-C 3.59Å; E34-R37 WeakPolarHBondContact O-CA 3.43Å; E34-R37 VanDerWaalsContact O-CB 3.29Å; E34-R37 WeakPolarHBondContact O-CB 3.45Å; E34-R37 PolarHBondContact O-N 2.79Å; E34-R37 IonicContact OE1-CZ 3.43Å; E34-R37 IonicContact OE1-NE 3.71Å; E34-R37 PolarHBondContact OE1-NE 2.93Å; E34-R37 IonicContact OE1-NH2 3.2Å; E34-R37 PolarHBondContact OE1-NH2 2.97Å; E34-R37 IonicContact OE2-CZ 2.79Å; E34-R37 IonicContact OE2-NE 2.69Å; E34-R37 PolarHBondContact OE2-NE 2.83Å; E34-R37 IonicContact OE2-NH2 2.66Å; E34-R37 PolarHBondContact OE2-NH2 3.43Å; E34-I38 HydrophobicContact CG-CD1 3.98Å; E34-I38 HydrophobicContact CG-CG1 4.46Å; E34-I38 WeakPolarHBondContact O-CG1 3.49Å; E34-I38 PolarHBondContact O-N 2.76Å
35	Q	77.6	Confident	79.2	Confident	119 Å²	119	84.1 Å²	84.1	56%	0.556	42%	0.423	S	S	*	.	H	α-helix	trans	-60.5	-41.9	174.8	-175.4	62.4	10	0	0	111.6	E31 A32 R37 I38 E39	E31-Q35 VanDerWaalsContact O-CB 3.27Å; E31-Q35 WeakPolarHBondContact O-CB 3.35Å; E31-Q35 PolarHBondContact O-N 2.79Å; A32-Q35 PolarHBondContact O-N 2.89Å; Q35-R37 VanDerWaalsContact C-N 3.26Å; Q35-R37 PolarHBondContact O-N 2.79Å; Q35-I38 PolarHBondContact O-N 2.92Å; Q35-E39 WeakPolarHBondContact O-CB 3.27Å; Q35-E39 PolarHBondContact O-N 3.34Å
36	Q	81.7	Confident	79.6	Confident	104 Å²	104	83.4 Å²	83.4	49%	0.486	41%	0.411	S	S	.	.	H	α-helix	trans	-65.7	-26.7	173.7	-159.2	-159.8	41.7	0	0	112.5	A32 M33 E34 R40	A32-Q36 WeakPolarHBondContact O-CB 3.35Å; A32-Q36 PolarHBondContact O-N 2.97Å; M33-Q36 PolarHBondContact O-N 2.86Å; E34-Q36 VanDerWaalsContact C-N 3.32Å; E34-Q36 PolarHBondContact O-N 3.18Å; Q36-R40 WeakPolarHBondContact O-CG 3.45Å; Q36-R40 PolarHBondContact O-N 2.8Å; Q36-R40 PolarHBondContact O-NE 3.11Å
37	R	82.1	Confident	80	Confident	95 Å²	95	81.8 Å²	81.8	36%	0.358	42%	0.415	S	S	.	.	H	α-helix	trans	-73.4	-42.5	171.6	-167.4	-173.1	71.1	94.2	2.3	111.1	M33 E34 Q35 R40 L41 R114	M33-R37 PolarHBondContact O-N 3.31Å; E34-R37 CarbonylContact O-C 3.59Å; E34-R37 WeakPolarHBondContact O-CA 3.43Å; E34-R37 VanDerWaalsContact O-CB 3.29Å; E34-R37 WeakPolarHBondContact O-CB 3.45Å; E34-R37 PolarHBondContact O-N 2.79Å; E34-R37 IonicContact OE1-CZ 3.43Å; E34-R37 IonicContact OE1-NE 3.71Å; E34-R37 PolarHBondContact OE1-NE 2.93Å; E34-R37 IonicContact OE1-NH2 3.2Å; E34-R37 PolarHBondContact OE1-NH2 2.97Å; E34-R37 IonicContact OE2-CZ 2.79Å; E34-R37 IonicContact OE2-NE 2.69Å; E34-R37 PolarHBondContact OE2-NE 2.83Å; E34-R37 IonicContact OE2-NH2 2.66Å; E34-R37 PolarHBondContact OE2-NH2 3.43Å; Q35-R37 VanDerWaalsContact C-N 3.26Å; Q35-R37 PolarHBondContact O-N 2.79Å; R37-R40 PolarHBondContact O-N 2.93Å; R37-L41 WeakPolarHBondContact O-CG 3.46Å; R37-L41 PolarHBondContact O-N 2.98Å; R37-R114 PolarHBondContact NH1-O 3.06Å; R37-R114 PolarHBondContact NH2-O 3.45Å; R37-R114 VanDerWaalsContact NH2-O 3.15Å
38	I	77.8	Confident	80.4	Confident	46 Å²	46	82 Å²	82	24%	0.236	41%	0.412	C	S	.	.	H	α-helix	trans	-65.2	-42.2	178.5	-67.2	171.8	0	0	0	111.3	E34 Q35 L41 S42	E34-I38 HydrophobicContact CG-CD1 3.98Å; E34-I38 HydrophobicContact CG-CG1 4.46Å; E34-I38 WeakPolarHBondContact O-CG1 3.49Å; E34-I38 PolarHBondContact O-N 2.76Å; Q35-I38 PolarHBondContact O-N 2.92Å; I38-L41 CarbonylContact O-C 3.58Å; I38-L41 WeakPolarHBondContact O-CB 3.25Å; I38-L41 PolarHBondContact O-N 3Å; I38-L41 VanDerWaalsContact O-N 3.15Å; I38-S42 PolarHBondContact O-N 2.9Å
39	E	77.3	Confident	80.6	Confident	126 Å²	126	84 Å²	84	59%	0.589	41%	0.412	S	S	*	.	H	α-helix	trans	-61.4	-45.2	175.1	-177.9	177.8	-150.9	0	0	111.8	Q35 L41 S42 S43	Q35-E39 WeakPolarHBondContact O-CB 3.27Å; Q35-E39 PolarHBondContact O-N 3.34Å; E39-L41 PolarHBondContact O-N 2.96Å; E39-S42 PolarHBondContact O-N 2.86Å; E39-S42 VanDerWaalsContact O-N 3.1Å; E39-S42 PolarHBondContact O-OG 3.23Å; E39-S43 PolarHBondContact O-N 2.76Å
40	R	76.3	Confident	80.9	Confident	151 Å²	151	87 Å²	87	57%	0.57	42%	0.421	S	S	*	.	H	α-helix	trans	-58.5	-37.2	173.4	-79.2	177.8	-78	178.5	-8.2	111.9	Q36 R37 S43	Q36-R40 WeakPolarHBondContact O-CG 3.45Å; Q36-R40 PolarHBondContact O-N 2.8Å; Q36-R40 PolarHBondContact O-NE 3.11Å; R37-R40 PolarHBondContact O-N 2.93Å; R40-S43 PolarHBondContact O-OG 2.78Å
41	L	75.3	Confident	81.6	Confident	43 Å²	43	85.9 Å²	85.9	23%	0.225	42%	0.421	C	S	.	.	H	α-helix	trans	-70.9	-35.4	173.6	-71.1	168.1	0	0	0	113.5	R37 I38 E39 V111 R114	R37-L41 WeakPolarHBondContact O-CG 3.46Å; R37-L41 PolarHBondContact O-N 2.98Å; I38-L41 CarbonylContact O-C 3.58Å; I38-L41 WeakPolarHBondContact O-CB 3.25Å; I38-L41 PolarHBondContact O-N 3Å; I38-L41 VanDerWaalsContact O-N 3.15Å; E39-L41 PolarHBondContact O-N 2.96Å; L41-V111 WeakPolarHBondContact O-CG2 3.36Å; L41-R114 HydrophobicContact CD1-CB 4Å; L41-R114 HydrophobicContact CD2-CB 4.21Å
42	S	80.7	Confident	81.9	Confident	27 Å²	27	82.6 Å²	82.6	19%	0.189	41%	0.411	C	S	.	.	H	α-helix	trans	-78	-25.1	-179.3	92.2	0	0	0	0	113.5	I38 E39 R44 L45 D46	I38-S42 PolarHBondContact O-N 2.9Å; E39-S42 PolarHBondContact O-N 2.86Å; E39-S42 VanDerWaalsContact O-N 3.1Å; E39-S42 PolarHBondContact O-OG 3.23Å; S42-R44 VanDerWaalsContact C-N 3.26Å; S42-R44 PolarHBondContact O-N 3.02Å; S42-L45 WeakPolarHBondContact O-CA 3.47Å; S42-L45 WeakPolarHBondContact O-CB 3.24Å; S42-L45 PolarHBondContact O-N 2.85Å; S42-D46 WeakPolarHBondContact CB-OD2 3.33Å; S42-D46 PolarHBondContact O-N 3.26Å; S42-D46 PolarHBondContact OG-OD2 2.84Å
43	S	83.1	Confident	82.2	Confident	73 Å²	73	84 Å²	84	51%	0.51	42%	0.417	S	S	.	.	H	α-helix	trans	-40.7	-47.7	-179.1	66.6	0	0	0	0	114.8	E39 R40 D46 S47	E39-S43 PolarHBondContact O-N 2.76Å; R40-S43 PolarHBondContact O-OG 2.78Å; S43-D46 PolarHBondContact O-N 2.85Å; S43-S47 WeakPolarHBondContact O-CB 3.48Å; S43-S47 PolarHBondContact O-N 3.46Å
44	R	81.9	Confident	82.7	Confident	155 Å²	155	79.2 Å²	79.2	59%	0.585	40%	0.396	S	S	*	.	H	α-helix	trans	-69.4	-42.7	178.4	175.2	170.1	144	144.7	-2.9	112.7	S42 D46 S47 I48 E107	S42-R44 VanDerWaalsContact C-N 3.26Å; S42-R44 PolarHBondContact O-N 3.02Å; R44-D46 VanDerWaalsContact C-N 3.32Å; R44-D46 PolarHBondContact O-N 2.92Å; R44-S47 PolarHBondContact O-N 3Å; R44-I48 HydrophobicContact CG-CD1 4.15Å; R44-I48 VanDerWaalsContact O-CG1 3.26Å; R44-I48 WeakPolarHBondContact O-CG1 3.37Å; R44-I48 PolarHBondContact O-N 2.8Å; R44-E107 WeakPolarHBondContact CD-OE1 3.39Å; R44-E107 HydrophobicContact CG-CG 4.5Å; R44-E107 IonicContact CZ-OE1 3.59Å; R44-E107 IonicContact CZ-OE2 2.76Å; R44-E107 VanDerWaalsContact CZ-OE2 3.31Å; R44-E107 IonicContact NE-OE1 2.67Å; R44-E107 PolarHBondContact NE-OE1 2.97Å; R44-E107 IonicContact NE-OE2 3.56Å; R44-E107 PolarHBondContact NE-OE2 2.83Å; R44-E107 IonicContact NH2-OE1 2.78Å; R44-E107 IonicContact NH2-OE2 2.95Å; R44-E107 PolarHBondContact NH2-OE2 2.92Å
45	L	86.3	Confident	83	Confident	4 Å²	4	78.1 Å²	78.1	2%	0.021	39%	0.393	C	S	.	.	H	α-helix	trans	-60.5	-42.4	174.5	167.3	65.7	0	0	0	111.1	S42 I48 K49 I104 E107 Q108 V111	S42-L45 WeakPolarHBondContact O-CA 3.47Å; S42-L45 WeakPolarHBondContact O-CB 3.24Å; S42-L45 PolarHBondContact O-N 2.85Å; L45-I48 PolarHBondContact O-N 3.12Å; L45-K49 WeakPolarHBondContact O-CG 3.15Å; L45-K49 PolarHBondContact O-N 2.92Å; L45-I104 HydrophobicContact CD1-CG2 4.1Å; L45-E107 HydrophobicContact CB-CB 4.46Å; L45-E107 HydrophobicContact CB-CG 3.89Å; L45-E107 HydrophobicContact CD1-CB 4.07Å; L45-E107 HydrophobicContact CD1-CG 4.42Å; L45-Q108 HydrophobicContact CD1-CB 4.11Å; L45-Q108 HydrophobicContact CD2-CB 4.26Å; L45-V111 HydrophobicContact CB-CG2 4.28Å; L45-V111 HydrophobicContact CD2-CG2 4.23Å
46	D	86.4	Confident	83.4	Confident	47 Å²	47	72.5 Å²	72.5	25%	0.251	37%	0.367	S	S	.	.	H	α-helix	trans	-75.7	-29.7	-178.2	-61.6	-43.9	0	0	0	112.5	S42 S43 R44 K49 K50	S42-D46 WeakPolarHBondContact CB-OD2 3.33Å; S42-D46 PolarHBondContact O-N 3.26Å; S42-D46 PolarHBondContact OG-OD2 2.84Å; S43-D46 PolarHBondContact O-N 2.85Å; R44-D46 VanDerWaalsContact C-N 3.32Å; R44-D46 PolarHBondContact O-N 2.92Å; D46-K49 PolarHBondContact O-N 3.11Å; D46-K49 WeakPolarHBondContact OD1-CD 3.39Å; D46-K49 WeakPolarHBondContact OD1-CE 3.34Å; D46-K49 IonicContact OD1-NZ 2.68Å; D46-K49 PolarHBondContact OD1-NZ 3Å; D46-K50 WeakPolarHBondContact O-CB 2.96Å; D46-K50 VanDerWaalsContact O-CG 3.29Å; D46-K50 WeakPolarHBondContact O-CG 3.2Å; D46-K50 PolarHBondContact O-N 2.84Å
47	S	88.2	Confident	83.5	Confident	67 Å²	67	74.7 Å²	74.7	47%	0.469	38%	0.377	S	S	.	.	H	α-helix	trans	-61.7	-46.1	165.3	-177	0	0	0	0	112.1	S43 R44 K49 K50 T51	S43-S47 WeakPolarHBondContact O-CB 3.48Å; S43-S47 PolarHBondContact O-N 3.46Å; R44-S47 PolarHBondContact O-N 3Å; S47-K49 VanDerWaalsContact C-N 3.33Å; S47-K49 PolarHBondContact O-N 3.34Å; S47-K50 PolarHBondContact O-N 3.37Å; S47-T51 PolarHBondContact O-N 2.89Å; S47-T51 PolarHBondContact O-OG1 3.11Å
48	I	84.8	Confident	83.6	Confident	31 Å²	31	73.3 Å²	73.3	16%	0.159	38%	0.383	C	S	.	.	H	α-helix	trans	-64.7	-36.2	177	-61.7	162.3	0	0	0	111.3	R44 L45 T51 A52 L62 R103 I104 E107	R44-I48 HydrophobicContact CG-CD1 4.15Å; R44-I48 VanDerWaalsContact O-CG1 3.26Å; R44-I48 WeakPolarHBondContact O-CG1 3.37Å; R44-I48 PolarHBondContact O-N 2.8Å; L45-I48 PolarHBondContact O-N 3.12Å; I48-T51 WeakPolarHBondContact CA-OG1 3.27Å; I48-T51 PolarHBondContact O-OG1 3.07Å; I48-A52 PolarHBondContact O-N 3.04Å; I48-L62 HydrophobicContact CG2-CD2 4.03Å; I48-R103 HydrophobicContact CG2-CB 4.38Å; I48-I104 HydrophobicContact CB-CG1 4.48Å; I48-I104 HydrophobicContact CG2-CD1 4.48Å; I48-I104 HydrophobicContact CG2-CG1 3.62Å; I48-E107 HydrophobicContact CD1-CB 4.36Å; I48-E107 HydrophobicContact CD1-CG 4.1Å
49	K	87.8	Confident	84.1	Confident	88 Å²	88	76.4 Å²	76.4	38%	0.383	39%	0.391	S	S	.	.	H	α-helix	trans	-63.6	-45.4	172.6	-70.1	170.8	-167.3	157.5	0	112.1	L45 D46 S47 T51 A52 I104	L45-K49 WeakPolarHBondContact O-CG 3.15Å; L45-K49 PolarHBondContact O-N 2.92Å; D46-K49 PolarHBondContact O-N 3.11Å; D46-K49 WeakPolarHBondContact OD1-CD 3.39Å; D46-K49 WeakPolarHBondContact OD1-CE 3.34Å; D46-K49 IonicContact OD1-NZ 2.68Å; D46-K49 PolarHBondContact OD1-NZ 3Å; S47-K49 VanDerWaalsContact C-N 3.33Å; S47-K49 PolarHBondContact O-N 3.34Å; K49-T51 VanDerWaalsContact C-N 3.29Å; K49-T51 PolarHBondContact O-N 2.43Å; K49-A52 PolarHBondContact O-N 3.07Å; K49-I104 HydrophobicContact CG-CD1 4.44Å; K49-I104 HydrophobicContact CG-CG1 4.47Å; K49-I104 HydrophobicContact CG-CG2 4.27Å
50	K	88.1	Confident	84.6	Confident	187 Å²	187	70.4 Å²	70.4	81%	0.813	36%	0.363	S	S	*	.	H	α-helix	trans	-67.2	-26.4	-179.6	-74.4	172.1	-179.6	178.7	0	113.4	D46 S47	D46-K50 WeakPolarHBondContact O-CB 2.96Å; D46-K50 VanDerWaalsContact O-CG 3.29Å; D46-K50 WeakPolarHBondContact O-CG 3.2Å; D46-K50 PolarHBondContact O-N 2.84Å; S47-K50 PolarHBondContact O-N 3.37Å
51	T	86	Confident	85.2	Confident	91 Å²	91	64.1 Å²	64.1	56%	0.558	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	8.4	-179.7	51.4	0	0	0	0	114.1	S47 I48 K49	S47-T51 PolarHBondContact O-N 2.89Å; S47-T51 PolarHBondContact O-OG1 3.11Å; I48-T51 WeakPolarHBondContact CA-OG1 3.27Å; I48-T51 PolarHBondContact O-OG1 3.07Å; K49-T51 VanDerWaalsContact C-N 3.29Å; K49-T51 PolarHBondContact O-N 2.43Å
52	A	87.6	Confident	85.8	Confident	32 Å²	32	63 Å²	63	26%	0.264	34%	0.335	S	S	.	.			trans	-87	112.3	-179.3	0	0	0	0	0	111.9	I48 K49 L62 I104	I48-A52 PolarHBondContact O-N 3.04Å; K49-A52 PolarHBondContact O-N 3.07Å; A52-L62 HydrophobicContact CB-CD2 4.14Å; A52-I104 HydrophobicContact CB-CD1 4.07Å
53	C	85.4	Confident	86.2	Confident	92 Å²	92	64.5 Å²	64.5	62%	0.622	35%	0.345	S	S	*	.			trans	-102.8	7.8	-168.1	-61.6	0	0	0	0	115.6	L62	C53-L62 PolarHBondContact N-O 2.88Å
54	G	85.3	Confident	86.4	Confident	15 Å²	15	61.9 Å²	61.9	16%	0.155	33%	0.33	C	S	.	.			trans	-118.4	155.2	-173.2	0	0	0	0	0	115.8	G56 C60 L61	G54-G56 VanDerWaalsContact C-N 3.33Å; G54-C60 WeakPolarHBondContact CA-O 3.42Å; G54-L61 PolarHBondContact N-O 3.36Å; G54-L61 VanDerWaalsContact N-O 3.11Å
55	D	84.2	Confident	86.7	Confident	47 Å²	47	57.4 Å²	57.4	25%	0.251	32%	0.32	S	S	.	.			trans	-67.1	-34.6	173.4	59.3	1.6	0	0	0	112.2	Q57 S58 R59 K82	D55-Q57 PolarHBondContact OD1-N 2.65Å; D55-S58 PolarHBondContact OD1-N 2.86Å; D55-S58 VanDerWaalsContact OD1-N 3.17Å; D55-S58 WeakPolarHBondContact OD2-CB 3.1Å; D55-S58 PolarHBondContact OD2-N 3.01Å; D55-S58 PolarHBondContact OD2-OG 3.49Å; D55-R59 WeakPolarHBondContact OD1-CA 3.4Å; D55-R59 PolarHBondContact OD1-N 3.04Å; D55-K82 PolarHBondContact O-NZ 3.27Å
56	G	85.2	Confident	86.7	Confident	2 Å²	2	60.9 Å²	60.9	2%	0.021	34%	0.344	C	S	.	.	S	Bend	trans	79.9	23.3	-168.5	0	0	0	0	0	113.3	G54 R59 H83	G54-G56 VanDerWaalsContact C-N 3.33Å; G56-R59 WeakPolarHBondContact CA-O 3.49Å; G56-R59 PolarHBondContact N-O 3.48Å; G56-R59 VanDerWaalsContact N-O 3.14Å; G56-H83 WeakPolarHBondContact CA-O 3.43Å; G56-H83 PolarHBondContact O-N 2.74Å
57	Q	83.8	Confident	86.6	Confident	149 Å²	149	60.9 Å²	60.9	70%	0.696	34%	0.342	S	S	*	.	S	Bend	trans	-128.2	-72.9	178.5	-60.6	-176.8	12.7	0	0	110	D55	D55-Q57 PolarHBondContact OD1-N 2.65Å
58	S	83.9	Confident	85.8	Confident	67 Å²	67	60.4 Å²	60.4	47%	0.469	35%	0.348	S	S	.	.	S	Bend	trans	-83.5	-24.2	175.3	67.6	0	0	0	0	112.9	D55 F67	D55-S58 PolarHBondContact OD1-N 2.86Å; D55-S58 VanDerWaalsContact OD1-N 3.17Å; D55-S58 WeakPolarHBondContact OD2-CB 3.1Å; D55-S58 PolarHBondContact OD2-N 3.01Å; D55-S58 PolarHBondContact OD2-OG 3.49Å; S58-F67 WeakPolarHBondContact O-CD2 3.21Å; S58-F67 PolarHBondContact O-N 2.76Å; S58-F67 VanDerWaalsContact O-N 3.09Å
59	R	87.6	Confident	84.6	Confident	111 Å²	111	64.4 Å²	64.4	42%	0.419	39%	0.385	S	S	.	.	B	Isolated β-bridge	trans	-130.7	150.9	-173.7	-70	177.3	-69.6	156.7	-2	111.1	D55 G56 L61 G64 T65	D55-R59 WeakPolarHBondContact OD1-CA 3.4Å; D55-R59 PolarHBondContact OD1-N 3.04Å; G56-R59 WeakPolarHBondContact CA-O 3.49Å; G56-R59 PolarHBondContact N-O 3.48Å; G56-R59 VanDerWaalsContact N-O 3.14Å; R59-L61 PolarHBondContact O-N 3.23Å; R59-L61 VanDerWaalsContact O-N 3.16Å; R59-G64 WeakPolarHBondContact CB-O 3.49Å; R59-G64 VanDerWaalsContact CD-O 3.25Å; R59-G64 WeakPolarHBondContact CD-O 3.31Å; R59-G64 WeakPolarHBondContact CG-O 3.3Å; R59-T65 CarbonylContact C-O 3.56Å; R59-T65 VanDerWaalsContact CA-O 3.31Å; R59-T65 WeakPolarHBondContact CA-O 3.32Å
60	C	89.9	Confident	83.5	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	41%	0.413	C	S	.	.			trans	-58.9	118.5	175.4	173.4	0	0	0	0	110.6	G54 L62 C63 G64 T65 F67 C85	G54-C60 WeakPolarHBondContact CA-O 3.42Å; C60-L62 PolarHBondContact O-N 3.47Å; C60-C63 PolarHBondContact O-N 3.35Å; C60-C63 PolarHBondContact SG-SG 3.22Å; C60-G64 WeakPolarHBondContact O-CA 3.3Å; C60-G64 PolarHBondContact O-N 3.08Å; C60-T65 PolarHBondContact N-O 3.23Å; C60-F67 VanDerWaalsContact CA-CZ 3.49Å; C60-F67 HydrophobicContact CB-CE1 4.2Å; C60-F67 HydrophobicContact CB-CZ 3.85Å; C60-C85 HydrophobicContact CB-CB 4.21Å; C60-C85 PolarHBondContact SG-N 2.83Å
61	L	88.6	Confident	82.3	Confident	19 Å²	19	63 Å²	63	10%	0.099	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-41.8	-36.7	179.3	175.6	60.8	0	0	0	114.2	G54 R59 K82 H83 C102	G54-L61 PolarHBondContact N-O 3.36Å; G54-L61 VanDerWaalsContact N-O 3.11Å; R59-L61 PolarHBondContact O-N 3.23Å; R59-L61 VanDerWaalsContact O-N 3.16Å; L61-K82 HydrophobicContact CD1-CD 3.68Å; L61-K82 HydrophobicContact CD2-CB 4.03Å; L61-K82 HydrophobicContact CD2-CD 3.96Å; L61-K82 HydrophobicContact CG-CD 4.35Å; L61-H83 WeakPolarHBondContact CB-O 3.29Å; L61-H83 PolarHBondContact N-O 3.04Å; L61-C102 HydrophobicContact CD2-CB 4.35Å
62	L	87.9	Confident	81.4	Confident	18 Å²	18	61 Å²	61	9%	0.094	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-60	-174.7	-65.2	168.4	0	0	0	112.1	I48 A52 C53 C60 C88 C102 R103 I104	I48-L62 HydrophobicContact CG2-CD2 4.03Å; A52-L62 HydrophobicContact CB-CD2 4.14Å; C53-L62 PolarHBondContact N-O 2.88Å; C60-L62 PolarHBondContact O-N 3.47Å; L62-C88 HydrophobicContact CB-CB 4.04Å; L62-C88 HydrophobicContact CD1-CB 3.89Å; L62-C88 WeakPolarHBondContact CD1-O 3.41Å; L62-C102 HydrophobicContact CD1-CB 4.12Å; L62-R103 HydrophobicContact CD1-CB 3.83Å; L62-R103 HydrophobicContact CD1-CG 4.05Å; L62-I104 HydrophobicContact CD2-CD1 3.65Å; L62-I104 HydrophobicContact CD2-CG1 3.84Å
63	C	88.5	Confident	81	Confident	59 Å²	59	64 Å²	64	40%	0.399	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.2	2.4	-172.5	68	0	0	0	0	115.5	C60 T65 C85 C88	C60-C63 PolarHBondContact O-N 3.35Å; C60-C63 PolarHBondContact SG-SG 3.22Å; C63-T65 PolarHBondContact O-N 2.97Å; C63-T65 PolarHBondContact SG-OG1 3.04Å; C63-C85 VanDerWaalsContact SG-SG 3.61Å; C63-C88 VanDerWaalsContact SG-SG 3.69Å
64	G	86.4	Confident	81	Confident	19 Å²	19	62.2 Å²	62.2	20%	0.196	39%	0.388	C	S	.	.			trans	69.8	-5.4	176.8	0	0	0	0	0	116.3	R59 C60 S66	R59-G64 WeakPolarHBondContact CB-O 3.49Å; R59-G64 VanDerWaalsContact CD-O 3.25Å; R59-G64 WeakPolarHBondContact CD-O 3.31Å; R59-G64 WeakPolarHBondContact CG-O 3.3Å; C60-G64 WeakPolarHBondContact O-CA 3.3Å; C60-G64 PolarHBondContact O-N 3.08Å; G64-S66 PolarHBondContact O-N 2.8Å
65	T	88.9	Confident	81.2	Confident	61 Å²	61	62.4 Å²	62.4	37%	0.374	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-60.8	131.9	178.4	-46.2	0	0	0	0	111.5	R59 C60 C63	R59-T65 CarbonylContact C-O 3.56Å; R59-T65 VanDerWaalsContact CA-O 3.31Å; R59-T65 WeakPolarHBondContact CA-O 3.32Å; C60-T65 PolarHBondContact N-O 3.23Å; C63-T65 PolarHBondContact O-N 2.97Å; C63-T65 PolarHBondContact SG-OG1 3.04Å
66	S	86.9	Confident	81.6	Confident	76 Å²	76	64.1 Å²	64.1	53%	0.531	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-71	150.9	176.3	43.8	0	0	0	0	113	G64	G64-S66 PolarHBondContact O-N 2.8Å
67	F	83.3	Confident	81.9	Confident	48 Å²	48	64 Å²	64	21%	0.211	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-97.1	131.7	172.2	-53	-59.5	0	0	0	109.7	S58 C60 V72 A74 H83 C85	S58-F67 WeakPolarHBondContact O-CD2 3.21Å; S58-F67 PolarHBondContact O-N 2.76Å; S58-F67 VanDerWaalsContact O-N 3.09Å; C60-F67 VanDerWaalsContact CA-CZ 3.49Å; C60-F67 HydrophobicContact CB-CE1 4.2Å; C60-F67 HydrophobicContact CB-CZ 3.85Å; F67-V72 WeakPolarHBondContact CD1-O 3.44Å; F67-A74 HydrophobicContact CB-CB 4.19Å; F67-A74 HydrophobicContact CD1-CB 3.5Å; F67-A74 HydrophobicContact CD2-CB 4.1Å; F67-A74 HydrophobicContact CE1-CB 3.76Å; F67-A74 HydrophobicContact CE2-CB 4.35Å; F67-A74 HydrophobicContact CG-CB 3.67Å; F67-A74 HydrophobicContact CZ-CB 4.17Å; F67-H83 HydrophobicContact CD2-CB 4.42Å; F67-H83 HydrophobicContact CE2-CB 3.54Å; F67-H83 HydrophobicContact CZ-CB 3.98Å; F67-C85 HydrophobicContact CE1-CB 4.17Å
68	G	72.8	Confident	82.2	Confident	57 Å²	57	58.4 Å²	58.4	59%	0.588	37%	0.371	S	S	*	.	S	Bend	trans	171.3	-170.7	-174.6	0	0	0	0	0	113.4	Q70 G71	G68-Q70 PolarHBondContact O-N 3.02Å; G68-G71 PolarHBondContact O-N 3.01Å
69	A	59.6	Low	82.5	Confident	115 Å²	115	60.1 Å²	60.1	95%	0.95	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-12.3	-167.1	0	0	0	0	0	116.8
70	Q	64.3	Low	82.6	Confident	207 Å²	207	57.3 Å²	57.3	97%	0.967	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128	14.3	171	-66.1	179.2	-17.4	0	0	111.8	G68	G68-Q70 PolarHBondContact O-N 3.02Å
71	G	62.8	Low	82.7	Confident	37 Å²	37	64.1 Å²	64.1	38%	0.381	40%	0.398	S	S	.	.	S	Bend	trans	-95.2	161.9	-172.3	0	0	0	0	0	114.3	G68	G68-G71 PolarHBondContact O-N 3.01Å
72	V	66.8	Low	82.9	Confident	50 Å²	50	67.1 Å²	67.1	30%	0.303	41%	0.41	S	S	.	.	P	Polyproline II helix	trans	-67.6	141.7	176.8	-171.3	0	0	0	0	110.3	F67 A74 C85	F67-V72 WeakPolarHBondContact CD1-O 3.44Å; V72-A74 PolarHBondContact O-N 2.88Å; V72-C85 HydrophobicContact CB-CB 3.94Å; V72-C85 HydrophobicContact CG1-CB 3.75Å
73	T	79.7	Confident	83	Confident	95 Å²	95	69.6 Å²	69.6	58%	0.583	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-50.7	125.5	-178.2	44.4	0	0	0	0	113.3	C85 S86	T73-C85 WeakPolarHBondContact O-CA 3.2Å; T73-S86 PolarHBondContact O-N 2.87Å; T73-S86 VanDerWaalsContact O-N 3.17Å; T73-S86 PolarHBondContact OG1-OG 3.2Å
74	A	85.4	Confident	83.1	Confident	55 Å²	55	66.9 Å²	66.9	46%	0.455	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	138	176.9	0	0	0	0	0	111.1	F67 V72	F67-A74 HydrophobicContact CB-CB 4.19Å; F67-A74 HydrophobicContact CD1-CB 3.5Å; F67-A74 HydrophobicContact CD2-CB 4.1Å; F67-A74 HydrophobicContact CE1-CB 3.76Å; F67-A74 HydrophobicContact CE2-CB 4.35Å; F67-A74 HydrophobicContact CG-CB 3.67Å; F67-A74 HydrophobicContact CZ-CB 4.17Å; V72-A74 PolarHBondContact O-N 2.88Å
75	V	89.3	Confident	83.3	Confident	19 Å²	19	66.1 Å²	66.1	12%	0.115	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	134	-174.7	-175.2	0	0	0	0	109.2	H83 M84 W100	V75-H83 CarbonylContact O-C 3.57Å; V75-H83 WeakPolarHBondContact O-CA 3.13Å; V75-M84 HydrophobicContact CB-CE 4.21Å; V75-M84 HydrophobicContact CB-CG 4.32Å; V75-M84 HydrophobicContact CG1-CE 3.79Å; V75-M84 PolarHBondContact N-O 2.91Å; V75-M84 PolarHBondContact O-N 2.75Å; V75-W100 HydrophobicContact CG1-CB 3.68Å; V75-W100 HydrophobicContact CG1-CD2 3.46Å; V75-W100 VanDerWaalsContact CG1-CD2 3.46Å; V75-W100 HydrophobicContact CG1-CE3 4.12Å; V75-W100 HydrophobicContact CG1-CG 3.24Å
76	L	91.8	Very high	83.1	Confident	83 Å²	83	65.1 Å²	65.1	44%	0.435	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	125.7	-178.7	-171.7	66.9	0	0	0	111.5	S78 K81	L76-S78 PolarHBondContact O-N 3.22Å; L76-K81 VanDerWaalsContact CD1-C 3.49Å; L76-K81 WeakPolarHBondContact CD1-O 3.21Å
77	C	92.5	Very high	83.1	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	40%	0.398	C	S	.	.			trans	-69.1	117.5	168.7	179.1	0	0	0	0	110.1	Q79 C80 K81 K82 M84 C102	C77-Q79 PolarHBondContact O-N 2.82Å; C77-C80 PolarHBondContact SG-SG 2.9Å; C77-K81 VanDerWaalsContact O-CA 3.24Å; C77-K81 WeakPolarHBondContact O-CA 3.13Å; C77-K81 PolarHBondContact O-N 3.31Å; C77-K82 WeakPolarHBondContact CB-O 3.45Å; C77-K82 PolarHBondContact N-O 2.76Å; C77-M84 HydrophobicContact CB-CE 4.14Å; C77-M84 HydrophobicContact CB-SD 3.93Å; C77-C102 HydrophobicContact CB-CB 4.24Å; C77-C102 PolarHBondContact SG-N 3.43Å
78	S	90.1	Very high	83.3	Confident	31 Å²	31	67.7 Å²	67.7	22%	0.217	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-24.7	-176.9	56.6	0	0	0	0	114.3	L76 K81 M99 W100 L101	L76-S78 PolarHBondContact O-N 3.22Å; S78-K81 WeakPolarHBondContact O-CE 3.5Å; S78-K81 PolarHBondContact O-NZ 3.37Å; S78-M99 WeakPolarHBondContact OG-CE 3.37Å; S78-W100 WeakPolarHBondContact CB-O 3.14Å; S78-W100 PolarHBondContact N-O 3Å; S78-W100 PolarHBondContact OG-O 3.44Å; S78-L101 WeakPolarHBondContact OG-CD2 3.37Å
79	Q	89.1	Confident	84	Confident	103 Å²	103	65.4 Å²	65.4	48%	0.481	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-64.2	178.9	-68.8	-73.9	-21.3	0	0	112.3	C77 K81 L101 C105	C77-Q79 PolarHBondContact O-N 2.82Å; Q79-K81 PolarHBondContact O-N 2.62Å; Q79-L101 HydrophobicContact CB-CD2 4.01Å; Q79-L101 HydrophobicContact CG-CD2 3.33Å; Q79-C105 HydrophobicContact CB-CB 4.16Å
80	C	90.5	Very high	85.3	Confident	52 Å²	52	62.6 Å²	62.6	35%	0.351	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-0.2	-175.6	67.6	0	0	0	0	115.3	C77 K82 C105	C77-C80 PolarHBondContact SG-SG 2.9Å; C80-K82 PolarHBondContact O-N 3.41Å; C80-K82 VanDerWaalsContact O-N 3.1Å; C80-C105 VanDerWaalsContact SG-SG 3.64Å
81	K	92.5	Very high	86.5	Confident	142 Å²	142	59.2 Å²	59.2	62%	0.617	32%	0.316	S	S	*	.			trans	54.4	26.3	179.5	-47.9	-55	-171.7	-172.6	0	114.8	L76 C77 S78 Q79	L76-K81 VanDerWaalsContact CD1-C 3.49Å; L76-K81 WeakPolarHBondContact CD1-O 3.21Å; C77-K81 VanDerWaalsContact O-CA 3.24Å; C77-K81 WeakPolarHBondContact O-CA 3.13Å; C77-K81 PolarHBondContact O-N 3.31Å; S78-K81 WeakPolarHBondContact O-CE 3.5Å; S78-K81 PolarHBondContact O-NZ 3.37Å; Q79-K81 PolarHBondContact O-N 2.62Å
82	K	91.3	Very high	87.4	Confident	83 Å²	83	59.8 Å²	59.8	36%	0.361	31%	0.31	S	S	.	.			trans	-102	149.9	173.7	-70.4	-162.7	171.1	-152.5	0	111.7	D55 L61 C77 C80	D55-K82 PolarHBondContact O-NZ 3.27Å; L61-K82 HydrophobicContact CD1-CD 3.68Å; L61-K82 HydrophobicContact CD2-CB 4.03Å; L61-K82 HydrophobicContact CD2-CD 3.96Å; L61-K82 HydrophobicContact CG-CD 4.35Å; C77-K82 WeakPolarHBondContact CB-O 3.45Å; C77-K82 PolarHBondContact N-O 2.76Å; C80-K82 PolarHBondContact O-N 3.41Å; C80-K82 VanDerWaalsContact O-N 3.1Å
83	H	90.8	Very high	87.8	Confident	70 Å²	70	63.9 Å²	63.9	32%	0.324	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	143.3	176.6	-64.6	101.8	0	0	0	113	G56 L61 F67 V75	G56-H83 WeakPolarHBondContact CA-O 3.43Å; G56-H83 PolarHBondContact O-N 2.74Å; L61-H83 WeakPolarHBondContact CB-O 3.29Å; L61-H83 PolarHBondContact N-O 3.04Å; F67-H83 HydrophobicContact CD2-CB 4.42Å; F67-H83 HydrophobicContact CE2-CB 3.54Å; F67-H83 HydrophobicContact CZ-CB 3.98Å; V75-H83 CarbonylContact O-C 3.57Å; V75-H83 WeakPolarHBondContact O-CA 3.13Å
84	M	91.4	Very high	87.3	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	157.8	174	66.5	-140.2	167	0	0	109.4	V75 C77 C88 W100 L101 C102	V75-M84 HydrophobicContact CB-CE 4.21Å; V75-M84 HydrophobicContact CB-CG 4.32Å; V75-M84 HydrophobicContact CG1-CE 3.79Å; V75-M84 PolarHBondContact N-O 2.91Å; V75-M84 PolarHBondContact O-N 2.75Å; C77-M84 HydrophobicContact CB-CE 4.14Å; C77-M84 HydrophobicContact CB-SD 3.93Å; M84-C88 HydrophobicContact CB-CB 4.42Å; M84-W100 HydrophobicContact CE-CB 3.67Å; M84-W100 HydrophobicContact CE-CE3 4.4Å; M84-W100 HydrophobicContact CE-CG 4.42Å; M84-L101 WeakPolarHBondContact CE-O 3.12Å; M84-C102 WeakPolarHBondContact SD-CA 3.27Å; M84-C102 HydrophobicContact SD-CB 3.43Å; M84-C102 WeakPolarHBondContact SD-CB 3.12Å; M84-C102 PolarHBondContact SD-N 2.86Å; M84-C102 VanDerWaalsContact SD-N 3.39Å
85	C	89.3	Confident	86.1	Confident	4 Å²	4	71.1 Å²	71.1	3%	0.027	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	154.8	168.9	71.9	0	0	0	0	110.3	C60 C63 F67 V72 T73 K87 C88 G89	C60-C85 HydrophobicContact CB-CB 4.21Å; C60-C85 PolarHBondContact SG-N 2.83Å; C63-C85 VanDerWaalsContact SG-SG 3.61Å; F67-C85 HydrophobicContact CE1-CB 4.17Å; V72-C85 HydrophobicContact CB-CB 3.94Å; V72-C85 HydrophobicContact CG1-CB 3.75Å; T73-C85 WeakPolarHBondContact O-CA 3.2Å; C85-K87 PolarHBondContact O-N 3.49Å; C85-K87 VanDerWaalsContact O-N 3.12Å; C85-C88 CarbonylContact O-C 3.53Å; C85-C88 WeakPolarHBondContact O-CA 3.49Å; C85-C88 PolarHBondContact O-N 2.73Å; C85-C88 VanDerWaalsContact SG-SG 3.62Å; C85-G89 PolarHBondContact O-N 2.79Å
86	S	86.1	Confident	84.8	Confident	40 Å²	40	76.6 Å²	76.6	28%	0.28	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-31.1	178.3	43.9	0	0	0	0	114.7	T73 C88	T73-S86 PolarHBondContact O-N 2.87Å; T73-S86 VanDerWaalsContact O-N 3.17Å; T73-S86 PolarHBondContact OG1-OG 3.2Å; S86-C88 VanDerWaalsContact C-N 3.34Å; S86-C88 PolarHBondContact O-N 2.89Å
87	K	86.1	Confident	83.5	Confident	161 Å²	161	76.6 Å²	76.6	70%	0.7	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-23.2	174.2	-61.5	-176.1	178.9	-178	0	114.1	C85 R103	C85-K87 PolarHBondContact O-N 3.49Å; C85-K87 VanDerWaalsContact O-N 3.12Å; K87-R103 PolarHBondContact O-NH2 3.07Å
88	C	87.5	Confident	82.8	Confident	16 Å²	16	79.3 Å²	79.3	11%	0.108	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-11.1	179.9	-73.5	0	0	0	0	113.1	L62 C63 M84 C85 S86	L62-C88 HydrophobicContact CB-CB 4.04Å; L62-C88 HydrophobicContact CD1-CB 3.89Å; L62-C88 WeakPolarHBondContact CD1-O 3.41Å; C63-C88 VanDerWaalsContact SG-SG 3.69Å; M84-C88 HydrophobicContact CB-CB 4.42Å; C85-C88 CarbonylContact O-C 3.53Å; C85-C88 WeakPolarHBondContact O-CA 3.49Å; C85-C88 PolarHBondContact O-N 2.73Å; C85-C88 VanDerWaalsContact SG-SG 3.62Å; S86-C88 VanDerWaalsContact C-N 3.34Å; S86-C88 PolarHBondContact O-N 2.89Å
89	G	86.7	Confident	82.8	Confident	9 Å²	9	80.7 Å²	80.7	9%	0.093	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	162.7	165.2	0	0	0	0	0	112.5	C85 L101	C85-G89 PolarHBondContact O-N 2.79Å; G89-L101 CarbonylContact C-O 3.45Å; G89-L101 VanDerWaalsContact CA-O 3.3Å; G89-L101 WeakPolarHBondContact CA-O 3.49Å
90	I	88.5	Confident	82.8	Confident	56 Å²	56	79.3 Å²	79.3	29%	0.287	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	128.6	165.2	-65.9	170	0	0	0	106.5	I92 W100 L101 R103 N106	I90-I92 HydrophobicContact CG2-CG1 4.26Å; I90-W100 VanDerWaalsContact C-CE3 3.42Å; I90-W100 WeakPolarHBondContact O-CA 3.4Å; I90-L101 PolarHBondContact N-O 2.89Å; I90-L101 PolarHBondContact O-N 3.02Å; I90-R103 HydrophobicContact CD1-CG 4.1Å; I90-R103 HydrophobicContact CG1-CG 4.4Å; I90-N106 HydrophobicContact CD1-CB 3.71Å
91	W	87.7	Confident	82.9	Confident	136 Å²	136	76.9 Å²	76.9	52%	0.515	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	113.3	176.1	175.7	-106.6	0	0	0	109.3	P98 W100	W91-P98 HydrophobicContact CH2-CB 3.67Å; W91-P98 HydrophobicContact CH2-CG 3.84Å; W91-P98 HydrophobicContact CZ2-CB 3.44Å; W91-P98 VanDerWaalsContact CZ2-CB 3.44Å; W91-P98 HydrophobicContact CZ2-CG 3.85Å; W91-P98 HydrophobicContact CZ3-CB 4.27Å; W91-W100 HydrophobicContact CB-CD2 4.32Å; W91-W100 HydrophobicContact CB-CE3 4.12Å; W91-W100 HydrophobicContact CB-CH2 4.1Å; W91-W100 HydrophobicContact CB-CZ2 4.29Å; W91-W100 HydrophobicContact CB-CZ3 4.01Å; W91-W100 AromaticContact CE3-CD1 3.5Å; W91-W100 VanDerWaalsContact CE3-CD1 3.5Å; W91-W100 AromaticContact CE3-CD2 3.85Å; W91-W100 HydrophobicContact CE3-CD2 3.85Å; W91-W100 AromaticContact CE3-CE2 3.49Å; W91-W100 VanDerWaalsContact CE3-CE2 3.49Å; W91-W100 AromaticContact CE3-CG 3.87Å; W91-W100 HydrophobicContact CE3-CG 3.87Å; W91-W100 HydrophobicContact CE3-CZ2 4.13Å; W91-W100 AromaticContact CE3-NE1 3.23Å; W91-W100 AromaticContact CZ3-CD1 3.57Å; W91-W100 HydrophobicContact CZ3-CG 4.36Å; W91-W100 AromaticContact CZ3-NE1 3.35Å; W91-W100 VanDerWaalsContact CZ3-NE1 3.35Å
92	I	83.2	Confident	82.9	Confident	50 Å²	50	70.1 Å²	70.1	26%	0.256	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	113.1	176.5	-62	-171.8	0	0	0	108.8	I90 S94 P98 M99 L101	I90-I92 HydrophobicContact CG2-CG1 4.26Å; I92-S94 VanDerWaalsContact C-N 3.33Å; I92-S94 PolarHBondContact O-N 2.87Å; I92-P98 WeakPolarHBondContact O-CA 3.48Å; I92-M99 HydrophobicContact CB-CG 4.12Å; I92-M99 PolarHBondContact N-O 2.71Å; I92-M99 PolarHBondContact O-N 2.77Å; I92-L101 HydrophobicContact CD1-CD1 3.45Å; I92-L101 VanDerWaalsContact CD1-CD1 3.45Å; I92-L101 HydrophobicContact CD1-CG 3.88Å
93	N	74.8	Confident	82.8	Confident	136 Å²	136	72.1 Å²	72.1	73%	0.727	35%	0.353	S	S	*	.			trans	-81.6	76	177.4	-165.6	18.2	0	0	0	110.9
94	S	69.3	Low	82.7	Confident	44 Å²	44	70.3 Å²	70.3	31%	0.308	35%	0.345	S	S	.	.			trans	-82.6	140.9	177	179.2	0	0	0	0	111.7	I92 T96 C97	I92-S94 VanDerWaalsContact C-N 3.33Å; I92-S94 PolarHBondContact O-N 2.87Å; S94-T96 PolarHBondContact O-N 2.99Å; S94-T96 PolarHBondContact OG-OG1 3.13Å; S94-C97 WeakPolarHBondContact CB-O 3.33Å; S94-C97 CarbonylContact O-C 3.59Å; S94-C97 PolarHBondContact O-N 2.75Å
95	R	60.1	Low	82.6	Confident	258 Å²	258	71.1 Å²	71.1	97%	0.974	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-13.9	-175.7	-50.2	-175.6	-160	-144.2	2.8	114.7
96	T	60.9	Low	82.6	Confident	134 Å²	134	72.1 Å²	72.1	82%	0.822	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-28.1	-177.9	51.2	0	0	0	0	113.8	S94	S94-T96 PolarHBondContact O-N 2.99Å; S94-T96 PolarHBondContact OG-OG1 3.13Å
97	C	64.4	Low	82.7	Confident	82 Å²	82	71.4 Å²	71.4	55%	0.554	35%	0.348	S	S	*	.			trans	-172.8	128.9	170.4	-173.5	0	0	0	0	108.5	S94	S94-C97 WeakPolarHBondContact CB-O 3.33Å; S94-C97 CarbonylContact O-C 3.59Å; S94-C97 PolarHBondContact O-N 2.75Å
98	P	79.1	Confident	82.6	Confident	57 Å²	57	66.7 Å²	66.7	37%	0.37	33%	0.329	S	S	.	.			trans	-69.4	139	174.4	30.7	-35.2	0	0	0	110.7	W91 I92	W91-P98 HydrophobicContact CH2-CB 3.67Å; W91-P98 HydrophobicContact CH2-CG 3.84Å; W91-P98 HydrophobicContact CZ2-CB 3.44Å; W91-P98 VanDerWaalsContact CZ2-CB 3.44Å; W91-P98 HydrophobicContact CZ2-CG 3.85Å; W91-P98 HydrophobicContact CZ3-CB 4.27Å; I92-P98 WeakPolarHBondContact O-CA 3.48Å
99	M	88.8	Confident	82.5	Confident	60 Å²	60	68.7 Å²	68.7	30%	0.296	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	140	-169.2	64.7	-168.3	-64.9	0	0	112.8	S78 I92	S78-M99 WeakPolarHBondContact OG-CE 3.37Å; I92-M99 HydrophobicContact CB-CG 4.12Å; I92-M99 PolarHBondContact N-O 2.71Å; I92-M99 PolarHBondContact O-N 2.77Å
100	W	90.8	Very high	82.3	Confident	75 Å²	75	70.5 Å²	70.5	28%	0.284	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	138.3	174.9	-76.8	104.8	0	0	0	112.1	V75 S78 M84 I90 W91	V75-W100 HydrophobicContact CG1-CB 3.68Å; V75-W100 HydrophobicContact CG1-CD2 3.46Å; V75-W100 VanDerWaalsContact CG1-CD2 3.46Å; V75-W100 HydrophobicContact CG1-CE3 4.12Å; V75-W100 HydrophobicContact CG1-CG 3.24Å; S78-W100 WeakPolarHBondContact CB-O 3.14Å; S78-W100 PolarHBondContact N-O 3Å; S78-W100 PolarHBondContact OG-O 3.44Å; M84-W100 HydrophobicContact CE-CB 3.67Å; M84-W100 HydrophobicContact CE-CE3 4.4Å; M84-W100 HydrophobicContact CE-CG 4.42Å; I90-W100 VanDerWaalsContact C-CE3 3.42Å; I90-W100 WeakPolarHBondContact O-CA 3.4Å; W91-W100 HydrophobicContact CB-CD2 4.32Å; W91-W100 HydrophobicContact CB-CE3 4.12Å; W91-W100 HydrophobicContact CB-CH2 4.1Å; W91-W100 HydrophobicContact CB-CZ2 4.29Å; W91-W100 HydrophobicContact CB-CZ3 4.01Å; W91-W100 AromaticContact CE3-CD1 3.5Å; W91-W100 VanDerWaalsContact CE3-CD1 3.5Å; W91-W100 AromaticContact CE3-CD2 3.85Å; W91-W100 HydrophobicContact CE3-CD2 3.85Å; W91-W100 AromaticContact CE3-CE2 3.49Å; W91-W100 VanDerWaalsContact CE3-CE2 3.49Å; W91-W100 AromaticContact CE3-CG 3.87Å; W91-W100 HydrophobicContact CE3-CG 3.87Å; W91-W100 HydrophobicContact CE3-CZ2 4.13Å; W91-W100 AromaticContact CE3-NE1 3.23Å; W91-W100 AromaticContact CZ3-CD1 3.57Å; W91-W100 HydrophobicContact CZ3-CG 4.36Å; W91-W100 AromaticContact CZ3-NE1 3.35Å; W91-W100 VanDerWaalsContact CZ3-NE1 3.35Å
101	L	92.5	Very high	82	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	152.7	166.5	-65	-169.6	0	0	0	111.1	S78 Q79 M84 G89 I90 I92 C105 N106	S78-L101 WeakPolarHBondContact OG-CD2 3.37Å; Q79-L101 HydrophobicContact CB-CD2 4.01Å; Q79-L101 HydrophobicContact CG-CD2 3.33Å; M84-L101 WeakPolarHBondContact CE-O 3.12Å; G89-L101 CarbonylContact C-O 3.45Å; G89-L101 VanDerWaalsContact CA-O 3.3Å; G89-L101 WeakPolarHBondContact CA-O 3.49Å; I90-L101 PolarHBondContact N-O 2.89Å; I90-L101 PolarHBondContact O-N 3.02Å; I92-L101 HydrophobicContact CD1-CD1 3.45Å; I92-L101 VanDerWaalsContact CD1-CD1 3.45Å; I92-L101 HydrophobicContact CD1-CG 3.88Å; L101-C105 HydrophobicContact CB-CB 4.46Å; L101-C105 HydrophobicContact CD2-CB 4.35Å; L101-N106 HydrophobicContact CB-CB 4.32Å; L101-N106 HydrophobicContact CD1-CB 4.12Å
102	C	91.5	Very high	81.5	Confident	1 Å²	1	64.1 Å²	64.1	1%	0.007	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	156	161.2	70.2	0	0	0	0	109.9	L61 L62 C77 M84 I104 C105 N106	L61-C102 HydrophobicContact CD2-CB 4.35Å; L62-C102 HydrophobicContact CD1-CB 4.12Å; C77-C102 HydrophobicContact CB-CB 4.24Å; C77-C102 PolarHBondContact SG-N 3.43Å; M84-C102 WeakPolarHBondContact SD-CA 3.27Å; M84-C102 HydrophobicContact SD-CB 3.43Å; M84-C102 WeakPolarHBondContact SD-CB 3.12Å; M84-C102 PolarHBondContact SD-N 2.86Å; M84-C102 VanDerWaalsContact SD-N 3.39Å; C102-I104 PolarHBondContact O-N 3.31Å; C102-C105 PolarHBondContact O-N 2.9Å; C102-C105 PolarHBondContact SG-N 2.9Å; C102-C105 VanDerWaalsContact SG-N 3.41Å; C102-N106 PolarHBondContact O-N 2.68Å
103	R	88.6	Confident	81.2	Confident	124 Å²	124	67.2 Å²	67.2	47%	0.468	33%	0.329	S	S	.	.	H	α-helix	trans	-52.4	-39.1	178.5	-63	-177.1	-172.3	-163.4	3.2	113	I48 L62 K87 I90 N106 E107	I48-R103 HydrophobicContact CG2-CB 4.38Å; L62-R103 HydrophobicContact CD1-CB 3.83Å; L62-R103 HydrophobicContact CD1-CG 4.05Å; K87-R103 PolarHBondContact O-NH2 3.07Å; I90-R103 HydrophobicContact CD1-CG 4.1Å; I90-R103 HydrophobicContact CG1-CG 4.4Å; R103-N106 PolarHBondContact O-N 2.83Å; R103-E107 VanDerWaalsContact O-CB 3.22Å; R103-E107 WeakPolarHBondContact O-CB 3.43Å; R103-E107 PolarHBondContact O-N 3.17Å
104	I	89.9	Confident	81.2	Confident	32 Å²	32	67.9 Å²	67.9	16%	0.164	32%	0.322	C	S	.	.	H	α-helix	trans	-59.8	-47.9	174.6	-66.3	165.5	0	0	0	111.5	L45 I48 K49 A52 L62 C102 Q108	L45-I104 HydrophobicContact CD1-CG2 4.1Å; I48-I104 HydrophobicContact CB-CG1 4.48Å; I48-I104 HydrophobicContact CG2-CD1 4.48Å; I48-I104 HydrophobicContact CG2-CG1 3.62Å; K49-I104 HydrophobicContact CG-CD1 4.44Å; K49-I104 HydrophobicContact CG-CG1 4.47Å; K49-I104 HydrophobicContact CG-CG2 4.27Å; A52-I104 HydrophobicContact CB-CD1 4.07Å; L62-I104 HydrophobicContact CD2-CD1 3.65Å; L62-I104 HydrophobicContact CD2-CG1 3.84Å; C102-I104 PolarHBondContact O-N 3.31Å; I104-Q108 WeakPolarHBondContact O-CB 3.14Å; I104-Q108 PolarHBondContact O-N 3.12Å
105	C	89.3	Confident	81.4	Confident	19 Å²	19	66.7 Å²	66.7	13%	0.128	31%	0.313	C	S	.	.	H	α-helix	trans	-69.3	-34.2	-179.9	-73	0	0	0	0	112.8	Q79 C80 L101 C102 Q109	Q79-C105 HydrophobicContact CB-CB 4.16Å; C80-C105 VanDerWaalsContact SG-SG 3.64Å; L101-C105 HydrophobicContact CB-CB 4.46Å; L101-C105 HydrophobicContact CD2-CB 4.35Å; C102-C105 PolarHBondContact O-N 2.9Å; C102-C105 PolarHBondContact SG-N 2.9Å; C102-C105 VanDerWaalsContact SG-N 3.41Å; C105-Q109 WeakPolarHBondContact O-CG 3.08Å; C105-Q109 PolarHBondContact O-N 2.89Å; C105-Q109 VanDerWaalsContact O-N 3.14Å
106	N	89.5	Confident	82	Confident	25 Å²	25	55.6 Å²	55.6	13%	0.134	28%	0.279	C	S	.	.	H	α-helix	trans	-67.1	-53.5	174.8	-167.5	99	0	0	0	110.9	I90 L101 C102 R103 Q108 Q109 E110	I90-N106 HydrophobicContact CD1-CB 3.71Å; L101-N106 HydrophobicContact CB-CB 4.32Å; L101-N106 HydrophobicContact CD1-CB 4.12Å; C102-N106 PolarHBondContact O-N 2.68Å; R103-N106 PolarHBondContact O-N 2.83Å; N106-Q108 VanDerWaalsContact C-N 3.25Å; N106-Q108 PolarHBondContact O-N 2.9Å; N106-Q109 WeakPolarHBondContact O-CA 3.31Å; N106-Q109 WeakPolarHBondContact O-CB 3.27Å; N106-Q109 PolarHBondContact O-N 2.91Å; N106-E110 PolarHBondContact O-N 2.92Å
107	E	87	Confident	82.5	Confident	25 Å²	25	51.2 Å²	51.2	12%	0.117	26%	0.257	C	S	.	.	H	α-helix	trans	-60.8	-36	178	-158.2	78.8	-146.6	0	0	111.4	R44 L45 I48 R103 Q109 E110 V111	R44-E107 WeakPolarHBondContact CD-OE1 3.39Å; R44-E107 HydrophobicContact CG-CG 4.5Å; R44-E107 IonicContact CZ-OE1 3.59Å; R44-E107 IonicContact CZ-OE2 2.76Å; R44-E107 VanDerWaalsContact CZ-OE2 3.31Å; R44-E107 IonicContact NE-OE1 2.67Å; R44-E107 PolarHBondContact NE-OE1 2.97Å; R44-E107 IonicContact NE-OE2 3.56Å; R44-E107 PolarHBondContact NE-OE2 2.83Å; R44-E107 IonicContact NH2-OE1 2.78Å; R44-E107 IonicContact NH2-OE2 2.95Å; R44-E107 PolarHBondContact NH2-OE2 2.92Å; L45-E107 HydrophobicContact CB-CB 4.46Å; L45-E107 HydrophobicContact CB-CG 3.89Å; L45-E107 HydrophobicContact CD1-CB 4.07Å; L45-E107 HydrophobicContact CD1-CG 4.42Å; I48-E107 HydrophobicContact CD1-CB 4.36Å; I48-E107 HydrophobicContact CD1-CG 4.1Å; R103-E107 VanDerWaalsContact O-CB 3.22Å; R103-E107 WeakPolarHBondContact O-CB 3.43Å; R103-E107 PolarHBondContact O-N 3.17Å; E107-Q109 VanDerWaalsContact C-N 3.31Å; E107-Q109 PolarHBondContact O-N 3.05Å; E107-E110 PolarHBondContact O-N 2.88Å; E107-V111 WeakPolarHBondContact O-CG2 3.31Å; E107-V111 PolarHBondContact O-N 2.83Å
108	Q	85.4	Confident	82.6	Confident	62 Å²	62	54.8 Å²	54.8	29%	0.29	26%	0.259	S	S	.	.	H	α-helix	trans	-64.6	-32.4	173.7	-178.5	63.8	93.1	0	0	112.9	L45 I104 N106 Q112	L45-Q108 HydrophobicContact CD1-CB 4.11Å; L45-Q108 HydrophobicContact CD2-CB 4.26Å; I104-Q108 WeakPolarHBondContact O-CB 3.14Å; I104-Q108 PolarHBondContact O-N 3.12Å; N106-Q108 VanDerWaalsContact C-N 3.25Å; N106-Q108 PolarHBondContact O-N 2.9Å; Q108-Q112 VanDerWaalsContact NE2-NE2 3.19Å; Q108-Q112 WeakPolarHBondContact O-CB 3Å; Q108-Q112 VanDerWaalsContact O-CG 3.28Å; Q108-Q112 WeakPolarHBondContact O-CG 3.02Å; Q108-Q112 PolarHBondContact O-N 2.94Å
109	Q	84.4	Confident	81.4	Confident	58 Å²	58	58.1 Å²	58.1	27%	0.271	27%	0.268	S	S	.	.	H	α-helix	trans	-73.2	-42.9	170.9	-74.2	-179.5	-2.4	0	0	111.4	C105 N106 E107 V111 Q112 K113	C105-Q109 WeakPolarHBondContact O-CG 3.08Å; C105-Q109 PolarHBondContact O-N 2.89Å; C105-Q109 VanDerWaalsContact O-N 3.14Å; N106-Q109 WeakPolarHBondContact O-CA 3.31Å; N106-Q109 WeakPolarHBondContact O-CB 3.27Å; N106-Q109 PolarHBondContact O-N 2.91Å; E107-Q109 VanDerWaalsContact C-N 3.31Å; E107-Q109 PolarHBondContact O-N 3.05Å; Q109-V111 PolarHBondContact O-N 2.9Å; Q109-Q112 CarbonylContact O-C 3.54Å; Q109-Q112 PolarHBondContact O-N 2.86Å; Q109-Q112 VanDerWaalsContact O-N 3.16Å; Q109-K113 WeakPolarHBondContact O-CG 3.47Å; Q109-K113 PolarHBondContact O-N 2.81Å
110	E	82.2	Confident	79.8	Confident	47 Å²	47	61.2 Å²	61.2	22%	0.22	28%	0.277	C	S	.	.	H	α-helix	trans	-62.2	-42.1	176.9	-64.9	-44.7	124.1	0	0	112.8	N106 E107 K113 R114	N106-E110 PolarHBondContact O-N 2.92Å; E107-E110 PolarHBondContact O-N 2.88Å; E110-K113 PolarHBondContact O-N 2.73Å; E110-K113 WeakPolarHBondContact OE1-CE 3.16Å; E110-K113 IonicContact OE1-NZ 3.17Å; E110-K113 PolarHBondContact OE1-NZ 2.8Å; E110-K113 WeakPolarHBondContact OE2-CD 3.35Å; E110-K113 IonicContact OE2-NZ 2.65Å; E110-K113 PolarHBondContact OE2-NZ 2.91Å; E110-R114 WeakPolarHBondContact O-CB 3.3Å; E110-R114 VanDerWaalsContact O-CG 3.29Å; E110-R114 WeakPolarHBondContact O-CG 3.37Å; E110-R114 PolarHBondContact O-N 3.1Å
111	V	81.9	Confident	77.9	Confident	14 Å²	14	65 Å²	65	9%	0.085	30%	0.295	C	S	.	.	H	α-helix	trans	-60.5	-47.5	171.4	173	0	0	0	0	110.3	L41 L45 E107 Q109 K113 R114 S115	L41-V111 WeakPolarHBondContact O-CG2 3.36Å; L45-V111 HydrophobicContact CB-CG2 4.28Å; L45-V111 HydrophobicContact CD2-CG2 4.23Å; E107-V111 WeakPolarHBondContact O-CG2 3.31Å; E107-V111 PolarHBondContact O-N 2.83Å; Q109-V111 PolarHBondContact O-N 2.9Å; V111-K113 VanDerWaalsContact C-N 3.3Å; V111-K113 PolarHBondContact O-N 2.59Å; V111-R114 PolarHBondContact O-N 2.88Å; V111-S115 WeakPolarHBondContact O-CB 3.15Å; V111-S115 PolarHBondContact O-N 2.78Å; V111-S115 PolarHBondContact O-OG 2.85Å
112	Q	77.3	Confident	75.9	Confident	43 Å²	43	69 Å²	69	20%	0.201	34%	0.337	C	S	.	.	H	α-helix	trans	-63.2	-31.6	179	-78.3	172.6	27.9	0	0	113.5	Q108 Q109 G116 A117 W118	Q108-Q112 VanDerWaalsContact NE2-NE2 3.19Å; Q108-Q112 WeakPolarHBondContact O-CB 3Å; Q108-Q112 VanDerWaalsContact O-CG 3.28Å; Q108-Q112 WeakPolarHBondContact O-CG 3.02Å; Q108-Q112 PolarHBondContact O-N 2.94Å; Q109-Q112 CarbonylContact O-C 3.54Å; Q109-Q112 PolarHBondContact O-N 2.86Å; Q109-Q112 VanDerWaalsContact O-N 3.16Å; Q112-G116 CarbonylContact O-C 3.47Å; Q112-G116 PolarHBondContact O-N 3.15Å; Q112-A117 PolarHBondContact O-N 2.84Å; Q112-W118 HydrophobicContact CB-CB 4.5Å; Q112-W118 VanDerWaalsContact O-CD1 3.28Å; Q112-W118 PolarHBondContact O-N 2.84Å
113	K	77.6	Confident	74	Confident	115 Å²	115	78.1 Å²	78.1	50%	0.5	37%	0.371	S	S	.	.	H	α-helix	trans	-66.8	-54.6	169.7	-69.8	170.5	-176.8	176	0	110.9	Q109 E110 V111 S115 G116	Q109-K113 WeakPolarHBondContact O-CG 3.47Å; Q109-K113 PolarHBondContact O-N 2.81Å; E110-K113 PolarHBondContact O-N 2.73Å; E110-K113 WeakPolarHBondContact OE1-CE 3.16Å; E110-K113 IonicContact OE1-NZ 3.17Å; E110-K113 PolarHBondContact OE1-NZ 2.8Å; E110-K113 WeakPolarHBondContact OE2-CD 3.35Å; E110-K113 IonicContact OE2-NZ 2.65Å; E110-K113 PolarHBondContact OE2-NZ 2.91Å; V111-K113 VanDerWaalsContact C-N 3.3Å; V111-K113 PolarHBondContact O-N 2.59Å; K113-S115 PolarHBondContact O-N 2.77Å; K113-G116 PolarHBondContact O-N 2.75Å; K113-G116 VanDerWaalsContact O-N 3.15Å
114	R	74	Confident	72.1	Confident	150 Å²	150	79.8 Å²	79.8	57%	0.566	39%	0.389	S	S	*	.	H	α-helix	trans	-72.3	-22.6	-171	-69	175.4	177.7	-128.8	-6.7	114.5	R37 L41 E110 V111	R37-R114 PolarHBondContact NH1-O 3.06Å; R37-R114 PolarHBondContact NH2-O 3.45Å; R37-R114 VanDerWaalsContact NH2-O 3.15Å; L41-R114 HydrophobicContact CD1-CB 4Å; L41-R114 HydrophobicContact CD2-CB 4.21Å; E110-R114 WeakPolarHBondContact O-CB 3.3Å; E110-R114 VanDerWaalsContact O-CG 3.29Å; E110-R114 WeakPolarHBondContact O-CG 3.37Å; E110-R114 PolarHBondContact O-N 3.1Å; V111-R114 PolarHBondContact O-N 2.88Å
115	S	74.5	Confident	70.5	Confident	19 Å²	19	86 Å²	86	13%	0.133	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-3	170.6	67.6	0	0	0	0	114.1	V111 K113 A117	V111-S115 WeakPolarHBondContact O-CB 3.15Å; V111-S115 PolarHBondContact O-N 2.78Å; V111-S115 PolarHBondContact O-OG 2.85Å; K113-S115 PolarHBondContact O-N 2.77Å; S115-A117 PolarHBondContact O-N 2.89Å; S115-A117 VanDerWaalsContact OG-CB 3.24Å; S115-A117 WeakPolarHBondContact OG-CB 3.43Å; S115-A117 PolarHBondContact OG-N 3.01Å
116	G	72.1	Confident	69	Low	25 Å²	25	94.3 Å²	94.3	26%	0.258	46%	0.455	S	S	.	.	S	Bend	trans	66.7	-2.3	-171.9	0	0	0	0	0	115	Q112 K113 W118 F119	Q112-G116 CarbonylContact O-C 3.47Å; Q112-G116 PolarHBondContact O-N 3.15Å; K113-G116 PolarHBondContact O-N 2.75Å; K113-G116 VanDerWaalsContact O-N 3.15Å; G116-W118 PolarHBondContact O-N 2.86Å; G116-F119 WeakPolarHBondContact O-CB 3.03Å; G116-F119 PolarHBondContact O-N 3.38Å
117	A	71	Confident	67.8	Low	43 Å²	43	95.6 Å²	95.6	36%	0.355	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-11.2	-176.4	0	0	0	0	0	114.4	Q112 S115 F119	Q112-A117 PolarHBondContact O-N 2.84Å; S115-A117 PolarHBondContact O-N 2.89Å; S115-A117 VanDerWaalsContact OG-CB 3.24Å; S115-A117 WeakPolarHBondContact OG-CB 3.43Å; S115-A117 PolarHBondContact OG-N 3.01Å; A117-F119 PolarHBondContact O-N 2.95Å
118	W	67.2	Low	67.2	Low	156 Å²	156	98 Å²	98	59%	0.591	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-27	167.2	72.4	-92.5	0	0	0	113.4	Q112 G116	Q112-W118 HydrophobicContact CB-CB 4.5Å; Q112-W118 VanDerWaalsContact O-CD1 3.28Å; Q112-W118 PolarHBondContact O-N 2.84Å; G116-W118 PolarHBondContact O-N 2.86Å
119	F	52.8	Low	66.8	Low	127 Å²	127	99.1 Å²	99.1	56%	0.557	50%	0.5	S	S	*	.	S	Bend	trans	-79.9	-34.1	-175.4	-177	-100.7	0	0	0	114.1	G116 A117 K121	G116-F119 WeakPolarHBondContact O-CB 3.03Å; G116-F119 PolarHBondContact O-N 3.38Å; A117-F119 PolarHBondContact O-N 2.95Å; F119-K121 VanDerWaalsContact C-N 3.35Å; F119-K121 PolarHBondContact O-N 3.48Å
120	Y	57.1	Low	66.5	Low	126 Å²	126	101.1 Å²	101.1	49%	0.494	52%	0.521	S	S	.	.	S	Bend	trans	-91.1	5.7	-173.8	-61.9	-76.8	0	0	0	114.3	G122 R123	Y120-G122 PolarHBondContact O-N 3.48Å; Y120-R123 PolarHBondContact O-N 3.4Å; Y120-R123 VanDerWaalsContact O-N 3.08Å
121	K	49.7	Very low	66.5	Low	153 Å²	153	103.2 Å²	103.2	67%	0.665	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	94.8	-166.1	-158.3	168.6	-172.9	173.1	0	112	F119	F119-K121 VanDerWaalsContact C-N 3.35Å; F119-K121 PolarHBondContact O-N 3.48Å
122	G	50.8	Low	66.6	Low	85 Å²	85	105.4 Å²	105.4	88%	0.876	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.8	19.4	-176.1	0	0	0	0	0	114.9	Y120	Y120-G122 PolarHBondContact O-N 3.48Å
123	R	50.8	Low	66.6	Low	193 Å²	193	108.6 Å²	108.6	73%	0.728	57%	0.574	S	S	*	*	S	Bend	trans	-119.7	140.3	164.4	-70.5	-178.9	172.7	-176.4	-3.6	109.6	Y120 Q125	Y120-R123 PolarHBondContact O-N 3.4Å; Y120-R123 VanDerWaalsContact O-N 3.08Å; R123-Q125 PolarHBondContact O-N 3.29Å
124	D	50.3	Low	66.6	Low	158 Å²	158	106.2 Å²	106.2	85%	0.845	57%	0.566	S	S	*	*			trans	-66.3	125	170.9	-57.6	-56	0	0	0	109.5	Q126	D124-Q126 PolarHBondContact O-N 3.37Å
125	Q	56.3	Low	66.4	Low	163 Å²	163	103.8 Å²	103.8	76%	0.762	57%	0.572	S	S	*	*			trans	-76.3	104.8	172.1	-70.4	-177.8	-83.1	0	0	108.4	R123 G127	R123-Q125 PolarHBondContact O-N 3.29Å; Q125-G127 PolarHBondContact O-N 3.38Å; Q125-G127 VanDerWaalsContact O-N 3.11Å
126	Q	56.7	Low	66	Low	193 Å²	193	111.5 Å²	111.5	90%	0.902	60%	0.598	S	S	*	*			trans	-69.8	102.6	168.1	-67.5	179.9	-17.5	0	0	108.1	D124	D124-Q126 PolarHBondContact O-N 3.37Å
127	G	65.7	Low	64.8	Low	53 Å²	53	115.4 Å²	115.4	55%	0.546	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-65	165.1	174.1	0	0	0	0	0	112.1	Q125	Q125-G127 PolarHBondContact O-N 3.38Å; Q125-G127 VanDerWaalsContact O-N 3.11Å
128	L	72.5	Confident	63.6	Low	74 Å²	74	119 Å²	119	39%	0.387	64%	0.639	S	S	.	*	P	Polyproline II helix	trans	-58.5	137.4	-179.1	-69.9	168.4	0	0	0	111.9	L24 A27 A28 E31	L24-L128 HydrophobicContact CD2-CD2 4.27Å; A27-L128 HydrophobicContact CB-CD1 3.71Å; A27-L128 HydrophobicContact CB-CD2 3.74Å; A27-L128 HydrophobicContact CB-CG 4.41Å; A28-L128 HydrophobicContact CB-CD1 3.9Å; A28-L128 VanDerWaalsContact N-CD1 3.33Å; E31-L128 WeakPolarHBondContact OE2-CD1 3.29Å
129	P	78.2	Confident	62.7	Low	87 Å²	87	119.5 Å²	119.5	57%	0.565	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-68.4	155.2	175.8	30.4	-35.2	0	0	0	110.9	L24	L24-P129 HydrophobicContact CD1-CG 4.49Å; L24-P129 HydrophobicContact CD2-CG 3.75Å
130	S	77.8	Confident	62	Low	100 Å²	100	118.5 Å²	118.5	70%	0.699	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-61.4	143.4	175.5	53.7	0	0	0	0	111.9
131	P	81.6	Confident	61.1	Low	91 Å²	91	120.3 Å²	120.3	59%	0.591	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-51.4	144.2	173.1	-28.2	36	0	0	0	113.5	N21	N21-P131 WeakPolarHBondContact OD1-CA 3.19Å; N21-P131 WeakPolarHBondContact OD1-CB 3.43Å
132	L	84.6	Confident	60.4	Low	59 Å²	59	118.2 Å²	118.2	31%	0.309	68%	0.679	S	S	.	*	P	Polyproline II helix	trans	-74.9	136.3	176.6	-63.2	178.4	0	0	0	110.4	L12 K17 I20 N21 L134	L12-L132 HydrophobicContact CD1-CD1 3.86Å; K17-L132 HydrophobicContact CB-CB 4.22Å; K17-L132 HydrophobicContact CB-CD1 4.45Å; K17-L132 HydrophobicContact CG-CB 4.14Å; K17-L132 HydrophobicContact CG-CD1 4.06Å; I20-L132 HydrophobicContact CB-CD1 4.2Å; I20-L132 HydrophobicContact CD1-CD1 3.8Å; I20-L132 HydrophobicContact CG2-CD1 3.82Å; I20-L132 HydrophobicContact CG2-CG 4.31Å; N21-L132 PolarHBondContact ND2-O 2.76Å; N21-L132 PolarHBondContact OD1-N 2.89Å; L132-L134 PolarHBondContact O-N 2.66Å
133	P	78.1	Confident	59.6	Low	110 Å²	110	123.4 Å²	123.4	71%	0.714	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-70.3	126.6	178.3	28.4	-33.5	0	0	0	111.1	K17	K17-P133 WeakPolarHBondContact CD-O 3.15Å
134	L	76.3	Confident	59	Low	65 Å²	65	122.7 Å²	122.7	34%	0.34	69%	0.691	S	S	.	*	P	Polyproline II helix	trans	-83.9	147.7	171.3	-58.3	177.1	0	0	0	110.3	D14 K17 E18 L132 R136	D14-L134 HydrophobicContact CB-CD2 4.5Å; K17-L134 HydrophobicContact CB-CD2 3.44Å; K17-L134 VanDerWaalsContact CB-CD2 3.44Å; K17-L134 HydrophobicContact CD-CD2 4.34Å; E18-L134 HydrophobicContact CB-CD2 4.4Å; L132-L134 PolarHBondContact O-N 2.66Å; L134-R136 VanDerWaalsContact C-N 3.29Å; L134-R136 PolarHBondContact O-N 2.75Å
135	S	71.3	Confident	58.1	Low	99 Å²	99	118.8 Å²	118.8	69%	0.692	69%	0.688	S	S	*	*	S	Bend	trans	-81.4	-8.4	-174.8	-36.1	0	0	0	0	113.3	D14	D14-S135 VanDerWaalsContact CG-OG 3.29Å; D14-S135 PolarHBondContact OD1-OG 3.06Å; D14-S135 WeakPolarHBondContact OD2-CA 3.49Å; D14-S135 WeakPolarHBondContact OD2-CB 3.2Å; D14-S135 PolarHBondContact OD2-N 2.8Å; D14-S135 PolarHBondContact OD2-OG 2.86Å
136	R	64.8	Low	57	Low	181 Å²	181	118.3 Å²	118.3	68%	0.683	70%	0.697	S	S	*	*	S	Bend	trans	-138.6	135.8	176.9	-180	178.4	-79.5	-165.6	-3.6	109.8	L134	L134-R136 VanDerWaalsContact C-N 3.29Å; L134-R136 PolarHBondContact O-N 2.75Å
137	P	47.5	Very low	55.7	Low	107 Å²	107	112.5 Å²	112.5	70%	0.695	69%	0.689	S	S	*	*			trans	-70	151.2	174.5	29.5	-35.2	0	0	0	111.6
138	P	46.3	Very low	54.6	Low	120 Å²	120	116.1 Å²	116.1	78%	0.779	70%	0.703	S	S	*	*			trans	-61.5	136	178.3	-21.7	33.2	0	0	0	112.3	S140	P138-S140 PolarHBondContact O-N 3.2Å
139	Q	46.7	Very low	52.5	Low	166 Å²	166	116.1 Å²	116.1	78%	0.776	72%	0.721	S	S	*	*			trans	-80.8	100.5	169.4	-69.7	-173.6	-100.9	0	0	109.6	N141	Q139-N141 PolarHBondContact O-N 2.93Å
140	S	38.8	Very low	50.1	Low	105 Å²	105	124.6 Å²	124.6	73%	0.734	74%	0.742	S	S	*	*			trans	-71.5	110.7	166.4	54.1	0	0	0	0	109.7	P138 S142	P138-S140 PolarHBondContact O-N 3.2Å; S140-S142 PolarHBondContact O-N 3.2Å
141	N	37.6	Very low	47.8	Very low	164 Å²	164	124.4 Å²	124.4	88%	0.877	74%	0.741	S	S	*	*			trans	-66.9	112.3	163.7	-85.3	4.2	0	0	0	108.6	Q139	Q139-N141 PolarHBondContact O-N 2.93Å
142	S	35.3	Very low	45.4	Very low	109 Å²	109	129 Å²	129	76%	0.762	75%	0.754	S	S	*	*			trans	-103.8	118.2	175.7	54.9	0	0	0	0	110.1	S140	S140-S142 PolarHBondContact O-N 3.2Å
143	E	35.5	Very low	42.7	Very low	195 Å²	195	129.1 Å²	129.1	91%	0.911	77%	0.77	S	S	*	*			trans	-113.7	150.8	157.2	-67.2	-172.3	118	0	0	108.2
144	D	36.8	Very low	40.4	Very low	177 Å²	177	132.9 Å²	132.9	95%	0.947	78%	0.777	S	S	*	*			trans	-74.2	147.3	-155.9	-76.7	-67.9	0	0	0	116.5
145	G	31	Very low	38.2	Very low	76 Å²	76	140.1 Å²	140.1	78%	0.784	80%	0.8	S	S	*	*			trans	-161	93.5	176.2	0	0	0	0	0	112.9
146	T	34.6	Very low	36.4	Very low	153 Å²	153	140.8 Å²	140.8	94%	0.939	80%	0.802	S	S	*	*			trans	-61.4	130.1	-172.3	49.3	0	0	0	0	115.9
147	G	29.3	Very low	34.8	Very low	72 Å²	72	136.3 Å²	136.3	74%	0.742	80%	0.798	S	S	*	*			trans	-174.5	140.1	167.5	0	0	0	0	0	113.2
148	P	42.4	Very low	34	Very low	129 Å²	129	140.2 Å²	140.2	84%	0.838	81%	0.807	S	S	*	*			trans	-112.5	141	-161.9	39.1	-32.4	0	0	0	118.2
149	G	28.4	Very low	33.1	Very low	74 Å²	74	142.9 Å²	142.9	76%	0.763	81%	0.809	S	S	*	*			trans	78.5	163.9	163.3	0	0	0	0	0	115.6
150	W	27.2	Very low	32.4	Very low	265 Å²	265	141.5 Å²	141.5	100%	1.004	81%	0.812	S	S	*	*			cis	-128.5	173.5	10.5	-85.1	47.6	0	0	0	112
151	S	29.2	Very low	31.9	Very low	96 Å²	96	144.1 Å²	144.1	67%	0.671	82%	0.818	S	S	*	*			trans	-113	155.9	-172.6	60.4	0	0	0	0	115.1
152	Q	32	Very low	31.6	Very low	187 Å²	187	140.6 Å²	140.6	87%	0.874	81%	0.812	S	S	*	*			trans	72.4	148.2	173.1	-51.1	175.9	1.1	0	0	115
153	G	27.8	Very low	31.2	Very low	62 Å²	62	143.6 Å²	143.6	64%	0.639	82%	0.818	S	S	*	*			cis	171.3	175.4	-6.3	0	0	0	0	0	113.3
154	H	29.3	Very low	30.8	Very low	189 Å²	189	144.1 Å²	144.1	88%	0.875	81%	0.812	S	S	*	*			trans	76.9	120.8	169.3	-58.2	-80.4	0	0	0	120.4
155	R	29.8	Very low	30.4	Very low	216 Å²	216	144.7 Å²	144.7	82%	0.815	81%	0.809	S	S	*	*			trans	-72.9	160.5	156.3	-150.6	-172	-165.1	-159.7	6.9	109.1
156	P	33.4	Very low	30.1	Very low	113 Å²	113	148.7 Å²	148.7	73%	0.734	81%	0.805	S	S	*	*				-139.9	163.7	103.9	37.8	-26.9	0	0	0	114.5
157	S	31.4	Very low	29.7	Very low	87 Å²	87	148.8 Å²	148.8	61%	0.608	80%	0.795	S	S	*	*			trans	-79.9	152	169.1	47	0	0	0	0	111.6
158	H	31.7	Very low	29.5	Very low	190 Å²	190	149.8 Å²	149.8	88%	0.88	79%	0.79	S	S	*	*			trans	-123.1	143.6	159.7	-101.5	-87	0	0	0	112
159	Q	27.4	Very low	28.6	Very low	176 Å²	176	148.5 Å²	148.5	82%	0.822	78%	0.784	S	S	*	*			trans	-111	143.9	-172.4	-173.3	170.9	-3.5	0	0	108.7
160	T	32.5	Very low	28.4	Very low	137 Å²	137	149.6 Å²	149.6	84%	0.84	79%	0.786	S	S	*	*			trans	-81.8	129.6	-179.7	51	0	0	0	0	111.2
161	D	26.6	Very low	28.3	Very low	159 Å²	159	141.6 Å²	141.6	85%	0.85	77%	0.77	S	S	*	*			trans	-139.5	149.7	165	-116.1	-44.3	0	0	0	110.5
162	A	33.1	Very low	28.2	Very low	90 Å²	90	145.4 Å²	145.4	74%	0.744	78%	0.778	S	S	*	*			trans	-139.6	132	-172.9	0	0	0	0	0	111.6
163	L	26.5	Very low	27.8	Very low	172 Å²	172	145.3 Å²	145.3	90%	0.901	78%	0.777	S	S	*	*			trans	-152.6	173.3	172.4	-112.9	159.8	0	0	0	113.6
164	R	27.4	Very low	27.6	Very low	207 Å²	207	153 Å²	153	78%	0.781	79%	0.787	S	S	*	*			trans	-149.1	123.3	-145.2	152.4	-169.7	161.9	-106.7	7	111.7
165	Q	27.6	Very low	27.5	Very low	189 Å²	189	151.1 Å²	151.1	88%	0.883	78%	0.779	S	S	*	*			trans	-173.7	144.5	157.3	-95.9	142.3	32.1	0	0	108
166	K	24.6	Very low	27.3	Very low	160 Å²	160	148.7 Å²	148.7	70%	0.696	78%	0.776	S	S	*	*			cis	105.6	115.5	7.4	-166.7	174.7	-172.2	-94.6	0	114.6
167	Q	26.5	Very low	27	Very low	155 Å²	155	150.6 Å²	150.6	72%	0.724	79%	0.786	S	S	*	*			trans	70.2	154.9	169.2	-74	168.3	-94.4	0	0	116.5
168	S	25.7	Very low	26.8	Very low	93 Å²	93	150.6 Å²	150.6	65%	0.65	79%	0.792	S	S	*	*			cis	-166.1	160.2	-13.9	44.2	0	0	0	0	113.3
169	S	23.5	Very low	26.6	Very low	102 Å²	102	152.7 Å²	152.7	71%	0.713	79%	0.792	S	S	*	*			trans	55	130.2	144.5	60.4	0	0	0	0	123.5
170	A	24	Very low	26.5	Very low	97 Å²	97	150 Å²	150	80%	0.802	79%	0.787	S	S	*	*			trans	68	153.8	143.5	0	0	0	0	0	119
171	S	25.1	Very low	26.3	Very low	96 Å²	96	148.8 Å²	148.8	67%	0.671	78%	0.78	S	S	*	*			cis	-168.6	142.6	-17.1	44.7	0	0	0	0	111.9
172	E	26.7	Very low	26.3	Very low	177 Å²	177	146.8 Å²	146.8	83%	0.827	77%	0.774	S	S	*	*			trans	61	162.7	149.7	-66	-173.4	105.4	0	0	123
173	Q	23.6	Very low	26	Very low	184 Å²	184	147.7 Å²	147.7	86%	0.86	77%	0.77	S	S	*	*			trans	69.8	150.8	172.2	-72.3	172	36.1	0	0	115.8
174	W	24.3	Very low	25.9	Very low	223 Å²	223	146.2 Å²	146.2	85%	0.845	76%	0.763	S	S	*	*			cis	-161.7	166.9	-9.9	64	-49.9	0	0	0	107.1
175	E	26.1	Very low	25.8	Very low	151 Å²	151	141.4 Å²	141.4	71%	0.706	76%	0.761	S	S	*	*			cis	-149.7	-131.5	-0.9	-151	-135	-105.8	0	0	111.4
176	Q	26.7	Very low	25.8	Very low	164 Å²	164	137.4 Å²	137.4	77%	0.766	75%	0.753	S	S	*	*			trans	-135.2	168.5	177.4	-64.7	-179.5	-5.1	0	0	113.2
177	T	26	Very low	26	Very low	154 Å²	154	136.8 Å²	136.8	95%	0.945	76%	0.758	S	S	*	*			trans	-158.5	155.3	151.2	-7.8	0	0	0	0	110
178	A	27.5	Very low	26	Very low	87 Å²	87	137.2 Å²	137.2	72%	0.719	76%	0.759	S	S	*	*			trans	-144.4	164.5	-156.3	0	0	0	0	0	115.8
179	R	28.1	Very low	26.1	Very low	233 Å²	233	138.3 Å²	138.3	88%	0.879	76%	0.763	S	S	*	*			trans	168.4	124.8	147.1	-91.1	157.1	-165.6	-124.5	0.7	108.9
180	T	25.4	Very low	26.3	Very low	119 Å²	119	142 Å²	142	73%	0.73	77%	0.768	S	S	*	*				52.8	143.7	90.6	59.3	0	0	0	0	114.7
181	T	27.1	Very low	26.5	Very low	113 Å²	113	142.1 Å²	142.1	69%	0.693	76%	0.763	S	S	*	*			cis	-162.6	151.9	43.5	-21.3	0	0	0	0	111.9
182	T	26.6	Very low	26.7	Very low	117 Å²	117	143.8 Å²	143.8	72%	0.718	77%	0.769	S	S	*	*			trans	33	151.6	141.2	54.2	0	0	0	0	122.6
183	T	26.1	Very low	26.8	Very low	109 Å²	109	143.8 Å²	143.8	67%	0.669	77%	0.769	S	S	*	*			cis	-165.7	179.7	5.8	16.1	0	0	0	0	111.9
184	D	24.6	Very low	27.1	Very low	140 Å²	140	139.4 Å²	139.4	75%	0.749	76%	0.764	S	S	*	*			trans	72.7	132.7	157.9	-50.3	-40.1	0	0	0	118.1
185	S	26	Very low	27.4	Very low	106 Å²	106	133.5 Å²	133.5	74%	0.741	76%	0.764	S	S	*	*			cis	77.2	137.4	13.4	-144.3	0	0	0	0	115.6
186	C	27.9	Very low	27.3	Very low	106 Å²	106	129.9 Å²	129.9	72%	0.716	77%	0.766	S	S	*	*			cis	-171.6	175.8	-20	59.1	0	0	0	0	106.7
187	D	28.2	Very low	27.4	Very low	147 Å²	147	128.6 Å²	128.6	79%	0.786	77%	0.77	S	S	*	*			cis	-159.5	-150.3	-0.6	-148.1	-89.6	0	0	0	109.9
188	E	26.1	Very low	27.4	Very low	163 Å²	163	131 Å²	131	76%	0.762	77%	0.768	S	S	*	*			trans	78.2	151	161.8	-60.9	-137.3	122.2	0	0	119.4
189	T	27.8	Very low	27.4	Very low	117 Å²	117	132.5 Å²	132.5	72%	0.718	77%	0.768	S	S	*	*			cis	-147.4	-171.3	-1.1	-0.5	0	0	0	0	114.3
190	H	28.9	Very low	27.3	Very low	179 Å²	179	128.7 Å²	128.7	83%	0.829	76%	0.76	S	S	*	*			trans	-104.1	175.2	-159.1	-96.3	-115	0	0	0	119.1
191	S	27.5	Very low	27.5	Very low	99 Å²	99	133 Å²	133	69%	0.692	76%	0.763	S	S	*	*			trans	90.4	125.5	157.4	-49.9	0	0	0	0	117.3
192	T	28.8	Very low	28.2	Very low	131 Å²	131	133.2 Å²	133.2	80%	0.804	77%	0.766	S	S	*	*			cis	72.9	138	42.3	73.6	0	0	0	0	115
193	Q	30.3	Very low	28.2	Very low	177 Å²	177	133.1 Å²	133.1	83%	0.827	77%	0.765	S	S	*	*			cis	-135.2	-146.5	12.4	-138.8	-170	94.6	0	0	111.4
194	A	28.9	Very low	28.3	Very low	92 Å²	92	135.7 Å²	135.7	76%	0.76	77%	0.774	S	S	*	*			cis	-144.3	-140.1	15.1	0	0	0	0	0	113.3
195	A	30.6	Very low	28.3	Very low	100 Å²	100	132.6 Å²	132.6	83%	0.826	77%	0.768	S	S	*	*			trans	-160	169	-151.3	0	0	0	0	0	116.4
196	G	24.3	Very low	28.4	Very low	74 Å²	74	132.9 Å²	132.9	76%	0.763	77%	0.77	S	S	*	*			trans	177.5	131.9	167.7	0	0	0	0	0	115.1
197	T	28.2	Very low	28.3	Very low	138 Å²	138	137.8 Å²	137.8	85%	0.847	78%	0.779	S	S	*	*			trans	-147.5	159.7	-171.7	55.1	0	0	0	0	113.6
198	K	26.7	Very low	28.3	Very low	205 Å²	205	137 Å²	137	89%	0.891	78%	0.78	S	S	*	*			trans	-169.5	145.9	142.6	-108.1	159.4	-172.9	177.5	0	117
199	T	27.6	Very low	28.6	Very low	118 Å²	118	135.7 Å²	135.7	72%	0.724	79%	0.785	S	S	*	*			trans	-80.9	-179.5	173.8	40.8	0	0	0	0	113
200	E	26.2	Very low	28.6	Very low	152 Å²	152	139.1 Å²	139.1	71%	0.71	79%	0.793	S	S	*	*			cis	-172.4	145.9	-29	-103.3	-170.9	108.9	0	0	110.7
201	R	29.6	Very low	28.6	Very low	211 Å²	211	135 Å²	135	80%	0.796	79%	0.79	S	S	*	*			trans	45.3	-176	144.4	-68.6	-175.7	174.6	-136.3	-3.6	119.7
202	P	41.9	Very low	28.7	Very low	116 Å²	116	136.6 Å²	136.6	75%	0.753	79%	0.791	S	S	*	*			cis	-122.3	152.1	-9.7	17.4	8.8	0	0	0	115.6
203	V	27	Very low	28.7	Very low	115 Å²	115	137.1 Å²	137.1	70%	0.697	79%	0.786	S	S	*	*				87.5	147	86.4	-176.9	0	0	0	0	117.3
204	L	26.8	Very low	28.6	Very low	163 Å²	163	135.7 Å²	135.7	85%	0.853	78%	0.779	S	S	*	*			trans	84.8	155.7	176.1	-66.2	117.4	0	0	0	119
205	A	25.7	Very low	28.6	Very low	76 Å²	76	138.4 Å²	138.4	63%	0.628	78%	0.776	S	S	*	*			cis	-174.3	146.5	-43.8	0	0	0	0	0	113
206	S	26.7	Very low	28.3	Very low	112 Å²	112	140.6 Å²	140.6	78%	0.783	78%	0.779	S	S	*	*			trans	80.8	145.1	150.3	-48.9	0	0	0	0	123.6
207	K	26.3	Very low	28.5	Very low	208 Å²	208	141.3 Å²	141.3	90%	0.904	78%	0.778	S	S	*	*			trans	92.1	149.3	150.4	-77.7	175.8	-178.9	-179.4	0	122.1
208	T	27.9	Very low	29.2	Very low	132 Å²	132	141 Å²	141	81%	0.81	78%	0.778	S	S	*	*			trans	-94.8	174.5	-178.9	48	0	0	0	0	112.5
209	P	34	Very low	29.3	Very low	134 Å²	134	137.7 Å²	137.7	87%	0.87	78%	0.775	S	S	*	*				-138.4	173.9	124.6	38.8	-27.9	0	0	0	114.4
210	Q	26.1	Very low	30.5	Very low	189 Å²	189	136.9 Å²	136.9	88%	0.883	77%	0.772	S	S	*	*			trans	-148.8	139.9	179.1	-173.4	-178.1	5.5	0	0	110.9
211	A	29.2	Very low	30.9	Very low	92 Å²	92	136.2 Å²	136.2	76%	0.76	78%	0.778	S	S	*	*			trans	66.6	164.7	175.4	0	0	0	0	0	115.8
212	N	29.4	Very low	31.6	Very low	133 Å²	133	132.2 Å²	132.2	71%	0.711	78%	0.78	S	S	*	*			cis	-159.8	152.3	19	-162.5	24	0	0	0	114.6
213	M	30	Very low	31	Very low	142 Å²	142	131.3 Å²	131.3	70%	0.7	78%	0.782	S	S	*	*			trans	58.3	161.1	160.1	-73.9	-71.9	106.7	0	0	118.7
214	Q	28.6	Very low	31.2	Very low	148 Å²	148	130.1 Å²	130.1	69%	0.692	78%	0.784	S	S	*	*			cis	-153.8	143.5	21.6	-156.4	149.5	-4.3	0	0	114.8
215	Q	27.9	Very low	31.4	Very low	149 Å²	149	129.4 Å²	129.4	70%	0.696	78%	0.781	S	S	*	*			trans	39.2	126.5	152.9	-66	165.8	3.5	0	0	120.5
216	T	24.9	Very low	31.6	Very low	146 Å²	146	133 Å²	133	90%	0.896	79%	0.789	S	S	*	*				-163.7	161.3	81.2	22.5	0	0	0	0	113.9
217	A	28.1	Very low	31.7	Very low	88 Å²	88	134.6 Å²	134.6	73%	0.727	78%	0.784	S	S	*	*			trans	-148.4	163.1	170.4	0	0	0	0	0	109.3
218	P	41.6	Very low	31.9	Very low	132 Å²	132	130.3 Å²	130.3	86%	0.857	77%	0.771	S	S	*	*				-143.6	-170.8	99.6	39	-23.5	0	0	0	114.5
219	T	30.4	Very low	31.9	Very low	135 Å²	135	130.7 Å²	130.7	83%	0.828	76%	0.761	S	S	*	*			trans	-114.9	-146.6	-166.1	41.3	0	0	0	0	113
220	P	52.1	Low	31.7	Very low	102 Å²	102	134.7 Å²	134.7	66%	0.662	76%	0.759	S	S	*	*				-136.2	179.4	-96.2	43.4	-26.5	0	0	0	117.7
221	V	33.8	Very low	31.9	Very low	137 Å²	137	134 Å²	134	83%	0.83	76%	0.756	S	S	*	*			trans	59.8	173.4	163.1	-96.2	0	0	0	0	117.7
222	P	44.8	Very low	33.3	Very low	128 Å²	128	134.6 Å²	134.6	83%	0.831	75%	0.752	S	S	*	*			cis	-124.8	-158.6	12	44.1	-26.4	0	0	0	116.5
223	A	29.7	Very low	33.3	Very low	96 Å²	96	134.9 Å²	134.9	79%	0.793	76%	0.758	S	S	*	*			trans	-126.8	-157.5	-168.6	0	0	0	0	0	113
224	A	32.2	Very low	33.5	Very low	90 Å²	90	134 Å²	134	74%	0.744	76%	0.76	S	S	*	*			trans	85.5	148	-179.9	0	0	0	0	0	115
225	D	29.4	Very low	33.5	Very low	148 Å²	148	132.8 Å²	132.8	79%	0.791	77%	0.769	S	S	*	*			cis	-161.3	-173.7	-3.4	-133.9	-32.8	0	0	0	114.1
226	L	30.9	Very low	33.7	Very low	153 Å²	153	131.7 Å²	131.7	80%	0.801	78%	0.777	S	S	*	*			trans	74.6	128	176.5	-81.9	64.2	0	0	0	116.2
227	E	29.4	Very low	33.9	Very low	144 Å²	144	128.4 Å²	128.4	67%	0.673	77%	0.772	S	S	*	*			cis	103.3	107	14.7	-158.8	-155.1	138.8	0	0	116.6	K229	E227-K229 IonicContact OE1-NZ 2.68Å
228	N	28.9	Very low	35.3	Very low	119 Å²	119	130.1 Å²	130.1	64%	0.636	78%	0.776	S	S	*	*				-170.7	130.7	125.1	-111.5	-73.7	0	0	0	114.4
229	K	29.5	Very low	34.7	Very low	139 Å²	139	130.4 Å²	130.4	60%	0.604	78%	0.775	S	S	*	*			trans	40.2	147.6	138.7	-65.8	174.6	-169.5	62.3	0	120.3	E227	E227-K229 IonicContact OE1-NZ 2.68Å
230	R	29.2	Very low	34.6	Very low	219 Å²	219	133.7 Å²	133.7	83%	0.826	77%	0.774	S	S	*	*			cis	-160.7	165.3	22	-145.5	-179.1	-104.5	-108.4	7.8	112.4
231	Q	30.1	Very low	33.8	Very low	175 Å²	175	135.9 Å²	135.9	82%	0.818	78%	0.778	S	S	*	*			trans	-151.7	-178.4	168.3	-110.1	-163.3	16.2	0	0	107.7
232	P	58.9	Low	34.2	Very low	104 Å²	104	135 Å²	135	68%	0.675	78%	0.776	S	S	*	*				-129.5	-147.2	-69	34.7	-12.9	0	0	0	112
233	V	29.7	Very low	33.6	Very low	138 Å²	138	133.1 Å²	133.1	84%	0.836	77%	0.771	S	S	*	*			trans	99.7	148.3	159.7	-170.6	0	0	0	0	119.5
234	V	33.2	Very low	33.7	Very low	123 Å²	123	135.1 Å²	135.1	75%	0.745	77%	0.774	S	S	*	*			trans	-79.6	158.1	-171.1	178.9	0	0	0	0	114.3
235	S	28.8	Very low	33.7	Very low	124 Å²	124	141.1 Å²	141.1	87%	0.867	78%	0.777	S	S	*	*			trans	-156.5	169.5	152.1	-83	0	0	0	0	112.8
236	S	32.1	Very low	33.7	Very low	126 Å²	126	140.8 Å²	140.8	88%	0.881	77%	0.774	S	S	*	*			trans	-132.1	159.7	-162.2	53.7	0	0	0	0	114.6
237	G	28.7	Very low	33.6	Very low	76 Å²	76	139.3 Å²	139.3	78%	0.784	77%	0.771	S	S	*	*			trans	168.3	135.1	171.2	0	0	0	0	0	115.8
238	P	58.2	Low	34.8	Very low	125 Å²	125	137.9 Å²	137.9	81%	0.812	77%	0.774	S	S	*	*			trans	-124.6	157.7	-175.2	41.1	-30.2	0	0	0	116.6
239	T	28.3	Very low	35.9	Very low	137 Å²	137	137.6 Å²	137.6	84%	0.84	78%	0.779	S	S	*	*			trans	-151.8	127	162.6	-27.6	0	0	0	0	116.2
240	Y	28.8	Very low	35.9	Very low	205 Å²	205	135.7 Å²	135.7	80%	0.804	79%	0.789	S	S	*	*			trans	4.5	122.3	157.8	-69.6	-99.8	0	0	0	125.7
241	I	34.7	Very low	36.2	Very low	147 Å²	147	132.9 Å²	132.9	75%	0.754	79%	0.791	S	S	*	*				26	129.6	104.5	-52.2	176.2	0	0	0	116.8
242	P	43.3	Very low	37.4	Very low	119 Å²	119	129.3 Å²	129.3	77%	0.773	78%	0.783	S	S	*	*				-155.4	139.9	67.8	39.4	-17	0	0	0	123
243	A	31.8	Very low	36.6	Very low	88 Å²	88	130 Å²	130	73%	0.727	79%	0.787	S	S	*	*			trans	28.2	138.2	133.5	0	0	0	0	0	126.3
244	T	30.8	Very low	36.6	Very low	139 Å²	139	127.6 Å²	127.6	85%	0.853	78%	0.777	S	S	*	*			trans	168.5	160.9	134.4	28.4	0	0	0	0	110.8
245	R	33.2	Very low	36.5	Very low	215 Å²	215	129.8 Å²	129.8	81%	0.811	78%	0.784	S	S	*	*			cis	-166.9	149.6	-36.8	-131.8	-169.1	173.3	-167.1	0.7	110.7
246	I	29.6	Very low	36.7	Very low	142 Å²	142	131.9 Å²	131.9	73%	0.728	79%	0.786	S	S	*	*			trans	78.9	162.9	154.5	-67.2	169.1	0	0	0	119.3
247	T	27.5	Very low	36.5	Very low	122 Å²	122	130.7 Å²	130.7	75%	0.748	78%	0.783	S	S	*	*			trans	-138.7	-149.1	-154.4	59.6	0	0	0	0	110.3
248	P	55.3	Low	36.7	Very low	113 Å²	113	133.8 Å²	133.8	73%	0.734	79%	0.787	S	S	*	*			cis	-118	-65	-27.5	27.6	-18.2	0	0	0	124.9
249	P	52.4	Low	36	Very low	113 Å²	113	133.5 Å²	133.5	73%	0.734	79%	0.785	S	S	*	*				-130.1	150.7	-121.2	39.9	-24.7	0	0	0	119.4
250	A	30.3	Very low	35.9	Very low	100 Å²	100	136.5 Å²	136.5	83%	0.826	79%	0.79	S	S	*	*			trans	-169	144.9	140.6	0	0	0	0	0	113.4
251	N	33.9	Very low	36.1	Very low	159 Å²	159	135.6 Å²	135.6	85%	0.85	79%	0.79	S	S	*	*			trans	179.8	170.7	174.1	-113.4	-11.4	0	0	0	108.2
252	P	55.7	Low	35.8	Very low	101 Å²	101	134.4 Å²	134.4	66%	0.656	79%	0.792	S	S	*	*			cis	-116.5	-140.2	-17.1	39.5	-19.2	0	0	0	109.7
253	P	42	Very low	35.1	Very low	117 Å²	117	132.4 Å²	132.4	76%	0.76	79%	0.786	S	S	*	*			cis	-115	148.5	32.9	10.3	15.4	0	0	0	114.4
254	S	31	Very low	35.9	Very low	89 Å²	89	134.2 Å²	134.2	62%	0.622	79%	0.79	S	S	*	*				85.6	106.6	61.5	-55.9	0	0	0	0	116
255	N	30.2	Very low	35.6	Very low	169 Å²	169	133.8 Å²	133.8	90%	0.904	78%	0.782	S	S	*	*				-175	155.2	124.4	-94.8	-15.8	0	0	0	113
256	N	33.1	Very low	35.7	Very low	168 Å²	168	131.1 Å²	131.1	90%	0.898	78%	0.779	S	S	*	*			trans	-108	148.7	-171	-68.9	-26.6	0	0	0	113.6
257	A	27.8	Very low	35.9	Very low	101 Å²	101	129.8 Å²	129.8	84%	0.835	78%	0.777	S	S	*	*			trans	-160.4	149.9	148.1	0	0	0	0	0	111.5
258	T	32.2	Very low	36.1	Very low	140 Å²	140	132 Å²	132	86%	0.859	78%	0.779	S	S	*	*			trans	-116.3	169	173.2	14.8	0	0	0	0	110.3
259	P	44.5	Very low	35	Very low	119 Å²	119	133.8 Å²	133.8	77%	0.773	78%	0.782	S	S	*	*			trans	-98.7	159.7	-143.6	37.7	-39.1	0	0	0	116.7
260	Q	25.4	Very low	34.1	Very low	200 Å²	200	135.6 Å²	135.6	94%	0.935	79%	0.786	S	S	*	*			trans	-152.5	167.1	156.1	-117.1	175.1	7.4	0	0	112.9
261	K	34.1	Very low	34.5	Very low	186 Å²	186	137.5 Å²	137.5	81%	0.809	78%	0.782	S	S	*	*			trans	-102.2	146.4	-168.7	-178.3	-168.1	175.3	-172.5	0	111.6
262	P	27.2	Very low	34.4	Very low	123 Å²	123	137.2 Å²	137.2	80%	0.799	78%	0.781	S	S	*	*				-135.9	174.9	125.7	32.3	-17.1	0	0	0	114.1
263	A	29.6	Very low	33.8	Very low	77 Å²	77	139.6 Å²	139.6	64%	0.636	79%	0.788	S	S	*	*			trans	-145.5	-176.8	168.5	0	0	0	0	0	106
264	P	47.2	Very low	33.5	Very low	125 Å²	125	144 Å²	144	81%	0.812	79%	0.791	S	S	*	*			cis	-123.2	-166.7	-9.4	42.7	-27.4	0	0	0	111.8
265	D	24.7	Very low	33.5	Very low	130 Å²	130	146.8 Å²	146.8	70%	0.695	80%	0.799	S	S	*	*				-166.5	171.8	121.2	-151.6	-3.4	0	0	0	111.8
266	H	36.2	Very low	33.8	Very low	160 Å²	160	144.2 Å²	144.2	74%	0.741	79%	0.794	S	S	*	*			trans	80.1	93.6	167.1	-58.7	-26.7	0	0	0	118.4
267	T	33.9	Very low	34.1	Very low	113 Å²	113	142.9 Å²	142.9	69%	0.693	79%	0.787	S	S	*	*			trans	-51.9	170.6	138	54.2	0	0	0	0	111.3
268	E	31.6	Very low	34.6	Very low	170 Å²	170	143.8 Å²	143.8	79%	0.794	78%	0.778	S	S	*	*			cis	-150.1	177.5	28.9	-139.3	131.8	-88.6	0	0	112.3
269	N	32.8	Very low	35	Very low	149 Å²	149	139.7 Å²	139.7	80%	0.797	76%	0.758	S	S	*	*			trans	-76.9	157	-171.4	-52.1	-37.3	0	0	0	113.5
270	D	32.8	Very low	35.3	Very low	151 Å²	151	137.3 Å²	137.3	81%	0.807	74%	0.742	S	S	*	*			trans	-146	134.5	142.4	-159.1	7	0	0	0	109.6
271	D	38	Very low	36.9	Very low	141 Å²	141	132.9 Å²	132.9	75%	0.754	73%	0.728	S	S	*	*			trans	-84.1	125.9	-165.6	-73.6	-57.4	0	0	0	112.5
272	N	32.5	Very low	38.8	Very low	152 Å²	152	124.6 Å²	124.6	81%	0.813	69%	0.693	S	S	*	*			trans	-136.2	53.4	169.3	-83.9	-98.3	0	0	0	111.3	Y274	N272-Y274 PolarHBondContact O-N 2.89Å
273	D	43.4	Very low	41.4	Very low	152 Å²	152	119.3 Å²	119.3	81%	0.813	66%	0.66	S	S	*	*			trans	-70.6	105	155.6	173.6	32.9	0	0	0	109.1
274	Y	35.2	Very low	44.1	Very low	210 Å²	210	116.9 Å²	116.9	82%	0.824	64%	0.639	S	S	*	*			trans	-162.5	137.6	159.1	-124.7	-79.1	0	0	0	113.5	N272	N272-Y274 PolarHBondContact O-N 2.89Å
275	D	30.8	Very low	46.3	Very low	146 Å²	146	110.9 Å²	110.9	78%	0.781	60%	0.6	S	S	*	*			trans	59.2	86.8	171.1	-96.3	-12.2	0	0	0	118.2
276	S	36.9	Very low	49.5	Very low	115 Å²	115	107 Å²	107	80%	0.804	58%	0.578	S	S	*	*			trans	-108.6	110.7	159.3	169.8	0	0	0	0	110.4	D278	S276-D278 PolarHBondContact O-N 3.13Å
277	D	38.6	Very low	52.4	Low	141 Å²	141	99.4 Å²	99.4	75%	0.754	54%	0.543	S	S	*	.			trans	-64.3	83.8	-176.2	-91	-45.6	0	0	0	114.6	A279	D277-A279 PolarHBondContact O-N 2.94Å
278	D	38.5	Very low	55.2	Low	119 Å²	119	94.1 Å²	94.1	64%	0.636	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	25.1	-179.5	-169.2	33.1	0	0	0	115.4	S276 K309	S276-D278 PolarHBondContact O-N 3.13Å; D278-K309 IonicContact OD1-NZ 2.76Å; D278-K309 PolarHBondContact OD1-NZ 2.86Å; D278-K309 IonicContact OD2-NZ 2.75Å; D278-K309 PolarHBondContact OD2-NZ 2.96Å
279	A	41.8	Very low	58.2	Low	55 Å²	55	86 Å²	86	46%	0.455	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	-44.9	-161.8	0	0	0	0	0	116.1	D277 R407	D277-A279 PolarHBondContact O-N 2.94Å; A279-R407 PolarHBondContact O-NH2 3.47Å
280	T	50.3	Low	61.1	Low	69 Å²	69	80.9 Å²	80.9	42%	0.423	45%	0.445	S	S	.	.	S	Bend	trans	-124	-3.7	-148.2	56.2	0	0	0	0	119.7
281	T	59.5	Low	64	Low	106 Å²	106	73.8 Å²	73.8	65%	0.65	41%	0.407	S	S	*	.			trans	-113.9	121.6	176.9	58.7	0	0	0	0	113
282	L	73.8	Confident	66.5	Low	12 Å²	12	70.2 Å²	70.2	6%	0.063	39%	0.385	C	S	.	.			trans	-97.6	3.9	172.2	-61	174.4	0	0	0	112.2	I383 L405 R407	L282-I383 WeakPolarHBondContact CD2-O 3.39Å; L282-L405 HydrophobicContact CB-CB 4.04Å; L282-R407 HydrophobicContact CD1-CB 3.72Å; L282-R407 HydrophobicContact CD1-CG 3.64Å; L282-R407 HydrophobicContact CD2-CG 4.33Å
283	G	82.5	Confident	69	Low	12 Å²	12	66.3 Å²	66.3	12%	0.124	36%	0.362	C	S	.	.			trans	85.5	177.8	-170.9	0	0	0	0	0	114.8	K306 G307 L405	G283-K306 CarbonylContact C-O 3.52Å; G283-K306 WeakPolarHBondContact CA-O 3.5Å; G283-G307 VanDerWaalsContact CA-C 3.47Å; G283-G307 WeakPolarHBondContact CA-O 3.17Å; G283-G307 PolarHBondContact N-O 3.46Å; G283-L405 PolarHBondContact O-N 3.36Å
284	S	86.3	Confident	71.1	Confident	26 Å²	26	67.5 Å²	67.5	18%	0.182	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	148.9	171.7	84.6	0	0	0	0	111.3	A305 K306 N402 V403	S284-A305 CarbonylContact O-C 3.57Å; S284-A305 WeakPolarHBondContact O-CA 3.4Å; S284-A305 VanDerWaalsContact O-CB 3.27Å; S284-A305 WeakPolarHBondContact O-CB 3.36Å; S284-K306 PolarHBondContact N-O 3.2Å; S284-K306 PolarHBondContact O-N 3.19Å; S284-N402 PolarHBondContact OG-OD1 3Å; S284-V403 CarbonylContact C-O 3.47Å; S284-V403 VanDerWaalsContact CA-O 3.26Å; S284-V403 WeakPolarHBondContact CA-O 3.36Å; S284-V403 WeakPolarHBondContact CB-O 3.3Å
285	L	92.4	Very high	73.5	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	125.7	178.2	-178.4	68.7	0	0	0	109.9	F287 I302 A305 V321 W348 L369 V371 T386 N402 V403 L405	L285-F287 HydrophobicContact CD2-CD1 4.09Å; L285-F287 HydrophobicContact CD2-CE1 4.44Å; L285-F287 HydrophobicContact CG-CD1 3.98Å; L285-I302 HydrophobicContact CD1-CG2 4.28Å; L285-A305 HydrophobicContact CD1-CB 4.16Å; L285-V321 HydrophobicContact CD1-CG2 3.98Å; L285-V321 HydrophobicContact CD2-CG1 4.06Å; L285-W348 HydrophobicContact CD1-CE3 4.5Å; L285-W348 HydrophobicContact CD1-CH2 4.37Å; L285-W348 HydrophobicContact CD1-CZ3 3.68Å; L285-L369 HydrophobicContact CD2-CB 4.05Å; L285-L369 HydrophobicContact CD2-CD2 4.02Å; L285-V371 HydrophobicContact CD1-CG2 4.28Å; L285-V371 HydrophobicContact CD2-CG2 4.15Å; L285-T386 HydrophobicContact CD2-CG2 4.36Å; L285-N402 WeakPolarHBondContact O-CA 3.45Å; L285-V403 PolarHBondContact N-O 3.05Å; L285-V403 PolarHBondContact O-N 3.2Å; L285-L405 HydrophobicContact CB-CD2 3.96Å; L285-L405 HydrophobicContact CB-CG 4.35Å; L285-L405 HydrophobicContact CD2-CD2 4.47Å
286	E	92.6	Very high	76.1	Confident	49 Å²	49	59.6 Å²	59.6	23%	0.229	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.2	175.7	-163.5	-171.4	105.1	0	0	110.1	I303 K304 F401 N402	E286-I303 HydrophobicContact CG-CD1 4.39Å; E286-I303 WeakPolarHBondContact O-CA 3.35Å; E286-I303 WeakPolarHBondContact O-CB 3.35Å; E286-I303 PolarHBondContact O-N 2.92Å; E286-K304 HydrophobicContact CB-CG 3.89Å; E286-K304 PolarHBondContact N-O 2.95Å; E286-K304 PolarHBondContact O-N 2.83Å; E286-K304 VanDerWaalsContact O-N 3.11Å; E286-K304 IonicContact OE1-NZ 2.73Å; E286-K304 PolarHBondContact OE1-NZ 2.95Å; E286-K304 WeakPolarHBondContact OE2-CE 3.29Å; E286-K304 IonicContact OE2-NZ 3.27Å; E286-K304 PolarHBondContact OE2-NZ 2.65Å; E286-F401 CarbonylContact C-O 3.47Å; E286-F401 VanDerWaalsContact CA-O 3.3Å; E286-F401 WeakPolarHBondContact CA-O 3.45Å; E286-N402 HydrophobicContact CG-CB 4.26Å
287	F	95.5	Very high	78.6	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	170.3	-176.4	64.2	-80.6	0	0	0	110.7	L285 L289 C301 I302 L369 T386 V388 F401 V403	L285-F287 HydrophobicContact CD2-CD1 4.09Å; L285-F287 HydrophobicContact CD2-CE1 4.44Å; L285-F287 HydrophobicContact CG-CD1 3.98Å; F287-L289 HydrophobicContact CD2-CD2 3.96Å; F287-L289 HydrophobicContact CD2-CG 4.05Å; F287-L289 HydrophobicContact CE2-CD1 4.09Å; F287-L289 HydrophobicContact CE2-CD2 4.21Å; F287-L289 HydrophobicContact CE2-CG 4.01Å; F287-C301 CarbonylContact C-O 3.5Å; F287-C301 VanDerWaalsContact CA-O 3.3Å; F287-C301 WeakPolarHBondContact CA-O 3.43Å; F287-C301 WeakPolarHBondContact CB-O 3.18Å; F287-I302 HydrophobicContact CB-CD1 3.88Å; F287-L369 HydrophobicContact CD1-CD2 4.32Å; F287-L369 HydrophobicContact CD2-CD2 3.99Å; F287-L369 HydrophobicContact CE1-CD2 4.48Å; F287-L369 HydrophobicContact CE2-CD1 3.96Å; F287-L369 HydrophobicContact CE2-CD2 4.17Å; F287-L369 HydrophobicContact CG-CD2 4.07Å; F287-L369 HydrophobicContact CZ-CD1 3.96Å; F287-L369 HydrophobicContact CZ-CD2 4.41Å; F287-T386 HydrophobicContact CE1-CG2 4.05Å; F287-T386 HydrophobicContact CZ-CG2 4.33Å; F287-V388 HydrophobicContact CE2-CG2 3.87Å; F287-V388 HydrophobicContact CZ-CG2 3.7Å; F287-F401 HydrophobicContact CD1-CB 3.95Å; F287-F401 HydrophobicContact CD2-CB 4.13Å; F287-F401 HydrophobicContact CD2-CD2 4.06Å; F287-F401 HydrophobicContact CD2-CG 4.36Å; F287-F401 HydrophobicContact CE1-CB 3.6Å; F287-F401 HydrophobicContact CE1-CG 4.35Å; F287-F401 HydrophobicContact CE2-CB 3.78Å; F287-F401 AromaticContact CE2-CD2 3.65Å; F287-F401 HydrophobicContact CE2-CD2 3.65Å; F287-F401 HydrophobicContact CE2-CE2 4.34Å; F287-F401 AromaticContact CE2-CG 3.75Å; F287-F401 HydrophobicContact CE2-CG 3.75Å; F287-F401 HydrophobicContact CG-CB 4.21Å; F287-F401 HydrophobicContact CZ-CB 3.51Å; F287-F401 HydrophobicContact CZ-CD1 4.27Å; F287-F401 HydrophobicContact CZ-CD2 4.16Å; F287-F401 AromaticContact CZ-CG 3.75Å; F287-F401 HydrophobicContact CZ-CG 3.75Å; F287-F401 PolarHBondContact N-O 3.39Å; F287-F401 PolarHBondContact O-N 2.93Å; F287-F401 VanDerWaalsContact O-O 3.07Å; F287-V403 HydrophobicContact CE1-CG2 4.08Å; F287-V403 HydrophobicContact CZ-CG2 4.49Å
288	S	94.3	Very high	81.1	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.007	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	139.6	176.6	55.8	0	0	0	0	111.2	C301 K398 K399 N400	S288-C301 PolarHBondContact N-O 2.97Å; S288-C301 PolarHBondContact O-N 3.2Å; S288-C301 WeakPolarHBondContact OG-CB 3.45Å; S288-K398 WeakPolarHBondContact OG-CE 3.03Å; S288-K398 PolarHBondContact OG-NZ 2.66Å; S288-K399 CarbonylContact C-O 3.57Å; S288-K399 VanDerWaalsContact CA-O 3.27Å; S288-K399 WeakPolarHBondContact CA-O 3.47Å; S288-N400 WeakPolarHBondContact CB-OD1 3.44Å
289	L	94.4	Very high	83.7	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	135.2	-179.2	-54.5	-178.1	0	0	0	109.5	F287 H299 C300 L367 V388 L393 K398 K399 F401	F287-L289 HydrophobicContact CD2-CD2 3.96Å; F287-L289 HydrophobicContact CD2-CG 4.05Å; F287-L289 HydrophobicContact CE2-CD1 4.09Å; F287-L289 HydrophobicContact CE2-CD2 4.21Å; F287-L289 HydrophobicContact CE2-CG 4.01Å; L289-H299 WeakPolarHBondContact CA-O 3.46Å; L289-C300 HydrophobicContact CD2-CB 3.88Å; L289-L367 HydrophobicContact CD1-CD2 3.94Å; L289-L367 HydrophobicContact CD2-CD2 3.65Å; L289-L367 HydrophobicContact CG-CD2 4.49Å; L289-V388 HydrophobicContact CD1-CB 4.1Å; L289-V388 HydrophobicContact CD1-CG1 3.93Å; L289-V388 HydrophobicContact CD1-CG2 4.29Å; L289-L393 HydrophobicContact CB-CD1 3.98Å; L289-L393 HydrophobicContact CB-CD2 4.04Å; L289-L393 HydrophobicContact CD1-CD1 4.14Å; L289-L393 HydrophobicContact CD1-CD2 4.18Å; L289-K398 WeakPolarHBondContact O-CA 3.41Å; L289-K399 PolarHBondContact N-O 3.49Å; L289-K399 PolarHBondContact O-N 2.78Å; L289-F401 HydrophobicContact CB-CE2 4.12Å; L289-F401 HydrophobicContact CD1-CE2 3.89Å; L289-F401 HydrophobicContact CD1-CZ 4.38Å; L289-F401 HydrophobicContact CG-CD2 4.25Å; L289-F401 HydrophobicContact CG-CE2 3.87Å
290	L	93.8	Very high	86.2	Confident	42 Å²	42	41.4 Å²	41.4	22%	0.22	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	128.6	171.5	168.1	65.3	0	0	0	107.1	L298 H299 D396 K398	L290-L298 CarbonylContact O-C 3.57Å; L290-H299 HydrophobicContact CB-CB 4.29Å; L290-H299 PolarHBondContact N-O 3.12Å; L290-H299 PolarHBondContact O-N 3.01Å; L290-D396 VanDerWaalsContact CD1-C 3.42Å; L290-K398 HydrophobicContact CB-CB 4.24Å; L290-K398 HydrophobicContact CB-CG 4.45Å; L290-K398 HydrophobicContact CD1-CB 4.39Å
291	Y	91.9	Very high	88.4	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.008	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	116.5	168.9	172.3	-119.7	0	0	0	108	Q293 A297 L298 I357 D359 M362 F395 D396	Y291-Q293 HydrophobicContact CE1-CB 4.28Å; Y291-Q293 HydrophobicContact CE1-CG 4.25Å; Y291-A297 WeakPolarHBondContact CA-O 3.49Å; Y291-A297 WeakPolarHBondContact CD2-O 3.49Å; Y291-L298 HydrophobicContact CD2-CB 4.4Å; Y291-I357 HydrophobicContact CE2-CB 4.4Å; Y291-I357 HydrophobicContact CE2-CG2 4.48Å; Y291-I357 WeakPolarHBondContact CE2-O 3.2Å; Y291-I357 PolarHBondContact OH-O 2.94Å; Y291-I357 VanDerWaalsContact OH-O 3.11Å; Y291-D359 WeakPolarHBondContact CE1-OD1 3.06Å; Y291-D359 PolarHBondContact OH-OD1 2.68Å; Y291-M362 HydrophobicContact CD1-CE 3.65Å; Y291-M362 HydrophobicContact CD1-CG 4.25Å; Y291-M362 HydrophobicContact CD1-SD 4.08Å; Y291-M362 HydrophobicContact CD2-CE 3.32Å; Y291-M362 HydrophobicContact CE1-CE 3.94Å; Y291-M362 HydrophobicContact CE1-CG 4.42Å; Y291-M362 HydrophobicContact CE2-CE 3.64Å; Y291-M362 HydrophobicContact CG-CE 3.32Å; Y291-M362 HydrophobicContact CG-SD 4.03Å; Y291-F395 AromaticContact CD1-CD1 3.7Å; Y291-F395 HydrophobicContact CD1-CD1 3.7Å; Y291-F395 HydrophobicContact CD1-CE1 4.13Å; Y291-F395 AromaticContact CE1-CD1 3.6Å; Y291-F395 HydrophobicContact CE1-CD1 3.6Å; Y291-F395 AromaticContact CE1-CE1 3.77Å; Y291-F395 HydrophobicContact CE1-CE1 3.77Å; Y291-D396 PolarHBondContact O-N 3.11Å
292	E	90.8	Very high	90.2	Very high	66 Å²	66	34.1 Å²	34.1	31%	0.308	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	110.4	179	-173.7	172.8	-109.3	0	0	108.1	N295 H296 A297 D396	E292-N295 HydrophobicContact CG-CB 4.39Å; E292-N295 WeakPolarHBondContact OE2-CB 3.22Å; E292-N295 PolarHBondContact OE2-ND2 2.89Å; E292-H296 PolarHBondContact O-N 3.42Å; E292-A297 PolarHBondContact N-O 3.28Å; E292-A297 PolarHBondContact O-N 2.85Å; E292-A297 VanDerWaalsContact O-N 3.12Å; E292-D396 WeakPolarHBondContact CA-OD1 3.4Å
293	Q	86	Confident	91.1	Very high	69 Å²	69	35.1 Å²	35.1	32%	0.322	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-39.3	-167.1	-166.5	176.9	8.8	0	0	112	Y291 N295 H296 D359 F395 D396	Y291-Q293 HydrophobicContact CE1-CB 4.28Å; Y291-Q293 HydrophobicContact CE1-CG 4.25Å; Q293-N295 VanDerWaalsContact C-N 3.31Å; Q293-N295 PolarHBondContact O-N 2.93Å; Q293-H296 PolarHBondContact O-CE1 2.7Å; Q293-H296 PolarHBondContact O-N 3.18Å; Q293-H296 PolarHBondContact O-ND1 3.32Å; Q293-D359 PolarHBondContact NE2-OD1 2.84Å; Q293-D359 PolarHBondContact NE2-OD2 2.85Å; Q293-F395 HydrophobicContact CB-CD1 4.29Å; Q293-F395 HydrophobicContact CG-CD1 4.22Å; Q293-D396 PolarHBondContact N-OD1 3.2Å
294	E	86.6	Confident	91.5	Very high	177 Å²	177	36.6 Å²	36.6	83%	0.827	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-36.8	-178.7	-59.6	-170.6	157.8	0	0	113
295	N	86.8	Confident	91.8	Very high	102 Å²	102	35.5 Å²	35.5	55%	0.545	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	2.8	-179.9	-71.6	-41.6	0	0	0	113.5	E292 Q293 A297	E292-N295 HydrophobicContact CG-CB 4.39Å; E292-N295 WeakPolarHBondContact OE2-CB 3.22Å; E292-N295 PolarHBondContact OE2-ND2 2.89Å; Q293-N295 VanDerWaalsContact C-N 3.31Å; Q293-N295 PolarHBondContact O-N 2.93Å; N295-A297 HydrophobicContact CB-CB 4.05Å; N295-A297 PolarHBondContact O-N 3.49Å
296	H	85.8	Confident	91.6	Very high	89 Å²	89	41.1 Å²	41.1	41%	0.412	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.5	42.4	-173.4	-61.2	-38.1	0	0	0	112.7	E292 Q293 G356 I357	E292-H296 PolarHBondContact O-N 3.42Å; Q293-H296 PolarHBondContact O-CE1 2.7Å; Q293-H296 PolarHBondContact O-N 3.18Å; Q293-H296 PolarHBondContact O-ND1 3.32Å; H296-G356 PolarHBondContact O-N 3.22Å; H296-I357 WeakPolarHBondContact CB-O 3.45Å; H296-I357 PolarHBondContact O-N 3.35Å
297	A	88.6	Confident	91.1	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.008	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	121.9	-165.7	0	0	0	0	0	112.3	Y291 E292 N295 I353 Y354	Y291-A297 WeakPolarHBondContact CA-O 3.49Å; Y291-A297 WeakPolarHBondContact CD2-O 3.49Å; E292-A297 PolarHBondContact N-O 3.28Å; E292-A297 PolarHBondContact O-N 2.85Å; E292-A297 VanDerWaalsContact O-N 3.12Å; N295-A297 HydrophobicContact CB-CB 4.05Å; N295-A297 PolarHBondContact O-N 3.49Å; A297-I353 HydrophobicContact CB-CG2 4.21Å; A297-Y354 CarbonylContact C-O 3.59Å; A297-Y354 WeakPolarHBondContact CA-O 3.42Å
298	L	91.1	Very high	90.6	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	103.7	173.5	178.2	70.8	0	0	0	110.2	L290 Y291 L325 I353 Y354 I357 L390 L393	L290-L298 CarbonylContact O-C 3.57Å; Y291-L298 HydrophobicContact CD2-CB 4.4Å; L298-L325 HydrophobicContact CD2-CD2 4.22Å; L298-I353 WeakPolarHBondContact O-CA 3.07Å; L298-Y354 HydrophobicContact CD2-CD2 4.32Å; L298-Y354 PolarHBondContact N-O 2.87Å; L298-Y354 PolarHBondContact O-N 2.96Å; L298-I357 HydrophobicContact CB-CG1 4.32Å; L298-L390 HydrophobicContact CD2-CD1 3.89Å; L298-L390 HydrophobicContact CD2-CD2 3.84Å; L298-L393 HydrophobicContact CD1-CD1 3.82Å
299	H	93.1	Very high	89.8	Confident	47 Å²	47	42.6 Å²	42.6	22%	0.218	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	114.7	177.5	-69.1	-127.4	0	0	0	110	L289 L290 T351	L289-H299 WeakPolarHBondContact CA-O 3.46Å; L290-H299 HydrophobicContact CB-CB 4.29Å; L290-H299 PolarHBondContact N-O 3.12Å; L290-H299 PolarHBondContact O-N 3.01Å; H299-T351 HydrophobicContact CB-CG2 4.34Å
300	C	94.7	Very high	89.1	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	93.9	178.5	-49.4	0	0	0	0	109.4	L289 L323 L352	L289-C300 HydrophobicContact CD2-CB 3.88Å; C300-L323 HydrophobicContact CB-CD2 3.43Å; C300-L323 VanDerWaalsContact CB-CD2 3.43Å; C300-L352 WeakPolarHBondContact CA-O 3.44Å; C300-L352 VanDerWaalsContact CB-O 3.3Å; C300-L352 WeakPolarHBondContact CB-O 3.09Å; C300-L352 PolarHBondContact N-O 2.99Å; C300-L352 PolarHBondContact O-N 3.25Å
301	C	95.9	Very high	88.4	Confident	22 Å²	22	45 Å²	45	15%	0.149	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	104.9	179.5	175.4	0	0	0	0	109.9	F287 S288 E350 T351	F287-C301 CarbonylContact C-O 3.5Å; F287-C301 VanDerWaalsContact CA-O 3.3Å; F287-C301 WeakPolarHBondContact CA-O 3.43Å; F287-C301 WeakPolarHBondContact CB-O 3.18Å; S288-C301 PolarHBondContact N-O 2.97Å; S288-C301 PolarHBondContact O-N 3.2Å; S288-C301 WeakPolarHBondContact OG-CB 3.45Å; C301-E350 CarbonylContact C-O 3.56Å; C301-T351 HydrophobicContact CB-CG2 4.3Å
302	I	96.3	Very high	87.6	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	112.1	179.3	-51.1	-51.6	0	0	0	108.2	L285 F287 V321 L323 T337 W348 N349 E350 L352 L369	L285-I302 HydrophobicContact CD1-CG2 4.28Å; F287-I302 HydrophobicContact CB-CD1 3.88Å; I302-V321 HydrophobicContact CG2-CB 4.26Å; I302-V321 HydrophobicContact CG2-CG2 3.8Å; I302-L323 HydrophobicContact CD1-CD1 4.12Å; I302-L323 HydrophobicContact CD1-CD2 4.39Å; I302-L323 HydrophobicContact CG1-CD1 4.18Å; I302-T337 HydrophobicContact CB-CG2 3.94Å; I302-T337 HydrophobicContact CG1-CG2 3.87Å; I302-T337 HydrophobicContact CG2-CG2 4.06Å; I302-W348 HydrophobicContact CG2-CD2 4.28Å; I302-W348 HydrophobicContact CG2-CE3 3.74Å; I302-W348 HydrophobicContact CG2-CZ3 4.32Å; I302-N349 CarbonylContact O-C 3.57Å; I302-N349 VanDerWaalsContact O-CA 3.28Å; I302-N349 WeakPolarHBondContact O-CA 3.36Å; I302-N349 PolarHBondContact O-N 3.21Å; I302-N349 VanDerWaalsContact O-N 3.08Å; I302-E350 PolarHBondContact N-O 3.38Å; I302-E350 PolarHBondContact O-N 3.32Å; I302-L352 HydrophobicContact CG1-CD1 4.45Å; I302-L369 HydrophobicContact CD1-CD2 3.54Å
303	I	93.9	Very high	86.6	Confident	32 Å²	32	50 Å²	50	16%	0.164	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-64.3	-169.8	-56	170.1	0	0	0	109	E286 W348 N349	E286-I303 HydrophobicContact CG-CD1 4.39Å; E286-I303 WeakPolarHBondContact O-CA 3.35Å; E286-I303 WeakPolarHBondContact O-CB 3.35Å; E286-I303 PolarHBondContact O-N 2.92Å; I303-W348 PolarHBondContact O-N 2.89Å; I303-N349 WeakPolarHBondContact CG2-OD1 3.46Å; I303-N349 PolarHBondContact O-N 2.16Å
304	K	91.6	Very high	86	Confident	44 Å²	44	50.6 Å²	50.6	19%	0.191	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	164.4	-173.8	61.8	179	179.5	-80.9	0	113.1	E286 P346 L347	E286-K304 HydrophobicContact CB-CG 3.89Å; E286-K304 PolarHBondContact N-O 2.95Å; E286-K304 PolarHBondContact O-N 2.83Å; E286-K304 VanDerWaalsContact O-N 3.11Å; E286-K304 IonicContact OE1-NZ 2.73Å; E286-K304 PolarHBondContact OE1-NZ 2.95Å; E286-K304 WeakPolarHBondContact OE2-CE 3.29Å; E286-K304 IonicContact OE2-NZ 3.27Å; E286-K304 PolarHBondContact OE2-NZ 2.65Å; K304-P346 CarbonylContact C-O 3.3Å; K304-P346 WeakPolarHBondContact CA-O 3.17Å; K304-P346 VanDerWaalsContact CB-O 3.22Å; K304-P346 WeakPolarHBondContact CB-O 3.39Å; K304-L347 HydrophobicContact CB-CD2 3.75Å; K304-L347 HydrophobicContact CD-CD2 3.75Å; K304-L347 HydrophobicContact CG-CD2 4.41Å
305	A	92	Very high	85.2	Confident	2 Å²	2	44.1 Å²	44.1	2%	0.017	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	163.1	159	0	0	0	0	0	111	S284 L285 L308 N345 P346 W348	S284-A305 CarbonylContact O-C 3.57Å; S284-A305 WeakPolarHBondContact O-CA 3.4Å; S284-A305 VanDerWaalsContact O-CB 3.27Å; S284-A305 WeakPolarHBondContact O-CB 3.36Å; L285-A305 HydrophobicContact CD1-CB 4.16Å; A305-L308 HydrophobicContact CB-CD1 4.21Å; A305-L308 HydrophobicContact CB-CD2 3.86Å; A305-L308 HydrophobicContact CB-CG 4.1Å; A305-N345 CarbonylContact O-C 3.49Å; A305-N345 WeakPolarHBondContact O-CA 3.47Å; A305-P346 HydrophobicContact CB-CG 3.85Å; A305-P346 PolarHBondContact N-O 2.85Å; A305-W348 HydrophobicContact CB-CH2 3.9Å; A305-W348 HydrophobicContact CB-CZ3 3.71Å
306	K	87.3	Confident	84.9	Confident	119 Å²	119	42.2 Å²	42.2	52%	0.517	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	142	176.4	-73.1	-171.4	172.7	-171	0	111.4	G283 S284 L308 N345	G283-K306 CarbonylContact C-O 3.52Å; G283-K306 WeakPolarHBondContact CA-O 3.5Å; S284-K306 PolarHBondContact N-O 3.2Å; S284-K306 PolarHBondContact O-N 3.19Å; K306-L308 VanDerWaalsContact C-N 3.3Å; K306-L308 PolarHBondContact O-N 2.67Å; K306-N345 VanDerWaalsContact CA-OD1 3.27Å; K306-N345 WeakPolarHBondContact CA-OD1 3.46Å
307	G	82.6	Confident	84.8	Confident	36 Å²	36	38 Å²	38	37%	0.371	22%	0.223	S	C	.	.	S	Bend	trans	57.6	38.2	172.3	0	0	0	0	0	114.1	G283 L344 N345	G283-G307 VanDerWaalsContact CA-C 3.47Å; G283-G307 WeakPolarHBondContact CA-O 3.17Å; G283-G307 PolarHBondContact N-O 3.46Å; G307-L344 PolarHBondContact N-O 2.91Å; G307-L344 VanDerWaalsContact N-O 3.11Å; G307-N345 PolarHBondContact N-OD1 2.68Å
308	L	85	Confident	84.8	Confident	3 Å²	3	38 Å²	38	2%	0.016	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-57.7	148.3	171.9	-61.1	178.8	0	0	0	109.9	A305 K306 P319 L344 P346 V371 I383 L405	A305-L308 HydrophobicContact CB-CD1 4.21Å; A305-L308 HydrophobicContact CB-CD2 3.86Å; A305-L308 HydrophobicContact CB-CG 4.1Å; K306-L308 VanDerWaalsContact C-N 3.3Å; K306-L308 PolarHBondContact O-N 2.67Å; L308-P319 HydrophobicContact CD1-CB 3.64Å; L308-P319 HydrophobicContact CD1-CG 3.82Å; L308-L344 HydrophobicContact CB-CB 4.5Å; L308-L344 HydrophobicContact CB-CD2 4.46Å; L308-L344 PolarHBondContact N-O 2.65Å; L308-P346 HydrophobicContact CD1-CG 3.82Å; L308-V371 HydrophobicContact CD1-CG1 4.23Å; L308-V371 HydrophobicContact CD2-CG1 4.19Å; L308-I383 HydrophobicContact CB-CG2 4.33Å; L308-I383 HydrophobicContact CD1-CD1 4.38Å; L308-I383 HydrophobicContact CD2-CG2 4.17Å; L308-L405 HydrophobicContact CD2-CD1 3.52Å
309	K	78.3	Confident	84.7	Confident	41 Å²	41	38 Å²	38	18%	0.178	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-67.6	134.3	171.8	-177	172.9	171	57.2	0	109	D278 M311	D278-K309 IonicContact OD1-NZ 2.76Å; D278-K309 PolarHBondContact OD1-NZ 2.86Å; D278-K309 IonicContact OD2-NZ 2.75Å; D278-K309 PolarHBondContact OD2-NZ 2.96Å; K309-M311 HydrophobicContact CB-CE 4.22Å; K309-M311 HydrophobicContact CB-SD 4.44Å; K309-M311 HydrophobicContact CD-CE 4.39Å; K309-M311 HydrophobicContact CD-SD 4.28Å; K309-M311 HydrophobicContact CG-CE 4.42Å; K309-M311 HydrophobicContact CG-SD 4.15Å
310	P	79.6	Confident	84.7	Confident	48 Å²	48	36.1 Å²	36.1	31%	0.312	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-66.8	134.1	169.7	27.9	-34.9	0	0	0	111.2	G315 L316 L344	P310-G315 VanDerWaalsContact CB-C 3.44Å; P310-G315 WeakPolarHBondContact CB-O 3.49Å; P310-L316 CarbonylContact C-O 3.6Å; P310-L316 VanDerWaalsContact CA-O 3.22Å; P310-L316 WeakPolarHBondContact CA-O 3.34Å; P310-L344 HydrophobicContact CB-CD1 4.2Å; P310-L344 HydrophobicContact CB-CD2 4.03Å; P310-L344 HydrophobicContact CG-CD1 4.38Å
311	M	77.9	Confident	84.7	Confident	46 Å²	46	36.1 Å²	36.1	23%	0.227	22%	0.215	C	C	.	.			trans	-120.7	-33.1	178.6	-55.1	-54.7	-160.3	0	0	111.4	K309 L316 E381 I383	K309-M311 HydrophobicContact CB-CE 4.22Å; K309-M311 HydrophobicContact CB-SD 4.44Å; K309-M311 HydrophobicContact CD-CE 4.39Å; K309-M311 HydrophobicContact CD-SD 4.28Å; K309-M311 HydrophobicContact CG-CE 4.42Å; K309-M311 HydrophobicContact CG-SD 4.15Å; M311-L316 PolarHBondContact N-O 2.55Å; M311-E381 HydrophobicContact CB-CB 4.45Å; M311-E381 HydrophobicContact CE-CG 4.33Å; M311-E381 HydrophobicContact CG-CB 4.48Å; M311-E381 HydrophobicContact CG-CG 4.22Å; M311-E381 HydrophobicContact SD-CG 4.37Å; M311-I383 HydrophobicContact CE-CB 4.25Å; M311-I383 HydrophobicContact CE-CG1 4.03Å; M311-I383 HydrophobicContact CE-CG2 4.28Å; M311-I383 HydrophobicContact CG-CG1 4.09Å
312	D	75.8	Confident	84.5	Confident	39 Å²	39	39.8 Å²	39.8	21%	0.209	23%	0.228	C	C	.	.	S	Bend	trans	-61.9	145.6	170.3	-99.6	-37.8	0	0	0	111.6	N314 G315 L316	D312-N314 VanDerWaalsContact CB-CG 3.45Å; D312-N314 WeakPolarHBondContact CB-ND2 3.49Å; D312-N314 WeakPolarHBondContact CB-OD1 3.28Å; D312-N314 VanDerWaalsContact CG-ND2 3.31Å; D312-N314 PolarHBondContact O-N 3.09Å; D312-N314 PolarHBondContact OD2-ND2 3.16Å; D312-G315 PolarHBondContact O-N 2.82Å; D312-L316 PolarHBondContact N-O 3.46Å
313	S	69.1	Low	84.3	Confident	134 Å²	134	39.8 Å²	39.8	94%	0.937	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-5.3	170.9	58.8	0	0	0	0	114.7
314	N	73.2	Confident	84	Confident	80 Å²	80	39.7 Å²	39.7	43%	0.428	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-2.4	172.8	66.2	34.6	0	0	0	113.5	D312 L316	D312-N314 VanDerWaalsContact CB-CG 3.45Å; D312-N314 WeakPolarHBondContact CB-ND2 3.49Å; D312-N314 WeakPolarHBondContact CB-OD1 3.28Å; D312-N314 VanDerWaalsContact CG-ND2 3.31Å; D312-N314 PolarHBondContact O-N 3.09Å; D312-N314 PolarHBondContact OD2-ND2 3.16Å; N314-L316 WeakPolarHBondContact OD1-CA 3.42Å; N314-L316 WeakPolarHBondContact OD1-CB 3.36Å; N314-L316 PolarHBondContact OD1-N 3.37Å
315	G	69.9	Low	83.7	Confident	41 Å²	41	37.6 Å²	37.6	42%	0.423	22%	0.218	S	C	.	.	S	Bend	trans	82.4	15.3	-177.5	0	0	0	0	0	114.9	P310 D312	P310-G315 VanDerWaalsContact CB-C 3.44Å; P310-G315 WeakPolarHBondContact CB-O 3.49Å; D312-G315 PolarHBondContact O-N 2.82Å
316	L	80.4	Confident	83.1	Confident	63 Å²	63	39.8 Å²	39.8	33%	0.33	23%	0.229	S	C	.	.	S	Bend	trans	-130.7	-149.2	179.7	-53.6	167.4	0	0	0	109.9	P310 M311 D312 N314 N342 L344	P310-L316 CarbonylContact C-O 3.6Å; P310-L316 VanDerWaalsContact CA-O 3.22Å; P310-L316 WeakPolarHBondContact CA-O 3.34Å; M311-L316 PolarHBondContact N-O 2.55Å; D312-L316 PolarHBondContact N-O 3.46Å; N314-L316 WeakPolarHBondContact OD1-CA 3.42Å; N314-L316 WeakPolarHBondContact OD1-CB 3.36Å; N314-L316 PolarHBondContact OD1-N 3.37Å; L316-N342 HydrophobicContact CD1-CB 3.81Å; L316-L344 HydrophobicContact CD2-CG 4.24Å
317	A	84.4	Confident	81.9	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.233	C	C	.	.			trans	-162.9	157.6	179.2	0	0	0	0	0	109.8	P319 N342 T343 L344 D373 I383	A317-P319 WeakPolarHBondContact O-CD 3.43Å; A317-N342 CarbonylContact O-C 3.53Å; A317-N342 VanDerWaalsContact O-CA 3.27Å; A317-N342 WeakPolarHBondContact O-CA 3.33Å; A317-N342 PolarHBondContact O-N 2.92Å; A317-T343 PolarHBondContact O-N 2.86Å; A317-L344 HydrophobicContact CB-CD2 3.98Å; A317-D373 WeakPolarHBondContact CA-OD2 3.14Å; A317-D373 WeakPolarHBondContact CB-OD2 3.06Å; A317-I383 HydrophobicContact CB-CD1 4.43Å
318	D	87.8	Confident	80.6	Confident	2 Å²	2	38.3 Å²	38.3	1%	0.011	23%	0.231	C	C	.	.			trans	-104.3	65	165.5	-86.9	10.7	0	0	0	110.2	T339 L340 K341 N342 D373 E374 K376	D318-T339 HydrophobicContact CB-CG2 4.02Å; D318-T339 WeakPolarHBondContact O-CG2 3.3Å; D318-L340 CarbonylContact C-O 3.6Å; D318-L340 VanDerWaalsContact C-O 3.25Å; D318-L340 VanDerWaalsContact CA-O 3.31Å; D318-L340 WeakPolarHBondContact CA-O 3.45Å; D318-K341 WeakPolarHBondContact OD1-CA 3.46Å; D318-K341 WeakPolarHBondContact OD1-CB 3.48Å; D318-K341 WeakPolarHBondContact OD2-CG 3.09Å; D318-N342 PolarHBondContact OD1-N 3.15Å; D318-D373 VanDerWaalsContact CA-OD1 3.29Å; D318-D373 WeakPolarHBondContact CA-OD1 3.4Å; D318-D373 WeakPolarHBondContact CB-OD1 3.32Å; D318-D373 PolarHBondContact N-OD1 2.86Å; D318-D373 PolarHBondContact N-OD2 3.33Å; D318-E374 PolarHBondContact O-N 3.36Å; D318-E374 VanDerWaalsContact O-N 3.1Å; D318-K376 IonicContact OD1-NZ 2.78Å; D318-K376 WeakPolarHBondContact OD2-CE 3.38Å; D318-K376 IonicContact OD2-NZ 2.66Å; D318-K376 PolarHBondContact OD2-NZ 3.41Å
319	P	90.6	Very high	78.7	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	146.4	-168.1	31.1	-40.7	0	0	0	116.2	L308 A317 L340 T343 P346 W348 V371 S372 I383	L308-P319 HydrophobicContact CD1-CB 3.64Å; L308-P319 HydrophobicContact CD1-CG 3.82Å; A317-P319 WeakPolarHBondContact O-CD 3.43Å; P319-L340 WeakPolarHBondContact CD-O 3.44Å; P319-L340 VanDerWaalsContact N-O 3.16Å; P319-L340 PolarHBondContact O-N 2.87Å; P319-T343 WeakPolarHBondContact CD-O 3.27Å; P319-T343 HydrophobicContact CG-CG2 4.22Å; P319-T343 VanDerWaalsContact CG-O 3.31Å; P319-T343 WeakPolarHBondContact CG-O 3.3Å; P319-P346 HydrophobicContact CB-CG 4.33Å; P319-P346 HydrophobicContact CG-CB 3.92Å; P319-P346 HydrophobicContact CG-CG 3.7Å; P319-W348 HydrophobicContact CB-CZ2 4.14Å; P319-W348 HydrophobicContact CG-CZ2 4.45Å; P319-V371 HydrophobicContact CB-CG1 4.42Å; P319-S372 WeakPolarHBondContact CA-O 3.43Å; P319-I383 HydrophobicContact CB-CD1 4.41Å
320	Y	93.1	Very high	77.6	Confident	7 Å²	7	43.6 Å²	43.6	3%	0.027	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	161.8	164.9	70.8	-84	0	0	0	111.6	K322 R336 V371 S372 D373 E374 N380	Y320-K322 HydrophobicContact CE2-CB 4.13Å; Y320-K322 HydrophobicContact CE2-CD 4.47Å; Y320-R336 HydrophobicContact CD2-CG 3.8Å; Y320-R336 HydrophobicContact CE2-CG 4.31Å; Y320-V371 WeakPolarHBondContact O-CA 3.4Å; Y320-S372 WeakPolarHBondContact CD1-O 3.4Å; Y320-S372 PolarHBondContact N-O 3.11Å; Y320-S372 PolarHBondContact O-N 2.82Å; Y320-D373 VanDerWaalsContact CE1-O 3.31Å; Y320-D373 WeakPolarHBondContact CE1-O 3.28Å; Y320-E374 HydrophobicContact CD1-CB 3.95Å; Y320-E374 HydrophobicContact CE1-CB 3.98Å; Y320-N380 WeakPolarHBondContact CE1-ND2 3.49Å; Y320-N380 PolarHBondContact OH-ND2 2.99Å
321	V	93.6	Very high	76.3	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133	176.5	-163.3	0	0	0	0	110.5	L285 I302 L323 R336 T337 W348 L369 V371	L285-V321 HydrophobicContact CD1-CG2 3.98Å; L285-V321 HydrophobicContact CD2-CG1 4.06Å; I302-V321 HydrophobicContact CG2-CB 4.26Å; I302-V321 HydrophobicContact CG2-CG2 3.8Å; V321-L323 HydrophobicContact CB-CD1 4.48Å; V321-L323 HydrophobicContact CG1-CD1 4.04Å; V321-R336 CarbonylContact O-C 3.52Å; V321-R336 VanDerWaalsContact O-CA 3.3Å; V321-R336 WeakPolarHBondContact O-CA 3.42Å; V321-T337 HydrophobicContact CB-CG2 4Å; V321-T337 HydrophobicContact CG2-CG2 4.41Å; V321-T337 PolarHBondContact N-OG1 2.8Å; V321-T337 PolarHBondContact O-N 2.79Å; V321-W348 HydrophobicContact CG2-CD2 4.08Å; V321-W348 HydrophobicContact CG2-CE3 3.86Å; V321-W348 HydrophobicContact CG2-CH2 3.3Å; V321-W348 HydrophobicContact CG2-CZ2 3.56Å; V321-W348 HydrophobicContact CG2-CZ3 3.46Å; V321-W348 VanDerWaalsContact CG2-CZ3 3.46Å; V321-L369 HydrophobicContact CG1-CB 4.25Å; V321-L369 HydrophobicContact CG1-CD2 4.48Å; V321-V371 HydrophobicContact CG1-CG2 4.28Å; V321-V371 HydrophobicContact CG2-CG2 4.17Å
322	K	92.1	Very high	75.6	Confident	98 Å²	98	52.3 Å²	52.3	43%	0.426	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	121.6	-179.6	-164.4	178.2	-164.3	159	0	109.4	Y320 L369 S370	Y320-K322 HydrophobicContact CE2-CB 4.13Å; Y320-K322 HydrophobicContact CE2-CD 4.47Å; K322-L369 WeakPolarHBondContact O-CA 3.26Å; K322-S370 PolarHBondContact N-O 3.2Å; K322-S370 PolarHBondContact O-N 3.35Å
323	L	92.6	Very high	75.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	134.8	-179.6	-75.5	63	0	0	0	108.6	C300 I302 V321 K334 L335 L352 Y354 L367 R368 L369	C300-L323 HydrophobicContact CB-CD2 3.43Å; C300-L323 VanDerWaalsContact CB-CD2 3.43Å; I302-L323 HydrophobicContact CD1-CD1 4.12Å; I302-L323 HydrophobicContact CD1-CD2 4.39Å; I302-L323 HydrophobicContact CG1-CD1 4.18Å; V321-L323 HydrophobicContact CB-CD1 4.48Å; V321-L323 HydrophobicContact CG1-CD1 4.04Å; L323-K334 VanDerWaalsContact O-CA 3.3Å; L323-K334 WeakPolarHBondContact O-CA 3.25Å; L323-L335 HydrophobicContact CB-CB 4.24Å; L323-L335 PolarHBondContact N-O 3.27Å; L323-L335 PolarHBondContact O-N 2.8Å; L323-L352 HydrophobicContact CD1-CD1 3.73Å; L323-L352 HydrophobicContact CD2-CB 4.08Å; L323-L352 HydrophobicContact CD2-CD1 3.86Å; L323-L352 HydrophobicContact CG-CD1 4.39Å; L323-Y354 HydrophobicContact CB-CE2 4.36Å; L323-Y354 WeakPolarHBondContact CB-OH 3.38Å; L323-Y354 HydrophobicContact CD2-CE2 4.36Å; L323-Y354 PolarHBondContact O-OH 3.31Å; L323-L367 HydrophobicContact CB-CD1 4.09Å; L323-L367 HydrophobicContact CG-CD1 4.35Å; L323-R368 CarbonylContact C-O 3.49Å; L323-R368 WeakPolarHBondContact CA-O 3.43Å; L323-L369 HydrophobicContact CD1-CD2 4.49Å; L323-L369 HydrophobicContact CG-CD2 4.41Å; L323-L369 HydrophobicContact CG-CG 4.39Å
324	H	88.1	Confident	76.2	Confident	31 Å²	31	49.8 Å²	49.8	14%	0.144	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	118.8	174.1	-171.8	-170.2	0	0	0	111.1	L326 G328 N333 K334 R368	H324-L326 VanDerWaalsContact CE1-CD2 3.4Å; H324-L326 WeakPolarHBondContact CE1-CD2 3.47Å; H324-G328 PolarHBondContact NE2-O 3.39Å; H324-N333 WeakPolarHBondContact CA-O 3.35Å; H324-K334 HydrophobicContact CB-CG 4.33Å; H324-K334 VanDerWaalsContact CE1-CE 3.5Å; H324-K334 WeakPolarHBondContact CE1-CE 3.43Å; H324-R368 PolarHBondContact N-O 2.81Å; H324-R368 PolarHBondContact O-N 3.43Å
325	L	84	Confident	77	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	118	170.5	-73.1	178.7	0	0	0	111.9	L298 N333 Y354 I357 K365 L367 L390	L298-L325 HydrophobicContact CD2-CD2 4.22Å; L325-N333 HydrophobicContact CB-CB 4.15Å; L325-N333 PolarHBondContact N-O 3.07Å; L325-N333 PolarHBondContact O-ND2 3.32Å; L325-Y354 HydrophobicContact CD1-CD1 3.64Å; L325-Y354 HydrophobicContact CD1-CD2 3.82Å; L325-Y354 HydrophobicContact CD1-CE1 3.85Å; L325-Y354 HydrophobicContact CD1-CE2 4.02Å; L325-Y354 HydrophobicContact CD1-CG 3.6Å; L325-Y354 HydrophobicContact CD2-CE2 4.49Å; L325-Y354 HydrophobicContact CG-CD1 4.34Å; L325-Y354 HydrophobicContact CG-CD2 4.16Å; L325-Y354 HydrophobicContact CG-CE1 4.07Å; L325-Y354 HydrophobicContact CG-CE2 3.88Å; L325-Y354 HydrophobicContact CG-CG 4.37Å; L325-I357 HydrophobicContact CD1-CD1 3.54Å; L325-I357 HydrophobicContact CD1-CG1 4.34Å; L325-K365 HydrophobicContact CB-CD 4.34Å; L325-L367 HydrophobicContact CD2-CB 4.06Å; L325-L367 HydrophobicContact CD2-CD1 3.85Å; L325-L367 HydrophobicContact CG-CD1 4.29Å; L325-L390 HydrophobicContact CD2-CD1 3.92Å
326	L	79.4	Confident	78.1	Confident	48 Å²	48	51.1 Å²	51.1	25%	0.251	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	145.4	177.4	-59.9	174.1	0	0	0	110.3	H324 K365 T366 R368	H324-L326 VanDerWaalsContact CE1-CD2 3.4Å; H324-L326 WeakPolarHBondContact CE1-CD2 3.47Å; L326-K365 CarbonylContact O-C 3.57Å; L326-K365 WeakPolarHBondContact O-CA 3.45Å; L326-K365 WeakPolarHBondContact O-CB 3.25Å; L326-T366 PolarHBondContact N-O 2.91Å; L326-T366 PolarHBondContact O-N 3.28Å; L326-R368 HydrophobicContact CD1-CB 4.17Å
327	P	63.5	Low	78.7	Confident	92 Å²	92	48.3 Å²	48.3	60%	0.597	27%	0.267	S	S	*	.	S	Bend	cis	-69.4	150.3	-10.4	30.3	-35.3	0	0	0	111.9
328	G	54.8	Low	79	Confident	32 Å²	32	54.9 Å²	54.9	33%	0.33	30%	0.296	S	S	.	.			trans	147	125.3	174.7	0	0	0	0	0	113.2	H324	H324-G328 PolarHBondContact NE2-O 3.39Å
329	A	45.3	Very low	79.1	Confident	96 Å²	96	56.1 Å²	56.1	79%	0.793	30%	0.304	S	S	*	.			trans	-94.7	-3.9	-176.9	0	0	0	0	0	114.2
330	S	55.6	Low	79.1	Confident	59 Å²	59	58.7 Å²	58.7	41%	0.413	32%	0.317	S	S	.	.			trans	-59.1	150.5	-178.1	-175.9	0	0	0	0	112.8	S332 N333	S330-S332 VanDerWaalsContact C-N 3.26Å; S330-S332 WeakPolarHBondContact CB-OG 3.29Å; S330-S332 PolarHBondContact O-N 2.81Å; S330-S332 PolarHBondContact OG-N 3.05Å; S330-S332 VanDerWaalsContact OG-N 3.16Å; S330-S332 PolarHBondContact OG-OG 2.89Å; S330-N333 PolarHBondContact O-N 2.86Å
331	K	51.5	Low	78.8	Confident	194 Å²	194	64.7 Å²	64.7	84%	0.843	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-62.5	-33.9	168.3	-68.5	-174	178.5	-177.9	0	111.7	N333 K334	K331-N333 PolarHBondContact O-N 2.87Å; K331-K334 PolarHBondContact O-N 3.47Å
332	S	62.2	Low	78.3	Confident	83 Å²	83	69 Å²	69	58%	0.58	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-63.7	-22.4	177.9	58.2	0	0	0	0	114.1	S330 K334	S330-S332 VanDerWaalsContact C-N 3.26Å; S330-S332 WeakPolarHBondContact CB-OG 3.29Å; S330-S332 PolarHBondContact O-N 2.81Å; S330-S332 PolarHBondContact OG-N 3.05Å; S330-S332 VanDerWaalsContact OG-N 3.16Å; S330-S332 PolarHBondContact OG-OG 2.89Å; S332-K334 PolarHBondContact O-N 2.86Å
333	N	75.4	Confident	78	Confident	19 Å²	19	66 Å²	66	10%	0.102	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-76.8	0.7	177.5	-74.7	33.3	0	0	0	113	H324 L325 S330 K331 Y354	H324-N333 WeakPolarHBondContact CA-O 3.35Å; L325-N333 HydrophobicContact CB-CB 4.15Å; L325-N333 PolarHBondContact N-O 3.07Å; L325-N333 PolarHBondContact O-ND2 3.32Å; S330-N333 PolarHBondContact O-N 2.86Å; K331-N333 PolarHBondContact O-N 2.87Å; N333-Y354 WeakPolarHBondContact O-CE1 3.37Å; N333-Y354 PolarHBondContact O-OH 3.04Å
334	K	83.5	Confident	77.7	Confident	101 Å²	101	67.6 Å²	67.6	44%	0.439	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	121.8	-173.3	-65.7	173.7	-177.6	172.3	0	111.4	L323 H324 K331 S332	L323-K334 VanDerWaalsContact O-CA 3.3Å; L323-K334 WeakPolarHBondContact O-CA 3.25Å; H324-K334 HydrophobicContact CB-CG 4.33Å; H324-K334 VanDerWaalsContact CE1-CE 3.5Å; H324-K334 WeakPolarHBondContact CE1-CE 3.43Å; K331-K334 PolarHBondContact O-N 3.47Å; S332-K334 PolarHBondContact O-N 2.86Å
335	L	89.3	Confident	77.7	Confident	48 Å²	48	70.4 Å²	70.4	25%	0.251	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	163.9	172	-60.9	174.9	0	0	0	109.2	L323 L352 I353 Y354	L323-L335 HydrophobicContact CB-CB 4.24Å; L323-L335 PolarHBondContact N-O 3.27Å; L323-L335 PolarHBondContact O-N 2.8Å; L335-L352 HydrophobicContact CB-CB 4.25Å; L335-L352 HydrophobicContact CB-CD1 4.17Å; L335-L352 HydrophobicContact CD1-CB 3.93Å; L335-I353 WeakPolarHBondContact CD1-O 3.48Å; L335-Y354 HydrophobicContact CD1-CD1 3.79Å; L335-Y354 HydrophobicContact CD1-CD2 3.85Å; L335-Y354 HydrophobicContact CD1-CE1 3.67Å; L335-Y354 HydrophobicContact CD1-CE2 3.73Å; L335-Y354 HydrophobicContact CD1-CG 3.89Å; L335-Y354 HydrophobicContact CG-CD1 4.18Å; L335-Y354 HydrophobicContact CG-CE1 3.63Å; L335-Y354 HydrophobicContact CG-CE2 4.28Å
336	R	92.3	Very high	78	Confident	100 Å²	100	70.4 Å²	70.4	38%	0.377	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	142.9	-177.8	156.3	171.3	170.7	-174	-12	109.9	Y320 V321 T339 E374	Y320-R336 HydrophobicContact CD2-CG 3.8Å; Y320-R336 HydrophobicContact CE2-CG 4.31Å; V321-R336 CarbonylContact O-C 3.52Å; V321-R336 VanDerWaalsContact O-CA 3.3Å; V321-R336 WeakPolarHBondContact O-CA 3.42Å; R336-T339 PolarHBondContact NH2-OG1 2.92Å; R336-E374 IonicContact CZ-OE1 3.75Å; R336-E374 IonicContact CZ-OE2 2.64Å; R336-E374 IonicContact NH1-OE1 2.98Å; R336-E374 PolarHBondContact NH1-OE1 3.28Å; R336-E374 IonicContact NH2-OE1 2.65Å; R336-E374 PolarHBondContact NH2-OE1 2.85Å; R336-E374 IonicContact NH2-OE2 3.1Å; R336-E374 PolarHBondContact NH2-OE2 2.9Å
337	T	93.4	Very high	78.7	Confident	4 Å²	4	73.4 Å²	73.4	3%	0.025	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-78.6	166.5	169.7	66.9	0	0	0	0	111.9	I302 V321 W348 E350 L352	I302-T337 HydrophobicContact CB-CG2 3.94Å; I302-T337 HydrophobicContact CG1-CG2 3.87Å; I302-T337 HydrophobicContact CG2-CG2 4.06Å; V321-T337 HydrophobicContact CB-CG2 4Å; V321-T337 HydrophobicContact CG2-CG2 4.41Å; V321-T337 PolarHBondContact N-OG1 2.8Å; V321-T337 PolarHBondContact O-N 2.79Å; T337-W348 HydrophobicContact CG2-CG 4.45Å; T337-W348 PolarHBondContact OG1-NE1 3.03Å; T337-E350 WeakPolarHBondContact CA-OE2 3.33Å; T337-E350 WeakPolarHBondContact CB-OE2 3.4Å; T337-L352 HydrophobicContact CG2-CD1 3.85Å
338	K	91.3	Very high	80.1	Confident	139 Å²	139	70.1 Å²	70.1	60%	0.604	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-56.2	150.1	161.5	-67.1	160.9	-171.1	161	0	110.9	W348 E350	K338-W348 PolarHBondContact O-NE1 3.1Å; K338-E350 WeakPolarHBondContact CD-OE1 3.41Å; K338-E350 WeakPolarHBondContact CE-OE1 3.3Å; K338-E350 PolarHBondContact N-OE2 3.19Å; K338-E350 IonicContact NZ-OE1 2.73Å; K338-E350 PolarHBondContact NZ-OE1 2.94Å
339	T	90.4	Very high	81.9	Confident	28 Å²	28	73.6 Å²	73.6	17%	0.172	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-81.5	129.6	169.4	-44.6	0	0	0	0	108.7	D318 R336 E374	D318-T339 HydrophobicContact CB-CG2 4.02Å; D318-T339 WeakPolarHBondContact O-CG2 3.3Å; R336-T339 PolarHBondContact NH2-OG1 2.92Å; T339-E374 WeakPolarHBondContact CB-OE2 3.41Å; T339-E374 HydrophobicContact CG2-CB 3.76Å; T339-E374 PolarHBondContact OG1-OE2 3.15Å
340	L	89.1	Confident	84.2	Confident	53 Å²	53	70.8 Å²	70.8	28%	0.277	35%	0.353	S	S	.	.			trans	-107	134.8	170.1	-63.2	-178.8	0	0	0	107.7	D318 P319 T343 P346 L347 W348	D318-L340 CarbonylContact C-O 3.6Å; D318-L340 VanDerWaalsContact C-O 3.25Å; D318-L340 VanDerWaalsContact CA-O 3.31Å; D318-L340 WeakPolarHBondContact CA-O 3.45Å; P319-L340 WeakPolarHBondContact CD-O 3.44Å; P319-L340 VanDerWaalsContact N-O 3.16Å; P319-L340 PolarHBondContact O-N 2.87Å; L340-T343 HydrophobicContact CB-CG2 4.01Å; L340-P346 HydrophobicContact CB-CB 4.21Å; L340-P346 HydrophobicContact CD1-CB 3.82Å; L340-L347 WeakPolarHBondContact CD1-O 3.42Å; L340-W348 HydrophobicContact CD1-CG 4.08Å
341	K	87.2	Confident	86	Confident	133 Å²	133	71.4 Å²	71.4	58%	0.578	36%	0.355	S	S	*	.			trans	-97.5	150.4	-167.2	-61.7	-168.8	172.6	161.6	0	113.3	D318 T343	D318-K341 WeakPolarHBondContact OD1-CA 3.46Å; D318-K341 WeakPolarHBondContact OD1-CB 3.48Å; D318-K341 WeakPolarHBondContact OD2-CG 3.09Å; K341-T343 PolarHBondContact O-N 2.87Å
342	N	84.3	Confident	88	Confident	92 Å²	92	63.2 Å²	63.2	49%	0.492	32%	0.32	S	S	.	.	S	Bend	trans	47	51.2	175.5	-62.4	-16.8	0	0	0	113.1	L316 A317 D318	L316-N342 HydrophobicContact CD1-CB 3.81Å; A317-N342 CarbonylContact O-C 3.53Å; A317-N342 VanDerWaalsContact O-CA 3.27Å; A317-N342 WeakPolarHBondContact O-CA 3.33Å; A317-N342 PolarHBondContact O-N 2.92Å; D318-N342 PolarHBondContact OD1-N 3.15Å
343	T	85.9	Confident	89.5	Confident	33 Å²	33	62 Å²	62	20%	0.202	31%	0.307	C	S	.	.			trans	-149.4	129.6	-177.7	-176.7	0	0	0	0	115.2	A317 P319 L340 K341 N345 P346	A317-T343 PolarHBondContact O-N 2.86Å; P319-T343 WeakPolarHBondContact CD-O 3.27Å; P319-T343 HydrophobicContact CG-CG2 4.22Å; P319-T343 VanDerWaalsContact CG-O 3.31Å; P319-T343 WeakPolarHBondContact CG-O 3.3Å; L340-T343 HydrophobicContact CB-CG2 4.01Å; K341-T343 PolarHBondContact O-N 2.87Å; T343-N345 VanDerWaalsContact C-N 3.34Å; T343-N345 PolarHBondContact OG1-N 2.76Å; T343-N345 VanDerWaalsContact OG1-N 3.1Å; T343-P346 HydrophobicContact CG2-CB 4Å
344	L	84.9	Confident	90.1	Very high	35 Å²	35	61.5 Å²	61.5	18%	0.183	30%	0.303	C	S	.	.	S	Bend	trans	-88.5	-1.9	170.1	-54.2	-177.2	0	0	0	113.2	G307 L308 P310 L316 A317 P346	G307-L344 PolarHBondContact N-O 2.91Å; G307-L344 VanDerWaalsContact N-O 3.11Å; L308-L344 HydrophobicContact CB-CB 4.5Å; L308-L344 HydrophobicContact CB-CD2 4.46Å; L308-L344 PolarHBondContact N-O 2.65Å; P310-L344 HydrophobicContact CB-CD1 4.2Å; P310-L344 HydrophobicContact CB-CD2 4.03Å; P310-L344 HydrophobicContact CG-CD1 4.38Å; L316-L344 HydrophobicContact CD2-CG 4.24Å; A317-L344 HydrophobicContact CB-CD2 3.98Å; L344-P346 VanDerWaalsContact C-CD 3.48Å
345	N	87.9	Confident	90.3	Very high	89 Å²	89	63.4 Å²	63.4	48%	0.476	31%	0.313	S	S	.	.	S	Bend	trans	-134.2	58.9	-178.7	-61.9	-82.5	0	0	0	111.3	A305 K306 G307 T343	A305-N345 CarbonylContact O-C 3.49Å; A305-N345 WeakPolarHBondContact O-CA 3.47Å; K306-N345 VanDerWaalsContact CA-OD1 3.27Å; K306-N345 WeakPolarHBondContact CA-OD1 3.46Å; G307-N345 PolarHBondContact N-OD1 2.68Å; T343-N345 VanDerWaalsContact C-N 3.34Å; T343-N345 PolarHBondContact OG1-N 2.76Å; T343-N345 VanDerWaalsContact OG1-N 3.1Å
346	P	91	Very high	90	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.006	33%	0.327	C	S	.	.			trans	-64.7	140.2	-175.8	26.7	-36.5	0	0	0	113.4	K304 A305 L308 P319 L340 T343 L344 W348	K304-P346 CarbonylContact C-O 3.3Å; K304-P346 WeakPolarHBondContact CA-O 3.17Å; K304-P346 VanDerWaalsContact CB-O 3.22Å; K304-P346 WeakPolarHBondContact CB-O 3.39Å; A305-P346 HydrophobicContact CB-CG 3.85Å; A305-P346 PolarHBondContact N-O 2.85Å; L308-P346 HydrophobicContact CD1-CG 3.82Å; P319-P346 HydrophobicContact CB-CG 4.33Å; P319-P346 HydrophobicContact CG-CB 3.92Å; P319-P346 HydrophobicContact CG-CG 3.7Å; L340-P346 HydrophobicContact CB-CB 4.21Å; L340-P346 HydrophobicContact CD1-CB 3.82Å; T343-P346 HydrophobicContact CG2-CB 4Å; L344-P346 VanDerWaalsContact C-CD 3.48Å; P346-W348 HydrophobicContact CB-CD2 4.18Å; P346-W348 HydrophobicContact CB-CE3 4.33Å; P346-W348 HydrophobicContact CB-CH2 3.86Å; P346-W348 HydrophobicContact CB-CZ2 3.64Å; P346-W348 HydrophobicContact CB-CZ3 4.2Å; P346-W348 HydrophobicContact CG-CE3 4.32Å; P346-W348 HydrophobicContact CG-CH2 3.24Å; P346-W348 HydrophobicContact CG-CZ2 3.49Å; P346-W348 VanDerWaalsContact CG-CZ2 3.49Å; P346-W348 HydrophobicContact CG-CZ3 3.71Å
347	L	93.1	Very high	89.6	Confident	111 Å²	111	59.2 Å²	59.2	58%	0.581	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.9	83.9	177.9	-67	167	0	0	0	109.7	K304 L340	K304-L347 HydrophobicContact CB-CD2 3.75Å; K304-L347 HydrophobicContact CD-CD2 3.75Å; K304-L347 HydrophobicContact CG-CD2 4.41Å; L340-L347 WeakPolarHBondContact CD1-O 3.42Å
348	W	94.1	Very high	89.1	Confident	23 Å²	23	61.9 Å²	61.9	9%	0.087	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-45.2	-176.5	-63.8	-77.2	0	0	0	113.5	L285 I302 I303 A305 P319 V321 T337 K338 L340 P346 E350 V371	L285-W348 HydrophobicContact CD1-CE3 4.5Å; L285-W348 HydrophobicContact CD1-CH2 4.37Å; L285-W348 HydrophobicContact CD1-CZ3 3.68Å; I302-W348 HydrophobicContact CG2-CD2 4.28Å; I302-W348 HydrophobicContact CG2-CE3 3.74Å; I302-W348 HydrophobicContact CG2-CZ3 4.32Å; I303-W348 PolarHBondContact O-N 2.89Å; A305-W348 HydrophobicContact CB-CH2 3.9Å; A305-W348 HydrophobicContact CB-CZ3 3.71Å; P319-W348 HydrophobicContact CB-CZ2 4.14Å; P319-W348 HydrophobicContact CG-CZ2 4.45Å; V321-W348 HydrophobicContact CG2-CD2 4.08Å; V321-W348 HydrophobicContact CG2-CE3 3.86Å; V321-W348 HydrophobicContact CG2-CH2 3.3Å; V321-W348 HydrophobicContact CG2-CZ2 3.56Å; V321-W348 HydrophobicContact CG2-CZ3 3.46Å; V321-W348 VanDerWaalsContact CG2-CZ3 3.46Å; T337-W348 HydrophobicContact CG2-CG 4.45Å; T337-W348 PolarHBondContact OG1-NE1 3.03Å; K338-W348 PolarHBondContact O-NE1 3.1Å; L340-W348 HydrophobicContact CD1-CG 4.08Å; P346-W348 HydrophobicContact CB-CD2 4.18Å; P346-W348 HydrophobicContact CB-CE3 4.33Å; P346-W348 HydrophobicContact CB-CH2 3.86Å; P346-W348 HydrophobicContact CB-CZ2 3.64Å; P346-W348 HydrophobicContact CB-CZ3 4.2Å; P346-W348 HydrophobicContact CG-CE3 4.32Å; P346-W348 HydrophobicContact CG-CH2 3.24Å; P346-W348 HydrophobicContact CG-CZ2 3.49Å; P346-W348 VanDerWaalsContact CG-CZ2 3.49Å; P346-W348 HydrophobicContact CG-CZ3 3.71Å; W348-E350 HydrophobicContact CB-CB 4.25Å; W348-E350 PolarHBondContact O-N 3.47Å; W348-E350 VanDerWaalsContact O-N 3.11Å; W348-V371 HydrophobicContact CH2-CG1 4.46Å
349	N	92.4	Very high	88.7	Confident	105 Å²	105	57.5 Å²	57.5	56%	0.561	31%	0.311	S	S	*	.	E	Extended strand (participates in β ladder)	trans	46.2	35	-172	-61	-58.8	0	0	0	114	I302 I303	I302-N349 CarbonylContact O-C 3.57Å; I302-N349 VanDerWaalsContact O-CA 3.28Å; I302-N349 WeakPolarHBondContact O-CA 3.36Å; I302-N349 PolarHBondContact O-N 3.21Å; I302-N349 VanDerWaalsContact O-N 3.08Å; I303-N349 WeakPolarHBondContact CG2-OD1 3.46Å; I303-N349 PolarHBondContact O-N 2.16Å
350	E	93.4	Very high	88.2	Confident	36 Å²	36	60.1 Å²	60.1	17%	0.168	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	132.5	-168.7	-174.6	158.3	-136.3	0	0	111.1	C301 I302 T337 K338 W348 L352	C301-E350 CarbonylContact C-O 3.56Å; I302-E350 PolarHBondContact N-O 3.38Å; I302-E350 PolarHBondContact O-N 3.32Å; T337-E350 WeakPolarHBondContact CA-OE2 3.33Å; T337-E350 WeakPolarHBondContact CB-OE2 3.4Å; K338-E350 WeakPolarHBondContact CD-OE1 3.41Å; K338-E350 WeakPolarHBondContact CE-OE1 3.3Å; K338-E350 PolarHBondContact N-OE2 3.19Å; K338-E350 IonicContact NZ-OE1 2.73Å; K338-E350 PolarHBondContact NZ-OE1 2.94Å; W348-E350 HydrophobicContact CB-CB 4.25Å; W348-E350 PolarHBondContact O-N 3.47Å; W348-E350 VanDerWaalsContact O-N 3.11Å; E350-L352 HydrophobicContact CG-CD2 4.35Å
351	T	93.9	Very high	87.8	Confident	72 Å²	72	60.3 Å²	60.3	44%	0.442	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	115.7	-179.6	-56.8	0	0	0	0	110.8	H299 C301 I353	H299-T351 HydrophobicContact CB-CG2 4.34Å; C301-T351 HydrophobicContact CB-CG2 4.3Å; T351-I353 HydrophobicContact CG2-CG1 4.23Å
352	L	93.7	Very high	87.7	Confident	23 Å²	23	54.5 Å²	54.5	12%	0.12	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	124.2	-179.9	-61.7	173.1	0	0	0	108.5	C300 I302 L323 L335 T337 E350	C300-L352 WeakPolarHBondContact CA-O 3.44Å; C300-L352 VanDerWaalsContact CB-O 3.3Å; C300-L352 WeakPolarHBondContact CB-O 3.09Å; C300-L352 PolarHBondContact N-O 2.99Å; C300-L352 PolarHBondContact O-N 3.25Å; I302-L352 HydrophobicContact CG1-CD1 4.45Å; L323-L352 HydrophobicContact CD1-CD1 3.73Å; L323-L352 HydrophobicContact CD2-CB 4.08Å; L323-L352 HydrophobicContact CD2-CD1 3.86Å; L323-L352 HydrophobicContact CG-CD1 4.39Å; L335-L352 HydrophobicContact CB-CB 4.25Å; L335-L352 HydrophobicContact CB-CD1 4.17Å; L335-L352 HydrophobicContact CD1-CB 3.93Å; T337-L352 HydrophobicContact CG2-CD1 3.85Å; E350-L352 HydrophobicContact CG-CD2 4.35Å
353	I	92.6	Very high	87.5	Confident	57 Å²	57	56.3 Å²	56.3	29%	0.292	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	130.1	-172.5	-52.1	169.8	0	0	0	110.2	A297 L298 L335 T351	A297-I353 HydrophobicContact CB-CG2 4.21Å; L298-I353 WeakPolarHBondContact O-CA 3.07Å; L335-I353 WeakPolarHBondContact CD1-O 3.48Å; T351-I353 HydrophobicContact CG2-CG1 4.23Å
354	Y	88.2	Confident	87.2	Confident	9 Å²	9	62 Å²	62	4%	0.035	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	118.8	164.9	-68.3	-79.7	0	0	0	109.5	A297 L298 L323 L325 N333 L335 L367	A297-Y354 CarbonylContact C-O 3.59Å; A297-Y354 WeakPolarHBondContact CA-O 3.42Å; L298-Y354 HydrophobicContact CD2-CD2 4.32Å; L298-Y354 PolarHBondContact N-O 2.87Å; L298-Y354 PolarHBondContact O-N 2.96Å; L323-Y354 HydrophobicContact CB-CE2 4.36Å; L323-Y354 WeakPolarHBondContact CB-OH 3.38Å; L323-Y354 HydrophobicContact CD2-CE2 4.36Å; L323-Y354 PolarHBondContact O-OH 3.31Å; L325-Y354 HydrophobicContact CD1-CD1 3.64Å; L325-Y354 HydrophobicContact CD1-CD2 3.82Å; L325-Y354 HydrophobicContact CD1-CE1 3.85Å; L325-Y354 HydrophobicContact CD1-CE2 4.02Å; L325-Y354 HydrophobicContact CD1-CG 3.6Å; L325-Y354 HydrophobicContact CD2-CE2 4.49Å; L325-Y354 HydrophobicContact CG-CD1 4.34Å; L325-Y354 HydrophobicContact CG-CD2 4.16Å; L325-Y354 HydrophobicContact CG-CE1 4.07Å; L325-Y354 HydrophobicContact CG-CE2 3.88Å; L325-Y354 HydrophobicContact CG-CG 4.37Å; N333-Y354 WeakPolarHBondContact O-CE1 3.37Å; N333-Y354 PolarHBondContact O-OH 3.04Å; L335-Y354 HydrophobicContact CD1-CD1 3.79Å; L335-Y354 HydrophobicContact CD1-CD2 3.85Å; L335-Y354 HydrophobicContact CD1-CE1 3.67Å; L335-Y354 HydrophobicContact CD1-CE2 3.73Å; L335-Y354 HydrophobicContact CD1-CG 3.89Å; L335-Y354 HydrophobicContact CG-CD1 4.18Å; L335-Y354 HydrophobicContact CG-CE1 3.63Å; L335-Y354 HydrophobicContact CG-CE2 4.28Å; Y354-L367 HydrophobicContact CE2-CD1 3.91Å
355	H	88.1	Confident	87.1	Confident	140 Å²	140	61 Å²	61	65%	0.648	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.4	151.4	175.9	-59.4	-81.7	0	0	0	111.5
356	G	82.6	Confident	87	Confident	52 Å²	52	58.6 Å²	58.6	54%	0.536	30%	0.304	S	S	.	.	S	Bend	trans	74.8	23.5	177.9	0	0	0	0	0	114.1	H296	H296-G356 PolarHBondContact O-N 3.22Å
357	I	83.6	Confident	87	Confident	8 Å²	8	58.6 Å²	58.6	4%	0.041	30%	0.304	C	S	.	.			trans	-81.8	118	172.5	-56.6	-56.4	0	0	0	107.9	Y291 H296 L298 L325 E361 M362	Y291-I357 HydrophobicContact CE2-CB 4.4Å; Y291-I357 HydrophobicContact CE2-CG2 4.48Å; Y291-I357 WeakPolarHBondContact CE2-O 3.2Å; Y291-I357 PolarHBondContact OH-O 2.94Å; Y291-I357 VanDerWaalsContact OH-O 3.11Å; H296-I357 WeakPolarHBondContact CB-O 3.45Å; H296-I357 PolarHBondContact O-N 3.35Å; L298-I357 HydrophobicContact CB-CG1 4.32Å; L325-I357 HydrophobicContact CD1-CD1 3.54Å; L325-I357 HydrophobicContact CD1-CG1 4.34Å; I357-E361 HydrophobicContact CG2-CB 4.27Å; I357-M362 HydrophobicContact CG2-CE 3.63Å
358	T	83.9	Confident	86.8	Confident	61 Å²	61	56.3 Å²	56.3	37%	0.374	29%	0.288	S	S	.	.			trans	-89.6	162.7	179.2	70.2	0	0	0	0	111.8	D360 E361 M362	T358-D360 PolarHBondContact O-N 3.27Å; T358-E361 CarbonylContact O-C 3.25Å; T358-E361 WeakPolarHBondContact O-CA 3.45Å; T358-E361 WeakPolarHBondContact O-CB 3.33Å; T358-E361 PolarHBondContact O-N 3.25Å; T358-E361 PolarHBondContact OG1-N 3.23Å; T358-M362 PolarHBondContact O-N 3.06Å
359	D	81.9	Confident	86.7	Confident	46 Å²	46	55.2 Å²	55.2	25%	0.246	28%	0.284	C	S	.	.	H	α-helix	trans	-61.1	-33.5	178	-54.2	-36.8	0	0	0	112.3	Y291 Q293 E361 M362 Q363	Y291-D359 WeakPolarHBondContact CE1-OD1 3.06Å; Y291-D359 PolarHBondContact OH-OD1 2.68Å; Q293-D359 PolarHBondContact NE2-OD1 2.84Å; Q293-D359 PolarHBondContact NE2-OD2 2.85Å; D359-E361 PolarHBondContact O-N 3.38Å; D359-M362 VanDerWaalsContact O-CB 3.32Å; D359-M362 WeakPolarHBondContact O-CB 3.03Å; D359-M362 PolarHBondContact O-N 2.89Å; D359-M362 VanDerWaalsContact O-N 3.15Å; D359-Q363 WeakPolarHBondContact O-CG 3.27Å; D359-Q363 PolarHBondContact O-N 3.14Å
360	D	80.6	Confident	86.6	Confident	84 Å²	84	50.7 Å²	50.7	45%	0.449	26%	0.26	S	S	.	.	H	α-helix	trans	-68	-25.1	176	-148	38.7	0	0	0	111.7	T358 R364	T358-D360 PolarHBondContact O-N 3.27Å; D360-R364 VanDerWaalsContact CG-CZ 3.5Å; D360-R364 PolarHBondContact O-NE 2.97Å; D360-R364 VanDerWaalsContact O-NE 3.09Å; D360-R364 PolarHBondContact O-NH2 3.38Å; D360-R364 IonicContact OD1-CZ 3.6Å; D360-R364 IonicContact OD1-NH1 3.46Å; D360-R364 PolarHBondContact OD1-NH1 3.35Å; D360-R364 VanDerWaalsContact OD1-NH1 3.1Å; D360-R364 IonicContact OD1-NH2 3.39Å; D360-R364 IonicContact OD2-CZ 3.48Å; D360-R364 IonicContact OD2-NH1 2.6Å; D360-R364 PolarHBondContact OD2-NH1 3.45Å; D360-R364 IonicContact OD2-NH2 2.88Å; D360-R364 PolarHBondContact OD2-NH2 2.83Å
361	E	81.3	Confident	86.5	Confident	57 Å²	57	49 Å²	49	27%	0.266	25%	0.252	S	S	.	.	H	α-helix	trans	-84.4	-36.1	167.3	-65.1	-165.5	134.2	0	0	112.9	I357 T358 D359 Q363 R364 K365	I357-E361 HydrophobicContact CG2-CB 4.27Å; T358-E361 CarbonylContact O-C 3.25Å; T358-E361 WeakPolarHBondContact O-CA 3.45Å; T358-E361 WeakPolarHBondContact O-CB 3.33Å; T358-E361 PolarHBondContact O-N 3.25Å; T358-E361 PolarHBondContact OG1-N 3.23Å; D359-E361 PolarHBondContact O-N 3.38Å; E361-Q363 PolarHBondContact O-N 3.01Å; E361-R364 PolarHBondContact O-N 3.42Å; E361-R364 VanDerWaalsContact O-N 3.08Å; E361-K365 HydrophobicContact CB-CD 3.96Å; E361-K365 HydrophobicContact CB-CG 4.27Å; E361-K365 HydrophobicContact CG-CD 4.49Å; E361-K365 VanDerWaalsContact O-CB 3.26Å; E361-K365 WeakPolarHBondContact O-CB 3.41Å; E361-K365 PolarHBondContact O-N 3.36Å; E361-K365 WeakPolarHBondContact OE1-CE 3.33Å; E361-K365 IonicContact OE1-NZ 2.75Å; E361-K365 PolarHBondContact OE1-NZ 3.26Å; E361-K365 WeakPolarHBondContact OE2-CE 3.35Å; E361-K365 IonicContact OE2-NZ 3.22Å; E361-K365 PolarHBondContact OE2-NZ 3.36Å
362	M	83.4	Confident	86.2	Confident	10 Å²	10	46.1 Å²	46.1	5%	0.049	24%	0.235	C	C	.	.	H	α-helix	trans	-54.9	-38.8	173.6	-164.8	63.4	39.6	0	0	111.2	Y291 I357 T358 D359 L390 K391 L393	Y291-M362 HydrophobicContact CD1-CE 3.65Å; Y291-M362 HydrophobicContact CD1-CG 4.25Å; Y291-M362 HydrophobicContact CD1-SD 4.08Å; Y291-M362 HydrophobicContact CD2-CE 3.32Å; Y291-M362 HydrophobicContact CE1-CE 3.94Å; Y291-M362 HydrophobicContact CE1-CG 4.42Å; Y291-M362 HydrophobicContact CE2-CE 3.64Å; Y291-M362 HydrophobicContact CG-CE 3.32Å; Y291-M362 HydrophobicContact CG-SD 4.03Å; I357-M362 HydrophobicContact CG2-CE 3.63Å; T358-M362 PolarHBondContact O-N 3.06Å; D359-M362 VanDerWaalsContact O-CB 3.32Å; D359-M362 WeakPolarHBondContact O-CB 3.03Å; D359-M362 PolarHBondContact O-N 2.89Å; D359-M362 VanDerWaalsContact O-N 3.15Å; M362-L390 HydrophobicContact CE-CD1 4.09Å; M362-L390 HydrophobicContact CG-CB 4.44Å; M362-L390 CarbonylContact O-C 3.58Å; M362-L390 WeakPolarHBondContact O-CB 3.35Å; M362-L390 HydrophobicContact SD-CB 3.7Å; M362-L390 HydrophobicContact SD-CD1 4.1Å; M362-L390 HydrophobicContact SD-CG 4.36Å; M362-K391 PolarHBondContact O-N 3.33Å; M362-L393 HydrophobicContact SD-CD1 4.26Å
363	Q	80.5	Confident	85.8	Confident	130 Å²	130	45.1 Å²	45.1	61%	0.607	23%	0.23	S	C	*	.	H	α-helix	trans	-69.3	-34.7	176.4	-69	-175.2	33.8	0	0	114.1	D359 E361	D359-Q363 WeakPolarHBondContact O-CG 3.27Å; D359-Q363 PolarHBondContact O-N 3.14Å; E361-Q363 PolarHBondContact O-N 3.01Å
364	R	79.7	Confident	85.3	Confident	153 Å²	153	44.8 Å²	44.8	58%	0.577	23%	0.227	S	C	*	.	H	α-helix	trans	-105.9	-19.9	-168.1	-63.5	-173.9	-62.9	-117.7	-0.1	114.6	D360 E361	D360-R364 VanDerWaalsContact CG-CZ 3.5Å; D360-R364 PolarHBondContact O-NE 2.97Å; D360-R364 VanDerWaalsContact O-NE 3.09Å; D360-R364 PolarHBondContact O-NH2 3.38Å; D360-R364 IonicContact OD1-CZ 3.6Å; D360-R364 IonicContact OD1-NH1 3.46Å; D360-R364 PolarHBondContact OD1-NH1 3.35Å; D360-R364 VanDerWaalsContact OD1-NH1 3.1Å; D360-R364 IonicContact OD1-NH2 3.39Å; D360-R364 IonicContact OD2-CZ 3.48Å; D360-R364 IonicContact OD2-NH1 2.6Å; D360-R364 PolarHBondContact OD2-NH1 3.45Å; D360-R364 IonicContact OD2-NH2 2.88Å; D360-R364 PolarHBondContact OD2-NH2 2.83Å; E361-R364 PolarHBondContact O-N 3.42Å; E361-R364 VanDerWaalsContact O-N 3.08Å
365	K	82.8	Confident	84.8	Confident	14 Å²	14	46.9 Å²	46.9	6%	0.061	24%	0.239	C	C	.	.			trans	-89.3	159.5	-178	-71.9	-174.7	179.1	170.2	0	113.6	L325 L326 E361 L390	L325-K365 HydrophobicContact CB-CD 4.34Å; L326-K365 CarbonylContact O-C 3.57Å; L326-K365 WeakPolarHBondContact O-CA 3.45Å; L326-K365 WeakPolarHBondContact O-CB 3.25Å; E361-K365 HydrophobicContact CB-CD 3.96Å; E361-K365 HydrophobicContact CB-CG 4.27Å; E361-K365 HydrophobicContact CG-CD 4.49Å; E361-K365 VanDerWaalsContact O-CB 3.26Å; E361-K365 WeakPolarHBondContact O-CB 3.41Å; E361-K365 PolarHBondContact O-N 3.36Å; E361-K365 WeakPolarHBondContact OE1-CE 3.33Å; E361-K365 IonicContact OE1-NZ 2.75Å; E361-K365 PolarHBondContact OE1-NZ 3.26Å; E361-K365 WeakPolarHBondContact OE2-CE 3.35Å; E361-K365 IonicContact OE2-NZ 3.22Å; E361-K365 PolarHBondContact OE2-NZ 3.36Å; K365-L390 HydrophobicContact CB-CD1 3.92Å; K365-L390 HydrophobicContact CB-CG 4.36Å; K365-L390 WeakPolarHBondContact O-CB 3.32Å; K365-L390 PolarHBondContact O-N 3.33Å
366	T	87.1	Confident	83.3	Confident	39 Å²	39	46.1 Å²	46.1	24%	0.239	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	127.5	173.4	-66	0	0	0	0	108.2	L326 R387 V388	L326-T366 PolarHBondContact N-O 2.91Å; L326-T366 PolarHBondContact O-N 3.28Å; T366-R387 HydrophobicContact CG2-CB 3.92Å; T366-V388 CarbonylContact C-O 3.47Å; T366-V388 WeakPolarHBondContact CA-O 3Å
367	L	90.2	Very high	81.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	114.6	170.7	-180	65.5	0	0	0	108.8	L289 L323 L325 Y354 L369 R387 V388 L390	L289-L367 HydrophobicContact CD1-CD2 3.94Å; L289-L367 HydrophobicContact CD2-CD2 3.65Å; L289-L367 HydrophobicContact CG-CD2 4.49Å; L323-L367 HydrophobicContact CB-CD1 4.09Å; L323-L367 HydrophobicContact CG-CD1 4.35Å; L325-L367 HydrophobicContact CD2-CB 4.06Å; L325-L367 HydrophobicContact CD2-CD1 3.85Å; L325-L367 HydrophobicContact CG-CD1 4.29Å; Y354-L367 HydrophobicContact CE2-CD1 3.91Å; L367-L369 HydrophobicContact CD2-CD1 3.98Å; L367-L369 HydrophobicContact CD2-CG 4.45Å; L367-L369 HydrophobicContact CG-CD1 3.88Å; L367-L369 HydrophobicContact CG-CG 4.35Å; L367-R387 WeakPolarHBondContact O-CA 3.37Å; L367-V388 PolarHBondContact N-O 2.85Å; L367-V388 PolarHBondContact O-N 2.99Å; L367-L390 HydrophobicContact CB-CD2 3.95Å
368	R	89.1	Confident	80.2	Confident	64 Å²	64	53 Å²	53	24%	0.242	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	130.1	167.1	-178.9	-179.9	-179.7	-146.9	0.6	108.3	L323 H324 L326 S370 E385 R387	L323-R368 CarbonylContact C-O 3.49Å; L323-R368 WeakPolarHBondContact CA-O 3.43Å; H324-R368 PolarHBondContact N-O 2.81Å; H324-R368 PolarHBondContact O-N 3.43Å; L326-R368 HydrophobicContact CD1-CB 4.17Å; R368-S370 PolarHBondContact NE-OG 2.8Å; R368-E385 IonicContact CZ-OE2 2.8Å; R368-E385 IonicContact NE-OE1 2.66Å; R368-E385 IonicContact NE-OE2 2.76Å; R368-E385 PolarHBondContact NE-OE2 3.35Å; R368-E385 IonicContact NH2-OE2 2.84Å; R368-E385 PolarHBondContact NH2-OE2 2.84Å; R368-R387 HydrophobicContact CB-CG 4.25Å; R368-R387 HydrophobicContact CG-CG 4.21Å
369	L	91.5	Very high	78.8	Confident	0 Å²	0	59 Å²	59	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	122.8	168.6	-59.8	92.9	0	0	0	107.3	L285 F287 I302 V321 K322 L323 L367 E385 T386	L285-L369 HydrophobicContact CD2-CB 4.05Å; L285-L369 HydrophobicContact CD2-CD2 4.02Å; F287-L369 HydrophobicContact CD1-CD2 4.32Å; F287-L369 HydrophobicContact CD2-CD2 3.99Å; F287-L369 HydrophobicContact CE1-CD2 4.48Å; F287-L369 HydrophobicContact CE2-CD1 3.96Å; F287-L369 HydrophobicContact CE2-CD2 4.17Å; F287-L369 HydrophobicContact CG-CD2 4.07Å; F287-L369 HydrophobicContact CZ-CD1 3.96Å; F287-L369 HydrophobicContact CZ-CD2 4.41Å; I302-L369 HydrophobicContact CD1-CD2 3.54Å; V321-L369 HydrophobicContact CG1-CB 4.25Å; V321-L369 HydrophobicContact CG1-CD2 4.48Å; K322-L369 WeakPolarHBondContact O-CA 3.26Å; L323-L369 HydrophobicContact CD1-CD2 4.49Å; L323-L369 HydrophobicContact CG-CD2 4.41Å; L323-L369 HydrophobicContact CG-CG 4.39Å; L367-L369 HydrophobicContact CD2-CD1 3.98Å; L367-L369 HydrophobicContact CD2-CG 4.45Å; L367-L369 HydrophobicContact CG-CD1 3.88Å; L367-L369 HydrophobicContact CG-CG 4.35Å; L369-E385 CarbonylContact O-C 3.47Å; L369-E385 WeakPolarHBondContact O-CA 3.49Å; L369-E385 WeakPolarHBondContact O-CB 3.21Å; L369-T386 HydrophobicContact CB-CG2 4.08Å; L369-T386 HydrophobicContact CD1-CG2 4.28Å; L369-T386 PolarHBondContact N-O 2.98Å; L369-T386 PolarHBondContact O-N 3.25Å
370	S	90.3	Very high	78.3	Confident	9 Å²	9	60.1 Å²	60.1	6%	0.063	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	125.4	178.2	-62.6	0	0	0	0	109.2	K322 R368	K322-S370 PolarHBondContact N-O 3.2Å; K322-S370 PolarHBondContact O-N 3.35Å; R368-S370 PolarHBondContact NE-OG 2.8Å
371	V	90.8	Very high	77.9	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	127.7	173.8	-173.2	0	0	0	0	108.2	L285 L308 P319 Y320 V321 W348 I383 G384 L405	L285-V371 HydrophobicContact CD1-CG2 4.28Å; L285-V371 HydrophobicContact CD2-CG2 4.15Å; L308-V371 HydrophobicContact CD1-CG1 4.23Å; L308-V371 HydrophobicContact CD2-CG1 4.19Å; P319-V371 HydrophobicContact CB-CG1 4.42Å; Y320-V371 WeakPolarHBondContact O-CA 3.4Å; V321-V371 HydrophobicContact CG1-CG2 4.28Å; V321-V371 HydrophobicContact CG2-CG2 4.17Å; W348-V371 HydrophobicContact CH2-CG1 4.46Å; V371-I383 HydrophobicContact CG1-CB 4.45Å; V371-I383 HydrophobicContact CG1-CD1 4.36Å; V371-I383 PolarHBondContact O-N 3.29Å; V371-G384 PolarHBondContact N-O 3.45Å; V371-G384 PolarHBondContact O-N 2.63Å; V371-L405 HydrophobicContact CB-CD1 3.95Å; V371-L405 HydrophobicContact CB-CD2 4.48Å; V371-L405 HydrophobicContact CG1-CD1 4.44Å; V371-L405 HydrophobicContact CG2-CD1 3.7Å; V371-L405 HydrophobicContact CG2-CD2 3.74Å; V371-L405 HydrophobicContact CG2-CG 4.4Å
372	S	88.1	Confident	78	Confident	12 Å²	12	60.8 Å²	60.8	8%	0.084	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	154.8	-179.4	-89.5	0	0	0	0	110.4	P319 Y320 E381	P319-S372 WeakPolarHBondContact CA-O 3.43Å; Y320-S372 WeakPolarHBondContact CD1-O 3.4Å; Y320-S372 PolarHBondContact N-O 3.11Å; Y320-S372 PolarHBondContact O-N 2.82Å; S372-E381 CarbonylContact C-O 3.59Å; S372-E381 WeakPolarHBondContact CA-O 3.41Å; S372-E381 VanDerWaalsContact CB-O 3.22Å; S372-E381 WeakPolarHBondContact CB-O 3.47Å; S372-E381 PolarHBondContact OG-O 2.95Å; S372-E381 VanDerWaalsContact OG-O 3.1Å
373	D	85.1	Confident	77.8	Confident	2 Å²	2	60.3 Å²	60.3	1%	0.011	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	158.2	167.8	-145	-39.2	0	0	0	111.2	A317 D318 Y320 N380 E381 I383	A317-D373 WeakPolarHBondContact CA-OD2 3.14Å; A317-D373 WeakPolarHBondContact CB-OD2 3.06Å; D318-D373 VanDerWaalsContact CA-OD1 3.29Å; D318-D373 WeakPolarHBondContact CA-OD1 3.4Å; D318-D373 WeakPolarHBondContact CB-OD1 3.32Å; D318-D373 PolarHBondContact N-OD1 2.86Å; D318-D373 PolarHBondContact N-OD2 3.33Å; Y320-D373 VanDerWaalsContact CE1-O 3.31Å; Y320-D373 WeakPolarHBondContact CE1-O 3.28Å; D373-N380 WeakPolarHBondContact O-CA 3.5Å; D373-N380 WeakPolarHBondContact O-CB 3.49Å; D373-N380 PolarHBondContact O-ND2 3Å; D373-E381 HydrophobicContact CB-CB 4.32Å; D373-E381 PolarHBondContact N-O 2.85Å; D373-I383 HydrophobicContact CB-CD1 4.41Å
374	E	82.9	Confident	77.9	Confident	51 Å²	51	54.1 Å²	54.1	24%	0.238	26%	0.259	C	S	.	.			trans	-123	77.2	173.5	-170.2	162.8	-113.2	0	0	113.2	D318 Y320 R336 T339 K376 N380	D318-E374 PolarHBondContact O-N 3.36Å; D318-E374 VanDerWaalsContact O-N 3.1Å; Y320-E374 HydrophobicContact CD1-CB 3.95Å; Y320-E374 HydrophobicContact CE1-CB 3.98Å; R336-E374 IonicContact CZ-OE1 3.75Å; R336-E374 IonicContact CZ-OE2 2.64Å; R336-E374 IonicContact NH1-OE1 2.98Å; R336-E374 PolarHBondContact NH1-OE1 3.28Å; R336-E374 IonicContact NH2-OE1 2.65Å; R336-E374 PolarHBondContact NH2-OE1 2.85Å; R336-E374 IonicContact NH2-OE2 3.1Å; R336-E374 PolarHBondContact NH2-OE2 2.9Å; T339-E374 WeakPolarHBondContact CB-OE2 3.41Å; T339-E374 HydrophobicContact CG2-CB 3.76Å; T339-E374 PolarHBondContact OG1-OE2 3.15Å; E374-K376 PolarHBondContact O-N 3.02Å; E374-K376 VanDerWaalsContact O-N 3.15Å; E374-N380 WeakPolarHBondContact CA-ND2 3.45Å
375	D	77.1	Confident	78.3	Confident	53 Å²	53	46.8 Å²	46.8	28%	0.283	23%	0.231	S	C	.	.			trans	-48.9	116.1	162.4	-50.6	-100.6	0	0	0	111.4	F377 N380 E381	D375-F377 PolarHBondContact O-N 3.38Å; D375-N380 WeakPolarHBondContact OD2-CA 3.42Å; D375-N380 PolarHBondContact OD2-N 3.19Å; D375-E381 PolarHBondContact OD2-N 3.46Å
376	K	56.7	Low	78.4	Confident	123 Å²	123	46.4 Å²	46.4	54%	0.535	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-22.3	174.7	-58.2	171.3	-167.6	75	0	112.1	D318 E374	D318-K376 IonicContact OD1-NZ 2.78Å; D318-K376 WeakPolarHBondContact OD2-CE 3.38Å; D318-K376 IonicContact OD2-NZ 2.66Å; D318-K376 PolarHBondContact OD2-NZ 3.41Å; E374-K376 PolarHBondContact O-N 3.02Å; E374-K376 VanDerWaalsContact O-N 3.15Å
377	F	45.9	Very low	78.5	Confident	162 Å²	162	47.3 Å²	47.3	71%	0.711	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-146.3	52.2	-178.4	-63.2	-74.8	0	0	0	111.1	D375	D375-F377 PolarHBondContact O-N 3.38Å
378	G	55.1	Low	78.3	Confident	44 Å²	44	47.8 Å²	47.8	45%	0.454	23%	0.232	S	C	.	.	S	Bend	trans	-157.1	-164	-178.7	0	0	0	0	0	114
379	H	54.8	Low	78.2	Confident	187 Å²	187	46 Å²	46	87%	0.866	23%	0.231	S	C	*	.			trans	-106.1	96.1	172.2	-75.7	-33.9	0	0	0	109.5	E381	H379-E381 PolarHBondContact O-N 2.92Å
380	N	71.1	Confident	77.9	Confident	68 Å²	68	46 Å²	46	36%	0.364	23%	0.231	S	C	.	.			trans	-17.6	95.8	175.3	-70.5	96.9	0	0	0	114.5	Y320 D373 E374 D375	Y320-N380 WeakPolarHBondContact CE1-ND2 3.49Å; Y320-N380 PolarHBondContact OH-ND2 2.99Å; D373-N380 WeakPolarHBondContact O-CA 3.5Å; D373-N380 WeakPolarHBondContact O-CB 3.49Å; D373-N380 PolarHBondContact O-ND2 3Å; E374-N380 WeakPolarHBondContact CA-ND2 3.45Å; D375-N380 WeakPolarHBondContact OD2-CA 3.42Å; D375-N380 PolarHBondContact OD2-N 3.19Å
381	E	73.7	Confident	77.7	Confident	95 Å²	95	52.9 Å²	52.9	44%	0.444	26%	0.26	S	S	.	.			trans	-65.3	148.4	-174.5	-172	145	-136.4	0	0	111.9	M311 S372 D373 D375 H379	M311-E381 HydrophobicContact CB-CB 4.45Å; M311-E381 HydrophobicContact CE-CG 4.33Å; M311-E381 HydrophobicContact CG-CB 4.48Å; M311-E381 HydrophobicContact CG-CG 4.22Å; M311-E381 HydrophobicContact SD-CG 4.37Å; S372-E381 CarbonylContact C-O 3.59Å; S372-E381 WeakPolarHBondContact CA-O 3.41Å; S372-E381 VanDerWaalsContact CB-O 3.22Å; S372-E381 WeakPolarHBondContact CB-O 3.47Å; S372-E381 PolarHBondContact OG-O 2.95Å; S372-E381 VanDerWaalsContact OG-O 3.1Å; D373-E381 HydrophobicContact CB-CB 4.32Å; D373-E381 PolarHBondContact N-O 2.85Å; D375-E381 PolarHBondContact OD2-N 3.46Å; H379-E381 PolarHBondContact O-N 2.92Å
382	F	81.6	Confident	77.3	Confident	60 Å²	60	57.1 Å²	57.1	26%	0.263	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	109.4	-179.5	173.8	-99.2	0	0	0	110.4	G384 E385 V408	F382-G384 WeakPolarHBondContact CE2-O 3.5Å; F382-G384 VanDerWaalsContact CZ-CA 3.44Å; F382-E385 HydrophobicContact CE2-CB 4.04Å; F382-E385 HydrophobicContact CZ-CB 3.79Å; F382-E385 HydrophobicContact CZ-CG 3.98Å; F382-V408 HydrophobicContact CD1-CG2 3.95Å; F382-V408 HydrophobicContact CE1-CB 4.47Å; F382-V408 HydrophobicContact CE1-CG2 3.39Å; F382-V408 HydrophobicContact CZ-CG2 4Å
383	I	80.6	Confident	77.1	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	-42.3	-178.9	-52.9	178.8	0	0	0	110.2	L282 L308 M311 A317 P319 V371 D373	L282-I383 WeakPolarHBondContact CD2-O 3.39Å; L308-I383 HydrophobicContact CB-CG2 4.33Å; L308-I383 HydrophobicContact CD1-CD1 4.38Å; L308-I383 HydrophobicContact CD2-CG2 4.17Å; M311-I383 HydrophobicContact CE-CB 4.25Å; M311-I383 HydrophobicContact CE-CG1 4.03Å; M311-I383 HydrophobicContact CE-CG2 4.28Å; M311-I383 HydrophobicContact CG-CG1 4.09Å; A317-I383 HydrophobicContact CB-CD1 4.43Å; P319-I383 HydrophobicContact CB-CD1 4.41Å; V371-I383 HydrophobicContact CG1-CB 4.45Å; V371-I383 HydrophobicContact CG1-CD1 4.36Å; V371-I383 PolarHBondContact O-N 3.29Å; D373-I383 HydrophobicContact CB-CD1 4.41Å
384	G	82.9	Confident	77	Confident	0 Å²	0	64 Å²	64	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.6	175.8	173.6	0	0	0	0	0	114.3	V371 F382 E406	V371-G384 PolarHBondContact N-O 3.45Å; V371-G384 PolarHBondContact O-N 2.63Å; F382-G384 WeakPolarHBondContact CE2-O 3.5Å; F382-G384 VanDerWaalsContact CZ-CA 3.44Å; G384-E406 CarbonylContact C-O 3.58Å; G384-E406 WeakPolarHBondContact CA-O 3.47Å
385	E	87.3	Confident	77.2	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	166.6	177.4	70.7	176.1	-121.3	0	0	114.3	R368 L369 F382 R387 E406 I409	R368-E385 IonicContact CZ-OE2 2.8Å; R368-E385 IonicContact NE-OE1 2.66Å; R368-E385 IonicContact NE-OE2 2.76Å; R368-E385 PolarHBondContact NE-OE2 3.35Å; R368-E385 IonicContact NH2-OE2 2.84Å; R368-E385 PolarHBondContact NH2-OE2 2.84Å; L369-E385 CarbonylContact O-C 3.47Å; L369-E385 WeakPolarHBondContact O-CA 3.49Å; L369-E385 WeakPolarHBondContact O-CB 3.21Å; F382-E385 HydrophobicContact CE2-CB 4.04Å; F382-E385 HydrophobicContact CZ-CB 3.79Å; F382-E385 HydrophobicContact CZ-CG 3.98Å; E385-R387 IonicContact OE1-CZ 3.61Å; E385-R387 IonicContact OE1-NE 3.81Å; E385-R387 PolarHBondContact OE1-NE 3.25Å; E385-R387 IonicContact OE1-NH2 2.7Å; E385-R387 PolarHBondContact OE1-NH2 2.88Å; E385-E406 PolarHBondContact N-O 2.91Å; E385-E406 PolarHBondContact O-N 3.34Å; E385-I409 HydrophobicContact CG-CG1 4.43Å
386	T	84.3	Confident	77.5	Confident	5 Å²	5	68.6 Å²	68.6	3%	0.031	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	162.1	164.5	-171.4	0	0	0	0	110	L285 F287 L369 V403	L285-T386 HydrophobicContact CD2-CG2 4.36Å; F287-T386 HydrophobicContact CE1-CG2 4.05Å; F287-T386 HydrophobicContact CZ-CG2 4.33Å; L369-T386 HydrophobicContact CB-CG2 4.08Å; L369-T386 HydrophobicContact CD1-CG2 4.28Å; L369-T386 PolarHBondContact N-O 2.98Å; L369-T386 PolarHBondContact O-N 3.25Å; T386-V403 WeakPolarHBondContact OG1-CG1 3.4Å
387	R	88.6	Confident	79	Confident	59 Å²	59	68 Å²	68	22%	0.223	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	130.9	-175.9	-63	-172.5	-169.9	-175.9	13.7	112.2	T366 L367 R368 E385 I409 V411	T366-R387 HydrophobicContact CG2-CB 3.92Å; L367-R387 WeakPolarHBondContact O-CA 3.37Å; R368-R387 HydrophobicContact CB-CG 4.25Å; R368-R387 HydrophobicContact CG-CG 4.21Å; E385-R387 IonicContact OE1-CZ 3.61Å; E385-R387 IonicContact OE1-NE 3.81Å; E385-R387 PolarHBondContact OE1-NE 3.25Å; E385-R387 IonicContact OE1-NH2 2.7Å; E385-R387 PolarHBondContact OE1-NH2 2.88Å; R387-I409 HydrophobicContact CG-CD1 4.24Å; R387-I409 PolarHBondContact NH2-O 3.21Å; R387-V411 VanDerWaalsContact NH1-CG2 3.35Å
388	V	86.4	Confident	81.1	Confident	10 Å²	10	65.9 Å²	65.9	6%	0.061	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	110.4	174.2	-175	0	0	0	0	109.6	F287 L289 T366 L367 L390 L393 F401	F287-V388 HydrophobicContact CE2-CG2 3.87Å; F287-V388 HydrophobicContact CZ-CG2 3.7Å; L289-V388 HydrophobicContact CD1-CB 4.1Å; L289-V388 HydrophobicContact CD1-CG1 3.93Å; L289-V388 HydrophobicContact CD1-CG2 4.29Å; T366-V388 CarbonylContact C-O 3.47Å; T366-V388 WeakPolarHBondContact CA-O 3Å; L367-V388 PolarHBondContact N-O 2.85Å; L367-V388 PolarHBondContact O-N 2.99Å; V388-L390 PolarHBondContact O-N 2.85Å; V388-L393 HydrophobicContact CG1-CD2 4.5Å; V388-F401 HydrophobicContact CG1-CE1 3.99Å; V388-F401 HydrophobicContact CG1-CZ 3.75Å; V388-F401 HydrophobicContact CG2-CD1 4.27Å; V388-F401 HydrophobicContact CG2-CE1 4.02Å; V388-F401 HydrophobicContact CG2-CZ 4.27Å
389	A	87.4	Confident	82.8	Confident	27 Å²	27	66.8 Å²	66.8	22%	0.223	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	120.7	168.8	0	0	0	0	0	108.9	K391 K392	A389-K391 HydrophobicContact CB-CG 4.3Å; A389-K391 PolarHBondContact O-N 2.94Å; A389-K392 WeakPolarHBondContact O-CB 3.31Å; A389-K392 PolarHBondContact O-N 2.75Å
390	L	86.4	Confident	84.5	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-63.4	-29.2	-169.1	-71.8	-165.5	0	0	0	112.6	L298 L325 M362 K365 L367 V388 K392 L393	L298-L390 HydrophobicContact CD2-CD1 3.89Å; L298-L390 HydrophobicContact CD2-CD2 3.84Å; L325-L390 HydrophobicContact CD2-CD1 3.92Å; M362-L390 HydrophobicContact CE-CD1 4.09Å; M362-L390 HydrophobicContact CG-CB 4.44Å; M362-L390 CarbonylContact O-C 3.58Å; M362-L390 WeakPolarHBondContact O-CB 3.35Å; M362-L390 HydrophobicContact SD-CB 3.7Å; M362-L390 HydrophobicContact SD-CD1 4.1Å; M362-L390 HydrophobicContact SD-CG 4.36Å; K365-L390 HydrophobicContact CB-CD1 3.92Å; K365-L390 HydrophobicContact CB-CG 4.36Å; K365-L390 WeakPolarHBondContact O-CB 3.32Å; K365-L390 PolarHBondContact O-N 3.33Å; L367-L390 HydrophobicContact CB-CD2 3.95Å; V388-L390 PolarHBondContact O-N 2.85Å; L390-K392 PolarHBondContact O-N 2.95Å; L390-L393 HydrophobicContact CD2-CD1 3.99Å; L390-L393 WeakPolarHBondContact O-CB 3.34Å; L390-L393 WeakPolarHBondContact O-CG 3.47Å; L390-L393 PolarHBondContact O-N 2.71Å
391	K	84.3	Confident	85.3	Confident	153 Å²	153	61.6 Å²	61.6	67%	0.665	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-58.6	-8.3	170.8	71.9	176.5	-174.1	174.5	0	115.7	M362 A389	M362-K391 PolarHBondContact O-N 3.33Å; A389-K391 HydrophobicContact CB-CG 4.3Å; A389-K391 PolarHBondContact O-N 2.94Å
392	K	82.3	Confident	86	Confident	88 Å²	88	62 Å²	62	38%	0.383	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-93.6	5.3	171.9	-66	-165.3	174.1	-166.6	0	113.1	A389 L390 K399 G471	A389-K392 WeakPolarHBondContact O-CB 3.31Å; A389-K392 PolarHBondContact O-N 2.75Å; L390-K392 PolarHBondContact O-N 2.95Å; K392-K399 PolarHBondContact O-NZ 3.17Å; K392-G471 PolarHBondContact NZ-O 2.91Å; K392-G471 VanDerWaalsContact NZ-O 3.09Å
393	L	84.8	Confident	86.1	Confident	20 Å²	20	61 Å²	61	11%	0.105	29%	0.291	C	S	.	.	S	Bend	trans	-93	163.2	169.1	-56.7	-176.4	0	0	0	110.7	L289 L298 M362 V388 L390 K399 F401	L289-L393 HydrophobicContact CB-CD1 3.98Å; L289-L393 HydrophobicContact CB-CD2 4.04Å; L289-L393 HydrophobicContact CD1-CD1 4.14Å; L289-L393 HydrophobicContact CD1-CD2 4.18Å; L298-L393 HydrophobicContact CD1-CD1 3.82Å; M362-L393 HydrophobicContact SD-CD1 4.26Å; V388-L393 HydrophobicContact CG1-CD2 4.5Å; L390-L393 HydrophobicContact CD2-CD1 3.99Å; L390-L393 WeakPolarHBondContact O-CB 3.34Å; L390-L393 WeakPolarHBondContact O-CG 3.47Å; L390-L393 PolarHBondContact O-N 2.71Å; L393-K399 HydrophobicContact CD2-CB 4.28Å; L393-K399 HydrophobicContact CD2-CD 4.1Å; L393-F401 HydrophobicContact CD2-CE2 4.08Å; L393-F401 HydrophobicContact CD2-CZ 3.88Å
394	K	83.5	Confident	86.2	Confident	138 Å²	138	63.4 Å²	63.4	60%	0.6	31%	0.307	S	S	*	.	B	Isolated β-bridge	trans	-118.6	147.8	167.8	-69.7	-173.9	-177.9	179.4	0	108.4	Q397	K394-Q397 HydrophobicContact CB-CB 4.13Å; K394-Q397 PolarHBondContact O-N 3.16Å
395	F	86.1	Confident	86	Confident	105 Å²	105	63.8 Å²	63.8	46%	0.461	31%	0.309	S	S	.	.	B	Isolated β-bridge	trans	-53.2	135.2	173.3	-47.9	-76.1	0	0	0	110.4	Y291 Q293 Q397	Y291-F395 AromaticContact CD1-CD1 3.7Å; Y291-F395 HydrophobicContact CD1-CD1 3.7Å; Y291-F395 HydrophobicContact CD1-CE1 4.13Å; Y291-F395 AromaticContact CE1-CD1 3.6Å; Y291-F395 HydrophobicContact CE1-CD1 3.6Å; Y291-F395 AromaticContact CE1-CE1 3.77Å; Y291-F395 HydrophobicContact CE1-CE1 3.77Å; Q293-F395 HydrophobicContact CB-CD1 4.29Å; Q293-F395 HydrophobicContact CG-CD1 4.22Å; F395-Q397 PolarHBondContact O-N 3.44Å
396	D	84.8	Confident	85.2	Confident	96 Å²	96	66.9 Å²	66.9	51%	0.513	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.9	7.2	174.2	-41.1	-45.9	0	0	0	116	L290 Y291 E292 Q293	L290-D396 VanDerWaalsContact CD1-C 3.42Å; Y291-D396 PolarHBondContact O-N 3.11Å; E292-D396 WeakPolarHBondContact CA-OD1 3.4Å; Q293-D396 PolarHBondContact N-OD1 3.2Å
397	Q	87.3	Confident	84.2	Confident	110 Å²	110	73.6 Å²	73.6	51%	0.514	35%	0.348	S	S	.	.	B	Isolated β-bridge	trans	-104.8	105.6	178.6	177.9	161.6	95.9	0	0	111	K394 F395 K399	K394-Q397 HydrophobicContact CB-CB 4.13Å; K394-Q397 PolarHBondContact O-N 3.16Å; F395-Q397 PolarHBondContact O-N 3.44Å; Q397-K399 PolarHBondContact O-N 3.42Å
398	K	89.8	Confident	82.6	Confident	118 Å²	118	73.6 Å²	73.6	51%	0.513	36%	0.355	S	S	.	.			trans	-60.1	119.5	172.6	-175.8	174	-178.8	172.9	0	110.3	S288 L289 L290	S288-K398 WeakPolarHBondContact OG-CE 3.03Å; S288-K398 PolarHBondContact OG-NZ 2.66Å; L289-K398 WeakPolarHBondContact O-CA 3.41Å; L290-K398 HydrophobicContact CB-CB 4.24Å; L290-K398 HydrophobicContact CB-CG 4.45Å; L290-K398 HydrophobicContact CD1-CB 4.39Å
399	K	89.9	Confident	80.6	Confident	64 Å²	64	75.2 Å²	75.2	28%	0.278	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.4	179.5	-174.3	167.4	173.2	170.8	0	110.2	S288 L289 K392 L393 Q397 F401	S288-K399 CarbonylContact C-O 3.57Å; S288-K399 VanDerWaalsContact CA-O 3.27Å; S288-K399 WeakPolarHBondContact CA-O 3.47Å; L289-K399 PolarHBondContact N-O 3.49Å; L289-K399 PolarHBondContact O-N 2.78Å; K392-K399 PolarHBondContact O-NZ 3.17Å; L393-K399 HydrophobicContact CD2-CB 4.28Å; L393-K399 HydrophobicContact CD2-CD 4.1Å; Q397-K399 PolarHBondContact O-N 3.42Å; K399-F401 HydrophobicContact CB-CE2 4Å; K399-F401 HydrophobicContact CB-CZ 4.41Å; K399-F401 HydrophobicContact CD-CE1 4.44Å; K399-F401 HydrophobicContact CD-CE2 4.18Å; K399-F401 HydrophobicContact CD-CZ 3.74Å; K399-F401 HydrophobicContact CG-CD2 4.45Å; K399-F401 HydrophobicContact CG-CE2 3.73Å; K399-F401 HydrophobicContact CG-CZ 3.78Å; K399-F401 WeakPolarHBondContact O-CD2 3.18Å; K399-F401 WeakPolarHBondContact O-CE2 3.31Å
400	N	90.6	Very high	78.3	Confident	114 Å²	114	79.2 Å²	79.2	61%	0.61	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	146.6	178.5	-58	-23.6	0	0	0	110.4	S288	S288-N400 WeakPolarHBondContact CB-OD1 3.44Å
401	F	89.1	Confident	76.1	Confident	31 Å²	31	84 Å²	84	14%	0.136	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	137.5	-178.7	-63.9	-94.3	0	0	0	109.2	E286 F287 L289 V388 L393 K399 V403	E286-F401 CarbonylContact C-O 3.47Å; E286-F401 VanDerWaalsContact CA-O 3.3Å; E286-F401 WeakPolarHBondContact CA-O 3.45Å; F287-F401 HydrophobicContact CD1-CB 3.95Å; F287-F401 HydrophobicContact CD2-CB 4.13Å; F287-F401 HydrophobicContact CD2-CD2 4.06Å; F287-F401 HydrophobicContact CD2-CG 4.36Å; F287-F401 HydrophobicContact CE1-CB 3.6Å; F287-F401 HydrophobicContact CE1-CG 4.35Å; F287-F401 HydrophobicContact CE2-CB 3.78Å; F287-F401 AromaticContact CE2-CD2 3.65Å; F287-F401 HydrophobicContact CE2-CD2 3.65Å; F287-F401 HydrophobicContact CE2-CE2 4.34Å; F287-F401 AromaticContact CE2-CG 3.75Å; F287-F401 HydrophobicContact CE2-CG 3.75Å; F287-F401 HydrophobicContact CG-CB 4.21Å; F287-F401 HydrophobicContact CZ-CB 3.51Å; F287-F401 HydrophobicContact CZ-CD1 4.27Å; F287-F401 HydrophobicContact CZ-CD2 4.16Å; F287-F401 AromaticContact CZ-CG 3.75Å; F287-F401 HydrophobicContact CZ-CG 3.75Å; F287-F401 PolarHBondContact N-O 3.39Å; F287-F401 PolarHBondContact O-N 2.93Å; F287-F401 VanDerWaalsContact O-O 3.07Å; L289-F401 HydrophobicContact CB-CE2 4.12Å; L289-F401 HydrophobicContact CD1-CE2 3.89Å; L289-F401 HydrophobicContact CD1-CZ 4.38Å; L289-F401 HydrophobicContact CG-CD2 4.25Å; L289-F401 HydrophobicContact CG-CE2 3.87Å; V388-F401 HydrophobicContact CG1-CE1 3.99Å; V388-F401 HydrophobicContact CG1-CZ 3.75Å; V388-F401 HydrophobicContact CG2-CD1 4.27Å; V388-F401 HydrophobicContact CG2-CE1 4.02Å; V388-F401 HydrophobicContact CG2-CZ 4.27Å; L393-F401 HydrophobicContact CD2-CE2 4.08Å; L393-F401 HydrophobicContact CD2-CZ 3.88Å; K399-F401 HydrophobicContact CB-CE2 4Å; K399-F401 HydrophobicContact CB-CZ 4.41Å; K399-F401 HydrophobicContact CD-CE1 4.44Å; K399-F401 HydrophobicContact CD-CE2 4.18Å; K399-F401 HydrophobicContact CD-CZ 3.74Å; K399-F401 HydrophobicContact CG-CD2 4.45Å; K399-F401 HydrophobicContact CG-CE2 3.73Å; K399-F401 HydrophobicContact CG-CZ 3.78Å; K399-F401 WeakPolarHBondContact O-CD2 3.18Å; K399-F401 WeakPolarHBondContact O-CE2 3.31Å; F401-V403 HydrophobicContact CB-CG2 4.11Å
402	N	88.5	Confident	73.9	Confident	103 Å²	103	85 Å²	85	55%	0.551	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.7	113.6	164.9	-179.9	8.2	0	0	0	105.8	S284 L285 E286	S284-N402 PolarHBondContact OG-OD1 3Å; L285-N402 WeakPolarHBondContact O-CA 3.45Å; E286-N402 HydrophobicContact CG-CB 4.26Å
403	V	83.6	Confident	71.6	Confident	39 Å²	39	88 Å²	88	24%	0.236	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	134.8	-166.7	-162	0	0	0	0	109.9	S284 L285 F287 T386 F401	S284-V403 CarbonylContact C-O 3.47Å; S284-V403 VanDerWaalsContact CA-O 3.26Å; S284-V403 WeakPolarHBondContact CA-O 3.36Å; S284-V403 WeakPolarHBondContact CB-O 3.3Å; L285-V403 PolarHBondContact N-O 3.05Å; L285-V403 PolarHBondContact O-N 3.2Å; F287-V403 HydrophobicContact CE1-CG2 4.08Å; F287-V403 HydrophobicContact CZ-CG2 4.49Å; T386-V403 WeakPolarHBondContact OG1-CG1 3.4Å; F401-V403 HydrophobicContact CB-CG2 4.11Å
404	C	82.1	Confident	69.1	Low	52 Å²	52	91.6 Å²	91.6	35%	0.351	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	144.1	169.4	-59.3	0	0	0	0	110.4
405	L	79.9	Confident	66.9	Low	7 Å²	7	92.2 Å²	92.2	4%	0.037	48%	0.481	C	S	.	.			trans	-83.5	142.1	174.6	-67.1	169.7	0	0	0	110.5	L282 G283 L285 L308 V371	L282-L405 HydrophobicContact CB-CB 4.04Å; G283-L405 PolarHBondContact O-N 3.36Å; L285-L405 HydrophobicContact CB-CD2 3.96Å; L285-L405 HydrophobicContact CB-CG 4.35Å; L285-L405 HydrophobicContact CD2-CD2 4.47Å; L308-L405 HydrophobicContact CD2-CD1 3.52Å; V371-L405 HydrophobicContact CB-CD1 3.95Å; V371-L405 HydrophobicContact CB-CD2 4.48Å; V371-L405 HydrophobicContact CG1-CD1 4.44Å; V371-L405 HydrophobicContact CG2-CD1 3.7Å; V371-L405 HydrophobicContact CG2-CD2 3.74Å; V371-L405 HydrophobicContact CG2-CG 4.4Å
406	E	70.4	Confident	64.6	Low	65 Å²	65	90.9 Å²	90.9	30%	0.304	50%	0.496	S	S	.	.	B	Isolated β-bridge	trans	-113.6	141.8	-174.5	-64.2	-179.9	-121.2	0	0	112	G384 E385 V408 I409	G384-E406 CarbonylContact C-O 3.58Å; G384-E406 WeakPolarHBondContact CA-O 3.47Å; E385-E406 PolarHBondContact N-O 2.91Å; E385-E406 PolarHBondContact O-N 3.34Å; E406-V408 PolarHBondContact O-N 2.87Å; E406-I409 HydrophobicContact CB-CG1 4.07Å; E406-I409 WeakPolarHBondContact OE2-CG1 3.43Å
407	R	61.7	Low	62	Low	146 Å²	146	89.8 Å²	89.8	55%	0.551	51%	0.507	S	S	*	.	S	Bend	trans	-80.3	68.9	-179.3	-122.1	179.5	-58.3	-138.7	9.3	110.8	A279 L282	A279-R407 PolarHBondContact O-NH2 3.47Å; L282-R407 HydrophobicContact CD1-CB 3.72Å; L282-R407 HydrophobicContact CD1-CG 3.64Å; L282-R407 HydrophobicContact CD2-CG 4.33Å
408	V	55	Low	59.8	Low	60 Å²	60	90.8 Å²	90.8	36%	0.364	53%	0.527	S	S	.	.			trans	66.1	104.9	-179.5	-172.1	0	0	0	0	114.3	F382 E406 P410	F382-V408 HydrophobicContact CD1-CG2 3.95Å; F382-V408 HydrophobicContact CE1-CB 4.47Å; F382-V408 HydrophobicContact CE1-CG2 3.39Å; F382-V408 HydrophobicContact CZ-CG2 4Å; E406-V408 PolarHBondContact O-N 2.87Å; V408-P410 VanDerWaalsContact O-CD 3.29Å; V408-P410 WeakPolarHBondContact O-CD 3.06Å
409	I	45.1	Very low	57.1	Low	43 Å²	43	92.9 Å²	92.9	22%	0.221	54%	0.542	C	S	.	.			trans	-74.7	118.3	173.2	-58	172.4	0	0	0	110.2	E385 R387 E406 V411	E385-I409 HydrophobicContact CG-CG1 4.43Å; R387-I409 HydrophobicContact CG-CD1 4.24Å; R387-I409 PolarHBondContact NH2-O 3.21Å; E406-I409 HydrophobicContact CB-CG1 4.07Å; E406-I409 WeakPolarHBondContact OE2-CG1 3.43Å; I409-V411 PolarHBondContact O-N 2.9Å
410	P	38.6	Very low	54.7	Low	112 Å²	112	101.8 Å²	101.8	73%	0.727	57%	0.574	S	S	*	*			trans	-61.9	126	172.6	-20.3	33.6	0	0	0	110.2	V408 K412	V408-P410 VanDerWaalsContact O-CD 3.29Å; V408-P410 WeakPolarHBondContact O-CD 3.06Å; P410-K412 PolarHBondContact O-N 3.41Å; P410-K412 VanDerWaalsContact O-N 3.07Å
411	V	41.8	Very low	52	Low	100 Å²	100	99.7 Å²	99.7	61%	0.606	58%	0.579	S	S	*	*			trans	-79.1	98.9	-179.8	-157.2	0	0	0	0	108.1	R387 I409 K413	R387-V411 VanDerWaalsContact NH1-CG2 3.35Å; I409-V411 PolarHBondContact O-N 2.9Å; V411-K413 PolarHBondContact O-N 3.23Å
412	K	37.3	Very low	49.5	Very low	173 Å²	173	107.6 Å²	107.6	75%	0.752	62%	0.619	S	S	*	*			trans	-52.2	107.1	169.7	-73.7	-165.3	176.7	-171.5	0	107.2	P410 A414 E436	P410-K412 PolarHBondContact O-N 3.41Å; P410-K412 VanDerWaalsContact O-N 3.07Å; K412-A414 PolarHBondContact O-N 3.3Å; K412-E436 IonicContact NZ-OE1 2.67Å; K412-E436 PolarHBondContact NZ-OE1 3.45Å
413	K	33.8	Very low	46.9	Very low	152 Å²	152	107.4 Å²	107.4	66%	0.661	63%	0.631	S	S	*	*			trans	-64.6	105.6	-172.9	-78.5	164.2	172.5	160.3	0	108.3	V411 V415 E426	V411-K413 PolarHBondContact O-N 3.23Å; K413-V415 PolarHBondContact O-N 3.04Å; K413-E426 IonicContact NZ-OE1 3.31Å; K413-E426 PolarHBondContact NZ-OE1 3.05Å; K413-E426 IonicContact NZ-OE2 2.67Å; K413-E426 PolarHBondContact NZ-OE2 2.91Å
414	A	33.2	Very low	44.6	Very low	96 Å²	96	113.5 Å²	113.5	79%	0.793	66%	0.661	S	S	*	*			trans	-58	138.2	176.9	0	0	0	0	0	110.2	K412 G416	K412-A414 PolarHBondContact O-N 3.3Å; A414-G416 PolarHBondContact O-N 3.41Å
415	V	36.2	Very low	42.4	Very low	151 Å²	151	120 Å²	120	92%	0.915	68%	0.68	S	S	*	*	S	Bend	trans	-66.9	126.6	-168.5	178.9	0	0	0	0	111.4	K413	K413-V415 PolarHBondContact O-N 3.04Å
416	G	37	Very low	40.8	Very low	76 Å²	76	127 Å²	127	78%	0.784	71%	0.713	S	S	*	*	S	Bend	trans	86.2	102.3	167	0	0	0	0	0	115.4	A414	A414-G416 PolarHBondContact O-N 3.41Å
417	G	32.1	Very low	39	Very low	73 Å²	73	131.4 Å²	131.4	75%	0.753	74%	0.738	S	S	*	*			trans	161.8	88.6	170.4	0	0	0	0	0	114.2	I419	G417-I419 PolarHBondContact O-N 3.47Å
418	S	39.8	Very low	37.7	Very low	131 Å²	131	131 Å²	131	92%	0.916	75%	0.747	S	S	*	*			trans	-81.1	102.1	172.5	-173.6	0	0	0	0	110.5
419	I	34.3	Very low	36.9	Very low	162 Å²	162	136.4 Å²	136.4	83%	0.831	77%	0.773	S	S	*	*			trans	-123.9	128.8	167.9	-62.4	-177.4	0	0	0	108.8	G417	G417-I419 PolarHBondContact O-N 3.47Å
420	R	39.5	Very low	36.3	Very low	252 Å²	252	143.4 Å²	143.4	95%	0.951	80%	0.802	S	S	*	*			trans	-70.2	129.4	-175	-70	165.1	155.1	172.1	-9.1	111.8
421	G	33.7	Very low	36.5	Very low	69 Å²	69	148 Å²	148	71%	0.711	81%	0.813	S	S	*	*			trans	147.4	108.5	156.3	0	0	0	0	0	116.6
422	M	36.1	Very low	35.9	Very low	198 Å²	198	146.5 Å²	146.5	98%	0.975	82%	0.819	S	S	*	*			trans	53.2	98.7	159.8	-58.6	-165.4	-59.1	0	0	119.3
423	A	34.1	Very low	35.7	Very low	99 Å²	99	147.3 Å²	147.3	82%	0.818	83%	0.825	S	S	*	*			trans	-142.2	137.4	134.4	0	0	0	0	0	108.2
424	L	34.8	Very low	35.8	Very low	166 Å²	166	147.8 Å²	147.8	87%	0.869	84%	0.835	S	S	*	*			trans	-128	65.9	-176.2	-98.7	173.9	0	0	0	110.7
425	Y	36.1	Very low	36.3	Very low	190 Å²	190	147.3 Å²	147.3	75%	0.745	83%	0.826	S	S	*	*			trans	-169.5	105.3	150.5	54.9	-90.1	0	0	0	109.4
426	E	45.2	Very low	37	Very low	154 Å²	154	144.1 Å²	144.1	72%	0.72	80%	0.801	S	S	*	*			trans	-147	89.5	164.7	-72.7	-163.3	131.7	0	0	107.3	K413	K413-E426 IonicContact NZ-OE1 3.31Å; K413-E426 PolarHBondContact NZ-OE1 3.05Å; K413-E426 IonicContact NZ-OE2 2.67Å; K413-E426 PolarHBondContact NZ-OE2 2.91Å
427	D	33.3	Very low	38.1	Very low	157 Å²	157	147.5 Å²	147.5	84%	0.84	80%	0.796	S	S	*	*			trans	-158.4	160	166.1	-103.2	-40.4	0	0	0	107.8
428	D	35.2	Very low	40.1	Very low	136 Å²	136	146.3 Å²	146.3	73%	0.727	77%	0.769	S	S	*	*			trans	63.1	38.3	-179	-70.5	-34.5	0	0	0	117.4
429	L	37.6	Very low	42.1	Very low	175 Å²	175	140.2 Å²	140.2	92%	0.916	73%	0.727	S	S	*	*			trans	-99.4	112.2	143.5	-75.5	-178.2	0	0	0	109
430	K	33.4	Very low	44.7	Very low	190 Å²	190	135.6 Å²	135.6	83%	0.826	70%	0.699	S	S	*	*			trans	-76.8	133.7	173.2	-65.7	175.5	-178.1	172.3	0	109.2	G432	K430-G432 PolarHBondContact O-N 3.1Å
431	E	41.1	Very low	47.2	Very low	207 Å²	207	123.6 Å²	123.6	97%	0.967	65%	0.654	S	S	*	*			trans	-64.8	121.7	170.1	-62.8	176.7	137.2	0	0	109.3
432	G	30.2	Very low	50	Low	70 Å²	70	121 Å²	121	72%	0.722	62%	0.624	S	S	*	*			trans	178.7	95.4	-175.9	0	0	0	0	0	112.7	K430	K430-G432 PolarHBondContact O-N 3.1Å
433	E	33.7	Very low	52.8	Low	189 Å²	189	111.6 Å²	111.6	88%	0.883	58%	0.577	S	S	*	*			trans	56.4	114.2	172.3	-63	-175.5	122	0	0	117.8	S435	E433-S435 PolarHBondContact O-N 3.26Å
434	D	35.5	Very low	55.7	Low	162 Å²	162	107 Å²	107	87%	0.866	54%	0.539	S	S	*	.			trans	-67.6	73.3	170.3	-82.1	-55.8	0	0	0	112.3	E436	D434-E436 VanDerWaalsContact C-N 3.33Å; D434-E436 PolarHBondContact O-N 3.43Å
435	S	43.4	Very low	58.6	Low	86 Å²	86	99 Å²	99	60%	0.601	50%	0.497	S	S	*	.			trans	-83.5	78.7	157.6	-69.3	0	0	0	0	109.2	E433 E437	E433-S435 PolarHBondContact O-N 3.26Å; S435-E437 PolarHBondContact O-N 2.78Å
436	E	51.5	Low	61.3	Low	85 Å²	85	91.1 Å²	91.1	40%	0.397	47%	0.469	S	S	.	.			trans	-55.8	112.9	166.3	-74.1	-164	126.7	0	0	108.8	K412 D434 R438	K412-E436 IonicContact NZ-OE1 2.67Å; K412-E436 PolarHBondContact NZ-OE1 3.45Å; D434-E436 VanDerWaalsContact C-N 3.33Å; D434-E436 PolarHBondContact O-N 3.43Å; E436-R438 HydrophobicContact CB-CG 4.46Å; E436-R438 PolarHBondContact O-N 3.17Å; E436-R438 IonicContact OE2-CZ 2.71Å; E436-R438 IonicContact OE2-NE 3.14Å; E436-R438 IonicContact OE2-NH2 3.48Å; E436-R438 PolarHBondContact OE2-NH2 3.08Å
437	E	59.3	Low	63.6	Low	146 Å²	146	84 Å²	84	68%	0.682	44%	0.435	S	S	*	.			trans	-67.6	100.9	175.6	-66.6	-165.8	161.9	0	0	109.9	S435 G439 V571	S435-E437 PolarHBondContact O-N 2.78Å; E437-G439 PolarHBondContact O-N 2.68Å; E437-G439 VanDerWaalsContact O-N 3.15Å; E437-V571 HydrophobicContact CB-CG1 4.4Å; E437-V571 HydrophobicContact CG-CG1 4.06Å
438	R	74.7	Confident	66.3	Low	49 Å²	49	78.2 Å²	78.2	19%	0.185	40%	0.404	C	S	.	.			trans	-86.7	26.2	-177.4	-66.3	-171.7	177	175.1	6.7	113.9	E436 L464 A465 I538 L572 N574	E436-R438 HydrophobicContact CB-CG 4.46Å; E436-R438 PolarHBondContact O-N 3.17Å; E436-R438 IonicContact OE2-CZ 2.71Å; E436-R438 IonicContact OE2-NE 3.14Å; E436-R438 IonicContact OE2-NH2 3.48Å; E436-R438 PolarHBondContact OE2-NH2 3.08Å; R438-L464 WeakPolarHBondContact O-CA 3.14Å; R438-A465 HydrophobicContact CB-CB 3.83Å; R438-A465 HydrophobicContact CG-CB 3.94Å; R438-A465 PolarHBondContact O-N 2.99Å; R438-I538 HydrophobicContact CB-CG2 4.35Å; R438-I538 WeakPolarHBondContact CB-O 3.43Å; R438-I538 WeakPolarHBondContact CD-O 3.45Å; R438-L572 PolarHBondContact N-O 3.09Å; R438-N574 VanDerWaalsContact CZ-OD1 3.26Å; R438-N574 PolarHBondContact NH1-OD1 2.64Å
439	G	81.7	Confident	68.8	Low	3 Å²	3	73.9 Å²	73.9	3%	0.031	39%	0.385	C	S	.	.			trans	106.9	-174.4	-178.5	0	0	0	0	0	113.4	E437 A462 H463 L572	E437-G439 PolarHBondContact O-N 2.68Å; E437-G439 VanDerWaalsContact O-N 3.15Å; G439-A462 WeakPolarHBondContact CA-O 3.47Å; G439-H463 WeakPolarHBondContact CA-O 3.31Å; G439-H463 PolarHBondContact N-O 2.99Å; G439-L572 WeakPolarHBondContact O-CB 3.47Å; G439-L572 PolarHBondContact O-N 2.75Å
440	R	89.1	Confident	71.2	Confident	64 Å²	64	74 Å²	74	24%	0.242	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	150.4	-176	-62.4	179.6	-70.4	169.9	0.4	110.6	C461 A462 W569 H570 V571	R440-C461 CarbonylContact O-C 3.49Å; R440-C461 VanDerWaalsContact O-CA 3.25Å; R440-C461 WeakPolarHBondContact O-CA 3.39Å; R440-C461 WeakPolarHBondContact O-CB 3.22Å; R440-A462 PolarHBondContact N-O 3.01Å; R440-A462 PolarHBondContact O-N 3.37Å; R440-W569 HydrophobicContact CB-CE3 3.78Å; R440-W569 HydrophobicContact CB-CZ3 4.11Å; R440-H570 CarbonylContact C-O 3.22Å; R440-H570 WeakPolarHBondContact CA-O 3.22Å; R440-V571 HydrophobicContact CG-CG2 4.26Å
441	I	91.9	Very high	73.8	Confident	0 Å²	0	69.7 Å²	69.7	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	135.1	178	-171.8	162.9	0	0	0	110.7	I443 V458 C461 V477 V524 V526 W569 H570 L572	I441-I443 HydrophobicContact CD1-CD1 3.76Å; I441-I443 HydrophobicContact CG1-CD1 3.76Å; I441-I443 HydrophobicContact CG1-CG1 4.14Å; I441-I443 HydrophobicContact CG2-CG1 4.23Å; I441-V458 HydrophobicContact CD1-CG1 4.22Å; I441-C461 VanDerWaalsContact CG1-SG 3.59Å; I441-V477 HydrophobicContact CD1-CG1 3.96Å; I441-V477 HydrophobicContact CD1-CG2 3.95Å; I441-V524 HydrophobicContact CD1-CG1 3.84Å; I441-V526 HydrophobicContact CD1-CG2 3.97Å; I441-W569 VanDerWaalsContact C-CE3 3.43Å; I441-W569 WeakPolarHBondContact O-CA 3.35Å; I441-H570 HydrophobicContact CG2-CB 4.13Å; I441-H570 PolarHBondContact N-O 3.16Å; I441-H570 PolarHBondContact O-N 3.19Å; I441-L572 HydrophobicContact CB-CD2 4.14Å; I441-L572 HydrophobicContact CG2-CD2 3.66Å; I441-L572 HydrophobicContact CG2-CG 4.41Å
442	L	92.4	Very high	76.1	Confident	16 Å²	16	62.5 Å²	62.5	8%	0.084	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	109.3	173.4	-179.6	57.4	0	0	0	108.4	V459 R460 E567 R568 W569	L442-V459 HydrophobicContact CB-CB 4.24Å; L442-V459 HydrophobicContact CD2-CB 4.01Å; L442-V459 HydrophobicContact CD2-CG1 3.89Å; L442-V459 HydrophobicContact CD2-CG2 4.47Å; L442-V459 HydrophobicContact CG-CB 3.92Å; L442-V459 HydrophobicContact CG-CG1 4.37Å; L442-V459 HydrophobicContact CG-CG2 4.16Å; L442-V459 PolarHBondContact O-N 3.32Å; L442-V459 VanDerWaalsContact O-N 3.11Å; L442-R460 HydrophobicContact CB-CG 4.25Å; L442-R460 HydrophobicContact CD2-CG 4.27Å; L442-R460 PolarHBondContact N-O 3.46Å; L442-E567 HydrophobicContact CD1-CB 4.13Å; L442-R568 WeakPolarHBondContact CD1-O 3.37Å; L442-W569 HydrophobicContact CB-CD2 3.96Å; L442-W569 HydrophobicContact CB-CE3 3.88Å; L442-W569 HydrophobicContact CB-CH2 3.85Å; L442-W569 HydrophobicContact CB-CZ2 3.92Å; L442-W569 HydrophobicContact CB-CZ3 3.83Å; L442-W569 HydrophobicContact CD1-CD2 4.26Å; L442-W569 HydrophobicContact CD1-CG 4.27Å; L442-W569 HydrophobicContact CD2-CZ2 4.07Å; L442-W569 HydrophobicContact CG-CZ2 4.47Å
443	I	95.2	Very high	79	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	139.7	177.9	-62	-60.9	0	0	0	109.1	I441 L445 V456 G457 V458 V524 H554 E567 R568	I441-I443 HydrophobicContact CD1-CD1 3.76Å; I441-I443 HydrophobicContact CG1-CD1 3.76Å; I441-I443 HydrophobicContact CG1-CG1 4.14Å; I441-I443 HydrophobicContact CG2-CG1 4.23Å; I443-L445 HydrophobicContact CG2-CD2 4.17Å; I443-L445 HydrophobicContact CG2-CG 4.32Å; I443-V456 HydrophobicContact CG2-CG1 4.25Å; I443-G457 CarbonylContact C-O 3.39Å; I443-G457 WeakPolarHBondContact CA-O 3.03Å; I443-V458 HydrophobicContact CD1-CG2 3.98Å; I443-V524 HydrophobicContact CD1-CG1 4.09Å; I443-V524 HydrophobicContact CD1-CG2 4.48Å; I443-H554 WeakPolarHBondContact CB-CE1 3.48Å; I443-H554 WeakPolarHBondContact CG2-CE1 3.41Å; I443-H554 PolarHBondContact O-CE1 3.47Å; I443-E567 CarbonylContact O-C 3.48Å; I443-E567 WeakPolarHBondContact O-CA 3.2Å; I443-R568 PolarHBondContact N-O 3.17Å; I443-R568 PolarHBondContact O-N 3.2Å
444	S	95.4	Very high	81.8	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.007	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	138.8	166.4	-170.7	0	0	0	0	110.3	V456 G457 H554 K565 I566	S444-V456 CarbonylContact O-C 3.5Å; S444-V456 WeakPolarHBondContact O-CA 3.19Å; S444-G457 PolarHBondContact N-O 3.46Å; S444-G457 PolarHBondContact O-N 3.45Å; S444-H554 PolarHBondContact N-CE1 2.78Å; S444-K565 WeakPolarHBondContact OG-CE 3.47Å; S444-K565 WeakPolarHBondContact OG-CG 3.24Å; S444-I566 CarbonylContact C-O 3.6Å; S444-I566 WeakPolarHBondContact CA-O 3.34Å
445	L	94.4	Very high	84.5	Confident	0 Å²	0	47 Å²	47	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	131.9	170.2	-62.6	178	0	0	0	109.1	I443 L454 V456 L522 L543 H554 W555 C558 I566	I443-L445 HydrophobicContact CG2-CD2 4.17Å; I443-L445 HydrophobicContact CG2-CG 4.32Å; L445-L454 HydrophobicContact CD2-CD1 4.49Å; L445-V456 HydrophobicContact CD2-CB 4.43Å; L445-V456 HydrophobicContact CD2-CG1 4.23Å; L445-V456 HydrophobicContact CD2-CG2 3.92Å; L445-L522 HydrophobicContact CD2-CD2 3.76Å; L445-L543 HydrophobicContact CD1-CD2 3.96Å; L445-H554 PolarHBondContact N-NE2 2.95Å; L445-W555 HydrophobicContact CD1-CE3 3.81Å; L445-W555 HydrophobicContact CD1-CZ3 4.27Å; L445-C558 HydrophobicContact CB-CB 3.86Å; L445-C558 HydrophobicContact CD1-CB 4.16Å; L445-I566 PolarHBondContact N-O 2.95Å; L445-I566 PolarHBondContact O-N 3.1Å
446	T	93.6	Very high	87	Confident	24 Å²	24	43 Å²	43	15%	0.147	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	120.8	171.2	-51.1	0	0	0	0	108.8	V455 K565	T446-V455 PolarHBondContact N-O 2.85Å; T446-V455 PolarHBondContact O-N 3.48Å; T446-K565 WeakPolarHBondContact OG1-CA 3.22Å; T446-K565 WeakPolarHBondContact OG1-CG 3.36Å
447	Y	92.5	Very high	89	Confident	3 Å²	3	39 Å²	39	1%	0.012	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	108.6	168.5	-178.7	-93	0	0	0	109.9	S449 I512 H514 L517 K562 D563	Y447-S449 PolarHBondContact O-N 2.7Å; Y447-I512 WeakPolarHBondContact CE2-O 3.34Å; Y447-I512 PolarHBondContact OH-O 3.08Å; Y447-H514 AromaticContact CD1-CD2 3.86Å; Y447-H514 HydrophobicContact CE1-CB 3.79Å; Y447-H514 AromaticContact CE1-CD2 3.85Å; Y447-H514 HydrophobicContact CE2-CB 4.44Å; Y447-H514 PolarHBondContact OH-N 3.48Å; Y447-L517 HydrophobicContact CD2-CD2 3.81Å; Y447-L517 HydrophobicContact CG-CD2 4.26Å; Y447-K562 HydrophobicContact CD1-CG 4.41Å; Y447-D563 WeakPolarHBondContact O-CA 3.35Å; Y447-D563 PolarHBondContact O-N 3.06Å
448	N	90.9	Very high	90.8	Very high	37 Å²	37	32 Å²	32	20%	0.198	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	112.3	176.1	-175.8	-57.4	0	0	0	109.6	Q450 Q451 S452 R453 D563	N448-Q450 PolarHBondContact OD1-N 2.98Å; N448-Q450 VanDerWaalsContact OD1-N 3.11Å; N448-Q451 WeakPolarHBondContact OD1-CB 3.47Å; N448-Q451 WeakPolarHBondContact OD1-CG 3.41Å; N448-Q451 PolarHBondContact OD1-N 2.79Å; N448-S452 PolarHBondContact O-N 3.07Å; N448-S452 VanDerWaalsContact O-N 3.15Å; N448-R453 HydrophobicContact CB-CG 4.05Å; N448-R453 PolarHBondContact N-O 3.39Å; N448-R453 PolarHBondContact O-N 3.27Å; N448-D563 VanDerWaalsContact CA-OD1 3.28Å; N448-D563 WeakPolarHBondContact CA-OD1 3.38Å
449	S	87.9	Confident	91.6	Very high	45 Å²	45	30.6 Å²	30.6	32%	0.315	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-19.7	-174.6	-163.2	0	0	0	0	113.7	Y447 D563	Y447-S449 PolarHBondContact O-N 2.7Å; S449-D563 WeakPolarHBondContact CB-OD2 3.38Å; S449-D563 PolarHBondContact N-OD1 2.87Å; S449-D563 PolarHBondContact N-OD2 2.91Å
450	Q	87.9	Confident	92	Very high	176 Å²	176	34.5 Å²	34.5	82%	0.822	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-41.6	174.6	-63.1	-175.4	-6	0	0	111.6	N448	N448-Q450 PolarHBondContact OD1-N 2.98Å; N448-Q450 VanDerWaalsContact OD1-N 3.11Å
451	Q	87.6	Confident	92	Very high	100 Å²	100	31.5 Å²	31.5	47%	0.467	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	5.9	-173.9	-55.4	-178	4.8	0	0	113.6	N448 R453	N448-Q451 WeakPolarHBondContact OD1-CB 3.47Å; N448-Q451 WeakPolarHBondContact OD1-CG 3.41Å; N448-Q451 PolarHBondContact OD1-N 2.79Å; Q451-R453 HydrophobicContact CB-CG 4.02Å; Q451-R453 PolarHBondContact O-N 2.79Å; Q451-R453 PolarHBondContact O-NE 2.71Å; Q451-R453 VanDerWaalsContact OE1-CZ 3.23Å
452	S	89.6	Confident	91.4	Very high	56 Å²	56	31.7 Å²	31.7	39%	0.392	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	42.9	57.1	-178.1	-65	0	0	0	0	113.6	N448 I512	N448-S452 PolarHBondContact O-N 3.07Å; N448-S452 VanDerWaalsContact O-N 3.15Å; S452-I512 CarbonylContact C-O 3.52Å; S452-I512 VanDerWaalsContact C-O 3.3Å; S452-I512 PolarHBondContact O-N 3.31Å
453	R	91.3	Very high	90.7	Very high	70 Å²	70	34 Å²	34	26%	0.264	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	141.7	-178.6	63.4	-172.7	62.6	178	-4.8	112.9	N448 Q451 Y510	N448-R453 HydrophobicContact CB-CG 4.05Å; N448-R453 PolarHBondContact N-O 3.39Å; N448-R453 PolarHBondContact O-N 3.27Å; Q451-R453 HydrophobicContact CB-CG 4.02Å; Q451-R453 PolarHBondContact O-N 2.79Å; Q451-R453 PolarHBondContact O-NE 2.71Å; Q451-R453 VanDerWaalsContact OE1-CZ 3.23Å; R453-Y510 CarbonylContact C-O 3.41Å; R453-Y510 WeakPolarHBondContact CA-O 3.22Å; R453-Y510 VanDerWaalsContact CB-O 3.3Å; R453-Y510 WeakPolarHBondContact CB-O 3.42Å
454	L	91.3	Very high	90	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	126.6	164.4	-179.9	73	0	0	0	108.4	L445 V456 L481 S509 Y510 I512 L517 W555	L445-L454 HydrophobicContact CD2-CD1 4.49Å; L454-V456 HydrophobicContact CD2-CG2 3.71Å; L454-V456 HydrophobicContact CG-CG2 3.91Å; L454-L481 HydrophobicContact CD2-CD1 4.48Å; L454-S509 CarbonylContact O-C 3.5Å; L454-S509 WeakPolarHBondContact O-CA 3.43Å; L454-Y510 PolarHBondContact N-O 2.67Å; L454-Y510 PolarHBondContact O-N 3.43Å; L454-I512 HydrophobicContact CB-CD1 3.76Å; L454-I512 HydrophobicContact CD2-CD1 4.2Å; L454-L517 HydrophobicContact CB-CD1 4.46Å; L454-L517 HydrophobicContact CD1-CD1 4.34Å; L454-L517 HydrophobicContact CD1-CD2 4.46Å; L454-L517 HydrophobicContact CD2-CD1 3.97Å; L454-W555 HydrophobicContact CD2-CH2 3.93Å; L454-W555 HydrophobicContact CD2-CZ3 4.12Å
455	V	93.3	Very high	89.1	Confident	27 Å²	27	35.4 Å²	35.4	16%	0.164	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	125.5	167.2	-175.4	0	0	0	0	107.9	T446 E507	T446-V455 PolarHBondContact N-O 2.85Å; T446-V455 PolarHBondContact O-N 3.48Å; V455-E507 HydrophobicContact CG1-CB 3.97Å; V455-E507 HydrophobicContact CG1-CG 4.48Å
456	V	95.1	Very high	88.5	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	110.1	177.6	-178.3	0	0	0	0	108	I443 S444 L445 L454 I479 F508 Y510 L522	I443-V456 HydrophobicContact CG2-CG1 4.25Å; S444-V456 CarbonylContact O-C 3.5Å; S444-V456 WeakPolarHBondContact O-CA 3.19Å; L445-V456 HydrophobicContact CD2-CB 4.43Å; L445-V456 HydrophobicContact CD2-CG1 4.23Å; L445-V456 HydrophobicContact CD2-CG2 3.92Å; L454-V456 HydrophobicContact CD2-CG2 3.71Å; L454-V456 HydrophobicContact CG-CG2 3.91Å; V456-I479 HydrophobicContact CG1-CD1 4.29Å; V456-F508 PolarHBondContact N-O 3.29Å; V456-F508 PolarHBondContact O-N 3.49Å; V456-Y510 HydrophobicContact CB-CE2 4.33Å; V456-Y510 HydrophobicContact CG2-CD2 3.99Å; V456-Y510 HydrophobicContact CG2-CE2 3.91Å; V456-L522 HydrophobicContact CG1-CD1 4.49Å; V456-L522 HydrophobicContact CG1-CD2 3.79Å; V456-L522 HydrophobicContact CG2-CD1 4.08Å; V456-L522 HydrophobicContact CG2-CD2 3.92Å
457	G	94.6	Very high	88	Confident	2 Å²	2	39 Å²	39	2%	0.021	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	125.6	175.2	0	0	0	0	0	111.6	I443 S444	I443-G457 CarbonylContact C-O 3.39Å; I443-G457 WeakPolarHBondContact CA-O 3.03Å; S444-G457 PolarHBondContact N-O 3.46Å; S444-G457 PolarHBondContact O-N 3.45Å
458	V	95.9	Very high	87.1	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	102.6	162.8	179.8	0	0	0	0	107	I441 I443 V477 I479 T493 F504 N505 E506 F508	I441-V458 HydrophobicContact CD1-CG1 4.22Å; I443-V458 HydrophobicContact CD1-CG2 3.98Å; V458-V477 HydrophobicContact CG1-CB 4.38Å; V458-V477 HydrophobicContact CG1-CG2 3.93Å; V458-V477 HydrophobicContact CG2-CG1 4.31Å; V458-I479 HydrophobicContact CG2-CD1 3.49Å; V458-I479 VanDerWaalsContact CG2-CD1 3.49Å; V458-I479 HydrophobicContact CG2-CG1 4.2Å; V458-T493 HydrophobicContact CB-CG2 4.08Å; V458-T493 HydrophobicContact CG1-CG2 4.11Å; V458-T493 HydrophobicContact CG2-CG2 4.2Å; V458-F504 HydrophobicContact CB-CB 4.46Å; V458-F504 HydrophobicContact CG1-CB 3.98Å; V458-F504 HydrophobicContact CG1-CD2 3.59Å; V458-F504 HydrophobicContact CG1-CE2 4.33Å; V458-F504 HydrophobicContact CG1-CG 3.97Å; V458-F504 WeakPolarHBondContact O-CB 3.24Å; V458-N505 WeakPolarHBondContact O-CA 3.26Å; V458-N505 PolarHBondContact O-N 3.43Å; V458-E506 PolarHBondContact N-O 2.9Å; V458-E506 PolarHBondContact O-N 3.49Å; V458-E506 VanDerWaalsContact O-N 3.07Å; V458-F508 HydrophobicContact CG2-CE2 4.31Å
459	V	92.1	Very high	86	Confident	19 Å²	19	44.9 Å²	44.9	12%	0.115	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-68.5	-176.8	-173.1	0	0	0	0	108.8	L442 F504 N505	L442-V459 HydrophobicContact CB-CB 4.24Å; L442-V459 HydrophobicContact CD2-CB 4.01Å; L442-V459 HydrophobicContact CD2-CG1 3.89Å; L442-V459 HydrophobicContact CD2-CG2 4.47Å; L442-V459 HydrophobicContact CG-CB 3.92Å; L442-V459 HydrophobicContact CG-CG1 4.37Å; L442-V459 HydrophobicContact CG-CG2 4.16Å; L442-V459 PolarHBondContact O-N 3.32Å; L442-V459 VanDerWaalsContact O-N 3.11Å; V459-F504 PolarHBondContact O-N 2.99Å; V459-N505 WeakPolarHBondContact CG1-OD1 3.44Å; V459-N505 PolarHBondContact O-N 2.76Å; V459-N505 PolarHBondContact O-OD1 2.94Å
460	R	89.6	Confident	85.1	Confident	84 Å²	84	45.7 Å²	45.7	32%	0.317	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	158.8	-178.9	62.1	-170.6	-179.4	104	-6.3	112.2	L442 P502 E503 W569	L442-R460 HydrophobicContact CB-CG 4.25Å; L442-R460 HydrophobicContact CD2-CG 4.27Å; L442-R460 PolarHBondContact N-O 3.46Å; R460-P502 CarbonylContact C-O 3.57Å; R460-P502 WeakPolarHBondContact CA-O 3.48Å; R460-P502 VanDerWaalsContact CB-O 3.29Å; R460-P502 WeakPolarHBondContact CB-O 3.45Å; R460-E503 HydrophobicContact CB-CB 4.33Å; R460-E503 HydrophobicContact CB-CG 3.94Å; R460-W569 HydrophobicContact CG-CH2 4.11Å
461	C	88.7	Confident	84	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.007	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	161.3	162.8	-56.5	0	0	0	0	110.8	R440 I441 L464 N501 P502	R440-C461 CarbonylContact O-C 3.49Å; R440-C461 VanDerWaalsContact O-CA 3.25Å; R440-C461 WeakPolarHBondContact O-CA 3.39Å; R440-C461 WeakPolarHBondContact O-CB 3.22Å; I441-C461 VanDerWaalsContact CG1-SG 3.59Å; C461-L464 HydrophobicContact CB-CD1 3.86Å; C461-L464 HydrophobicContact CB-CD2 3.7Å; C461-L464 HydrophobicContact CB-CG 3.78Å; C461-N501 CarbonylContact O-C 3.6Å; C461-N501 WeakPolarHBondContact O-CA 3.29Å; C461-P502 HydrophobicContact CB-CG 3.75Å; C461-P502 PolarHBondContact N-O 2.87Å
462	A	81.1	Confident	83.4	Confident	5 Å²	5	37.3 Å²	37.3	4%	0.041	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	142.5	173.5	0	0	0	0	0	110.8	G439 R440 L464 N501 W569	G439-A462 WeakPolarHBondContact CA-O 3.47Å; R440-A462 PolarHBondContact N-O 3.01Å; R440-A462 PolarHBondContact O-N 3.37Å; A462-L464 VanDerWaalsContact C-N 3.28Å; A462-L464 PolarHBondContact O-N 3.36Å; A462-N501 VanDerWaalsContact CA-OD1 3.29Å; A462-N501 WeakPolarHBondContact CA-OD1 3.44Å; A462-W569 HydrophobicContact CB-CH2 3.73Å; A462-W569 HydrophobicContact CB-CZ3 3.87Å
463	H	76.9	Confident	83.1	Confident	65 Å²	65	34.6 Å²	34.6	30%	0.301	19%	0.191	S	C	.	.	S	Bend	trans	57.8	35.9	174.1	-54	-161.3	0	0	0	113.2	G439 L500 N501	G439-H463 WeakPolarHBondContact CA-O 3.31Å; G439-H463 PolarHBondContact N-O 2.99Å; H463-L500 PolarHBondContact N-O 3.33Å; H463-N501 PolarHBondContact N-OD1 2.84Å
464	L	80.2	Confident	83	Confident	5 Å²	5	31.9 Å²	31.9	3%	0.026	18%	0.182	C	C	.	.			trans	-56.9	145	176.3	-65.1	-177.5	0	0	0	111.3	R438 C461 A462 P475 L500 P502 V526 I538 L572	R438-L464 WeakPolarHBondContact O-CA 3.14Å; C461-L464 HydrophobicContact CB-CD1 3.86Å; C461-L464 HydrophobicContact CB-CD2 3.7Å; C461-L464 HydrophobicContact CB-CG 3.78Å; A462-L464 VanDerWaalsContact C-N 3.28Å; A462-L464 PolarHBondContact O-N 3.36Å; L464-P475 HydrophobicContact CD1-CB 3.55Å; L464-P475 HydrophobicContact CD1-CG 3.82Å; L464-L500 HydrophobicContact CB-CB 4.36Å; L464-L500 HydrophobicContact CB-CD2 4.35Å; L464-L500 PolarHBondContact N-O 3.34Å; L464-L500 WeakPolarHBondContact O-CD2 3.19Å; L464-P502 HydrophobicContact CD1-CG 3.78Å; L464-V526 HydrophobicContact CD1-CG1 3.99Å; L464-V526 HydrophobicContact CD2-CG1 4.14Å; L464-I538 HydrophobicContact CB-CG2 4.32Å; L464-I538 HydrophobicContact CD1-CD1 4.41Å; L464-I538 HydrophobicContact CD2-CG2 4.23Å; L464-L572 HydrophobicContact CD2-CD1 3.33Å
465	A	77.8	Confident	83	Confident	25 Å²	25	31.9 Å²	31.9	21%	0.207	18%	0.182	C	C	.	.			trans	-67.9	131.8	171	0	0	0	0	0	110.5	R438 M467 S473 I538	R438-A465 HydrophobicContact CB-CB 3.83Å; R438-A465 HydrophobicContact CG-CB 3.94Å; R438-A465 PolarHBondContact O-N 2.99Å; A465-M467 HydrophobicContact CB-CE 3.59Å; A465-M467 PolarHBondContact O-N 2.84Å; A465-S473 PolarHBondContact O-OG 2.96Å; A465-I538 HydrophobicContact CB-CG2 4.27Å
466	A	81.5	Confident	83	Confident	42 Å²	42	31 Å²	31	35%	0.347	18%	0.176	S	C	.	.			trans	-78.7	110.7	175.2	0	0	0	0	0	110.5	Y472 L500	A466-Y472 WeakPolarHBondContact CA-O 3.21Å; A466-Y472 WeakPolarHBondContact CB-O 3.17Å; A466-L500 HydrophobicContact CB-CD1 4.11Å; A466-L500 HydrophobicContact CB-CD2 3.94Å
467	M	81.6	Confident	83	Confident	57 Å²	57	31 Å²	31	28%	0.281	18%	0.176	S	C	.	.			trans	-86.4	-36.4	172.4	-44.3	-72.5	77.8	0	0	110.6	A465 S473 D528 D536 I538	A465-M467 HydrophobicContact CB-CE 3.59Å; A465-M467 PolarHBondContact O-N 2.84Å; M467-S473 PolarHBondContact N-OG 3.11Å; M467-D528 HydrophobicContact CB-CB 4.27Å; M467-D528 WeakPolarHBondContact CB-OD2 3.29Å; M467-D528 HydrophobicContact CG-CB 4.14Å; M467-D536 HydrophobicContact CB-CB 3.92Å; M467-D536 HydrophobicContact CG-CB 3.9Å; M467-I538 HydrophobicContact CG-CG1 3.92Å
468	D	74.1	Confident	83	Confident	38 Å²	38	32.1 Å²	32.1	20%	0.203	18%	0.18	C	C	.	.	S	Bend	trans	-65.7	137.4	-177.3	-163.4	-20.4	0	0	0	112.6	N470 G471 Y472	D468-N470 PolarHBondContact O-N 2.79Å; D468-N470 PolarHBondContact OD1-N 3.37Å; D468-N470 PolarHBondContact OD1-ND2 3.04Å; D468-N470 PolarHBondContact OD2-ND2 2.86Å; D468-G471 WeakPolarHBondContact O-CA 3.46Å; D468-G471 PolarHBondContact O-N 3.02Å; D468-Y472 VanDerWaalsContact CB-O 3.31Å; D468-Y472 WeakPolarHBondContact CB-O 3.32Å; D468-Y472 PolarHBondContact N-O 3.15Å
469	S	67.5	Low	82.8	Confident	125 Å²	125	32.1 Å²	32.1	87%	0.874	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-22.8	178	63	0	0	0	0	115	G471	S469-G471 VanDerWaalsContact C-N 3.25Å; S469-G471 PolarHBondContact O-N 2.66Å
470	N	68.8	Low	82.7	Confident	62 Å²	62	31.7 Å²	31.7	33%	0.332	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-6.8	174.7	66.3	56.8	0	0	0	113.8	D468 Y472	D468-N470 PolarHBondContact O-N 2.79Å; D468-N470 PolarHBondContact OD1-N 3.37Å; D468-N470 PolarHBondContact OD1-ND2 3.04Å; D468-N470 PolarHBondContact OD2-ND2 2.86Å; N470-Y472 WeakPolarHBondContact OD1-CB 3.15Å; N470-Y472 WeakPolarHBondContact OD1-CD2 3.2Å; N470-Y472 PolarHBondContact OD1-N 2.69Å; N470-Y472 VanDerWaalsContact OD1-N 3.16Å
471	G	66.1	Low	82.7	Confident	19 Å²	19	27.7 Å²	27.7	20%	0.196	16%	0.163	C	C	.	.	S	Bend	trans	76.7	35	177.6	0	0	0	0	0	113.8	K392 D468 S469	K392-G471 PolarHBondContact NZ-O 2.91Å; K392-G471 VanDerWaalsContact NZ-O 3.09Å; D468-G471 WeakPolarHBondContact O-CA 3.46Å; D468-G471 PolarHBondContact O-N 3.02Å; S469-G471 VanDerWaalsContact C-N 3.25Å; S469-G471 PolarHBondContact O-N 2.66Å
472	Y	74.8	Confident	82.5	Confident	81 Å²	81	31 Å²	31	32%	0.318	18%	0.177	S	C	.	.	S	Bend	trans	-135.8	-161.3	164.7	-63.8	-93.3	0	0	0	107.8	A466 D468 N470 K498	A466-Y472 WeakPolarHBondContact CA-O 3.21Å; A466-Y472 WeakPolarHBondContact CB-O 3.17Å; D468-Y472 VanDerWaalsContact CB-O 3.31Å; D468-Y472 WeakPolarHBondContact CB-O 3.32Å; D468-Y472 PolarHBondContact N-O 3.15Å; N470-Y472 WeakPolarHBondContact OD1-CB 3.15Å; N470-Y472 WeakPolarHBondContact OD1-CD2 3.2Å; N470-Y472 PolarHBondContact OD1-N 2.69Å; N470-Y472 VanDerWaalsContact OD1-N 3.16Å; Y472-K498 WeakPolarHBondContact CD1-O 3.42Å
473	S	83.8	Confident	82.5	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	20%	0.2	C	C	.	.			trans	-144.7	162.8	167.6	-75.2	0	0	0	0	108.9	A465 M467 P475 K498 T499 D528	A465-S473 PolarHBondContact O-OG 2.96Å; M467-S473 PolarHBondContact N-OG 3.11Å; S473-P475 WeakPolarHBondContact O-CD 3.42Å; S473-K498 CarbonylContact O-C 3.52Å; S473-K498 WeakPolarHBondContact O-CA 3.39Å; S473-K498 PolarHBondContact O-N 2.96Å; S473-T499 PolarHBondContact O-N 3.18Å; S473-D528 WeakPolarHBondContact CA-OD1 3.34Å; S473-D528 WeakPolarHBondContact CA-OD2 3.27Å; S473-D528 VanDerWaalsContact CB-CG 3.43Å; S473-D528 WeakPolarHBondContact CB-OD1 3.48Å; S473-D528 WeakPolarHBondContact CB-OD2 3.35Å; S473-D528 PolarHBondContact OG-OD2 2.96Å
474	D	87.8	Confident	82	Confident	12 Å²	12	36.4 Å²	36.4	6%	0.064	21%	0.212	C	C	.	.			trans	-102.3	64.4	163.3	-84.1	15.8	0	0	0	109.7	I495 K496 K497 K498 D528 Y529	D474-I495 HydrophobicContact CB-CG2 4.09Å; D474-I495 WeakPolarHBondContact O-CG2 3.39Å; D474-K496 CarbonylContact C-O 3.59Å; D474-K496 WeakPolarHBondContact CA-O 3.19Å; D474-K497 WeakPolarHBondContact OD1-CA 3.42Å; D474-K497 WeakPolarHBondContact OD1-CB 3.45Å; D474-K497 WeakPolarHBondContact OD2-CD 3.35Å; D474-K497 VanDerWaalsContact OD2-CG 3.24Å; D474-K497 WeakPolarHBondContact OD2-CG 3.44Å; D474-K497 IonicContact OD2-NZ 3.45Å; D474-K497 PolarHBondContact OD2-NZ 3.48Å; D474-K498 WeakPolarHBondContact OD1-CG 3.3Å; D474-K498 PolarHBondContact OD1-N 2.91Å; D474-D528 PolarHBondContact N-OD1 2.86Å; D474-Y529 WeakPolarHBondContact O-CB 3.24Å; D474-Y529 PolarHBondContact O-N 3.21Å; D474-Y529 VanDerWaalsContact O-N 3.13Å
475	P	91.4	Very high	81.4	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	145.7	-168.7	27.6	-39.9	0	0	0	115.7	L464 S473 K496 T499 P502 V526 W527 I538	L464-P475 HydrophobicContact CD1-CB 3.55Å; L464-P475 HydrophobicContact CD1-CG 3.82Å; S473-P475 WeakPolarHBondContact O-CD 3.42Å; P475-K496 WeakPolarHBondContact CD-O 3.32Å; P475-K496 PolarHBondContact O-N 3.2Å; P475-T499 VanDerWaalsContact CD-O 3.27Å; P475-T499 WeakPolarHBondContact CD-O 3.11Å; P475-T499 HydrophobicContact CG-CG2 4.14Å; P475-T499 WeakPolarHBondContact CG-O 3.03Å; P475-P502 HydrophobicContact CB-CG 4.16Å; P475-P502 HydrophobicContact CG-CB 3.82Å; P475-P502 HydrophobicContact CG-CG 3.57Å; P475-V526 HydrophobicContact CB-CG1 4.32Å; P475-W527 CarbonylContact C-O 3.6Å; P475-W527 VanDerWaalsContact CA-O 3.28Å; P475-W527 WeakPolarHBondContact CA-O 3.46Å; P475-I538 HydrophobicContact CB-CD1 4.32Å
476	F	94.8	Very high	80.8	Confident	10 Å²	10	41.1 Å²	41.1	4%	0.044	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	159.7	163.7	69.6	-78.5	0	0	0	111	K478 I495 V526 W527 N535	F476-K478 HydrophobicContact CD2-CG 4.41Å; F476-K478 HydrophobicContact CE2-CG 3.87Å; F476-I495 HydrophobicContact CB-CG1 3.82Å; F476-I495 HydrophobicContact CD1-CG1 4.08Å; F476-I495 HydrophobicContact CG-CG1 4.08Å; F476-V526 WeakPolarHBondContact O-CA 3.43Å; F476-W527 HydrophobicContact CD1-CB 4Å; F476-W527 WeakPolarHBondContact CD1-O 3.48Å; F476-W527 HydrophobicContact CD2-CB 4.47Å; F476-W527 HydrophobicContact CE1-CB 3.47Å; F476-W527 VanDerWaalsContact CE1-CB 3.47Å; F476-W527 HydrophobicContact CE2-CB 4Å; F476-W527 HydrophobicContact CE2-CG 4.35Å; F476-W527 HydrophobicContact CG-CB 4.48Å; F476-W527 HydrophobicContact CZ-CB 3.47Å; F476-W527 VanDerWaalsContact CZ-CB 3.47Å; F476-W527 HydrophobicContact CZ-CG 4.07Å; F476-W527 PolarHBondContact N-O 3.4Å; F476-W527 PolarHBondContact O-N 3.06Å; F476-N535 HydrophobicContact CE1-CB 4.36Å; F476-N535 HydrophobicContact CZ-CB 4.38Å
477	V	94.9	Very high	79.8	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	126.1	-178.9	-171.4	0	0	0	0	109.7	I441 V458 I479 K492 T493 F504 V524 S525 V526	I441-V477 HydrophobicContact CD1-CG1 3.96Å; I441-V477 HydrophobicContact CD1-CG2 3.95Å; V458-V477 HydrophobicContact CG1-CB 4.38Å; V458-V477 HydrophobicContact CG1-CG2 3.93Å; V458-V477 HydrophobicContact CG2-CG1 4.31Å; V477-I479 HydrophobicContact CG1-CG1 4.24Å; V477-K492 CarbonylContact O-C 3.57Å; V477-K492 WeakPolarHBondContact O-CA 3.36Å; V477-T493 HydrophobicContact CB-CG2 3.89Å; V477-T493 HydrophobicContact CG2-CG2 4.36Å; V477-T493 PolarHBondContact N-OG1 3.44Å; V477-T493 PolarHBondContact O-N 3.15Å; V477-F504 HydrophobicContact CG2-CD2 4.29Å; V477-F504 HydrophobicContact CG2-CE2 3.7Å; V477-F504 HydrophobicContact CG2-CZ 3.84Å; V477-V524 HydrophobicContact CG1-CG1 3.59Å; V477-S525 CarbonylContact C-O 3.52Å; V477-S525 VanDerWaalsContact CA-O 3.3Å; V477-S525 WeakPolarHBondContact CA-O 3.35Å; V477-S525 WeakPolarHBondContact CG1-O 3.24Å; V477-V526 HydrophobicContact CG2-CG1 4.47Å; V477-V526 HydrophobicContact CG2-CG2 4.16Å
478	K	93.1	Very high	79	Confident	25 Å²	25	54.3 Å²	54.3	11%	0.109	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	130.5	164.2	-61.7	-172.9	-176.6	-172	0	108.5	F476 N491 S525 F580 D582	F476-K478 HydrophobicContact CD2-CG 4.41Å; F476-K478 HydrophobicContact CE2-CG 3.87Å; K478-N491 WeakPolarHBondContact CA-O 3.5Å; K478-S525 PolarHBondContact N-O 3.42Å; K478-S525 PolarHBondContact O-N 2.96Å; K478-S525 PolarHBondContact O-OG 3.15Å; K478-S525 VanDerWaalsContact O-OG 3.12Å; K478-F580 HydrophobicContact CB-CE1 3.98Å; K478-F580 HydrophobicContact CB-CE2 4.21Å; K478-F580 HydrophobicContact CB-CZ 3.61Å; K478-F580 HydrophobicContact CD-CD1 3.98Å; K478-F580 HydrophobicContact CD-CD2 4.09Å; K478-F580 HydrophobicContact CD-CE1 3.92Å; K478-F580 HydrophobicContact CD-CE2 4.03Å; K478-F580 HydrophobicContact CD-CG 4.07Å; K478-F580 HydrophobicContact CD-CZ 3.94Å; K478-F580 HydrophobicContact CG-CZ 4.44Å; K478-D582 IonicContact NZ-OD1 2.73Å; K478-D582 PolarHBondContact NZ-OD1 3.3Å; K478-D582 IonicContact NZ-OD2 2.7Å
479	I	92.9	Very high	79	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	133.9	176.9	-48.2	173.6	0	0	0	108.6	V456 V458 V477 K490 N491 F508 L522 D523	V456-I479 HydrophobicContact CG1-CD1 4.29Å; V458-I479 HydrophobicContact CG2-CD1 3.49Å; V458-I479 VanDerWaalsContact CG2-CD1 3.49Å; V458-I479 HydrophobicContact CG2-CG1 4.2Å; V477-I479 HydrophobicContact CG1-CG1 4.24Å; I479-K490 CarbonylContact O-C 3.55Å; I479-K490 WeakPolarHBondContact O-CA 3.33Å; I479-N491 PolarHBondContact N-O 3.32Å; I479-N491 PolarHBondContact O-N 2.94Å; I479-F508 HydrophobicContact CD1-CD2 3.35Å; I479-F508 HydrophobicContact CD1-CE2 3.66Å; I479-F508 HydrophobicContact CD1-CG 4.09Å; I479-L522 HydrophobicContact CG2-CD1 3.49Å; I479-L522 VanDerWaalsContact CG2-CD1 3.49Å; I479-L522 HydrophobicContact CG2-CG 4.32Å; I479-D523 CarbonylContact C-O 3.52Å; I479-D523 WeakPolarHBondContact CA-O 3.39Å
480	C	90.2	Very high	79.9	Confident	9 Å²	9	51 Å²	51	6%	0.061	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	129.1	178	-169.6	0	0	0	0	111	A489 D523 F580	C480-A489 WeakPolarHBondContact CA-O 3.33Å; C480-D523 HydrophobicContact CB-CB 4.31Å; C480-D523 PolarHBondContact N-O 2.67Å; C480-D523 PolarHBondContact O-N 2.78Å; C480-F580 HydrophobicContact CB-CE1 4.03Å; C480-F580 HydrophobicContact CB-CZ 4.3Å
481	L	88.9	Confident	80.9	Confident	1 Å²	1	50.4 Å²	50.4	1%	0.005	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	112.7	174.3	-169.1	81.9	0	0	0	110.9	L454 A489 Y510 I512 K520 L522 W555	L454-L481 HydrophobicContact CD2-CD1 4.48Å; L481-A489 PolarHBondContact N-O 2.6Å; L481-Y510 HydrophobicContact CB-CD1 4.29Å; L481-Y510 HydrophobicContact CB-CE1 4.16Å; L481-Y510 HydrophobicContact CD2-CD1 4.29Å; L481-Y510 HydrophobicContact CD2-CG 4.32Å; L481-I512 HydrophobicContact CD1-CD1 4.48Å; L481-I512 HydrophobicContact CD2-CD1 3.45Å; L481-I512 VanDerWaalsContact CD2-CD1 3.45Å; L481-I512 HydrophobicContact CD2-CG1 4.05Å; L481-K520 HydrophobicContact CD1-CB 4.07Å; L481-K520 HydrophobicContact CD2-CD 4.24Å; L481-K520 HydrophobicContact CD2-CG 4.23Å; L481-K520 HydrophobicContact CG-CB 4.36Å; L481-K520 HydrophobicContact CG-CD 4.37Å; L481-K520 HydrophobicContact CG-CG 4.44Å; L481-L522 HydrophobicContact CD1-CB 4.32Å; L481-L522 HydrophobicContact CD1-CD1 4.06Å; L481-W555 HydrophobicContact CD1-CH2 4.32Å
482	K	85.3	Confident	82.2	Confident	69 Å²	69	56.4 Å²	56.4	30%	0.3	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	155.9	178	-69.2	178.7	178.9	163.7	0	111.8	K520 T521 D523	K482-K520 CarbonylContact O-C 3.41Å; K482-K520 VanDerWaalsContact O-CA 3.3Å; K482-K520 WeakPolarHBondContact O-CA 3.49Å; K482-K520 WeakPolarHBondContact O-CD 3.4Å; K482-T521 PolarHBondContact N-O 3.41Å; K482-T521 PolarHBondContact O-N 2.76Å; K482-D523 VanDerWaalsContact CD-OD2 3.24Å; K482-D523 WeakPolarHBondContact CD-OD2 3.41Å; K482-D523 WeakPolarHBondContact CE-OD2 3.5Å; K482-D523 IonicContact NZ-OD2 2.91Å; K482-D523 PolarHBondContact NZ-OD2 3.31Å
483	P	79.9	Confident	83.1	Confident	81 Å²	81	53 Å²	53	53%	0.526	26%	0.261	S	S	.	.	S	Bend	cis	-57.5	149.8	-20.1	26.1	-35.3	0	0	0	111.1	K519 K520	P483-K519 WeakPolarHBondContact CD-O 3.4Å; P483-K520 HydrophobicContact CG-CD 4.48Å; P483-K520 PolarHBondContact O-NZ 2.9Å
484	D	67.6	Low	83.5	Confident	103 Å²	103	59 Å²	59	55%	0.551	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-56.9	144.9	-165.7	-168.6	9.2	0	0	0	113.3	G486 A489	D484-G486 WeakPolarHBondContact OD1-CA 3.41Å; D484-G486 PolarHBondContact OD1-N 3.49Å; D484-G486 VanDerWaalsContact OD1-O 3.13Å; D484-A489 WeakPolarHBondContact OD1-CB 3.46Å
485	M	67.6	Low	83.8	Confident	96 Å²	96	61.7 Å²	61.7	47%	0.473	30%	0.302	S	S	.	.			trans	-108.6	17.4	172.5	-62.3	-69.6	-76	0	0	111.2	A489 K520	M485-A489 HydrophobicContact CB-CB 4.28Å; M485-K520 PolarHBondContact SD-NZ 2.71Å
486	G	64.2	Low	83.6	Confident	34 Å²	34	64.1 Å²	64.1	35%	0.351	31%	0.313	S	S	.	.	S	Bend	trans	80.7	-165.8	-172.9	0	0	0	0	0	112.1	D484 K488 A489	D484-G486 WeakPolarHBondContact OD1-CA 3.41Å; D484-G486 PolarHBondContact OD1-N 3.49Å; D484-G486 VanDerWaalsContact OD1-O 3.13Å; G486-K488 PolarHBondContact O-N 3.38Å; G486-A489 WeakPolarHBondContact O-CB 3.43Å; G486-A489 PolarHBondContact O-N 2.88Å
487	K	61.5	Low	83.3	Confident	215 Å²	215	69.3 Å²	69.3	94%	0.935	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-11.1	-169.8	-62.1	-171.4	178.2	-173	0	116.7
488	K	64.8	Low	82.6	Confident	161 Å²	161	75.8 Å²	75.8	70%	0.7	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-9.2	172.6	-66.3	-173.4	177.2	-175.7	0	114.5	G486	G486-K488 PolarHBondContact O-N 3.38Å
489	A	73.9	Confident	81.6	Confident	0 Å²	0	76.3 Å²	76.3	0%	0	37%	0.369	C	S	.	.	S	Bend	trans	-79.2	-31.4	-176.7	0	0	0	0	0	113.7	C480 L481 D484 M485 G486 Y510	C480-A489 WeakPolarHBondContact CA-O 3.33Å; L481-A489 PolarHBondContact N-O 2.6Å; D484-A489 WeakPolarHBondContact OD1-CB 3.46Å; M485-A489 HydrophobicContact CB-CB 4.28Å; G486-A489 WeakPolarHBondContact O-CB 3.43Å; G486-A489 PolarHBondContact O-N 2.88Å; A489-Y510 WeakPolarHBondContact O-CE1 3.32Å; A489-Y510 PolarHBondContact O-OH 3.32Å
490	K	85.7	Confident	81	Confident	92 Å²	92	78.2 Å²	78.2	40%	0.4	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	114.9	175.9	-65.8	179.4	-179	177.4	0	109.8	I479 F580 E581	I479-K490 CarbonylContact O-C 3.55Å; I479-K490 WeakPolarHBondContact O-CA 3.33Å; K490-F580 HydrophobicContact CD-CD1 4.42Å; K490-E581 PolarHBondContact NZ-O 3.5Å
491	N	90.4	Very high	80.7	Confident	50 Å²	50	81.2 Å²	81.2	27%	0.267	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	160.9	171.9	-76.6	-50.6	0	0	0	110.7	K478 I479 F508 Y510	K478-N491 WeakPolarHBondContact CA-O 3.5Å; I479-N491 PolarHBondContact N-O 3.32Å; I479-N491 PolarHBondContact O-N 2.94Å; N491-F508 HydrophobicContact CB-CD1 3.57Å; N491-F508 HydrophobicContact CB-CE1 3.94Å; N491-F508 HydrophobicContact CB-CG 4.07Å; N491-Y510 WeakPolarHBondContact ND2-CE1 3.46Å; N491-Y510 PolarHBondContact ND2-OH 2.95Å
492	K	92.5	Very high	80.7	Confident	146 Å²	146	81.3 Å²	81.3	64%	0.635	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.7	148.4	172.3	67.3	179.2	-177.5	178.9	0	111.8	V477	V477-K492 CarbonylContact O-C 3.57Å; V477-K492 WeakPolarHBondContact O-CA 3.36Å
493	T	94.6	Very high	80.9	Confident	9 Å²	9	83.6 Å²	83.6	6%	0.055	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-77.2	174	174.3	64.4	0	0	0	0	112.4	V458 V477 F504 E506 F508	V458-T493 HydrophobicContact CB-CG2 4.08Å; V458-T493 HydrophobicContact CG1-CG2 4.11Å; V458-T493 HydrophobicContact CG2-CG2 4.2Å; V477-T493 HydrophobicContact CB-CG2 3.89Å; V477-T493 HydrophobicContact CG2-CG2 4.36Å; V477-T493 PolarHBondContact N-OG1 3.44Å; V477-T493 PolarHBondContact O-N 3.15Å; T493-F504 HydrophobicContact CG2-CB 4.37Å; T493-F504 HydrophobicContact CG2-CD1 3.99Å; T493-F504 HydrophobicContact CG2-CG 4.18Å; T493-F504 WeakPolarHBondContact OG1-CD1 3.42Å; T493-F504 VanDerWaalsContact OG1-CE1 3.32Å; T493-F504 WeakPolarHBondContact OG1-CE1 3.33Å; T493-E506 WeakPolarHBondContact CA-OE2 3.37Å; T493-E506 HydrophobicContact CG2-CB 4.42Å; T493-F508 HydrophobicContact CG2-CE2 3.98Å; T493-F508 HydrophobicContact CG2-CZ 4.02Å
494	Q	92.4	Very high	81.5	Confident	125 Å²	125	80.1 Å²	80.1	58%	0.584	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-62.1	157.7	159.5	-59.4	176.6	27.2	0	0	111.3	F504 E506	Q494-F504 VanDerWaalsContact O-CE1 3.31Å; Q494-F504 WeakPolarHBondContact O-CE1 3.48Å; Q494-E506 WeakPolarHBondContact CB-OE1 3.12Å; Q494-E506 PolarHBondContact N-OE1 2.88Å; Q494-E506 VanDerWaalsContact N-OE1 3.12Å; Q494-E506 PolarHBondContact N-OE2 3.05Å
495	I	92.9	Very high	82.7	Confident	69 Å²	69	80.2 Å²	80.2	35%	0.354	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-88.3	124.2	173.7	-65.5	154.7	0	0	0	108.7	D474 F476 K497 Y529	D474-I495 HydrophobicContact CB-CG2 4.09Å; D474-I495 WeakPolarHBondContact O-CG2 3.39Å; F476-I495 HydrophobicContact CB-CG1 3.82Å; F476-I495 HydrophobicContact CD1-CG1 4.08Å; F476-I495 HydrophobicContact CG-CG1 4.08Å; I495-K497 HydrophobicContact CG2-CG 4.41Å; I495-Y529 HydrophobicContact CD1-CD1 3.98Å; I495-Y529 HydrophobicContact CD1-CD2 3.71Å; I495-Y529 HydrophobicContact CD1-CE1 4.41Å; I495-Y529 HydrophobicContact CD1-CE2 4.18Å; I495-Y529 HydrophobicContact CD1-CG 3.61Å; I495-Y529 HydrophobicContact CG1-CG 4.24Å; I495-Y529 HydrophobicContact CG2-CD1 4.22Å; I495-Y529 HydrophobicContact CG2-CG 4.19Å
496	K	88.6	Confident	83.9	Confident	51 Å²	51	77 Å²	77	22%	0.222	37%	0.368	C	S	.	.			trans	-105.6	115.2	-179.9	-56.6	-72.9	170.7	145.3	0	108.3	D474 P475 T499 P502 E503 F504	D474-K496 CarbonylContact C-O 3.59Å; D474-K496 WeakPolarHBondContact CA-O 3.19Å; P475-K496 WeakPolarHBondContact CD-O 3.32Å; P475-K496 PolarHBondContact O-N 3.2Å; K496-T499 HydrophobicContact CB-CG2 4.03Å; K496-P502 HydrophobicContact CB-CB 3.77Å; K496-P502 HydrophobicContact CG-CB 3.97Å; K496-E503 VanDerWaalsContact CE-O 3.25Å; K496-E503 WeakPolarHBondContact CE-O 3.41Å; K496-E503 PolarHBondContact NZ-O 3.1Å; K496-F504 HydrophobicContact CB-CE1 4.34Å; K496-F504 HydrophobicContact CD-CD1 4.36Å; K496-F504 HydrophobicContact CG-CD1 3.68Å; K496-F504 HydrophobicContact CG-CE1 3.44Å; K496-F504 VanDerWaalsContact CG-CE1 3.44Å; K496-F504 HydrophobicContact CG-CZ 4.17Å; K496-F504 PolarHBondContact NZ-O 3.37Å
497	K	87.2	Confident	85.3	Confident	119 Å²	119	80.9 Å²	80.9	52%	0.517	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.5	143.6	-167	-59.6	-165.6	164.3	-94.4	0	114.2	D474 I495 T499	D474-K497 WeakPolarHBondContact OD1-CA 3.42Å; D474-K497 WeakPolarHBondContact OD1-CB 3.45Å; D474-K497 WeakPolarHBondContact OD2-CD 3.35Å; D474-K497 VanDerWaalsContact OD2-CG 3.24Å; D474-K497 WeakPolarHBondContact OD2-CG 3.44Å; D474-K497 IonicContact OD2-NZ 3.45Å; D474-K497 PolarHBondContact OD2-NZ 3.48Å; I495-K497 HydrophobicContact CG2-CG 4.41Å; K497-T499 PolarHBondContact O-N 3.26Å
498	K	80.5	Confident	86.8	Confident	136 Å²	136	71.9 Å²	71.9	59%	0.591	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	48.9	171.7	-61.2	-179.5	179.7	175.6	0	114	Y472 S473 D474	Y472-K498 WeakPolarHBondContact CD1-O 3.42Å; S473-K498 CarbonylContact O-C 3.52Å; S473-K498 WeakPolarHBondContact O-CA 3.39Å; S473-K498 PolarHBondContact O-N 2.96Å; D474-K498 WeakPolarHBondContact OD1-CG 3.3Å; D474-K498 PolarHBondContact OD1-N 2.91Å
499	T	72.8	Confident	88.1	Confident	36 Å²	36	67.8 Å²	67.8	22%	0.221	33%	0.329	C	S	.	.			trans	-141.1	143	179.5	-177.1	0	0	0	0	112.2	S473 P475 K496 K497 N501 P502	S473-T499 PolarHBondContact O-N 3.18Å; P475-T499 VanDerWaalsContact CD-O 3.27Å; P475-T499 WeakPolarHBondContact CD-O 3.11Å; P475-T499 HydrophobicContact CG-CG2 4.14Å; P475-T499 WeakPolarHBondContact CG-O 3.03Å; K496-T499 HydrophobicContact CB-CG2 4.03Å; K497-T499 PolarHBondContact O-N 3.26Å; T499-N501 VanDerWaalsContact OG1-C 3.3Å; T499-N501 PolarHBondContact OG1-N 3.21Å; T499-N501 PolarHBondContact OG1-O 2.91Å; T499-P502 HydrophobicContact CG2-CB 3.8Å
500	L	80	Confident	88.8	Confident	40 Å²	40	68.3 Å²	68.3	21%	0.209	33%	0.331	C	S	.	.	S	Bend	trans	-103.3	0.3	170.4	-55.8	-179.8	0	0	0	112.2	H463 L464 A466 P502	H463-L500 PolarHBondContact N-O 3.33Å; L464-L500 HydrophobicContact CB-CB 4.36Å; L464-L500 HydrophobicContact CB-CD2 4.35Å; L464-L500 PolarHBondContact N-O 3.34Å; L464-L500 WeakPolarHBondContact O-CD2 3.19Å; A466-L500 HydrophobicContact CB-CD1 4.11Å; A466-L500 HydrophobicContact CB-CD2 3.94Å; L500-P502 VanDerWaalsContact C-CD 3.46Å
501	N	84.5	Confident	89	Confident	73 Å²	73	70 Å²	70	39%	0.39	34%	0.341	S	S	.	.	S	Bend	trans	-132.5	64.2	175.9	-54.2	-73	0	0	0	109	C461 A462 H463 T499	C461-N501 CarbonylContact O-C 3.6Å; C461-N501 WeakPolarHBondContact O-CA 3.29Å; A462-N501 VanDerWaalsContact CA-OD1 3.29Å; A462-N501 WeakPolarHBondContact CA-OD1 3.44Å; H463-N501 PolarHBondContact N-OD1 2.84Å; T499-N501 VanDerWaalsContact OG1-C 3.3Å; T499-N501 PolarHBondContact OG1-N 3.21Å; T499-N501 PolarHBondContact OG1-O 2.91Å
502	P	87.1	Confident	88.9	Confident	2 Å²	2	67.8 Å²	67.8	1%	0.013	33%	0.329	C	S	.	.			trans	-70.2	132.8	179.4	30	-37.6	0	0	0	111.8	R460 C461 L464 P475 K496 T499 L500 F504	R460-P502 CarbonylContact C-O 3.57Å; R460-P502 WeakPolarHBondContact CA-O 3.48Å; R460-P502 VanDerWaalsContact CB-O 3.29Å; R460-P502 WeakPolarHBondContact CB-O 3.45Å; C461-P502 HydrophobicContact CB-CG 3.75Å; C461-P502 PolarHBondContact N-O 2.87Å; L464-P502 HydrophobicContact CD1-CG 3.78Å; P475-P502 HydrophobicContact CB-CG 4.16Å; P475-P502 HydrophobicContact CG-CB 3.82Å; P475-P502 HydrophobicContact CG-CG 3.57Å; K496-P502 HydrophobicContact CB-CB 3.77Å; K496-P502 HydrophobicContact CG-CB 3.97Å; T499-P502 HydrophobicContact CG2-CB 3.8Å; L500-P502 VanDerWaalsContact C-CD 3.46Å; P502-F504 HydrophobicContact CB-CD2 4.33Å; P502-F504 HydrophobicContact CB-CE1 4.3Å; P502-F504 HydrophobicContact CB-CE2 3.64Å; P502-F504 HydrophobicContact CB-CZ 3.61Å; P502-F504 HydrophobicContact CG-CD2 4.45Å; P502-F504 HydrophobicContact CG-CE2 3.48Å; P502-F504 VanDerWaalsContact CG-CE2 3.48Å; P502-F504 HydrophobicContact CG-CZ 3.68Å
503	E	90.9	Very high	88.7	Confident	117 Å²	117	66.9 Å²	66.9	55%	0.547	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	119	165.7	-59.3	-170.1	162.1	0	0	109	R460 K496	R460-E503 HydrophobicContact CB-CB 4.33Å; R460-E503 HydrophobicContact CB-CG 3.94Å; K496-E503 VanDerWaalsContact CE-O 3.25Å; K496-E503 WeakPolarHBondContact CE-O 3.41Å; K496-E503 PolarHBondContact NZ-O 3.1Å
504	F	91.8	Very high	88.3	Confident	9 Å²	9	69.2 Å²	69.2	4%	0.039	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-58.3	-179.9	-61.1	-81.2	0	0	0	109.4	V458 V459 V477 T493 Q494 K496 P502 E506	V458-F504 HydrophobicContact CB-CB 4.46Å; V458-F504 HydrophobicContact CG1-CB 3.98Å; V458-F504 HydrophobicContact CG1-CD2 3.59Å; V458-F504 HydrophobicContact CG1-CE2 4.33Å; V458-F504 HydrophobicContact CG1-CG 3.97Å; V458-F504 WeakPolarHBondContact O-CB 3.24Å; V459-F504 PolarHBondContact O-N 2.99Å; V477-F504 HydrophobicContact CG2-CD2 4.29Å; V477-F504 HydrophobicContact CG2-CE2 3.7Å; V477-F504 HydrophobicContact CG2-CZ 3.84Å; T493-F504 HydrophobicContact CG2-CB 4.37Å; T493-F504 HydrophobicContact CG2-CD1 3.99Å; T493-F504 HydrophobicContact CG2-CG 4.18Å; T493-F504 WeakPolarHBondContact OG1-CD1 3.42Å; T493-F504 VanDerWaalsContact OG1-CE1 3.32Å; T493-F504 WeakPolarHBondContact OG1-CE1 3.33Å; Q494-F504 VanDerWaalsContact O-CE1 3.31Å; Q494-F504 WeakPolarHBondContact O-CE1 3.48Å; K496-F504 HydrophobicContact CB-CE1 4.34Å; K496-F504 HydrophobicContact CD-CD1 4.36Å; K496-F504 HydrophobicContact CG-CD1 3.68Å; K496-F504 HydrophobicContact CG-CE1 3.44Å; K496-F504 VanDerWaalsContact CG-CE1 3.44Å; K496-F504 HydrophobicContact CG-CZ 4.17Å; K496-F504 PolarHBondContact NZ-O 3.37Å; P502-F504 HydrophobicContact CB-CD2 4.33Å; P502-F504 HydrophobicContact CB-CE1 4.3Å; P502-F504 HydrophobicContact CB-CE2 3.64Å; P502-F504 HydrophobicContact CB-CZ 3.61Å; P502-F504 HydrophobicContact CG-CD2 4.45Å; P502-F504 HydrophobicContact CG-CE2 3.48Å; P502-F504 VanDerWaalsContact CG-CE2 3.48Å; P502-F504 HydrophobicContact CG-CZ 3.68Å; F504-E506 VanDerWaalsContact C-N 3.27Å; F504-E506 HydrophobicContact CB-CB 4.47Å; F504-E506 HydrophobicContact CB-CG 4.29Å
505	N	92.1	Very high	87.9	Confident	105 Å²	105	67.2 Å²	67.2	56%	0.561	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	54.2	43.5	-172.4	-56.7	-50.2	0	0	0	111.9	V458 V459	V458-N505 WeakPolarHBondContact O-CA 3.26Å; V458-N505 PolarHBondContact O-N 3.43Å; V459-N505 WeakPolarHBondContact CG1-OD1 3.44Å; V459-N505 PolarHBondContact O-N 2.76Å; V459-N505 PolarHBondContact O-OD1 2.94Å
506	E	93.1	Very high	87.6	Confident	29 Å²	29	67.2 Å²	67.2	14%	0.136	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	126.2	-176.3	-68.2	174.7	-123.1	0	0	109.8	V458 T493 Q494 F504 F508	V458-E506 PolarHBondContact N-O 2.9Å; V458-E506 PolarHBondContact O-N 3.49Å; V458-E506 VanDerWaalsContact O-N 3.07Å; T493-E506 WeakPolarHBondContact CA-OE2 3.37Å; T493-E506 HydrophobicContact CG2-CB 4.42Å; Q494-E506 WeakPolarHBondContact CB-OE1 3.12Å; Q494-E506 PolarHBondContact N-OE1 2.88Å; Q494-E506 VanDerWaalsContact N-OE1 3.12Å; Q494-E506 PolarHBondContact N-OE2 3.05Å; F504-E506 VanDerWaalsContact C-N 3.27Å; F504-E506 HydrophobicContact CB-CB 4.47Å; F504-E506 HydrophobicContact CB-CG 4.29Å; E506-F508 HydrophobicContact CB-CE2 3.91Å; E506-F508 HydrophobicContact CB-CZ 4.01Å
507	E	94.1	Very high	87.4	Confident	114 Å²	114	64.8 Å²	64.8	53%	0.533	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	135.4	-178.8	-61.7	-166.3	161.6	0	0	112.1	V455 K565	V455-E507 HydrophobicContact CG1-CB 3.97Å; V455-E507 HydrophobicContact CG1-CG 4.48Å; E507-K565 WeakPolarHBondContact OE1-CE 3.12Å; E507-K565 IonicContact OE1-NZ 2.71Å; E507-K565 PolarHBondContact OE1-NZ 2.97Å
508	F	92.9	Very high	87.2	Confident	27 Å²	27	61.2 Å²	61.2	12%	0.118	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	122.9	-175.7	-57.8	-84.5	0	0	0	110.6	V456 V458 I479 N491 T493 E506 Y510	V456-F508 PolarHBondContact N-O 3.29Å; V456-F508 PolarHBondContact O-N 3.49Å; V458-F508 HydrophobicContact CG2-CE2 4.31Å; I479-F508 HydrophobicContact CD1-CD2 3.35Å; I479-F508 HydrophobicContact CD1-CE2 3.66Å; I479-F508 HydrophobicContact CD1-CG 4.09Å; N491-F508 HydrophobicContact CB-CD1 3.57Å; N491-F508 HydrophobicContact CB-CE1 3.94Å; N491-F508 HydrophobicContact CB-CG 4.07Å; T493-F508 HydrophobicContact CG2-CE2 3.98Å; T493-F508 HydrophobicContact CG2-CZ 4.02Å; E506-F508 HydrophobicContact CB-CE2 3.91Å; E506-F508 HydrophobicContact CB-CZ 4.01Å; F508-Y510 HydrophobicContact CB-CE2 4.24Å
509	S	91.3	Very high	87.5	Confident	74 Å²	74	62.7 Å²	62.7	52%	0.517	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	127.6	-178	62.9	0	0	0	0	112.9	L454	L454-S509 CarbonylContact O-C 3.5Å; L454-S509 WeakPolarHBondContact O-CA 3.43Å
510	Y	90.1	Very high	88.2	Confident	11 Å²	11	61.7 Å²	61.7	4%	0.043	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	122.5	175.5	-61.8	-83.9	0	0	0	110.4	R453 L454 V456 L481 A489 N491 F508 I512	R453-Y510 CarbonylContact C-O 3.41Å; R453-Y510 WeakPolarHBondContact CA-O 3.22Å; R453-Y510 VanDerWaalsContact CB-O 3.3Å; R453-Y510 WeakPolarHBondContact CB-O 3.42Å; L454-Y510 PolarHBondContact N-O 2.67Å; L454-Y510 PolarHBondContact O-N 3.43Å; V456-Y510 HydrophobicContact CB-CE2 4.33Å; V456-Y510 HydrophobicContact CG2-CD2 3.99Å; V456-Y510 HydrophobicContact CG2-CE2 3.91Å; L481-Y510 HydrophobicContact CB-CD1 4.29Å; L481-Y510 HydrophobicContact CB-CE1 4.16Å; L481-Y510 HydrophobicContact CD2-CD1 4.29Å; L481-Y510 HydrophobicContact CD2-CG 4.32Å; A489-Y510 WeakPolarHBondContact O-CE1 3.32Å; A489-Y510 PolarHBondContact O-OH 3.32Å; N491-Y510 WeakPolarHBondContact ND2-CE1 3.46Å; N491-Y510 PolarHBondContact ND2-OH 2.95Å; F508-Y510 HydrophobicContact CB-CE2 4.24Å; Y510-I512 PolarHBondContact O-N 3.38Å
511	E	89.8	Confident	88.7	Confident	128 Å²	128	60.8 Å²	60.8	60%	0.598	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.5	109.8	175.2	-68	166.9	176.6	0	0	109.6
512	I	88.4	Confident	89	Confident	4 Å²	4	57.3 Å²	57.3	2%	0.021	30%	0.297	C	S	.	.			trans	-150.2	136.6	-174	-42.8	162.8	0	0	0	108.5	Y447 S452 L454 L481 Y510 E516 L517 K520	Y447-I512 WeakPolarHBondContact CE2-O 3.34Å; Y447-I512 PolarHBondContact OH-O 3.08Å; S452-I512 CarbonylContact C-O 3.52Å; S452-I512 VanDerWaalsContact C-O 3.3Å; S452-I512 PolarHBondContact O-N 3.31Å; L454-I512 HydrophobicContact CB-CD1 3.76Å; L454-I512 HydrophobicContact CD2-CD1 4.2Å; L481-I512 HydrophobicContact CD1-CD1 4.48Å; L481-I512 HydrophobicContact CD2-CD1 3.45Å; L481-I512 VanDerWaalsContact CD2-CD1 3.45Å; L481-I512 HydrophobicContact CD2-CG1 4.05Å; Y510-I512 PolarHBondContact O-N 3.38Å; I512-E516 HydrophobicContact CG2-CB 3.97Å; I512-L517 HydrophobicContact CD1-CD1 4.07Å; I512-K520 HydrophobicContact CG2-CG 4.32Å
513	K	87.9	Confident	89.2	Confident	127 Å²	127	57.2 Å²	57.2	55%	0.552	30%	0.296	S	S	*	.			trans	-76.4	144.8	171.4	-53.6	-168.7	-158.9	99.4	0	111	A515 E516 L517	K513-A515 PolarHBondContact O-N 2.94Å; K513-A515 VanDerWaalsContact O-N 3.13Å; K513-E516 HydrophobicContact CB-CG 4.26Å; K513-E516 WeakPolarHBondContact CD-OE1 3.47Å; K513-E516 IonicContact NZ-OE1 3.13Å; K513-E516 PolarHBondContact NZ-OE1 3.14Å; K513-E516 WeakPolarHBondContact O-CA 3.5Å; K513-E516 WeakPolarHBondContact O-CB 3.4Å; K513-E516 PolarHBondContact O-N 3.16Å; K513-L517 PolarHBondContact O-N 3.18Å; K513-L517 VanDerWaalsContact O-N 3.13Å
514	H	85.4	Confident	89.3	Confident	57 Å²	57	51.6 Å²	51.6	26%	0.264	27%	0.27	S	S	.	.	H	α-helix	trans	-50.4	-41.1	179.1	-172.7	-115.1	0	0	0	113.5	Y447 E516 L517 L559 K562	Y447-H514 AromaticContact CD1-CD2 3.86Å; Y447-H514 HydrophobicContact CE1-CB 3.79Å; Y447-H514 AromaticContact CE1-CD2 3.85Å; Y447-H514 HydrophobicContact CE2-CB 4.44Å; Y447-H514 PolarHBondContact OH-N 3.48Å; H514-E516 VanDerWaalsContact C-N 3.28Å; H514-E516 PolarHBondContact O-N 2.86Å; H514-L517 WeakPolarHBondContact O-CB 3.29Å; H514-L517 PolarHBondContact O-N 3.42Å; H514-L559 PolarHBondContact NE2-O 3.49Å; H514-K562 WeakPolarHBondContact CE1-CE 3.34Å; H514-K562 WeakPolarHBondContact ND1-CE 3.38Å; H514-K562 WeakPolarHBondContact NE2-CE 3.46Å
515	A	84.8	Confident	89.3	Confident	83 Å²	83	51.2 Å²	51.2	69%	0.686	27%	0.268	S	S	*	.	H	α-helix	trans	-70.1	-17.9	177.2	0	0	0	0	0	114.8	K513	K513-A515 PolarHBondContact O-N 2.94Å; K513-A515 VanDerWaalsContact O-N 3.13Å
516	E	85.4	Confident	89.4	Confident	69 Å²	69	46.2 Å²	46.2	32%	0.322	24%	0.241	S	C	.	.	H	α-helix	trans	-92.3	-26.3	176.7	-65.6	166.3	-155.6	0	0	111.4	I512 K513 H514 A518 K519 K520	I512-E516 HydrophobicContact CG2-CB 3.97Å; K513-E516 HydrophobicContact CB-CG 4.26Å; K513-E516 WeakPolarHBondContact CD-OE1 3.47Å; K513-E516 IonicContact NZ-OE1 3.13Å; K513-E516 PolarHBondContact NZ-OE1 3.14Å; K513-E516 WeakPolarHBondContact O-CA 3.5Å; K513-E516 WeakPolarHBondContact O-CB 3.4Å; K513-E516 PolarHBondContact O-N 3.16Å; H514-E516 VanDerWaalsContact C-N 3.28Å; H514-E516 PolarHBondContact O-N 2.86Å; E516-A518 PolarHBondContact O-N 2.86Å; E516-K519 WeakPolarHBondContact O-CA 3.42Å; E516-K519 WeakPolarHBondContact O-CB 3.27Å; E516-K519 PolarHBondContact O-N 3.25Å; E516-K520 PolarHBondContact O-N 2.92Å
517	L	84.3	Confident	89.4	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.005	24%	0.241	C	C	.	.	H	α-helix	trans	-58.2	-33.1	179.5	-174.2	64.3	0	0	0	112.9	Y447 L454 I512 K513 H514 K519 K520 W555 L559	Y447-L517 HydrophobicContact CD2-CD2 3.81Å; Y447-L517 HydrophobicContact CG-CD2 4.26Å; L454-L517 HydrophobicContact CB-CD1 4.46Å; L454-L517 HydrophobicContact CD1-CD1 4.34Å; L454-L517 HydrophobicContact CD1-CD2 4.46Å; L454-L517 HydrophobicContact CD2-CD1 3.97Å; I512-L517 HydrophobicContact CD1-CD1 4.07Å; K513-L517 PolarHBondContact O-N 3.18Å; K513-L517 VanDerWaalsContact O-N 3.13Å; H514-L517 WeakPolarHBondContact O-CB 3.29Å; H514-L517 PolarHBondContact O-N 3.42Å; L517-K519 PolarHBondContact O-N 3Å; L517-K520 PolarHBondContact O-N 3.31Å; L517-K520 VanDerWaalsContact O-N 3.08Å; L517-W555 HydrophobicContact CD1-CH2 3.66Å; L517-W555 HydrophobicContact CD1-CZ2 3.48Å; L517-W555 VanDerWaalsContact CD1-CZ2 3.48Å; L517-W555 HydrophobicContact CG-CZ2 4.02Å; L517-L559 HydrophobicContact CB-CD2 3.99Å; L517-L559 HydrophobicContact CD2-CD2 3.78Å; L517-L559 HydrophobicContact CD2-CG 4.22Å; L517-L559 HydrophobicContact CG-CD2 3.85Å; L517-L559 HydrophobicContact CG-CG 4.42Å
518	A	84.9	Confident	89.2	Confident	43 Å²	43	41 Å²	41	36%	0.355	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-18.6	173.4	0	0	0	0	0	114.1	E516 I545 L559	E516-A518 PolarHBondContact O-N 2.86Å; A518-I545 HydrophobicContact CB-CD1 3.74Å; A518-I545 WeakPolarHBondContact O-CD1 3.42Å; A518-L559 HydrophobicContact CB-CD2 4.48Å
519	K	86	Confident	89	Confident	167 Å²	167	43.7 Å²	43.7	73%	0.726	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.5	5.6	176	-58.7	177.8	-176.1	178.6	0	112.7	P483 E516 L517	P483-K519 WeakPolarHBondContact CD-O 3.4Å; E516-K519 WeakPolarHBondContact O-CA 3.42Å; E516-K519 WeakPolarHBondContact O-CB 3.27Å; E516-K519 PolarHBondContact O-N 3.25Å; L517-K519 PolarHBondContact O-N 3Å
520	K	88.1	Confident	88.5	Confident	16 Å²	16	40.9 Å²	40.9	7%	0.07	21%	0.205	C	C	.	.			trans	-102.6	153.2	177.4	-64.8	-56	-165.5	-178.2	0	111.3	L481 K482 P483 M485 I512 E516 L517 W555	L481-K520 HydrophobicContact CD1-CB 4.07Å; L481-K520 HydrophobicContact CD2-CD 4.24Å; L481-K520 HydrophobicContact CD2-CG 4.23Å; L481-K520 HydrophobicContact CG-CB 4.36Å; L481-K520 HydrophobicContact CG-CD 4.37Å; L481-K520 HydrophobicContact CG-CG 4.44Å; K482-K520 CarbonylContact O-C 3.41Å; K482-K520 VanDerWaalsContact O-CA 3.3Å; K482-K520 WeakPolarHBondContact O-CA 3.49Å; K482-K520 WeakPolarHBondContact O-CD 3.4Å; P483-K520 HydrophobicContact CG-CD 4.48Å; P483-K520 PolarHBondContact O-NZ 2.9Å; M485-K520 PolarHBondContact SD-NZ 2.71Å; I512-K520 HydrophobicContact CG2-CG 4.32Å; E516-K520 PolarHBondContact O-N 2.92Å; L517-K520 PolarHBondContact O-N 3.31Å; L517-K520 VanDerWaalsContact O-N 3.08Å; K520-W555 HydrophobicContact CB-CZ2 4.14Å; K520-W555 WeakPolarHBondContact O-CZ2 3.44Å
521	T	90.2	Very high	87.9	Confident	20 Å²	20	47.8 Å²	47.8	12%	0.123	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	130.6	176	-60.7	0	0	0	0	107.6	K482 Q542 L543	K482-T521 PolarHBondContact N-O 3.41Å; K482-T521 PolarHBondContact O-N 2.76Å; T521-Q542 HydrophobicContact CG2-CG 3.3Å; T521-L543 CarbonylContact C-O 3.56Å; T521-L543 WeakPolarHBondContact CA-O 3.46Å
522	L	91.3	Very high	86.8	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	109.4	179.7	-178.1	73.4	0	0	0	109	L445 V456 I479 L481 V524 L543 W555	L445-L522 HydrophobicContact CD2-CD2 3.76Å; V456-L522 HydrophobicContact CG1-CD1 4.49Å; V456-L522 HydrophobicContact CG1-CD2 3.79Å; V456-L522 HydrophobicContact CG2-CD1 4.08Å; V456-L522 HydrophobicContact CG2-CD2 3.92Å; I479-L522 HydrophobicContact CG2-CD1 3.49Å; I479-L522 VanDerWaalsContact CG2-CD1 3.49Å; I479-L522 HydrophobicContact CG2-CG 4.32Å; L481-L522 HydrophobicContact CD1-CB 4.32Å; L481-L522 HydrophobicContact CD1-CD1 4.06Å; L522-V524 HydrophobicContact CD2-CG2 4.27Å; L522-V524 HydrophobicContact CG-CG2 4.13Å; L522-L543 HydrophobicContact CB-CB 4.36Å; L522-L543 PolarHBondContact N-O 3.41Å; L522-L543 PolarHBondContact O-N 2.95Å; L522-W555 HydrophobicContact CB-CE3 4.49Å; L522-W555 HydrophobicContact CB-CH2 4.03Å; L522-W555 HydrophobicContact CB-CZ3 3.65Å; L522-W555 HydrophobicContact CD2-CZ3 4.18Å
523	D	90.9	Very high	86.1	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	128.3	171.5	-70.5	-11.1	0	0	0	109.4	I479 C480 K482 Q542 V578	I479-D523 CarbonylContact C-O 3.52Å; I479-D523 WeakPolarHBondContact CA-O 3.39Å; C480-D523 HydrophobicContact CB-CB 4.31Å; C480-D523 PolarHBondContact N-O 2.67Å; C480-D523 PolarHBondContact O-N 2.78Å; K482-D523 VanDerWaalsContact CD-OD2 3.24Å; K482-D523 WeakPolarHBondContact CD-OD2 3.41Å; K482-D523 WeakPolarHBondContact CE-OD2 3.5Å; K482-D523 IonicContact NZ-OD2 2.91Å; K482-D523 PolarHBondContact NZ-OD2 3.31Å; D523-Q542 WeakPolarHBondContact OD1-CG 3.35Å; D523-Q542 PolarHBondContact OD1-NE2 3.48Å; D523-V578 HydrophobicContact CB-CG1 4Å; D523-V578 HydrophobicContact CB-CG2 3.92Å
524	V	92.9	Very high	85.7	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.7	175.6	-175.1	0	0	0	0	108.3	I441 I443 V477 L522 G540 C541 L543	I441-V524 HydrophobicContact CD1-CG1 3.84Å; I443-V524 HydrophobicContact CD1-CG1 4.09Å; I443-V524 HydrophobicContact CD1-CG2 4.48Å; V477-V524 HydrophobicContact CG1-CG1 3.59Å; L522-V524 HydrophobicContact CD2-CG2 4.27Å; L522-V524 HydrophobicContact CG-CG2 4.13Å; V524-G540 CarbonylContact O-C 3.59Å; V524-G540 WeakPolarHBondContact O-CA 3.28Å; V524-C541 PolarHBondContact N-O 3.02Å; V524-C541 PolarHBondContact O-N 3.38Å; V524-L543 HydrophobicContact CG2-CD1 4.09Å
525	S	92.1	Very high	85.7	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	137.7	-178	58	0	0	0	0	111.4	V477 K478 W527 F580	V477-S525 CarbonylContact C-O 3.52Å; V477-S525 VanDerWaalsContact CA-O 3.3Å; V477-S525 WeakPolarHBondContact CA-O 3.35Å; V477-S525 WeakPolarHBondContact CG1-O 3.24Å; K478-S525 PolarHBondContact N-O 3.42Å; K478-S525 PolarHBondContact O-N 2.96Å; K478-S525 PolarHBondContact O-OG 3.15Å; K478-S525 VanDerWaalsContact O-OG 3.12Å; S525-W527 PolarHBondContact OG-NE1 3Å; S525-F580 VanDerWaalsContact OG-CE2 3.22Å; S525-F580 WeakPolarHBondContact OG-CE2 3.33Å; S525-F580 WeakPolarHBondContact OG-CZ 3.4Å
526	V	93.4	Very high	85.7	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	131.4	-178	-168.3	0	0	0	0	108.9	I441 L464 P475 F476 V477 I538 G539 L572	I441-V526 HydrophobicContact CD1-CG2 3.97Å; L464-V526 HydrophobicContact CD1-CG1 3.99Å; L464-V526 HydrophobicContact CD2-CG1 4.14Å; P475-V526 HydrophobicContact CB-CG1 4.32Å; F476-V526 WeakPolarHBondContact O-CA 3.43Å; V477-V526 HydrophobicContact CG2-CG1 4.47Å; V477-V526 HydrophobicContact CG2-CG2 4.16Å; V526-I538 HydrophobicContact CB-CB 4.44Å; V526-I538 HydrophobicContact CG1-CB 4.46Å; V526-I538 HydrophobicContact CG1-CD1 4.29Å; V526-I538 WeakPolarHBondContact O-CB 3.44Å; V526-I538 PolarHBondContact O-N 3.17Å; V526-G539 PolarHBondContact N-O 3.43Å; V526-G539 PolarHBondContact O-N 2.87Å; V526-L572 HydrophobicContact CB-CD1 4.09Å; V526-L572 HydrophobicContact CG2-CD1 3.67Å; V526-L572 HydrophobicContact CG2-CD2 3.74Å; V526-L572 HydrophobicContact CG2-CG 4.38Å
527	W	92.6	Very high	85.8	Confident	32 Å²	32	48.1 Å²	48.1	12%	0.121	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	145.2	-171.2	-64.6	80.4	0	0	0	109.8	P475 F476 S525 N535 D536 F537 F580	P475-W527 CarbonylContact C-O 3.6Å; P475-W527 VanDerWaalsContact CA-O 3.28Å; P475-W527 WeakPolarHBondContact CA-O 3.46Å; F476-W527 HydrophobicContact CD1-CB 4Å; F476-W527 WeakPolarHBondContact CD1-O 3.48Å; F476-W527 HydrophobicContact CD2-CB 4.47Å; F476-W527 HydrophobicContact CE1-CB 3.47Å; F476-W527 VanDerWaalsContact CE1-CB 3.47Å; F476-W527 HydrophobicContact CE2-CB 4Å; F476-W527 HydrophobicContact CE2-CG 4.35Å; F476-W527 HydrophobicContact CG-CB 4.48Å; F476-W527 HydrophobicContact CZ-CB 3.47Å; F476-W527 VanDerWaalsContact CZ-CB 3.47Å; F476-W527 HydrophobicContact CZ-CG 4.07Å; F476-W527 PolarHBondContact N-O 3.4Å; F476-W527 PolarHBondContact O-N 3.06Å; S525-W527 PolarHBondContact OG-NE1 3Å; W527-N535 HydrophobicContact CE3-CB 4.21Å; W527-D536 CarbonylContact C-O 3.59Å; W527-D536 WeakPolarHBondContact CA-O 3.34Å; W527-F537 HydrophobicContact CD2-CD2 4.19Å; W527-F537 AromaticContact CE2-CD2 3.81Å; W527-F537 HydrophobicContact CE3-CB 4.1Å; W527-F537 HydrophobicContact CE3-CD2 4.43Å; W527-F537 HydrophobicContact CH2-CB 4.26Å; W527-F537 HydrophobicContact CH2-CD2 4.03Å; W527-F537 AromaticContact CZ2-CD2 3.74Å; W527-F537 HydrophobicContact CZ2-CD2 3.74Å; W527-F537 HydrophobicContact CZ2-CE2 4.39Å; W527-F537 HydrophobicContact CZ3-CB 3.92Å; W527-F537 HydrophobicContact CZ3-CD2 4.37Å; W527-F580 AromaticContact CZ2-CD2 3.96Å; W527-F580 HydrophobicContact CZ2-CD2 3.96Å; W527-F580 HydrophobicContact CZ2-CE2 4.3Å
528	D	89.7	Confident	85.8	Confident	1 Å²	1	48 Å²	48	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	142.4	169.4	-151.5	-19.3	0	0	0	109.8	M467 S473 D474 N535 D536 I538	M467-D528 HydrophobicContact CB-CB 4.27Å; M467-D528 WeakPolarHBondContact CB-OD2 3.29Å; M467-D528 HydrophobicContact CG-CB 4.14Å; S473-D528 WeakPolarHBondContact CA-OD1 3.34Å; S473-D528 WeakPolarHBondContact CA-OD2 3.27Å; S473-D528 VanDerWaalsContact CB-CG 3.43Å; S473-D528 WeakPolarHBondContact CB-OD1 3.48Å; S473-D528 WeakPolarHBondContact CB-OD2 3.35Å; S473-D528 PolarHBondContact OG-OD2 2.96Å; D474-D528 PolarHBondContact N-OD1 2.86Å; D528-N535 VanDerWaalsContact O-CA 3.31Å; D528-N535 WeakPolarHBondContact O-CA 3.4Å; D528-N535 WeakPolarHBondContact O-CB 3.41Å; D528-D536 HydrophobicContact CB-CB 4.23Å; D528-D536 PolarHBondContact N-O 2.98Å; D528-D536 PolarHBondContact O-N 2.86Å; D528-I538 HydrophobicContact CB-CD1 4.06Å; D528-I538 HydrophobicContact CB-CG1 4.18Å
529	Y	89.4	Confident	86	Confident	84 Å²	84	46 Å²	46	33%	0.329	25%	0.245	S	C	.	.			trans	-102.7	97.9	-179	177.9	-100.8	0	0	0	112.3	D474 I495 N535	D474-Y529 WeakPolarHBondContact O-CB 3.24Å; D474-Y529 PolarHBondContact O-N 3.21Å; D474-Y529 VanDerWaalsContact O-N 3.13Å; I495-Y529 HydrophobicContact CD1-CD1 3.98Å; I495-Y529 HydrophobicContact CD1-CD2 3.71Å; I495-Y529 HydrophobicContact CD1-CE1 4.41Å; I495-Y529 HydrophobicContact CD1-CE2 4.18Å; I495-Y529 HydrophobicContact CD1-CG 3.61Å; I495-Y529 HydrophobicContact CG1-CG 4.24Å; I495-Y529 HydrophobicContact CG2-CD1 4.22Å; I495-Y529 HydrophobicContact CG2-CG 4.19Å; Y529-N535 VanDerWaalsContact CD2-OD1 3.28Å; Y529-N535 WeakPolarHBondContact CD2-OD1 3.44Å
530	D	81.3	Confident	86.2	Confident	16 Å²	16	38.4 Å²	38.4	9%	0.086	21%	0.214	C	C	.	.			trans	-81.8	120.3	176.2	-95.8	-93.9	0	0	0	112.7	G532 K533	D530-G532 PolarHBondContact O-N 3.41Å; D530-K533 HydrophobicContact CB-CB 3.82Å; D530-K533 HydrophobicContact CB-CG 4.24Å; D530-K533 WeakPolarHBondContact OD1-CD 3.34Å; D530-K533 WeakPolarHBondContact OD1-CE 3.43Å; D530-K533 IonicContact OD1-NZ 3.13Å; D530-K533 PolarHBondContact OD1-NZ 3.38Å
531	M	77	Confident	86.3	Confident	155 Å²	155	38.3 Å²	38.3	76%	0.764	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.8	95.4	170.9	-175.5	173.1	-73.1	0	0	110.5
532	G	66.3	Low	86.4	Confident	80 Å²	80	40.8 Å²	40.8	83%	0.825	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	98.8	14.8	175.2	0	0	0	0	0	115.4	D530	D530-G532 PolarHBondContact O-N 3.41Å
533	K	73.8	Confident	86.3	Confident	147 Å²	147	40.8 Å²	40.8	64%	0.639	23%	0.225	S	C	*	.	S	Bend	trans	-130.5	-175.3	167.3	-42.3	-171.5	-156.1	118.6	0	110.7	D530	D530-K533 HydrophobicContact CB-CB 3.82Å; D530-K533 HydrophobicContact CB-CG 4.24Å; D530-K533 WeakPolarHBondContact OD1-CD 3.34Å; D530-K533 WeakPolarHBondContact OD1-CE 3.43Å; D530-K533 IonicContact OD1-NZ 3.13Å; D530-K533 PolarHBondContact OD1-NZ 3.38Å
534	S	79	Confident	86.1	Confident	94 Å²	94	40.8 Å²	40.8	66%	0.657	23%	0.225	S	C	*	.	P	Polyproline II helix	trans	-63.9	143.3	158.9	47.9	0	0	0	0	110.9
535	N	85.8	Confident	85.8	Confident	56 Å²	56	45 Å²	45	30%	0.299	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-69.2	126.7	172.3	-58.5	-58.9	0	0	0	110.3	F476 W527 D528 Y529	F476-N535 HydrophobicContact CE1-CB 4.36Å; F476-N535 HydrophobicContact CZ-CB 4.38Å; W527-N535 HydrophobicContact CE3-CB 4.21Å; D528-N535 VanDerWaalsContact O-CA 3.31Å; D528-N535 WeakPolarHBondContact O-CA 3.4Å; D528-N535 WeakPolarHBondContact O-CB 3.41Å; Y529-N535 VanDerWaalsContact CD2-OD1 3.28Å; Y529-N535 WeakPolarHBondContact CD2-OD1 3.44Å
536	D	84.9	Confident	85.1	Confident	68 Å²	68	52.8 Å²	52.8	36%	0.364	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-76.8	143.3	177.5	-80.5	-19	0	0	0	112	M467 W527 D528	M467-D536 HydrophobicContact CB-CB 3.92Å; M467-D536 HydrophobicContact CG-CB 3.9Å; W527-D536 CarbonylContact C-O 3.59Å; W527-D536 WeakPolarHBondContact CA-O 3.34Å; D528-D536 HydrophobicContact CB-CB 4.23Å; D528-D536 PolarHBondContact N-O 2.98Å; D528-D536 PolarHBondContact O-N 2.86Å
537	F	87	Confident	84.6	Confident	30 Å²	30	53.5 Å²	53.5	13%	0.132	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	113.3	178.8	177	-102.7	0	0	0	110.5	W527 N576	W527-F537 HydrophobicContact CD2-CD2 4.19Å; W527-F537 AromaticContact CE2-CD2 3.81Å; W527-F537 HydrophobicContact CE3-CB 4.1Å; W527-F537 HydrophobicContact CE3-CD2 4.43Å; W527-F537 HydrophobicContact CH2-CB 4.26Å; W527-F537 HydrophobicContact CH2-CD2 4.03Å; W527-F537 AromaticContact CZ2-CD2 3.74Å; W527-F537 HydrophobicContact CZ2-CD2 3.74Å; W527-F537 HydrophobicContact CZ2-CE2 4.39Å; W527-F537 HydrophobicContact CZ3-CB 3.92Å; W527-F537 HydrophobicContact CZ3-CD2 4.37Å; F537-N576 HydrophobicContact CD1-CB 4.18Å; F537-N576 HydrophobicContact CE1-CB 3.86Å; F537-N576 HydrophobicContact CE2-CB 4.37Å; F537-N576 HydrophobicContact CZ-CB 3.96Å
538	I	85.6	Confident	83.8	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	-46.6	179.4	-56.2	-178.6	0	0	0	109.8	R438 L464 A465 M467 P475 V526 D528	R438-I538 HydrophobicContact CB-CG2 4.35Å; R438-I538 WeakPolarHBondContact CB-O 3.43Å; R438-I538 WeakPolarHBondContact CD-O 3.45Å; L464-I538 HydrophobicContact CB-CG2 4.32Å; L464-I538 HydrophobicContact CD1-CD1 4.41Å; L464-I538 HydrophobicContact CD2-CG2 4.23Å; A465-I538 HydrophobicContact CB-CG2 4.27Å; M467-I538 HydrophobicContact CG-CG1 3.92Å; P475-I538 HydrophobicContact CB-CD1 4.32Å; V526-I538 HydrophobicContact CB-CB 4.44Å; V526-I538 HydrophobicContact CG1-CB 4.46Å; V526-I538 HydrophobicContact CG1-CD1 4.29Å; V526-I538 WeakPolarHBondContact O-CB 3.44Å; V526-I538 PolarHBondContact O-N 3.17Å; D528-I538 HydrophobicContact CB-CD1 4.06Å; D528-I538 HydrophobicContact CB-CG1 4.18Å
539	G	89.1	Confident	83.6	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.7	171	176.3	0	0	0	0	0	113.3	V526 L573	V526-G539 PolarHBondContact N-O 3.43Å; V526-G539 PolarHBondContact O-N 2.87Å; G539-L573 CarbonylContact C-O 3.58Å; G539-L573 WeakPolarHBondContact CA-O 3.37Å
540	G	90.4	Very high	83.3	Confident	8 Å²	8	62.8 Å²	62.8	8%	0.082	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	167.2	-177.8	0	0	0	0	0	114.9	V524 L573	V524-G540 CarbonylContact O-C 3.59Å; V524-G540 WeakPolarHBondContact O-CA 3.28Å; G540-L573 PolarHBondContact N-O 3.45Å; G540-L573 PolarHBondContact O-N 3.39Å
541	C	89.8	Confident	83.5	Confident	13 Å²	13	62.8 Å²	62.8	9%	0.088	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	144	173.3	62.3	0	0	0	0	110.6	V524 H570	V524-C541 PolarHBondContact N-O 3.02Å; V524-C541 PolarHBondContact O-N 3.38Å; C541-H570 HydrophobicContact CB-CB 3.97Å
542	Q	91	Very high	84	Confident	72 Å²	72	58.5 Å²	58.5	34%	0.336	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	134.2	179.5	-179.4	174	91	0	0	110.5	T521 D523 S551	T521-Q542 HydrophobicContact CG2-CG 3.3Å; D523-Q542 WeakPolarHBondContact OD1-CG 3.35Å; D523-Q542 PolarHBondContact OD1-NE2 3.48Å; Q542-S551 WeakPolarHBondContact O-CB 3.41Å; Q542-S551 PolarHBondContact O-OG 3.27Å
543	L	90.1	Very high	85	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	133.2	177	-60.5	81.8	0	0	0	109.3	L445 T521 L522 V524 H554 W555	L445-L543 HydrophobicContact CD1-CD2 3.96Å; T521-L543 CarbonylContact C-O 3.56Å; T521-L543 WeakPolarHBondContact CA-O 3.46Å; L522-L543 HydrophobicContact CB-CB 4.36Å; L522-L543 PolarHBondContact N-O 3.41Å; L522-L543 PolarHBondContact O-N 2.95Å; V524-L543 HydrophobicContact CG2-CD1 4.09Å; L543-H554 HydrophobicContact CD2-CB 4.38Å; L543-H554 WeakPolarHBondContact CD2-ND1 3.4Å; L543-W555 HydrophobicContact CB-CE3 3.97Å
544	G	87.9	Confident	85.9	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.5	172	-173.7	0	0	0	0	0	111.9	Q546 A547 L552	G544-Q546 PolarHBondContact O-N 3.04Å; G544-A547 VanDerWaalsContact O-CB 3.27Å; G544-A547 WeakPolarHBondContact O-CB 3.22Å; G544-A547 PolarHBondContact O-N 3.24Å; G544-L552 WeakPolarHBondContact O-CD1 3.32Å
545	I	84.7	Confident	86.4	Confident	88 Å²	88	48.1 Å²	48.1	45%	0.451	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-22	178.1	-62.4	-166.7	0	0	0	112.4	A518 L559	A518-I545 HydrophobicContact CB-CD1 3.74Å; A518-I545 WeakPolarHBondContact O-CD1 3.42Å; I545-L559 HydrophobicContact CD1-CD1 3.96Å; I545-L559 HydrophobicContact CG1-CD1 4.12Å
546	Q	79.1	Confident	86.6	Confident	165 Å²	165	52.4 Å²	52.4	77%	0.771	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-5.4	175.5	-65.6	178.5	-13.9	0	0	113.8	G544	G544-Q546 PolarHBondContact O-N 3.04Å
547	A	81.3	Confident	86.7	Confident	14 Å²	14	51.5 Å²	51.5	12%	0.116	26%	0.255	C	S	.	.			trans	-72.2	171.4	177	0	0	0	0	0	111.6	G544	G544-A547 VanDerWaalsContact O-CB 3.27Å; G544-A547 WeakPolarHBondContact O-CB 3.22Å; G544-A547 PolarHBondContact O-N 3.24Å
548	K	77.1	Confident	86.7	Confident	185 Å²	185	50.1 Å²	50.1	80%	0.804	25%	0.249	S	C	*	.			trans	-123	158.1	178.2	-63.1	176.3	-175.9	171.7	0	110.5
549	G	84.4	Confident	86.8	Confident	50 Å²	50	51.2 Å²	51.2	52%	0.515	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.6	-139.3	175.1	0	0	0	0	0	113.8	S551 L552 K553	G549-S551 VanDerWaalsContact C-N 3.27Å; G549-S551 PolarHBondContact O-N 3.49Å; G549-L552 WeakPolarHBondContact O-CB 3.49Å; G549-L552 PolarHBondContact O-N 3.04Å; G549-K553 PolarHBondContact O-N 2.94Å
550	E	83.3	Confident	86.7	Confident	77 Å²	77	58.2 Å²	58.2	36%	0.36	29%	0.286	S	S	.	.	H	α-helix	trans	-60.1	-31.7	-175.3	-59.6	-51.9	113.3	0	0	113.9	L552 K553 H554 R568 H570	E550-L552 VanDerWaalsContact C-N 3.28Å; E550-L552 PolarHBondContact O-N 3.4Å; E550-K553 PolarHBondContact O-N 2.78Å; E550-K553 WeakPolarHBondContact OE1-CD 3.45Å; E550-K553 VanDerWaalsContact OE1-CE 3.24Å; E550-K553 WeakPolarHBondContact OE1-CE 3.26Å; E550-K553 IonicContact OE1-NZ 2.77Å; E550-K553 PolarHBondContact OE1-NZ 2.9Å; E550-K553 IonicContact OE2-NZ 2.68Å; E550-H554 WeakPolarHBondContact O-CB 3.39Å; E550-H554 PolarHBondContact O-N 3.46Å; E550-R568 IonicContact OE2-CZ 3.99Å; E550-R568 IonicContact OE2-NE 3.99Å; E550-R568 PolarHBondContact OE2-NE 3.16Å; E550-R568 IonicContact OE2-NH2 3.65Å; E550-R568 PolarHBondContact OE2-NH2 2.88Å; E550-H570 PolarHBondContact O-NE2 3.29Å
551	S	86.3	Confident	86.5	Confident	17 Å²	17	60.3 Å²	60.3	12%	0.119	30%	0.295	C	S	.	.	H	α-helix	trans	-65.7	-29.7	175.6	-62	0	0	0	0	113.4	Q542 G549 W555 H570	Q542-S551 WeakPolarHBondContact O-CB 3.41Å; Q542-S551 PolarHBondContact O-OG 3.27Å; G549-S551 VanDerWaalsContact C-N 3.27Å; G549-S551 PolarHBondContact O-N 3.49Å; S551-W555 PolarHBondContact O-N 2.99Å; S551-H570 WeakPolarHBondContact CA-CE1 3.49Å; S551-H570 WeakPolarHBondContact CA-NE2 3.37Å; S551-H570 WeakPolarHBondContact CB-CE1 3.46Å; S551-H570 PolarHBondContact N-CE1 2.8Å; S551-H570 VanDerWaalsContact N-CE1 3.32Å; S551-H570 PolarHBondContact N-NE2 2.85Å; S551-H570 PolarHBondContact OG-CE1 2.83Å; S551-H570 PolarHBondContact OG-ND1 3Å
552	L	87.6	Confident	86.2	Confident	65 Å²	65	64.2 Å²	64.2	34%	0.34	31%	0.31	S	S	.	.	H	α-helix	trans	-76.8	-43.2	172.7	-179.7	61	0	0	0	111.1	G544 G549 E550 H554 W555 Y556	G544-L552 WeakPolarHBondContact O-CD1 3.32Å; G549-L552 WeakPolarHBondContact O-CB 3.49Å; G549-L552 PolarHBondContact O-N 3.04Å; E550-L552 VanDerWaalsContact C-N 3.28Å; E550-L552 PolarHBondContact O-N 3.4Å; L552-H554 PolarHBondContact O-N 3.31Å; L552-W555 PolarHBondContact O-N 2.96Å; L552-Y556 WeakPolarHBondContact O-CB 3.4Å; L552-Y556 PolarHBondContact O-N 3.11Å
553	K	87.9	Confident	86.1	Confident	101 Å²	101	64.6 Å²	64.6	44%	0.439	32%	0.315	S	S	.	.	H	α-helix	trans	-56.4	-50.8	176.7	-67.5	-176.8	-175.5	167.7	0	111.2	G549 E550 W555 Y556 E557	G549-K553 PolarHBondContact O-N 2.94Å; E550-K553 PolarHBondContact O-N 2.78Å; E550-K553 WeakPolarHBondContact OE1-CD 3.45Å; E550-K553 VanDerWaalsContact OE1-CE 3.24Å; E550-K553 WeakPolarHBondContact OE1-CE 3.26Å; E550-K553 IonicContact OE1-NZ 2.77Å; E550-K553 PolarHBondContact OE1-NZ 2.9Å; E550-K553 IonicContact OE2-NZ 2.68Å; K553-W555 VanDerWaalsContact C-N 3.35Å; K553-W555 PolarHBondContact O-N 2.87Å; K553-Y556 PolarHBondContact O-N 2.85Å; K553-E557 WeakPolarHBondContact O-CB 3.44Å; K553-E557 VanDerWaalsContact O-CG 3.29Å; K553-E557 WeakPolarHBondContact O-CG 3.3Å; K553-E557 PolarHBondContact O-N 3.45Å
554	H	91.3	Very high	86.1	Confident	0 Å²	0	70.9 Å²	70.9	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-59.5	-43.4	-179.1	-166.8	-158.4	0	0	0	112.8	I443 S444 L445 L543 E550 L552 C558 I566 E567 R568 H570	I443-H554 WeakPolarHBondContact CB-CE1 3.48Å; I443-H554 WeakPolarHBondContact CG2-CE1 3.41Å; I443-H554 PolarHBondContact O-CE1 3.47Å; S444-H554 PolarHBondContact N-CE1 2.78Å; L445-H554 PolarHBondContact N-NE2 2.95Å; L543-H554 HydrophobicContact CD2-CB 4.38Å; L543-H554 WeakPolarHBondContact CD2-ND1 3.4Å; E550-H554 WeakPolarHBondContact O-CB 3.39Å; E550-H554 PolarHBondContact O-N 3.46Å; L552-H554 PolarHBondContact O-N 3.31Å; H554-C558 WeakPolarHBondContact O-CB 3.29Å; H554-C558 PolarHBondContact O-N 3.39Å; H554-I566 WeakPolarHBondContact NE2-CB 3.38Å; H554-I566 PolarHBondContact NE2-O 3.07Å; H554-E567 WeakPolarHBondContact NE2-CA 3.43Å; H554-E567 PolarHBondContact NE2-N 3.12Å; H554-R568 HydrophobicContact CB-CB 4.22Å; H554-H570 WeakPolarHBondContact CB-NE2 3.31Å; H554-H570 AromaticContact CG-NE2 3.67Å; H554-H570 AromaticContact ND1-NE2 3.5Å
555	W	90.7	Very high	86.2	Confident	2 Å²	2	75.9 Å²	75.9	1%	0.008	36%	0.364	C	S	.	.	H	α-helix	trans	-66.3	-41.9	177.3	-164.6	-103.7	0	0	0	112.1	L445 L454 L481 L517 K520 L522 L543 S551 L552 K553 C558 L559	L445-W555 HydrophobicContact CD1-CE3 3.81Å; L445-W555 HydrophobicContact CD1-CZ3 4.27Å; L454-W555 HydrophobicContact CD2-CH2 3.93Å; L454-W555 HydrophobicContact CD2-CZ3 4.12Å; L481-W555 HydrophobicContact CD1-CH2 4.32Å; L517-W555 HydrophobicContact CD1-CH2 3.66Å; L517-W555 HydrophobicContact CD1-CZ2 3.48Å; L517-W555 VanDerWaalsContact CD1-CZ2 3.48Å; L517-W555 HydrophobicContact CG-CZ2 4.02Å; K520-W555 HydrophobicContact CB-CZ2 4.14Å; K520-W555 WeakPolarHBondContact O-CZ2 3.44Å; L522-W555 HydrophobicContact CB-CE3 4.49Å; L522-W555 HydrophobicContact CB-CH2 4.03Å; L522-W555 HydrophobicContact CB-CZ3 3.65Å; L522-W555 HydrophobicContact CD2-CZ3 4.18Å; L543-W555 HydrophobicContact CB-CE3 3.97Å; S551-W555 PolarHBondContact O-N 2.99Å; L552-W555 PolarHBondContact O-N 2.96Å; K553-W555 VanDerWaalsContact C-N 3.35Å; K553-W555 PolarHBondContact O-N 2.87Å; W555-C558 PolarHBondContact O-N 2.98Å; W555-L559 HydrophobicContact CG-CD1 4.49Å; W555-L559 WeakPolarHBondContact O-CB 3.07Å; W555-L559 WeakPolarHBondContact O-CG 3.46Å; W555-L559 PolarHBondContact O-N 2.9Å
556	Y	88.9	Confident	86.5	Confident	146 Å²	146	73 Å²	73	57%	0.573	35%	0.349	S	S	*	.	H	α-helix	trans	-67.9	-40	178	-175.3	-95.7	0	0	0	112.6	L552 K553 L559 K560	L552-Y556 WeakPolarHBondContact O-CB 3.4Å; L552-Y556 PolarHBondContact O-N 3.11Å; K553-Y556 PolarHBondContact O-N 2.85Å; Y556-L559 WeakPolarHBondContact O-CB 3.13Å; Y556-L559 PolarHBondContact O-N 2.74Å; Y556-K560 HydrophobicContact CE1-CD 4.19Å; Y556-K560 WeakPolarHBondContact O-CB 3.41Å; Y556-K560 PolarHBondContact O-N 3.18Å
557	E	87.5	Confident	87.2	Confident	49 Å²	49	69.2 Å²	69.2	23%	0.229	33%	0.331	C	S	.	.	H	α-helix	trans	-62.3	-43.7	173.6	-74.4	161.4	-160	0	0	111.4	K553 L559 K560 N561 I566 R568	K553-E557 WeakPolarHBondContact O-CB 3.44Å; K553-E557 VanDerWaalsContact O-CG 3.29Å; K553-E557 WeakPolarHBondContact O-CG 3.3Å; K553-E557 PolarHBondContact O-N 3.45Å; E557-L559 VanDerWaalsContact C-N 3.31Å; E557-L559 PolarHBondContact O-N 2.78Å; E557-K560 PolarHBondContact O-N 2.88Å; E557-N561 VanDerWaalsContact O-CB 3.25Å; E557-N561 WeakPolarHBondContact O-CB 3.43Å; E557-N561 PolarHBondContact O-N 3.28Å; E557-I566 HydrophobicContact CB-CG1 4.43Å; E557-I566 HydrophobicContact CB-CG2 4.4Å; E557-I566 WeakPolarHBondContact OE2-CG2 3.32Å; E557-R568 IonicContact OE1-CZ 3.76Å; E557-R568 IonicContact OE1-NH1 2.78Å; E557-R568 PolarHBondContact OE1-NH1 3.14Å; E557-R568 IonicContact OE1-NH2 3.9Å; E557-R568 IonicContact OE2-CZ 3.52Å; E557-R568 IonicContact OE2-NH1 2.62Å; E557-R568 PolarHBondContact OE2-NH1 3.43Å
558	C	87.9	Confident	87.5	Confident	1 Å²	1	70.9 Å²	70.9	1%	0.007	34%	0.335	C	S	.	.	H	α-helix	trans	-64.9	-32.1	173.7	-174.6	0	0	0	0	113	L445 H554 W555	L445-C558 HydrophobicContact CB-CB 3.86Å; L445-C558 HydrophobicContact CD1-CB 4.16Å; H554-C558 WeakPolarHBondContact O-CB 3.29Å; H554-C558 PolarHBondContact O-N 3.39Å; W555-C558 PolarHBondContact O-N 2.98Å
559	L	86.5	Confident	88	Confident	23 Å²	23	65.1 Å²	65.1	12%	0.12	31%	0.308	C	S	.	.	H	α-helix	trans	-71	-38	174.7	-84.8	161.8	0	0	0	112.4	H514 L517 A518 I545 W555 Y556 E557	H514-L559 PolarHBondContact NE2-O 3.49Å; L517-L559 HydrophobicContact CB-CD2 3.99Å; L517-L559 HydrophobicContact CD2-CD2 3.78Å; L517-L559 HydrophobicContact CD2-CG 4.22Å; L517-L559 HydrophobicContact CG-CD2 3.85Å; L517-L559 HydrophobicContact CG-CG 4.42Å; A518-L559 HydrophobicContact CB-CD2 4.48Å; I545-L559 HydrophobicContact CD1-CD1 3.96Å; I545-L559 HydrophobicContact CG1-CD1 4.12Å; W555-L559 HydrophobicContact CG-CD1 4.49Å; W555-L559 WeakPolarHBondContact O-CB 3.07Å; W555-L559 WeakPolarHBondContact O-CG 3.46Å; W555-L559 PolarHBondContact O-N 2.9Å; Y556-L559 WeakPolarHBondContact O-CB 3.13Å; Y556-L559 PolarHBondContact O-N 2.74Å; E557-L559 VanDerWaalsContact C-N 3.31Å; E557-L559 PolarHBondContact O-N 2.78Å
560	K	87.3	Confident	88.1	Confident	147 Å²	147	63 Å²	63	64%	0.639	29%	0.285	S	S	*	.	H	α-helix	trans	-80.2	-48.1	-178.4	-176.7	-178.8	176.4	-174	0	112.2	Y556 E557 K562	Y556-K560 HydrophobicContact CE1-CD 4.19Å; Y556-K560 WeakPolarHBondContact O-CB 3.41Å; Y556-K560 PolarHBondContact O-N 3.18Å; E557-K560 PolarHBondContact O-N 2.88Å; K560-K562 PolarHBondContact O-N 2.92Å
561	N	86.7	Confident	88.3	Confident	52 Å²	52	62.1 Å²	62.1	28%	0.278	28%	0.284	S	S	.	.	S	Bend	trans	-94.9	76.1	-172.7	-61.4	-34.1	0	0	0	110.8	E557 K564 I566	E557-N561 VanDerWaalsContact O-CB 3.25Å; E557-N561 WeakPolarHBondContact O-CB 3.43Å; E557-N561 PolarHBondContact O-N 3.28Å; N561-K564 HydrophobicContact CB-CB 4.16Å; N561-K564 HydrophobicContact CB-CD 4.23Å; N561-K564 HydrophobicContact CB-CG 4.39Å; N561-K564 PolarHBondContact O-N 2.86Å; N561-I566 HydrophobicContact CB-CD1 4.44Å
562	K	83.9	Confident	88.3	Confident	95 Å²	95	61.3 Å²	61.3	41%	0.413	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	142.3	173.4	-63.3	-178.4	178.6	-175.3	0	111.1	Y447 H514 K560 K564	Y447-K562 HydrophobicContact CD1-CG 4.41Å; H514-K562 WeakPolarHBondContact CE1-CE 3.34Å; H514-K562 WeakPolarHBondContact ND1-CE 3.38Å; H514-K562 WeakPolarHBondContact NE2-CE 3.46Å; K560-K562 PolarHBondContact O-N 2.92Å; K562-K564 PolarHBondContact O-N 2.92Å
563	D	87.8	Confident	88.1	Confident	80 Å²	80	62.3 Å²	62.3	43%	0.428	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	59	9.9	175.3	-53.7	-80.3	0	0	0	115.4	Y447 N448 S449	Y447-D563 WeakPolarHBondContact O-CA 3.35Å; Y447-D563 PolarHBondContact O-N 3.06Å; N448-D563 VanDerWaalsContact CA-OD1 3.28Å; N448-D563 WeakPolarHBondContact CA-OD1 3.38Å; S449-D563 WeakPolarHBondContact CB-OD2 3.38Å; S449-D563 PolarHBondContact N-OD1 2.87Å; S449-D563 PolarHBondContact N-OD2 2.91Å
564	K	89.5	Confident	87.4	Confident	132 Å²	132	61.3 Å²	61.3	57%	0.574	28%	0.283	S	S	*	.			trans	-97.6	138.6	167.8	-65.5	-164	178.7	-174.2	0	111.1	N561 K562 I566	N561-K564 HydrophobicContact CB-CB 4.16Å; N561-K564 HydrophobicContact CB-CD 4.23Å; N561-K564 HydrophobicContact CB-CG 4.39Å; N561-K564 PolarHBondContact O-N 2.86Å; K562-K564 PolarHBondContact O-N 2.92Å; K564-I566 HydrophobicContact CB-CD1 4.19Å
565	K	91	Very high	86.1	Confident	104 Å²	104	66.5 Å²	66.5	45%	0.452	31%	0.311	S	S	.	.			trans	-80.7	119.3	169.9	-166.9	-176.7	-144.8	-143.6	0	109.4	S444 T446 E507 E567	S444-K565 WeakPolarHBondContact OG-CE 3.47Å; S444-K565 WeakPolarHBondContact OG-CG 3.24Å; T446-K565 WeakPolarHBondContact OG1-CA 3.22Å; T446-K565 WeakPolarHBondContact OG1-CG 3.36Å; E507-K565 WeakPolarHBondContact OE1-CE 3.12Å; E507-K565 IonicContact OE1-NZ 2.71Å; E507-K565 PolarHBondContact OE1-NZ 2.97Å; K565-E567 HydrophobicContact CD-CG 4.47Å; K565-E567 WeakPolarHBondContact CD-OE1 3.37Å; K565-E567 WeakPolarHBondContact CE-OE1 3.46Å; K565-E567 HydrophobicContact CG-CG 4.36Å; K565-E567 IonicContact NZ-OE1 3.63Å; K565-E567 PolarHBondContact NZ-OE1 3.5Å
566	I	91.4	Very high	84.4	Confident	27 Å²	27	69.6 Å²	69.6	14%	0.138	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	124.4	175.3	-46.1	-61.5	0	0	0	108.4	S444 L445 H554 E557 N561 K564	S444-I566 CarbonylContact C-O 3.6Å; S444-I566 WeakPolarHBondContact CA-O 3.34Å; L445-I566 PolarHBondContact N-O 2.95Å; L445-I566 PolarHBondContact O-N 3.1Å; H554-I566 WeakPolarHBondContact NE2-CB 3.38Å; H554-I566 PolarHBondContact NE2-O 3.07Å; E557-I566 HydrophobicContact CB-CG1 4.43Å; E557-I566 HydrophobicContact CB-CG2 4.4Å; E557-I566 WeakPolarHBondContact OE2-CG2 3.32Å; N561-I566 HydrophobicContact CB-CD1 4.44Å; K564-I566 HydrophobicContact CB-CD1 4.19Å
567	E	92.1	Very high	82.3	Confident	86 Å²	86	66.7 Å²	66.7	40%	0.402	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	132.9	177.5	-51.1	-159	155.2	0	0	110.4	L442 I443 H554 K565	L442-E567 HydrophobicContact CD1-CB 4.13Å; I443-E567 CarbonylContact O-C 3.48Å; I443-E567 WeakPolarHBondContact O-CA 3.2Å; H554-E567 WeakPolarHBondContact NE2-CA 3.43Å; H554-E567 PolarHBondContact NE2-N 3.12Å; K565-E567 HydrophobicContact CD-CG 4.47Å; K565-E567 WeakPolarHBondContact CD-OE1 3.37Å; K565-E567 WeakPolarHBondContact CE-OE1 3.46Å; K565-E567 HydrophobicContact CG-CG 4.36Å; K565-E567 IonicContact NZ-OE1 3.63Å; K565-E567 PolarHBondContact NZ-OE1 3.5Å
568	R	88.4	Confident	80.3	Confident	50 Å²	50	64.8 Å²	64.8	19%	0.189	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	149.2	-177.5	-143.5	178.8	-165.6	102.7	0.7	112.6	L442 I443 E550 H554 E557 H570	L442-R568 WeakPolarHBondContact CD1-O 3.37Å; I443-R568 PolarHBondContact N-O 3.17Å; I443-R568 PolarHBondContact O-N 3.2Å; E550-R568 IonicContact OE2-CZ 3.99Å; E550-R568 IonicContact OE2-NE 3.99Å; E550-R568 PolarHBondContact OE2-NE 3.16Å; E550-R568 IonicContact OE2-NH2 3.65Å; E550-R568 PolarHBondContact OE2-NH2 2.88Å; H554-R568 HydrophobicContact CB-CB 4.22Å; E557-R568 IonicContact OE1-CZ 3.76Å; E557-R568 IonicContact OE1-NH1 2.78Å; E557-R568 PolarHBondContact OE1-NH1 3.14Å; E557-R568 IonicContact OE1-NH2 3.9Å; E557-R568 IonicContact OE2-CZ 3.52Å; E557-R568 IonicContact OE2-NH1 2.62Å; E557-R568 PolarHBondContact OE2-NH1 3.43Å; R568-H570 PolarHBondContact O-CD2 2.85Å
569	W	88.6	Confident	77.7	Confident	64 Å²	64	72.6 Å²	72.6	24%	0.242	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	135	175.7	-75.4	101.3	0	0	0	111.4	R440 I441 L442 R460 A462	R440-W569 HydrophobicContact CB-CE3 3.78Å; R440-W569 HydrophobicContact CB-CZ3 4.11Å; I441-W569 VanDerWaalsContact C-CE3 3.43Å; I441-W569 WeakPolarHBondContact O-CA 3.35Å; L442-W569 HydrophobicContact CB-CD2 3.96Å; L442-W569 HydrophobicContact CB-CE3 3.88Å; L442-W569 HydrophobicContact CB-CH2 3.85Å; L442-W569 HydrophobicContact CB-CZ2 3.92Å; L442-W569 HydrophobicContact CB-CZ3 3.83Å; L442-W569 HydrophobicContact CD1-CD2 4.26Å; L442-W569 HydrophobicContact CD1-CG 4.27Å; L442-W569 HydrophobicContact CD2-CZ2 4.07Å; L442-W569 HydrophobicContact CG-CZ2 4.47Å; R460-W569 HydrophobicContact CG-CH2 4.11Å; A462-W569 HydrophobicContact CB-CH2 3.73Å; A462-W569 HydrophobicContact CB-CZ3 3.87Å
570	H	86.6	Confident	75.6	Confident	6 Å²	6	73 Å²	73	3%	0.028	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	139.8	173.1	-56.1	-86.2	0	0	0	109.8	R440 I441 C541 E550 S551 H554 R568	R440-H570 CarbonylContact C-O 3.22Å; R440-H570 WeakPolarHBondContact CA-O 3.22Å; I441-H570 HydrophobicContact CG2-CB 4.13Å; I441-H570 PolarHBondContact N-O 3.16Å; I441-H570 PolarHBondContact O-N 3.19Å; C541-H570 HydrophobicContact CB-CB 3.97Å; E550-H570 PolarHBondContact O-NE2 3.29Å; S551-H570 WeakPolarHBondContact CA-CE1 3.49Å; S551-H570 WeakPolarHBondContact CA-NE2 3.37Å; S551-H570 WeakPolarHBondContact CB-CE1 3.46Å; S551-H570 PolarHBondContact N-CE1 2.8Å; S551-H570 VanDerWaalsContact N-CE1 3.32Å; S551-H570 PolarHBondContact N-NE2 2.85Å; S551-H570 PolarHBondContact OG-CE1 2.83Å; S551-H570 PolarHBondContact OG-ND1 3Å; H554-H570 WeakPolarHBondContact CB-NE2 3.31Å; H554-H570 AromaticContact CG-NE2 3.67Å; H554-H570 AromaticContact ND1-NE2 3.5Å; R568-H570 PolarHBondContact O-CD2 2.85Å
571	V	86.7	Confident	73	Confident	57 Å²	57	73.6 Å²	73.6	35%	0.345	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	136.9	172.4	-177.5	0	0	0	0	108.9	E437 R440 L573	E437-V571 HydrophobicContact CB-CG1 4.4Å; E437-V571 HydrophobicContact CG-CG1 4.06Å; R440-V571 HydrophobicContact CG-CG2 4.26Å; V571-L573 HydrophobicContact CG1-CD2 4.44Å
572	L	86.9	Confident	70.4	Confident	0 Å²	0	80.4 Å²	80.4	0%	0	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-86.2	116.4	176.6	-62	175.4	0	0	0	109.5	R438 G439 I441 L464 V526	R438-L572 PolarHBondContact N-O 3.09Å; G439-L572 WeakPolarHBondContact O-CB 3.47Å; G439-L572 PolarHBondContact O-N 2.75Å; I441-L572 HydrophobicContact CB-CD2 4.14Å; I441-L572 HydrophobicContact CG2-CD2 3.66Å; I441-L572 HydrophobicContact CG2-CG 4.41Å; L464-L572 HydrophobicContact CD2-CD1 3.33Å; V526-L572 HydrophobicContact CB-CD1 4.09Å; V526-L572 HydrophobicContact CG2-CD1 3.67Å; V526-L572 HydrophobicContact CG2-CD2 3.74Å; V526-L572 HydrophobicContact CG2-CG 4.38Å
573	L	82.3	Confident	69.7	Low	86 Å²	86	79.7 Å²	79.7	45%	0.45	40%	0.395	S	S	.	.	B	Isolated β-bridge	trans	-91.9	150	179.2	-56.1	179.1	0	0	0	110.7	G539 G540 V571 D575	G539-L573 CarbonylContact C-O 3.58Å; G539-L573 WeakPolarHBondContact CA-O 3.37Å; G540-L573 PolarHBondContact N-O 3.45Å; G540-L573 PolarHBondContact O-N 3.39Å; V571-L573 HydrophobicContact CG1-CD2 4.44Å; L573-D575 PolarHBondContact O-N 3.17Å
574	N	73.1	Confident	68.7	Low	80 Å²	80	79.6 Å²	79.6	43%	0.428	39%	0.393	S	S	.	.	S	Bend	trans	-73.2	-9.6	176.9	-177.5	46.4	0	0	0	113.6	R438 N576	R438-N574 VanDerWaalsContact CZ-OD1 3.26Å; R438-N574 PolarHBondContact NH1-OD1 2.64Å; N574-N576 PolarHBondContact O-N 3.03Å; N574-N576 VanDerWaalsContact O-N 3.16Å
575	D	64.9	Low	67.6	Low	109 Å²	109	76.7 Å²	76.7	58%	0.583	38%	0.383	S	S	*	.			trans	-78.3	101.9	-175.8	-170.9	6	0	0	0	112.1	L573 T577	L573-D575 PolarHBondContact O-N 3.17Å; D575-T577 PolarHBondContact O-N 2.81Å; D575-T577 WeakPolarHBondContact OD2-CG2 3.46Å
576	N	54.4	Low	66.2	Low	67 Å²	67	75.1 Å²	75.1	36%	0.358	38%	0.379	S	S	.	.			trans	-78.8	59.9	177.6	-168.4	17	0	0	0	112.3	F537 N574 V578	F537-N576 HydrophobicContact CD1-CB 4.18Å; F537-N576 HydrophobicContact CE1-CB 3.86Å; F537-N576 HydrophobicContact CE2-CB 4.37Å; F537-N576 HydrophobicContact CZ-CB 3.96Å; N574-N576 PolarHBondContact O-N 3.03Å; N574-N576 VanDerWaalsContact O-N 3.16Å; N576-V578 PolarHBondContact O-N 3.09Å; N576-V578 VanDerWaalsContact O-N 3.11Å; N576-V578 PolarHBondContact OD1-O 2.85Å
577	T	45	Very low	64.6	Low	86 Å²	86	78.1 Å²	78.1	53%	0.528	39%	0.394	S	S	.	.			trans	-62.3	-7.8	167.5	44.4	0	0	0	0	113.5	D575 Q579	D575-T577 PolarHBondContact O-N 2.81Å; D575-T577 WeakPolarHBondContact OD2-CG2 3.46Å; T577-Q579 PolarHBondContact O-N 3.47Å
578	V	44.8	Very low	62.8	Low	9 Å²	9	77.6 Å²	77.6	6%	0.055	39%	0.393	C	S	.	.			trans	-101.1	73.4	-177.8	-159.4	0	0	0	0	110.1	D523 N576 F580	D523-V578 HydrophobicContact CB-CG1 4Å; D523-V578 HydrophobicContact CB-CG2 3.92Å; N576-V578 PolarHBondContact O-N 3.09Å; N576-V578 VanDerWaalsContact O-N 3.11Å; N576-V578 PolarHBondContact OD1-O 2.85Å; V578-F580 HydrophobicContact CB-CD2 4.28Å; V578-F580 HydrophobicContact CB-CE2 3.86Å; V578-F580 HydrophobicContact CG1-CD2 3.78Å; V578-F580 HydrophobicContact CG1-CE1 4.32Å; V578-F580 HydrophobicContact CG1-CE2 3.25Å; V578-F580 HydrophobicContact CG1-CZ 3.57Å; V578-F580 WeakPolarHBondContact O-CD2 3.25Å; V578-F580 PolarHBondContact O-N 2.61Å
579	Q	33.7	Very low	61	Low	165 Å²	165	79.6 Å²	79.6	77%	0.771	41%	0.408	S	S	*	.			trans	-59.6	100.3	165.5	-74.1	-169.3	-12.1	0	0	109.8	T577 E581	T577-Q579 PolarHBondContact O-N 3.47Å; Q579-E581 PolarHBondContact O-N 3.04Å
580	F	43.2	Very low	58.8	Low	31 Å²	31	80.8 Å²	80.8	14%	0.136	42%	0.421	C	S	.	.			trans	-84.5	89.9	161.5	-66.9	-89.7	0	0	0	107.6	K478 C480 K490 S525 W527 V578 D582	K478-F580 HydrophobicContact CB-CE1 3.98Å; K478-F580 HydrophobicContact CB-CE2 4.21Å; K478-F580 HydrophobicContact CB-CZ 3.61Å; K478-F580 HydrophobicContact CD-CD1 3.98Å; K478-F580 HydrophobicContact CD-CD2 4.09Å; K478-F580 HydrophobicContact CD-CE1 3.92Å; K478-F580 HydrophobicContact CD-CE2 4.03Å; K478-F580 HydrophobicContact CD-CG 4.07Å; K478-F580 HydrophobicContact CD-CZ 3.94Å; K478-F580 HydrophobicContact CG-CZ 4.44Å; C480-F580 HydrophobicContact CB-CE1 4.03Å; C480-F580 HydrophobicContact CB-CZ 4.3Å; K490-F580 HydrophobicContact CD-CD1 4.42Å; S525-F580 VanDerWaalsContact OG-CE2 3.22Å; S525-F580 WeakPolarHBondContact OG-CE2 3.33Å; S525-F580 WeakPolarHBondContact OG-CZ 3.4Å; W527-F580 AromaticContact CZ2-CD2 3.96Å; W527-F580 HydrophobicContact CZ2-CD2 3.96Å; W527-F580 HydrophobicContact CZ2-CE2 4.3Å; V578-F580 HydrophobicContact CB-CD2 4.28Å; V578-F580 HydrophobicContact CB-CE2 3.86Å; V578-F580 HydrophobicContact CG1-CD2 3.78Å; V578-F580 HydrophobicContact CG1-CE1 4.32Å; V578-F580 HydrophobicContact CG1-CE2 3.25Å; V578-F580 HydrophobicContact CG1-CZ 3.57Å; V578-F580 WeakPolarHBondContact O-CD2 3.25Å; V578-F580 PolarHBondContact O-N 2.61Å; F580-D582 PolarHBondContact O-N 2.89Å
581	E	32.3	Very low	56.5	Low	159 Å²	159	87 Å²	87	74%	0.743	45%	0.453	S	S	*	.			trans	-62.8	120.8	150.7	-62.3	-177.7	136.3	0	0	106.5	K490 Q579	K490-E581 PolarHBondContact NZ-O 3.5Å; Q579-E581 PolarHBondContact O-N 3.04Å
582	D	31.1	Very low	53.8	Low	195 Å²	195	89.7 Å²	89.7	100%	1.043	46%	0.463	S	S	*	.			trans	-88.6	0	-177.3	-81.6	-32.1	0	0	0	111.1	K478 F580	K478-D582 IonicContact NZ-OD1 2.73Å; K478-D582 PolarHBondContact NZ-OD1 3.3Å; K478-D582 IonicContact NZ-OD2 2.7Å; F580-D582 PolarHBondContact O-N 2.89Å

Retrieved 582 of 582 residues in 404.6 ms (Link to these results)

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