A0A087YDP3_POEFO Loading...

T-box transcription factor T

AlphaFold DB , UniProt , Accession A0A087YDP3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 436 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.4	Very low	41.1	Very low	245 Å²	245	118.5 Å²	118.5	100%	1.207	77%	0.766	S	S	*	*				0	107.1	0	-72	179.3	-170.5	0	0	107.5
2	A	35.1	Very low	41.4	Very low	107 Å²	107	113.3 Å²	113.3	88%	0.884	74%	0.741	S	S	*	*			trans	-90.8	117.5	175	0	0	0	0	0	108.2	G4	A2-G4 PolarHBondContact O-N 3.33Å
3	T	38.9	Very low	41.8	Very low	140 Å²	140	108.8 Å²	108.8	86%	0.859	72%	0.719	S	S	*	*			trans	-82.5	96.5	175.2	47.2	0	0	0	0	109	A5	T3-A5 PolarHBondContact O-N 3.36Å
4	G	34	Very low	42.3	Very low	75 Å²	75	105.6 Å²	105.6	77%	0.773	69%	0.689	S	S	*	*			trans	-76.7	109.5	167	0	0	0	0	0	109.8	A2 G6	A2-G4 PolarHBondContact O-N 3.33Å; G4-G6 PolarHBondContact O-N 3.33Å
5	A	40.7	Very low	42.5	Very low	98 Å²	98	110.4 Å²	110.4	81%	0.81	69%	0.689	S	S	*	*			trans	-70.5	104.1	168.3	0	0	0	0	0	108.5	T3 E7	T3-A5 PolarHBondContact O-N 3.36Å; A5-E7 PolarHBondContact O-N 3.42Å
6	G	39.1	Very low	43.3	Very low	77 Å²	77	115.8 Å²	115.8	79%	0.794	69%	0.693	S	S	*	*			trans	-71.2	104.6	167.7	0	0	0	0	0	109.1	G4 C8	G4-G6 PolarHBondContact O-N 3.33Å; G6-C8 PolarHBondContact O-N 2.92Å
7	E	45.4	Very low	44.2	Very low	170 Å²	170	111.8 Å²	111.8	79%	0.794	67%	0.669	S	S	*	*			trans	-60.4	130.5	167.8	-79	-172.2	119.2	0	0	109.9	A5	A5-E7 PolarHBondContact O-N 3.42Å
8	C	41.7	Very low	44.7	Very low	78 Å²	78	109.3 Å²	109.3	53%	0.527	65%	0.652	S	S	.	*			trans	-67.3	127.2	179.8	-148.4	0	0	0	0	109.1	G6 S10 K11	G6-C8 PolarHBondContact O-N 2.92Å; C8-S10 PolarHBondContact O-N 3.39Å; C8-K11 PolarHBondContact O-N 3.42Å
9	P	47.9	Very low	45.4	Very low	108 Å²	108	110.8 Å²	110.8	70%	0.701	65%	0.651	S	S	*	*	H	α-helix	trans	-60.3	-15.7	-173.5	18.6	-30.2	0	0	0	114.7	A13	P9-A13 PolarHBondContact O-N 3.44Å
10	S	50.1	Low	46.2	Very low	69 Å²	69	110.9 Å²	110.9	48%	0.483	65%	0.648	S	S	.	*	H	α-helix	trans	-67.9	-37.1	174.3	52.4	0	0	0	0	113.5	C8 Q14	C8-S10 PolarHBondContact O-N 3.39Å; S10-Q14 PolarHBondContact O-N 3.49Å
11	K	41.8	Very low	46.9	Very low	136 Å²	136	107.5 Å²	107.5	59%	0.591	63%	0.627	S	S	*	*	H	α-helix	trans	-69.7	-42.5	-179.7	-74.8	-175.3	175.8	-178.8	0	111.4	C8 A13 Q14 Y15	C8-K11 PolarHBondContact O-N 3.42Å; K11-A13 VanDerWaalsContact C-N 3.31Å; K11-A13 PolarHBondContact O-N 3.15Å; K11-Q14 WeakPolarHBondContact O-CB 3.32Å; K11-Q14 PolarHBondContact O-N 3.24Å; K11-Y15 WeakPolarHBondContact O-CD2 3.45Å; K11-Y15 PolarHBondContact O-N 3.34Å
12	A	44.5	Very low	48.1	Very low	56 Å²	56	99.1 Å²	99.1	46%	0.463	59%	0.593	S	S	.	*	H	α-helix	trans	-63.6	-35	178.8	0	0	0	0	0	112.9	R16	A12-R16 WeakPolarHBondContact O-CG 3.24Å; A12-R16 PolarHBondContact O-N 3.46Å
13	A	47.7	Very low	49.3	Very low	56 Å²	56	95.5 Å²	95.5	46%	0.463	56%	0.563	S	S	.	*	H	α-helix	trans	-68.8	-41.2	174.2	0	0	0	0	0	112	P9 K11 R16 V17	P9-A13 PolarHBondContact O-N 3.44Å; K11-A13 VanDerWaalsContact C-N 3.31Å; K11-A13 PolarHBondContact O-N 3.15Å; A13-R16 PolarHBondContact O-N 2.67Å; A13-V17 WeakPolarHBondContact O-CG2 3.45Å; A13-V17 PolarHBondContact O-N 2.82Å
14	Q	47.5	Very low	50.2	Low	64 Å²	64	90.5 Å²	90.5	30%	0.299	53%	0.532	S	S	.	.	H	α-helix	trans	-60.1	-50.7	176.2	-148.1	106.3	19.8	0	0	111.4	S10 K11 R16 V17 D18 P120	S10-Q14 PolarHBondContact O-N 3.49Å; K11-Q14 WeakPolarHBondContact O-CB 3.32Å; K11-Q14 PolarHBondContact O-N 3.24Å; Q14-R16 VanDerWaalsContact C-N 3.25Å; Q14-R16 PolarHBondContact O-N 2.68Å; Q14-V17 PolarHBondContact O-N 3.28Å; Q14-D18 PolarHBondContact O-N 3.49Å; Q14-P120 HydrophobicContact CG-CB 4.2Å; Q14-P120 HydrophobicContact CG-CG 4.11Å; Q14-P120 VanDerWaalsContact NE2-CB 3.3Å
15	Y	45.7	Very low	51.4	Low	177 Å²	177	93.7 Å²	93.7	69%	0.694	53%	0.527	S	S	*	.	H	α-helix	trans	-58.1	-35.1	177.6	-92.4	-81.9	0	0	0	113	K11 H19	K11-Y15 WeakPolarHBondContact O-CD2 3.45Å; K11-Y15 PolarHBondContact O-N 3.34Å; Y15-H19 WeakPolarHBondContact O-CB 3.42Å; Y15-H19 PolarHBondContact O-N 2.85Å
16	R	55.9	Low	52.3	Low	196 Å²	196	93 Å²	93	74%	0.74	52%	0.516	S	S	*	.	H	α-helix	trans	-69.3	-35.5	175.6	-79.6	-175.3	178.9	-172.9	0.9	112.8	A12 A13 Q14 L20	A12-R16 WeakPolarHBondContact O-CG 3.24Å; A12-R16 PolarHBondContact O-N 3.46Å; A13-R16 PolarHBondContact O-N 2.67Å; Q14-R16 VanDerWaalsContact C-N 3.25Å; Q14-R16 PolarHBondContact O-N 2.68Å; R16-L20 WeakPolarHBondContact O-CB 3.38Å; R16-L20 WeakPolarHBondContact O-CD1 3.3Å; R16-L20 VanDerWaalsContact O-CG 3.24Å; R16-L20 WeakPolarHBondContact O-CG 3.12Å; R16-L20 PolarHBondContact O-N 3.41Å
17	V	57.5	Low	53.3	Low	48 Å²	48	92.2 Å²	92.2	29%	0.291	49%	0.491	S	S	.	.	H	α-helix	trans	-74.8	-43.4	178.4	179.1	0	0	0	0	110.6	A13 Q14 H19 L20 L21 V123	A13-V17 WeakPolarHBondContact O-CG2 3.45Å; A13-V17 PolarHBondContact O-N 2.82Å; Q14-V17 PolarHBondContact O-N 3.28Å; V17-H19 VanDerWaalsContact C-N 3.32Å; V17-H19 PolarHBondContact O-N 3.44Å; V17-L20 WeakPolarHBondContact O-CB 3.38Å; V17-L20 PolarHBondContact O-N 3.1Å; V17-L20 VanDerWaalsContact O-N 3.09Å; V17-L21 HydrophobicContact CG1-CD1 4.16Å; V17-L21 HydrophobicContact CG1-CG 4.44Å; V17-L21 WeakPolarHBondContact O-CG 3.24Å; V17-L21 PolarHBondContact O-N 3.23Å; V17-V123 HydrophobicContact CG1-CG2 4.48Å
18	D	54.1	Low	53.7	Low	67 Å²	67	87.3 Å²	87.3	36%	0.358	47%	0.47	S	S	.	.	H	α-helix	trans	-63.3	-39.4	176	-65.4	-35.6	0	0	0	111.3	Q14 L20 L21 S22	Q14-D18 PolarHBondContact O-N 3.49Å; D18-L20 VanDerWaalsContact C-N 3.35Å; D18-L21 PolarHBondContact O-N 3.02Å; D18-S22 VanDerWaalsContact O-CB 3.29Å; D18-S22 WeakPolarHBondContact O-CB 3.38Å; D18-S22 PolarHBondContact O-N 3.34Å
19	H	57.9	Low	54.3	Low	139 Å²	139	90.6 Å²	90.6	64%	0.644	48%	0.478	S	S	*	.	H	α-helix	trans	-67	-34	172.9	-172	-81.2	0	0	0	112.5	Y15 V17 A23	Y15-H19 WeakPolarHBondContact O-CB 3.42Å; Y15-H19 PolarHBondContact O-N 2.85Å; V17-H19 VanDerWaalsContact C-N 3.32Å; V17-H19 PolarHBondContact O-N 3.44Å; H19-A23 WeakPolarHBondContact O-CB 3.1Å; H19-A23 PolarHBondContact O-N 3.29Å
20	L	61.6	Low	54.5	Low	112 Å²	112	88.9 Å²	88.9	59%	0.586	47%	0.473	S	S	*	.	H	α-helix	trans	-66.8	-44.4	172.4	-81.2	165.2	0	0	0	111.2	R16 V17 D18 A23 V24	R16-L20 WeakPolarHBondContact O-CB 3.38Å; R16-L20 WeakPolarHBondContact O-CD1 3.3Å; R16-L20 VanDerWaalsContact O-CG 3.24Å; R16-L20 WeakPolarHBondContact O-CG 3.12Å; R16-L20 PolarHBondContact O-N 3.41Å; V17-L20 WeakPolarHBondContact O-CB 3.38Å; V17-L20 PolarHBondContact O-N 3.1Å; V17-L20 VanDerWaalsContact O-N 3.09Å; D18-L20 VanDerWaalsContact C-N 3.35Å; L20-A23 PolarHBondContact O-N 2.86Å; L20-V24 VanDerWaalsContact O-CB 3.29Å; L20-V24 WeakPolarHBondContact O-CB 2.8Å; L20-V24 WeakPolarHBondContact O-CG2 3.31Å; L20-V24 PolarHBondContact O-N 3.45Å
21	L	61.6	Low	54.4	Low	39 Å²	39	86.9 Å²	86.9	20%	0.204	46%	0.463	C	S	.	.	H	α-helix	trans	-66	-41.4	178.3	-70.8	173.9	0	0	0	112	V17 D18 V24 E25 V123	V17-L21 HydrophobicContact CG1-CD1 4.16Å; V17-L21 HydrophobicContact CG1-CG 4.44Å; V17-L21 WeakPolarHBondContact O-CG 3.24Å; V17-L21 PolarHBondContact O-N 3.23Å; D18-L21 PolarHBondContact O-N 3.02Å; L21-V24 WeakPolarHBondContact O-CB 3.47Å; L21-V24 PolarHBondContact O-N 2.84Å; L21-E25 WeakPolarHBondContact O-CB 3.33Å; L21-E25 PolarHBondContact O-N 3.44Å; L21-V123 HydrophobicContact CD1-CG2 4.43Å; L21-V123 HydrophobicContact CD2-CG2 3.73Å; L21-V123 HydrophobicContact CG-CG2 4.34Å
22	S	61	Low	54.9	Low	70 Å²	70	84.7 Å²	84.7	49%	0.49	47%	0.465	S	S	.	.	H	α-helix	trans	-69.3	-37.9	175.5	178.3	0	0	0	0	112.3	D18 V24 E25 S26	D18-S22 VanDerWaalsContact O-CB 3.29Å; D18-S22 WeakPolarHBondContact O-CB 3.38Å; D18-S22 PolarHBondContact O-N 3.34Å; S22-V24 VanDerWaalsContact C-N 3.33Å; S22-E25 PolarHBondContact O-N 2.93Å; S22-S26 WeakPolarHBondContact O-CB 3.47Å; S22-S26 PolarHBondContact O-N 3.11Å
23	A	61	Low	55	Low	31 Å²	31	90.5 Å²	90.5	26%	0.256	48%	0.483	S	S	.	.	H	α-helix	trans	-65.6	-38.5	172	0	0	0	0	0	111.5	H19 L20 E27	H19-A23 WeakPolarHBondContact O-CB 3.1Å; H19-A23 PolarHBondContact O-N 3.29Å; L20-A23 PolarHBondContact O-N 2.86Å; A23-E27 WeakPolarHBondContact O-CB 3.49Å; A23-E27 WeakPolarHBondContact O-CG 3.41Å; A23-E27 PolarHBondContact O-N 2.87Å
24	V	57.8	Low	55	Low	35 Å²	35	95.3 Å²	95.3	21%	0.212	49%	0.493	C	S	.	.	H	α-helix	trans	-60.4	-46.5	172.6	160.2	0	0	0	0	110.6	L20 L21 S22 E27 L28 I182	L20-V24 VanDerWaalsContact O-CB 3.29Å; L20-V24 WeakPolarHBondContact O-CB 2.8Å; L20-V24 WeakPolarHBondContact O-CG2 3.31Å; L20-V24 PolarHBondContact O-N 3.45Å; L21-V24 WeakPolarHBondContact O-CB 3.47Å; L21-V24 PolarHBondContact O-N 2.84Å; S22-V24 VanDerWaalsContact C-N 3.33Å; V24-E27 PolarHBondContact O-N 3.36Å; V24-L28 HydrophobicContact CG1-CD1 4.14Å; V24-L28 WeakPolarHBondContact O-CB 3.43Å; V24-L28 PolarHBondContact O-N 2.97Å; V24-I182 HydrophobicContact CB-CD1 3.85Å; V24-I182 HydrophobicContact CG1-CB 4.44Å; V24-I182 HydrophobicContact CG1-CD1 3.79Å; V24-I182 HydrophobicContact CG1-CG2 3.67Å; V24-I182 HydrophobicContact CG2-CD1 3.81Å
25	E	58.8	Low	55.1	Low	142 Å²	142	93.5 Å²	93.5	66%	0.664	49%	0.492	S	S	*	.	H	α-helix	trans	-66.8	-41.8	179.5	-169.4	170	-155.1	0	0	112.2	L21 S22 L28 Q29	L21-E25 WeakPolarHBondContact O-CB 3.33Å; L21-E25 PolarHBondContact O-N 3.44Å; S22-E25 PolarHBondContact O-N 2.93Å; E25-L28 VanDerWaalsContact O-CB 3.24Å; E25-L28 WeakPolarHBondContact O-CB 3.4Å; E25-L28 PolarHBondContact O-N 3.41Å; E25-Q29 PolarHBondContact O-N 3.45Å; E25-Q29 VanDerWaalsContact O-N 3.15Å
26	S	59.3	Low	55.6	Low	82 Å²	82	86.6 Å²	86.6	57%	0.573	47%	0.467	S	S	*	.	H	α-helix	trans	-66.9	-36	176	-174.2	0	0	0	0	112.6	S22 A30	S22-S26 WeakPolarHBondContact O-CB 3.47Å; S22-S26 PolarHBondContact O-N 3.11Å; S26-A30 PolarHBondContact O-N 3.22Å
27	E	59.9	Low	55.5	Low	61 Å²	61	82 Å²	82	29%	0.285	46%	0.463	S	S	.	.	H	α-helix	trans	-76	-30	173.8	-76.9	-175	163.8	0	0	112.5	A23 V24 Q29 A30 G31 R180 I182	A23-E27 WeakPolarHBondContact O-CB 3.49Å; A23-E27 WeakPolarHBondContact O-CG 3.41Å; A23-E27 PolarHBondContact O-N 2.87Å; V24-E27 PolarHBondContact O-N 3.36Å; E27-Q29 VanDerWaalsContact C-N 3.29Å; E27-Q29 PolarHBondContact O-N 3.08Å; E27-A30 PolarHBondContact O-N 3.15Å; E27-G31 PolarHBondContact O-N 3.31Å; E27-R180 VanDerWaalsContact CD-CD 3.45Å; E27-R180 VanDerWaalsContact OE1-CD 3.31Å; E27-R180 WeakPolarHBondContact OE1-CD 3.45Å; E27-R180 IonicContact OE1-CZ 2.82Å; E27-R180 IonicContact OE1-NE 3.41Å; E27-R180 IonicContact OE1-NH1 2.67Å; E27-R180 PolarHBondContact OE1-NH1 3.23Å; E27-R180 VanDerWaalsContact OE1-NH1 3.11Å; E27-R180 WeakPolarHBondContact OE2-CB 3.26Å; E27-R180 WeakPolarHBondContact OE2-CD 3.4Å; E27-R180 IonicContact OE2-NE 3.97Å; E27-R180 IonicContact OE2-NH1 3.89Å; E27-R180 PolarHBondContact OE2-NH1 2.85Å; E27-I182 HydrophobicContact CB-CD1 4.2Å
28	L	54.8	Low	55.6	Low	68 Å²	68	81.2 Å²	81.2	36%	0.356	46%	0.458	S	S	.	.	H	α-helix	trans	-55.6	-46.8	169.8	-126.7	108.7	0	0	0	110.6	V24 E25 A30 G31 S32 I182	V24-L28 HydrophobicContact CG1-CD1 4.14Å; V24-L28 WeakPolarHBondContact O-CB 3.43Å; V24-L28 PolarHBondContact O-N 2.97Å; E25-L28 VanDerWaalsContact O-CB 3.24Å; E25-L28 WeakPolarHBondContact O-CB 3.4Å; E25-L28 PolarHBondContact O-N 3.41Å; L28-A30 VanDerWaalsContact C-N 3.34Å; L28-A30 PolarHBondContact O-N 3.41Å; L28-G31 PolarHBondContact O-N 2.88Å; L28-S32 PolarHBondContact O-N 3.48Å; L28-I182 HydrophobicContact CD1-CB 3.77Å; L28-I182 HydrophobicContact CD1-CG2 3.68Å; L28-I182 VanDerWaalsContact CD1-O 3.3Å; L28-I182 WeakPolarHBondContact CD1-O 3.36Å; L28-I182 WeakPolarHBondContact CG-O 3.46Å
29	Q	54.2	Low	55.9	Low	147 Å²	147	81.2 Å²	81.2	69%	0.687	46%	0.455	S	S	*	.	H	α-helix	trans	-67.2	-36.1	179.9	-159.5	66.4	28.9	0	0	111.9	E25 E27	E25-Q29 PolarHBondContact O-N 3.45Å; E25-Q29 VanDerWaalsContact O-N 3.15Å; E27-Q29 VanDerWaalsContact C-N 3.29Å; E27-Q29 PolarHBondContact O-N 3.08Å
30	A	52.5	Low	56.2	Low	71 Å²	71	85 Å²	85	59%	0.587	46%	0.464	S	S	*	.	H	α-helix	trans	-78.8	-28.5	179.5	0	0	0	0	0	113.9	S26 E27 L28	S26-A30 PolarHBondContact O-N 3.22Å; E27-A30 PolarHBondContact O-N 3.15Å; L28-A30 VanDerWaalsContact C-N 3.34Å; L28-A30 PolarHBondContact O-N 3.41Å
31	G	48.2	Very low	57.2	Low	28 Å²	28	84.7 Å²	84.7	29%	0.289	46%	0.463	S	S	.	.	H	α-helix	trans	-73.9	-31	177.4	0	0	0	0	0	113.5	E27 L28 E33 K34 G35	E27-G31 PolarHBondContact O-N 3.31Å; L28-G31 PolarHBondContact O-N 2.88Å; G31-E33 VanDerWaalsContact C-N 3.33Å; G31-E33 PolarHBondContact O-N 3.12Å; G31-K34 PolarHBondContact O-N 2.9Å; G31-G35 PolarHBondContact O-N 3.45Å
32	S	50.7	Low	58.6	Low	89 Å²	89	83.9 Å²	83.9	62%	0.622	46%	0.459	S	S	*	.	H	α-helix	trans	-62.4	-33.3	-176.2	-167.9	0	0	0	0	113.7	L28 K34	L28-S32 PolarHBondContact O-N 3.48Å; S32-K34 VanDerWaalsContact C-N 3.32Å; S32-K34 PolarHBondContact O-N 3.37Å
33	E	47	Very low	60.2	Low	179 Å²	179	87.5 Å²	87.5	84%	0.836	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-12.1	-174.7	-66.5	-168.4	157.7	0	0	114.7	G31	G31-E33 VanDerWaalsContact C-N 3.33Å; G31-E33 PolarHBondContact O-N 3.12Å
34	K	47.6	Very low	61.9	Low	156 Å²	156	87 Å²	87	68%	0.678	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.9	22.8	-176	-119.7	-172.7	-165.3	-172.6	0	115	G31 S32 R179	G31-K34 PolarHBondContact O-N 2.9Å; S32-K34 VanDerWaalsContact C-N 3.32Å; S32-K34 PolarHBondContact O-N 3.37Å; K34-R179 PolarHBondContact O-NH1 2.86Å
35	G	51	Low	63.8	Low	27 Å²	27	88 Å²	88	28%	0.278	47%	0.468	S	S	.	.			trans	-15.7	126.7	-170.8	0	0	0	0	0	116.9	G31	G31-G35 PolarHBondContact O-N 3.45Å
36	D	55	Low	65.7	Low	32 Å²	32	81.8 Å²	81.8	17%	0.171	44%	0.439	C	S	.	.			trans	-56.4	130.7	167.6	-168.6	-35.8	0	0	0	108.1	T38 E39 R174 M181	D36-T38 PolarHBondContact O-N 2.83Å; D36-T38 PolarHBondContact OD1-N 3.43Å; D36-T38 VanDerWaalsContact OD1-N 3.1Å; D36-T38 PolarHBondContact OD1-OG1 2.91Å; D36-T38 PolarHBondContact OD2-OG1 2.84Å; D36-E39 VanDerWaalsContact O-CB 3.24Å; D36-E39 WeakPolarHBondContact O-CB 3.5Å; D36-E39 PolarHBondContact O-N 3.35Å; D36-R174 IonicContact OD1-NH1 3.85Å; D36-R174 IonicContact OD2-CZ 3.99Å; D36-R174 IonicContact OD2-NH1 3.39Å; D36-R174 PolarHBondContact OD2-NH1 2.84Å; D36-M181 HydrophobicContact CB-SD 4.16Å
37	P	55	Low	67.5	Low	100 Å²	100	80 Å²	80	65%	0.649	42%	0.423	S	S	*	.	H	α-helix	trans	-53.1	-27.1	177.7	17.2	-29.7	0	0	0	113	E39 R40	P37-E39 VanDerWaalsContact C-N 3.3Å; P37-E39 PolarHBondContact O-N 3.33Å; P37-R40 PolarHBondContact O-N 2.82Å
38	T	58.2	Low	69.3	Low	30 Å²	30	81.1 Å²	81.1	18%	0.184	43%	0.428	C	S	.	.	H	α-helix	trans	-70.4	-18.4	174.2	42.4	0	0	0	0	115.1	D36 R40 L42 D83	D36-T38 PolarHBondContact O-N 2.83Å; D36-T38 PolarHBondContact OD1-N 3.43Å; D36-T38 VanDerWaalsContact OD1-N 3.1Å; D36-T38 PolarHBondContact OD1-OG1 2.91Å; D36-T38 PolarHBondContact OD2-OG1 2.84Å; T38-R40 VanDerWaalsContact C-N 3.32Å; T38-L42 PolarHBondContact O-N 3.28Å; T38-D83 HydrophobicContact CG2-CB 4.14Å
39	E	60.9	Low	71.3	Confident	67 Å²	67	83.6 Å²	83.6	31%	0.313	43%	0.433	S	S	.	.	H	α-helix	trans	-70.1	-31.4	175.1	-162.5	176.1	-177.1	0	0	111.9	D36 P37 D41 L42 M181 T183	D36-E39 VanDerWaalsContact O-CB 3.24Å; D36-E39 WeakPolarHBondContact O-CB 3.5Å; D36-E39 PolarHBondContact O-N 3.35Å; P37-E39 VanDerWaalsContact C-N 3.3Å; P37-E39 PolarHBondContact O-N 3.33Å; E39-D41 VanDerWaalsContact C-N 3.31Å; E39-D41 PolarHBondContact O-N 2.99Å; E39-L42 PolarHBondContact O-N 3.35Å; E39-M181 HydrophobicContact CB-SD 3.75Å; E39-M181 HydrophobicContact CG-SD 4.04Å; E39-T183 HydrophobicContact CG-CG2 3.92Å
40	R	64.1	Low	73.4	Confident	219 Å²	219	84.3 Å²	84.3	83%	0.826	44%	0.436	S	S	*	.	H	α-helix	trans	-71.2	-27.3	-178.1	-64.9	-171.3	177.4	-180	-0.6	113.3	P37 T38	P37-R40 PolarHBondContact O-N 2.82Å; T38-R40 VanDerWaalsContact C-N 3.32Å
41	D	82.8	Confident	75.6	Confident	106 Å²	106	82.1 Å²	82.1	57%	0.567	42%	0.415	S	S	*	.	H	α-helix	trans	-96.2	-9.2	-179.5	-67.4	-34.5	0	0	0	112.9	E39 K43 G81	E39-D41 VanDerWaalsContact C-N 3.31Å; E39-D41 PolarHBondContact O-N 2.99Å; D41-K43 PolarHBondContact O-N 3.38Å; D41-G81 WeakPolarHBondContact O-CA 3.07Å
42	L	91.3	Very high	78	Confident	21 Å²	21	80.8 Å²	80.8	11%	0.11	40%	0.401	C	S	.	.			trans	-63.5	119.8	-179.2	178.3	61.6	0	0	0	111.1	T38 E39 V44 V79 S80 L82 I172 T183	T38-L42 PolarHBondContact O-N 3.28Å; E39-L42 PolarHBondContact O-N 3.35Å; L42-V44 HydrophobicContact CD1-CG2 4.2Å; L42-V44 HydrophobicContact CG-CG2 4.38Å; L42-V79 HydrophobicContact CD1-CG1 3.9Å; L42-S80 WeakPolarHBondContact CA-O 3.22Å; L42-S80 WeakPolarHBondContact CD1-O 3.18Å; L42-L82 HydrophobicContact CD1-CD2 3.64Å; L42-L82 HydrophobicContact CD1-CG 4.1Å; L42-I172 HydrophobicContact CD1-CD1 4.21Å; L42-I172 HydrophobicContact CD2-CD1 4.31Å; L42-T183 HydrophobicContact CD2-CG2 3.85Å; L42-T183 WeakPolarHBondContact CD2-OG1 3.3Å
43	K	94.4	Very high	80.3	Confident	146 Å²	146	79.8 Å²	79.8	64%	0.635	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.6	130.1	174	-64	174.1	-174.3	176.1	0	109.9	D41 V79 S80	D41-K43 PolarHBondContact O-N 3.38Å; K43-V79 WeakPolarHBondContact O-CA 3.39Å; K43-S80 WeakPolarHBondContact CB-OG 3.29Å; K43-S80 PolarHBondContact N-O 2.99Å; K43-S80 PolarHBondContact O-N 2.83Å
44	V	97.1	Very high	82.7	Confident	22 Å²	22	75.4 Å²	75.4	13%	0.133	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	122.5	176.4	-171.6	0	0	0	0	108.3	L42 V77 N78 V79 I172 H185 F187	L42-V44 HydrophobicContact CD1-CG2 4.2Å; L42-V44 HydrophobicContact CG-CG2 4.38Å; V44-V77 HydrophobicContact CG1-CB 3.88Å; V44-V77 HydrophobicContact CG1-CG1 4.15Å; V44-V77 HydrophobicContact CG1-CG2 4.12Å; V44-N78 WeakPolarHBondContact CA-O 3.4Å; V44-V79 HydrophobicContact CG1-CG2 4.44Å; V44-V79 HydrophobicContact CG2-CG1 4.43Å; V44-I172 HydrophobicContact CG2-CD1 3.72Å; V44-H185 HydrophobicContact CB-CB 4.37Å; V44-H185 HydrophobicContact CG1-CB 4.38Å; V44-F187 HydrophobicContact CG1-CZ 4.1Å
45	S	97.8	Very high	85.2	Confident	55 Å²	55	68 Å²	68	39%	0.385	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	138	180	61.2	0	0	0	0	111.5	D47 V77 N78	S45-D47 PolarHBondContact O-N 2.83Å; S45-V77 CarbonylContact O-C 3.52Å; S45-V77 VanDerWaalsContact O-CA 3.29Å; S45-V77 WeakPolarHBondContact O-CA 3.43Å; S45-N78 PolarHBondContact N-O 3.32Å; S45-N78 PolarHBondContact O-N 2.92Å
46	L	98.4	Very high	87.4	Confident	11 Å²	11	70.2 Å²	70.2	6%	0.058	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	127.4	175.1	-176.2	67.3	0	0	0	111.4	R49 W52 L75 F187 E189 T190	L46-R49 HydrophobicContact CD2-CB 4.41Å; L46-R49 HydrophobicContact CD2-CG 4.36Å; L46-W52 HydrophobicContact CD2-CB 4.16Å; L46-W52 HydrophobicContact CD2-CG 4.04Å; L46-L75 HydrophobicContact CD1-CD1 3.75Å; L46-F187 HydrophobicContact CB-CD1 3.79Å; L46-F187 HydrophobicContact CB-CD2 4.27Å; L46-F187 HydrophobicContact CB-CE1 3.91Å; L46-F187 HydrophobicContact CB-CE2 4.38Å; L46-F187 HydrophobicContact CB-CG 3.98Å; L46-F187 HydrophobicContact CB-CZ 4.21Å; L46-F187 HydrophobicContact CD1-CD2 4.27Å; L46-F187 HydrophobicContact CD1-CG 4.49Å; L46-F187 HydrophobicContact CD2-CB 4.22Å; L46-F187 HydrophobicContact CD2-CG 4.39Å; L46-E189 HydrophobicContact CD2-CG 3.42Å; L46-E189 VanDerWaalsContact CD2-CG 3.42Å; L46-E189 WeakPolarHBondContact CD2-OE1 3.43Å; L46-T190 HydrophobicContact CD1-CG2 3.75Å; L46-T190 HydrophobicContact CD2-CG2 3.58Å; L46-T190 HydrophobicContact CG-CG2 4.34Å
47	D	97.7	Very high	89.5	Confident	45 Å²	45	74 Å²	74	24%	0.241	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	153.2	172.1	-173.3	30.7	0	0	0	110.5	S45 R49 K76	S45-D47 PolarHBondContact O-N 2.83Å; D47-R49 PolarHBondContact O-N 2.77Å; D47-K76 HydrophobicContact CB-CB 3.76Å; D47-K76 PolarHBondContact N-O 3.2Å; D47-K76 WeakPolarHBondContact OD2-CD 3.37Å
48	E	96.8	Very high	91.5	Very high	84 Å²	84	71.4 Å²	71.4	39%	0.393	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.3	35.6	-176	-62.1	173.9	-157.8	0	0	114.1	E50 L51 W52 K76	E48-E50 VanDerWaalsContact C-N 3.26Å; E48-E50 PolarHBondContact O-N 2.83Å; E48-E50 VanDerWaalsContact O-N 3.15Å; E48-L51 HydrophobicContact CB-CB 4.47Å; E48-L51 WeakPolarHBondContact O-CB 3.13Å; E48-L51 PolarHBondContact O-N 2.9Å; E48-W52 PolarHBondContact O-N 2.91Å; E48-K76 IonicContact OE1-NZ 3.11Å; E48-K76 PolarHBondContact OE1-NZ 2.82Å
49	R	97.7	Very high	93.4	Very high	120 Å²	120	72.6 Å²	72.6	45%	0.453	34%	0.342	S	S	.	.	H	α-helix	trans	-51.9	-39.8	-175.9	-176.9	-178.5	-62	-117.1	8.6	113.9	L46 D47 L51 W52 Q53 E189	L46-R49 HydrophobicContact CD2-CB 4.41Å; L46-R49 HydrophobicContact CD2-CG 4.36Å; D47-R49 PolarHBondContact O-N 2.77Å; R49-L51 VanDerWaalsContact C-N 3.28Å; R49-L51 PolarHBondContact O-N 3.47Å; R49-W52 WeakPolarHBondContact O-CB 3.29Å; R49-W52 PolarHBondContact O-N 2.75Å; R49-Q53 PolarHBondContact O-N 2.9Å; R49-E189 WeakPolarHBondContact CD-OE1 3.44Å; R49-E189 HydrophobicContact CG-CG 4.42Å; R49-E189 WeakPolarHBondContact CG-OE1 3.42Å; R49-E189 IonicContact CZ-OE1 3.77Å; R49-E189 IonicContact NE-OE1 3.97Å; R49-E189 PolarHBondContact NE-OE1 3.48Å; R49-E189 IonicContact NH1-OE1 3.54Å; R49-E189 PolarHBondContact NH1-OE1 2.83Å; R49-E189 IonicContact NH1-OE2 2.82Å; R49-E189 IonicContact NH2-OE1 2.99Å
50	E	98.1	Very high	95.2	Very high	162 Å²	162	69.5 Å²	69.5	76%	0.757	33%	0.328	S	S	*	.	H	α-helix	trans	-62.1	-35.3	179.7	-64.3	-178.6	-175.3	0	0	112.8	E48 Q53 K54	E48-E50 VanDerWaalsContact C-N 3.26Å; E48-E50 PolarHBondContact O-N 2.83Å; E48-E50 VanDerWaalsContact O-N 3.15Å; E50-Q53 PolarHBondContact O-N 3.2Å; E50-K54 WeakPolarHBondContact O-CG 3.32Å; E50-K54 PolarHBondContact O-N 3.13Å
51	L	98.3	Very high	96.9	Very high	25 Å²	25	59 Å²	59	13%	0.131	29%	0.289	C	S	.	.	H	α-helix	trans	-68.6	-44.2	175.7	-178.9	60.8	0	0	0	110.2	E48 R49 Q53 K54 F55 F72 P73 Y210	E48-L51 HydrophobicContact CB-CB 4.47Å; E48-L51 WeakPolarHBondContact O-CB 3.13Å; E48-L51 PolarHBondContact O-N 2.9Å; R49-L51 VanDerWaalsContact C-N 3.28Å; R49-L51 PolarHBondContact O-N 3.47Å; L51-Q53 VanDerWaalsContact C-N 3.29Å; L51-Q53 PolarHBondContact O-N 3.29Å; L51-K54 PolarHBondContact O-N 2.82Å; L51-F55 HydrophobicContact CD1-CD2 4.23Å; L51-F55 HydrophobicContact CD1-CE2 3.8Å; L51-F55 HydrophobicContact CG-CD2 4.28Å; L51-F55 HydrophobicContact CG-CE2 4.09Å; L51-F55 VanDerWaalsContact O-CD2 3.28Å; L51-F55 WeakPolarHBondContact O-CD2 3.03Å; L51-F55 PolarHBondContact O-N 2.61Å; L51-F72 HydrophobicContact CD2-CZ 4.42Å; L51-P73 HydrophobicContact CD2-CB 4.02Å; L51-P73 HydrophobicContact CD2-CG 3.94Å; L51-P73 HydrophobicContact CG-CB 4.41Å; L51-P73 HydrophobicContact CG-CG 3.87Å; L51-Y210 HydrophobicContact CD1-CD1 4.02Å; L51-Y210 HydrophobicContact CD1-CD2 3.87Å; L51-Y210 HydrophobicContact CD1-CE1 4.45Å; L51-Y210 HydrophobicContact CD1-CE2 4.31Å; L51-Y210 HydrophobicContact CD1-CG 3.71Å
52	W	98.6	Very high	97.6	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-58.3	-41.6	173.8	-78.9	103.4	0	0	0	112.2	L46 E48 R49 K54 F55 K56 N60 M62 P73 L75 E189 T190	L46-W52 HydrophobicContact CD2-CB 4.16Å; L46-W52 HydrophobicContact CD2-CG 4.04Å; E48-W52 PolarHBondContact O-N 2.91Å; R49-W52 WeakPolarHBondContact O-CB 3.29Å; R49-W52 PolarHBondContact O-N 2.75Å; W52-K54 PolarHBondContact O-N 2.86Å; W52-F55 PolarHBondContact O-N 3.39Å; W52-F55 VanDerWaalsContact O-N 3.14Å; W52-K56 PolarHBondContact O-N 2.93Å; W52-N60 WeakPolarHBondContact CZ3-ND2 3.32Å; W52-M62 HydrophobicContact CH2-CE 3.66Å; W52-M62 HydrophobicContact CZ3-CE 3.77Å; W52-P73 HydrophobicContact CD2-CB 4.2Å; W52-P73 HydrophobicContact CD2-CG 4.15Å; W52-P73 HydrophobicContact CE3-CG 4.39Å; W52-P73 HydrophobicContact CH2-CB 4.45Å; W52-P73 HydrophobicContact CZ2-CB 3.85Å; W52-P73 HydrophobicContact CZ2-CG 4.44Å; W52-P73 WeakPolarHBondContact CZ2-O 3.37Å; W52-L75 HydrophobicContact CZ2-CB 4.4Å; W52-E189 HydrophobicContact CB-CG 4.15Å; W52-T190 HydrophobicContact CD2-CG2 3.84Å; W52-T190 HydrophobicContact CE3-CG2 3.96Å; W52-T190 HydrophobicContact CG-CG2 4.23Å; W52-T190 HydrophobicContact CZ2-CG2 4.44Å; W52-T190 HydrophobicContact CZ3-CG2 4.28Å
53	Q	98.4	Very high	98	Very high	69 Å²	69	54.3 Å²	54.3	32%	0.322	26%	0.263	S	S	.	.	H	α-helix	trans	-60.7	-44.5	178	-168.4	60.6	49.6	0	0	112.1	R49 E50 L51 F55 K56 D57	R49-Q53 PolarHBondContact O-N 2.9Å; E50-Q53 PolarHBondContact O-N 3.2Å; L51-Q53 VanDerWaalsContact C-N 3.29Å; L51-Q53 PolarHBondContact O-N 3.29Å; Q53-F55 PolarHBondContact O-N 2.94Å; Q53-K56 WeakPolarHBondContact O-CB 3.2Å; Q53-K56 PolarHBondContact O-N 3.04Å; Q53-D57 PolarHBondContact NE2-OD1 3.42Å; Q53-D57 PolarHBondContact O-N 3.16Å
54	K	98.4	Very high	98.1	Very high	86 Å²	86	47.5 Å²	47.5	37%	0.374	23%	0.233	S	C	.	.	H	α-helix	trans	-56.6	-38.5	174.9	-69.7	171.4	-177.8	174.4	0	112.9	E50 L51 W52 L206 Y210	E50-K54 WeakPolarHBondContact O-CG 3.32Å; E50-K54 PolarHBondContact O-N 3.13Å; L51-K54 PolarHBondContact O-N 2.82Å; W52-K54 PolarHBondContact O-N 2.86Å; K54-L206 HydrophobicContact CB-CD1 4.44Å; K54-Y210 PolarHBondContact NZ-OH 3.48Å
55	F	98.5	Very high	98	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-73.2	-38	175.1	-81.5	-74.4	0	0	0	112.3	L51 W52 Q53 L58 T59 N60 F72 P73 I203 L206 K207	L51-F55 HydrophobicContact CD1-CD2 4.23Å; L51-F55 HydrophobicContact CD1-CE2 3.8Å; L51-F55 HydrophobicContact CG-CD2 4.28Å; L51-F55 HydrophobicContact CG-CE2 4.09Å; L51-F55 VanDerWaalsContact O-CD2 3.28Å; L51-F55 WeakPolarHBondContact O-CD2 3.03Å; L51-F55 PolarHBondContact O-N 2.61Å; W52-F55 PolarHBondContact O-N 3.39Å; W52-F55 VanDerWaalsContact O-N 3.14Å; Q53-F55 PolarHBondContact O-N 2.94Å; F55-L58 PolarHBondContact O-N 3.01Å; F55-T59 PolarHBondContact O-N 3.43Å; F55-N60 HydrophobicContact CB-CB 3.96Å; F55-N60 WeakPolarHBondContact CD1-OD1 3.33Å; F55-N60 WeakPolarHBondContact O-CA 3.33Å; F55-N60 PolarHBondContact O-N 3.24Å; F55-F72 HydrophobicContact CE2-CD1 4.37Å; F55-F72 AromaticContact CE2-CE1 3.89Å; F55-F72 HydrophobicContact CE2-CE1 3.89Å; F55-F72 HydrophobicContact CZ-CD1 4.06Å; F55-F72 AromaticContact CZ-CE1 3.74Å; F55-F72 HydrophobicContact CZ-CE1 3.74Å; F55-P73 HydrophobicContact CD2-CG 3.43Å; F55-P73 VanDerWaalsContact CD2-CG 3.43Å; F55-P73 HydrophobicContact CE2-CG 3.53Å; F55-P73 HydrophobicContact CG-CG 4.38Å; F55-I203 HydrophobicContact CD1-CD1 3.94Å; F55-L206 HydrophobicContact CD1-CB 4.35Å; F55-L206 HydrophobicContact CD1-CD1 4.17Å; F55-L206 HydrophobicContact CE1-CB 3.57Å; F55-L206 HydrophobicContact CE1-CD1 4.2Å; F55-L206 HydrophobicContact CZ-CB 3.68Å; F55-K207 HydrophobicContact CD1-CD 4.49Å; F55-K207 HydrophobicContact CE1-CD 3.52Å; F55-K207 HydrophobicContact CE1-CG 3.96Å; F55-K207 HydrophobicContact CZ-CD 3.82Å; F55-K207 HydrophobicContact CZ-CG 4.39Å
56	K	98.1	Very high	97.8	Very high	75 Å²	75	52.9 Å²	52.9	33%	0.326	25%	0.252	S	S	.	.	H	α-helix	trans	-61	-44.6	177.9	-167.8	-157.2	-165.2	170.3	0	111.5	W52 Q53 L58 T59 L188 E189	W52-K56 PolarHBondContact O-N 2.93Å; Q53-K56 WeakPolarHBondContact O-CB 3.2Å; Q53-K56 PolarHBondContact O-N 3.04Å; K56-L58 PolarHBondContact O-N 3.31Å; K56-L58 VanDerWaalsContact O-N 3.13Å; K56-T59 PolarHBondContact O-N 3.32Å; K56-L188 WeakPolarHBondContact CE-O 3.1Å; K56-E189 HydrophobicContact CD-CB 3.93Å
57	D	98.2	Very high	97.5	Very high	110 Å²	110	58.1 Å²	58.1	59%	0.588	28%	0.28	S	S	*	.	H	α-helix	trans	-58.9	-27	-177.5	-64.1	-19.7	0	0	0	112.5	Q53	Q53-D57 PolarHBondContact NE2-OD1 3.42Å; Q53-D57 PolarHBondContact O-N 3.16Å
58	L	97.8	Very high	97.4	Very high	47 Å²	47	56.5 Å²	56.5	25%	0.246	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.4	12.5	178.8	-60.1	-175.6	0	0	0	113.8	F55 K56 N200 E202 I203 L206	F55-L58 PolarHBondContact O-N 3.01Å; K56-L58 PolarHBondContact O-N 3.31Å; K56-L58 VanDerWaalsContact O-N 3.13Å; L58-N200 PolarHBondContact O-ND2 3.31Å; L58-E202 HydrophobicContact CD1-CB 3.75Å; L58-E202 VanDerWaalsContact CD2-OE2 3.26Å; L58-E202 WeakPolarHBondContact CD2-OE2 3.5Å; L58-I203 HydrophobicContact CB-CD1 3.58Å; L58-I203 HydrophobicContact CB-CG1 4.09Å; L58-L206 HydrophobicContact CD1-CD1 3.63Å; L58-L206 HydrophobicContact CD1-CG 4.33Å
59	T	98.2	Very high	97.3	Very high	54 Å²	54	58.8 Å²	58.8	33%	0.331	28%	0.279	S	S	.	.			trans	57.4	88.8	-169.7	-54.7	0	0	0	0	111.7	F55 K56 W109 I193	F55-T59 PolarHBondContact O-N 3.43Å; K56-T59 PolarHBondContact O-N 3.32Å; T59-W109 HydrophobicContact CG2-CB 4.46Å; T59-W109 HydrophobicContact CG2-CG 4.03Å; T59-I193 HydrophobicContact CG2-CD1 3.72Å; T59-I193 HydrophobicContact CG2-CG1 4.27Å
60	N	98.7	Very high	97.3	Very high	2 Å²	2	59.9 Å²	59.9	1%	0.011	28%	0.283	C	S	.	.			trans	-55.3	144.9	-174	-166	10	0	0	0	113	W52 F55 Q191 F192 I193 K207	W52-N60 WeakPolarHBondContact CZ3-ND2 3.32Å; F55-N60 HydrophobicContact CB-CB 3.96Å; F55-N60 WeakPolarHBondContact CD1-OD1 3.33Å; F55-N60 WeakPolarHBondContact O-CA 3.33Å; F55-N60 PolarHBondContact O-N 3.24Å; N60-Q191 WeakPolarHBondContact CB-O 3.49Å; N60-F192 HydrophobicContact CB-CB 3.98Å; N60-F192 CarbonylContact O-C 3.6Å; N60-F192 WeakPolarHBondContact O-CA 3.36Å; N60-F192 WeakPolarHBondContact O-CB 3.23Å; N60-I193 PolarHBondContact O-N 2.85Å; N60-K207 PolarHBondContact OD1-NZ 3.23Å
61	E	98.7	Very high	97.3	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	138.9	177.7	-57.8	179.7	-164.8	0	0	110.6	W109 I193 V195 Y198 Q199 N200 I203 K207	E61-W109 HydrophobicContact CG-CZ2 4.06Å; E61-W109 WeakPolarHBondContact OE1-CZ2 3.16Å; E61-W109 PolarHBondContact OE1-NE1 2.94Å; E61-I193 WeakPolarHBondContact CA-O 3.49Å; E61-V195 HydrophobicContact CB-CG2 3.96Å; E61-Y198 HydrophobicContact CB-CD1 3.94Å; E61-Y198 HydrophobicContact CB-CE1 4.22Å; E61-Y198 VanDerWaalsContact OE2-CA 3.23Å; E61-Y198 WeakPolarHBondContact OE2-CA 3.38Å; E61-Q199 PolarHBondContact OE2-N 2.93Å; E61-N200 VanDerWaalsContact OE1-CB 3.29Å; E61-N200 WeakPolarHBondContact OE1-CB 3.47Å; E61-N200 PolarHBondContact OE1-N 3.39Å; E61-I203 HydrophobicContact CB-CG2 4.09Å; E61-I203 HydrophobicContact CG-CG1 4.47Å; E61-I203 HydrophobicContact CG-CG2 4.37Å; E61-K207 WeakPolarHBondContact O-CE 3.22Å; E61-K207 PolarHBondContact O-NZ 2.69Å
62	M	98.6	Very high	97.3	Very high	3 Å²	3	52.9 Å²	52.9	2%	0.015	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129.3	173.8	-64.8	-68.8	-178.7	0	0	110.9	W52 M71 F72 L148 F192 I193 A194 V195	W52-M62 HydrophobicContact CH2-CE 3.66Å; W52-M62 HydrophobicContact CZ3-CE 3.77Å; M62-M71 HydrophobicContact CE-CB 4.27Å; M62-M71 HydrophobicContact SD-CB 4.05Å; M62-M71 HydrophobicContact SD-CG 4.42Å; M62-F72 VanDerWaalsContact CE-O 3.26Å; M62-F72 WeakPolarHBondContact CE-O 3.37Å; M62-L148 HydrophobicContact CB-CD1 3.96Å; M62-L148 HydrophobicContact CG-CD1 4.44Å; M62-F192 HydrophobicContact CB-CD2 3.38Å; M62-F192 HydrophobicContact CB-CE2 3.6Å; M62-F192 HydrophobicContact CB-CG 4.02Å; M62-F192 HydrophobicContact CB-CZ 4.4Å; M62-F192 HydrophobicContact CG-CB 3.83Å; M62-F192 HydrophobicContact CG-CD1 3.85Å; M62-F192 HydrophobicContact CG-CD2 3.28Å; M62-F192 HydrophobicContact CG-CE1 4.24Å; M62-F192 HydrophobicContact CG-CE2 3.72Å; M62-F192 HydrophobicContact CG-CG 3.35Å; M62-F192 HydrophobicContact CG-CZ 4.17Å; M62-I193 PolarHBondContact N-O 2.82Å; M62-A194 CarbonylContact O-C 3.56Å; M62-A194 WeakPolarHBondContact O-CA 3.35Å; M62-V195 PolarHBondContact O-N 2.81Å
63	I	98.4	Very high	97.3	Very high	25 Å²	25	52.9 Å²	52.9	13%	0.128	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	130.2	178.9	-62.8	-74.7	0	0	0	109.8	T65 R69 V195 Y198	I63-T65 HydrophobicContact CG2-CG2 3.79Å; I63-R69 HydrophobicContact CB-CG 4.04Å; I63-R69 HydrophobicContact CG2-CB 4.39Å; I63-R69 HydrophobicContact CG2-CG 3.99Å; I63-R69 VanDerWaalsContact O-CB 3.3Å; I63-R69 WeakPolarHBondContact O-CB 3.31Å; I63-V195 CarbonylContact C-O 3.56Å; I63-V195 VanDerWaalsContact CA-O 3.24Å; I63-V195 WeakPolarHBondContact CA-O 3.32Å; I63-V195 HydrophobicContact CD1-CG2 3.95Å; I63-Y198 HydrophobicContact CD1-CD1 4.04Å; I63-Y198 HydrophobicContact CD1-CD2 4.2Å; I63-Y198 HydrophobicContact CD1-CE1 4.02Å; I63-Y198 HydrophobicContact CD1-CE2 4.19Å; I63-Y198 HydrophobicContact CD1-CG 4.12Å; I63-Y198 HydrophobicContact CG1-CD1 4.25Å; I63-Y198 HydrophobicContact CG1-CD2 4.46Å; I63-Y198 HydrophobicContact CG1-CE1 3.71Å; I63-Y198 HydrophobicContact CG1-CE2 3.95Å
64	V	97	Very high	97.3	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.012	25%	0.245	C	C	.	.			trans	-109.3	137.3	166.8	-65.5	0	0	0	0	109.7	L148 N150 L160 S162 A194 V195 T196	V64-L148 HydrophobicContact CG1-CB 3.83Å; V64-N150 HydrophobicContact CB-CB 4.31Å; V64-N150 HydrophobicContact CG2-CB 3.92Å; V64-L160 HydrophobicContact CG1-CB 4.4Å; V64-S162 VanDerWaalsContact CG2-OG 3.3Å; V64-S162 WeakPolarHBondContact CG2-OG 3.45Å; V64-A194 HydrophobicContact CG1-CB 4.06Å; V64-V195 WeakPolarHBondContact CG2-O 3.37Å; V64-V195 PolarHBondContact N-O 3.43Å; V64-T196 HydrophobicContact CG2-CG2 4.24Å
65	T	95.7	Very high	97.3	Very high	48 Å²	48	47.2 Å²	47.2	29%	0.294	23%	0.227	S	C	.	.			trans	-135.1	161.4	178.4	65.4	0	0	0	0	110.7	I63 N67 G68 R69 T149	I63-T65 HydrophobicContact CG2-CG2 3.79Å; T65-N67 PolarHBondContact O-N 3.02Å; T65-G68 PolarHBondContact O-N 3.32Å; T65-G68 PolarHBondContact OG1-N 3.08Å; T65-G68 PolarHBondContact OG1-O 3.47Å; T65-R69 HydrophobicContact CG2-CB 4.17Å; T65-T149 VanDerWaalsContact O-CA 3.3Å; T65-T149 WeakPolarHBondContact O-CA 3.27Å; T65-T149 WeakPolarHBondContact O-CB 3.31Å; T65-T149 PolarHBondContact O-OG1 3.45Å; T65-T149 VanDerWaalsContact O-OG1 3.06Å
66	K	93.3	Very high	97.3	Very high	143 Å²	143	49.7 Å²	49.7	62%	0.622	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-39	176.5	-176.1	179.6	178.6	-176.8	0	112.8	T149 K151 N153	K66-T149 PolarHBondContact O-OG1 3.19Å; K66-K151 HydrophobicContact CG-CG 4.41Å; K66-N153 PolarHBondContact O-ND2 3.09Å
67	N	92.3	Very high	97.3	Very high	120 Å²	120	46.1 Å²	46.1	64%	0.642	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93	3.4	-176.3	-64.9	-16.3	0	0	0	113.5	T65 Q157	T65-N67 PolarHBondContact O-N 3.02Å; N67-Q157 PolarHBondContact O-NE2 3Å; N67-Q157 VanDerWaalsContact O-NE2 3.14Å
68	G	94.8	Very high	97.4	Very high	11 Å²	11	43.8 Å²	43.8	11%	0.113	21%	0.21	C	C	.	.			trans	82.3	134.2	-174	0	0	0	0	0	113	T65 L148	T65-G68 PolarHBondContact O-N 3.32Å; T65-G68 PolarHBondContact OG1-N 3.08Å; T65-G68 PolarHBondContact OG1-O 3.47Å; G68-L148 CarbonylContact C-O 3.52Å; G68-L148 VanDerWaalsContact CA-O 3.27Å; G68-L148 WeakPolarHBondContact CA-O 3.4Å
69	R	96.6	Very high	97.3	Very high	133 Å²	133	42 Å²	42	50%	0.502	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	138.5	177.1	-174.2	70.4	176.1	-172.7	-0.9	110.1	I63 T65 K147 L148	I63-R69 HydrophobicContact CB-CG 4.04Å; I63-R69 HydrophobicContact CG2-CB 4.39Å; I63-R69 HydrophobicContact CG2-CG 3.99Å; I63-R69 VanDerWaalsContact O-CB 3.3Å; I63-R69 WeakPolarHBondContact O-CB 3.31Å; T65-R69 HydrophobicContact CG2-CB 4.17Å; R69-K147 CarbonylContact O-C 3.59Å; R69-K147 WeakPolarHBondContact O-CA 3.48Å; R69-L148 PolarHBondContact N-O 2.87Å; R69-L148 PolarHBondContact O-N 3.45Å
70	R	97.1	Very high	97.2	Very high	142 Å²	142	42.1 Å²	42.1	54%	0.536	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	146.4	174.9	-71.2	180	175	169.4	-0.3	110.5	S144 V146 K147	R70-S144 VanDerWaalsContact CD-O 3.29Å; R70-S144 WeakPolarHBondContact CD-O 3.19Å; R70-S144 PolarHBondContact NE-O 3.29Å; R70-V146 WeakPolarHBondContact CA-O 3.29Å; R70-K147 HydrophobicContact CG-CG 4.29Å
71	M	98.2	Very high	97	Very high	11 Å²	11	43.1 Å²	43.1	5%	0.054	22%	0.215	C	C	.	.			trans	-69.2	150.5	174	-58.9	-168.6	-52.6	0	0	111.4	M62 P73 L75 L92 F94 V146 L148	M62-M71 HydrophobicContact CE-CB 4.27Å; M62-M71 HydrophobicContact SD-CB 4.05Å; M62-M71 HydrophobicContact SD-CG 4.42Å; M71-P73 CarbonylContact C-O 3.54Å; M71-L75 HydrophobicContact CE-CB 3.67Å; M71-L92 HydrophobicContact CE-CD2 4.48Å; M71-F94 HydrophobicContact CE-CZ 4.27Å; M71-F94 HydrophobicContact SD-CE1 3.71Å; M71-F94 HydrophobicContact SD-CZ 3.54Å; M71-F94 VanDerWaalsContact SD-CZ 3.54Å; M71-V146 HydrophobicContact CE-CG1 3.67Å; M71-V146 HydrophobicContact CG-CG1 4.12Å; M71-V146 HydrophobicContact SD-CG1 4.22Å; M71-L148 HydrophobicContact CG-CD1 3.67Å; M71-L148 HydrophobicContact CG-CD2 4.4Å; M71-L148 HydrophobicContact CG-CG 3.94Å; M71-L148 HydrophobicContact SD-CD1 4.08Å; M71-L148 HydrophobicContact SD-CD2 4.41Å; M71-L148 HydrophobicContact SD-CG 4.49Å
72	F	98.4	Very high	96.7	Very high	29 Å²	29	43.5 Å²	43.5	13%	0.127	22%	0.217	C	C	.	.	S	Bend	trans	-144.5	128.4	164.2	-176.7	-89.1	0	0	0	108.9	L51 F55 M62 K207 Y210 N211	L51-F72 HydrophobicContact CD2-CZ 4.42Å; F55-F72 HydrophobicContact CE2-CD1 4.37Å; F55-F72 AromaticContact CE2-CE1 3.89Å; F55-F72 HydrophobicContact CE2-CE1 3.89Å; F55-F72 HydrophobicContact CZ-CD1 4.06Å; F55-F72 AromaticContact CZ-CE1 3.74Å; F55-F72 HydrophobicContact CZ-CE1 3.74Å; M62-F72 VanDerWaalsContact CE-O 3.26Å; M62-F72 WeakPolarHBondContact CE-O 3.37Å; F72-K207 HydrophobicContact CD1-CD 3.65Å; F72-K207 HydrophobicContact CE1-CD 4.45Å; F72-K207 PolarHBondContact O-NZ 3.3Å; F72-Y210 VanDerWaalsContact CZ-O 3.27Å; F72-Y210 WeakPolarHBondContact CZ-O 3.39Å; F72-N211 HydrophobicContact CD1-CB 3.97Å; F72-N211 HydrophobicContact CD2-CB 3.78Å; F72-N211 HydrophobicContact CE1-CB 3.87Å; F72-N211 HydrophobicContact CE2-CB 3.7Å; F72-N211 HydrophobicContact CG-CB 3.93Å; F72-N211 VanDerWaalsContact CZ-CA 3.49Å; F72-N211 HydrophobicContact CZ-CB 3.76Å
73	P	98.4	Very high	96.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.227	C	C	.	.	S	Bend	cis	-59.6	161.6	-3.7	-20.3	33	0	0	0	112.6	L51 W52 F55 M71	L51-P73 HydrophobicContact CD2-CB 4.02Å; L51-P73 HydrophobicContact CD2-CG 3.94Å; L51-P73 HydrophobicContact CG-CB 4.41Å; L51-P73 HydrophobicContact CG-CG 3.87Å; W52-P73 HydrophobicContact CD2-CB 4.2Å; W52-P73 HydrophobicContact CD2-CG 4.15Å; W52-P73 HydrophobicContact CE3-CG 4.39Å; W52-P73 HydrophobicContact CH2-CB 4.45Å; W52-P73 HydrophobicContact CZ2-CB 3.85Å; W52-P73 HydrophobicContact CZ2-CG 4.44Å; W52-P73 WeakPolarHBondContact CZ2-O 3.37Å; F55-P73 HydrophobicContact CD2-CG 3.43Å; F55-P73 VanDerWaalsContact CD2-CG 3.43Å; F55-P73 HydrophobicContact CE2-CG 3.53Å; F55-P73 HydrophobicContact CG-CG 4.38Å; M71-P73 CarbonylContact C-O 3.54Å
74	V	98.4	Very high	96.1	Very high	36 Å²	36	47.2 Å²	47.2	22%	0.218	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-77.4	131.7	176.3	174.7	0	0	0	0	108.2	K76	V74-K76 HydrophobicContact CG1-CG 4.03Å; V74-K76 PolarHBondContact O-N 3.14Å
75	L	98.6	Very high	95.9	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.005	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-70.1	116.1	173	-177.6	65.6	0	0	0	109.5	L46 W52 M71 L92 F143 P168 I170 T190	L46-L75 HydrophobicContact CD1-CD1 3.75Å; W52-L75 HydrophobicContact CZ2-CB 4.4Å; M71-L75 HydrophobicContact CE-CB 3.67Å; L75-L92 HydrophobicContact CD2-CD1 3.57Å; L75-L92 HydrophobicContact CD2-CD2 4.12Å; L75-F143 HydrophobicContact CB-CB 4.4Å; L75-F143 HydrophobicContact CD2-CD2 4.33Å; L75-F143 HydrophobicContact CG-CD2 4.35Å; L75-F143 PolarHBondContact O-N 2.94Å; L75-P168 HydrophobicContact CD2-CB 3.82Å; L75-I170 HydrophobicContact CD2-CD1 3.98Å; L75-I170 HydrophobicContact CD2-CG1 4.12Å; L75-I170 HydrophobicContact CG-CD1 4.28Å; L75-T190 HydrophobicContact CD1-CG2 4.05Å
76	K	98.4	Very high	95.7	Very high	51 Å²	51	51.7 Å²	51.7	22%	0.222	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	139.1	178.9	-66.1	178.5	-168.4	167.5	0	109.3	D47 E48 V74 V141	D47-K76 HydrophobicContact CB-CB 3.76Å; D47-K76 PolarHBondContact N-O 3.2Å; D47-K76 WeakPolarHBondContact OD2-CD 3.37Å; E48-K76 IonicContact OE1-NZ 3.11Å; E48-K76 PolarHBondContact OE1-NZ 2.82Å; V74-K76 HydrophobicContact CG1-CG 4.03Å; V74-K76 PolarHBondContact O-N 3.14Å; K76-V141 CarbonylContact C-O 3.56Å; K76-V141 VanDerWaalsContact CA-O 3.24Å; K76-V141 WeakPolarHBondContact CA-O 3.45Å
77	V	98.6	Very high	95.7	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	142.7	177.8	-64.7	0	0	0	0	111.8	V44 S45 V79 P140 V141 I170 F187	V44-V77 HydrophobicContact CG1-CB 3.88Å; V44-V77 HydrophobicContact CG1-CG1 4.15Å; V44-V77 HydrophobicContact CG1-CG2 4.12Å; S45-V77 CarbonylContact O-C 3.52Å; S45-V77 VanDerWaalsContact O-CA 3.29Å; S45-V77 WeakPolarHBondContact O-CA 3.43Å; V77-V79 HydrophobicContact CG2-CG2 4.17Å; V77-P140 CarbonylContact O-C 3.51Å; V77-P140 WeakPolarHBondContact O-CA 3.46Å; V77-V141 HydrophobicContact CG2-CB 4.03Å; V77-V141 PolarHBondContact N-O 2.91Å; V77-V141 PolarHBondContact O-N 2.92Å; V77-I170 HydrophobicContact CB-CD1 4.32Å; V77-I170 HydrophobicContact CG1-CD1 3.4Å; V77-I170 HydrophobicContact CG2-CD1 3.94Å; V77-F187 HydrophobicContact CG1-CE2 3.69Å; V77-F187 HydrophobicContact CG1-CZ 4.17Å
78	N	98.3	Very high	95.9	Very high	61 Å²	61	43 Å²	43	33%	0.326	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	138.1	165.5	-63	79.2	0	0	0	109	V44 S45	V44-N78 WeakPolarHBondContact CA-O 3.4Å; S45-N78 PolarHBondContact N-O 3.32Å; S45-N78 PolarHBondContact O-N 2.92Å
79	V	97.4	Very high	96	Very high	10 Å²	10	43.5 Å²	43.5	6%	0.061	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	139.6	-178.4	-172.7	0	0	0	0	109.3	L42 K43 V44 V77 L82 F90 M137 V141 I172	L42-V79 HydrophobicContact CD1-CG1 3.9Å; K43-V79 WeakPolarHBondContact O-CA 3.39Å; V44-V79 HydrophobicContact CG1-CG2 4.44Å; V44-V79 HydrophobicContact CG2-CG1 4.43Å; V77-V79 HydrophobicContact CG2-CG2 4.17Å; V79-L82 HydrophobicContact CG1-CD1 3.75Å; V79-L82 HydrophobicContact CG1-CG 3.92Å; V79-F90 HydrophobicContact CB-CZ 4.46Å; V79-F90 HydrophobicContact CG1-CZ 4.18Å; V79-F90 HydrophobicContact CG2-CE1 3.68Å; V79-F90 HydrophobicContact CG2-CZ 3.82Å; V79-M137 WeakPolarHBondContact O-CG 3.38Å; V79-V141 HydrophobicContact CG2-CG2 4.14Å; V79-I172 HydrophobicContact CG1-CD1 4.32Å
80	S	96.2	Very high	96	Very high	56 Å²	56	37.2 Å²	37.2	39%	0.392	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	160.4	173.1	55.7	0	0	0	0	110.2	L42 K43	L42-S80 WeakPolarHBondContact CA-O 3.22Å; L42-S80 WeakPolarHBondContact CD1-O 3.18Å; K43-S80 WeakPolarHBondContact CB-OG 3.29Å; K43-S80 PolarHBondContact N-O 2.99Å; K43-S80 PolarHBondContact O-N 2.83Å
81	G	93.2	Very high	96	Very high	24 Å²	24	32 Å²	32	25%	0.247	18%	0.184	C	C	.	.	S	Bend	trans	86.9	5	178.2	0	0	0	0	0	115.8	D41 M137	D41-G81 WeakPolarHBondContact O-CA 3.07Å; G81-M137 PolarHBondContact N-SD 3.16Å; G81-M137 VanDerWaalsContact N-SD 3.45Å
82	L	92.8	Very high	95.9	Very high	8 Å²	8	31.5 Å²	31.5	4%	0.042	18%	0.181	C	C	.	.	S	Bend	trans	-74.2	148.1	170.3	-61.9	175.8	0	0	0	110.8	L42 V79 P84 Y88 F90 W136 M137 I172	L42-L82 HydrophobicContact CD1-CD2 3.64Å; L42-L82 HydrophobicContact CD1-CG 4.1Å; V79-L82 HydrophobicContact CG1-CD1 3.75Å; V79-L82 HydrophobicContact CG1-CG 3.92Å; L82-P84 VanDerWaalsContact O-CD 3.22Å; L82-P84 WeakPolarHBondContact O-CD 3.4Å; L82-Y88 HydrophobicContact CB-CE2 4.01Å; L82-Y88 HydrophobicContact CD1-CD2 4.32Å; L82-Y88 HydrophobicContact CD1-CG 4.49Å; L82-Y88 HydrophobicContact CD2-CD1 4.08Å; L82-Y88 HydrophobicContact CD2-CE1 3.77Å; L82-Y88 HydrophobicContact CD2-CE2 4.36Å; L82-Y88 HydrophobicContact CD2-CG 4.5Å; L82-F90 HydrophobicContact CD1-CE2 4.23Å; L82-F90 HydrophobicContact CD1-CZ 4.23Å; L82-W136 HydrophobicContact CD1-CB 3.91Å; L82-M137 HydrophobicContact CB-CE 3.98Å; L82-M137 HydrophobicContact CB-CG 4.27Å; L82-M137 HydrophobicContact CB-SD 3.81Å; L82-M137 HydrophobicContact CD1-CG 4.23Å; L82-M137 HydrophobicContact CG-CG 4.41Å; L82-M137 HydrophobicContact CG-SD 4.37Å; L82-M137 PolarHBondContact N-SD 2.93Å; L82-M137 VanDerWaalsContact N-SD 3.37Å; L82-M137 WeakPolarHBondContact O-CE 3.48Å; L82-I172 HydrophobicContact CD2-CG2 4.11Å
83	D	91.2	Very high	95.7	Very high	42 Å²	42	30.1 Å²	30.1	23%	0.225	18%	0.175	C	C	.	.			trans	-58.7	115.8	164.1	179.7	-15.4	0	0	0	109.4	T38 N85 A86 Y88 G133 R174	T38-D83 HydrophobicContact CG2-CB 4.14Å; D83-N85 PolarHBondContact O-N 2.92Å; D83-N85 VanDerWaalsContact O-N 3.12Å; D83-N85 PolarHBondContact OD1-N 2.81Å; D83-A86 HydrophobicContact CB-CB 3.77Å; D83-A86 PolarHBondContact O-N 2.84Å; D83-A86 PolarHBondContact OD1-N 2.87Å; D83-Y88 WeakPolarHBondContact CB-OH 3.5Å; D83-Y88 PolarHBondContact N-OH 2.98Å; D83-Y88 VanDerWaalsContact N-OH 3.15Å; D83-Y88 WeakPolarHBondContact O-CE2 3.24Å; D83-G133 WeakPolarHBondContact O-CA 3.44Å; D83-R174 IonicContact OD2-NH2 3.11Å; D83-R174 PolarHBondContact OD2-NH2 3.06Å
84	P	93.4	Very high	95.6	Very high	64 Å²	64	30.6 Å²	30.6	42%	0.416	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-27.3	-177.9	-24.3	34.9	0	0	0	113.9	L82 A134 M137	L82-P84 VanDerWaalsContact O-CD 3.22Å; L82-P84 WeakPolarHBondContact O-CD 3.4Å; P84-A134 HydrophobicContact CB-CB 4.05Å; P84-A134 WeakPolarHBondContact O-CB 3.39Å; P84-A134 PolarHBondContact O-N 2.81Å; P84-A134 VanDerWaalsContact O-N 3.13Å; P84-M137 HydrophobicContact CG-CE 4.1Å
85	N	92.5	Very high	95.4	Very high	133 Å²	133	30.8 Å²	30.8	71%	0.711	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-12.8	-172.8	-61	96.9	0	0	0	113.5	D83 F132	D83-N85 PolarHBondContact O-N 2.92Å; D83-N85 VanDerWaalsContact O-N 3.12Å; D83-N85 PolarHBondContact OD1-N 2.81Å; N85-F132 WeakPolarHBondContact O-CD1 3.2Å; N85-F132 WeakPolarHBondContact O-CE1 3.46Å
86	A	91.8	Very high	95.1	Very high	10 Å²	10	32.3 Å²	32.3	8%	0.083	19%	0.189	C	C	.	.	S	Bend	trans	-83	154.6	174.9	0	0	0	0	0	111.9	D83 Y88 F132 G133	D83-A86 HydrophobicContact CB-CB 3.77Å; D83-A86 PolarHBondContact O-N 2.84Å; D83-A86 PolarHBondContact OD1-N 2.87Å; A86-Y88 HydrophobicContact CB-CE2 3.7Å; A86-Y88 WeakPolarHBondContact O-CD2 3.3Å; A86-Y88 WeakPolarHBondContact O-CE2 3.21Å; A86-F132 CarbonylContact O-C 3.42Å; A86-F132 VanDerWaalsContact O-CA 3.29Å; A86-F132 WeakPolarHBondContact O-CA 3.24Å; A86-G133 PolarHBondContact O-N 3.46Å
87	M	94.2	Very high	94.9	Very high	80 Å²	80	31.7 Å²	31.7	39%	0.394	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	143.9	174.1	-68.5	-170.9	-66	0	0	111.1	N131 F132 V175	M87-N131 CarbonylContact C-O 3.49Å; M87-N131 WeakPolarHBondContact CA-O 3.46Å; M87-F132 HydrophobicContact CG-CD1 4.21Å; M87-F132 HydrophobicContact CG-CE1 4.1Å; M87-V175 HydrophobicContact CB-CB 3.96Å; M87-V175 HydrophobicContact CE-CG1 4.35Å; M87-V175 PolarHBondContact O-N 2.92Å
88	Y	95.4	Very high	94.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	148.4	178.3	-59	-91.7	0	0	0	110.9	L82 D83 A86 P130 N131 W136 I172 V173 R174 M181	L82-Y88 HydrophobicContact CB-CE2 4.01Å; L82-Y88 HydrophobicContact CD1-CD2 4.32Å; L82-Y88 HydrophobicContact CD1-CG 4.49Å; L82-Y88 HydrophobicContact CD2-CD1 4.08Å; L82-Y88 HydrophobicContact CD2-CE1 3.77Å; L82-Y88 HydrophobicContact CD2-CE2 4.36Å; L82-Y88 HydrophobicContact CD2-CG 4.5Å; D83-Y88 WeakPolarHBondContact CB-OH 3.5Å; D83-Y88 PolarHBondContact N-OH 2.98Å; D83-Y88 VanDerWaalsContact N-OH 3.15Å; D83-Y88 WeakPolarHBondContact O-CE2 3.24Å; A86-Y88 HydrophobicContact CB-CE2 3.7Å; A86-Y88 WeakPolarHBondContact O-CD2 3.3Å; A86-Y88 WeakPolarHBondContact O-CE2 3.21Å; Y88-P130 CarbonylContact O-C 3.49Å; Y88-P130 WeakPolarHBondContact O-CA 3.28Å; Y88-N131 PolarHBondContact N-O 2.84Å; Y88-N131 PolarHBondContact O-N 3.37Å; Y88-W136 PolarHBondContact O-NE1 3Å; Y88-W136 VanDerWaalsContact O-NE1 3.15Å; Y88-I172 HydrophobicContact CD1-CG2 3.96Å; Y88-V173 CarbonylContact C-O 3.59Å; Y88-V173 VanDerWaalsContact CA-O 3.22Å; Y88-V173 WeakPolarHBondContact CA-O 3.21Å; Y88-R174 HydrophobicContact CD1-CB 3.96Å; Y88-R174 HydrophobicContact CD1-CG 4.29Å; Y88-R174 HydrophobicContact CE1-CB 3.78Å; Y88-R174 HydrophobicContact CE1-CG 3.85Å; Y88-M181 HydrophobicContact CE1-CE 3.83Å
89	S	96.6	Very high	94.1	Very high	23 Å²	23	35.2 Å²	35.2	16%	0.161	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	136.5	165.9	-62.1	0	0	0	0	109.7	V173 V175	S89-V173 PolarHBondContact N-O 3.21Å; S89-V173 PolarHBondContact O-N 2.93Å; S89-V175 WeakPolarHBondContact OG-CG2 3.36Å
90	F	97.4	Very high	93.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	128.1	174.7	-86.5	-118	0	0	0	109.1	V79 L82 H126 S129 W136 V141 F143 I170 H171 I172	V79-F90 HydrophobicContact CB-CZ 4.46Å; V79-F90 HydrophobicContact CG1-CZ 4.18Å; V79-F90 HydrophobicContact CG2-CE1 3.68Å; V79-F90 HydrophobicContact CG2-CZ 3.82Å; L82-F90 HydrophobicContact CD1-CE2 4.23Å; L82-F90 HydrophobicContact CD1-CZ 4.23Å; F90-H126 HydrophobicContact CB-CB 3.89Å; F90-H126 VanDerWaalsContact O-CB 3.25Å; F90-H126 WeakPolarHBondContact O-CB 3.26Å; F90-H126 PolarHBondContact O-N 3.15Å; F90-S129 PolarHBondContact N-OG 2.89Å; F90-S129 PolarHBondContact O-OG 2.88Å; F90-W136 HydrophobicContact CB-CH2 3.92Å; F90-W136 HydrophobicContact CB-CZ2 4.33Å; F90-W136 HydrophobicContact CB-CZ3 4.04Å; F90-W136 AromaticContact CD2-CD2 3.5Å; F90-W136 HydrophobicContact CD2-CD2 3.5Å; F90-W136 VanDerWaalsContact CD2-CD2 3.5Å; F90-W136 AromaticContact CD2-CE2 3.55Å; F90-W136 AromaticContact CD2-CE3 3.78Å; F90-W136 HydrophobicContact CD2-CE3 3.78Å; F90-W136 AromaticContact CD2-CG 3.94Å; F90-W136 HydrophobicContact CD2-CG 3.94Å; F90-W136 HydrophobicContact CD2-CH2 4.12Å; F90-W136 AromaticContact CD2-CZ2 3.88Å; F90-W136 HydrophobicContact CD2-CZ2 3.88Å; F90-W136 HydrophobicContact CD2-CZ3 4.08Å; F90-W136 AromaticContact CD2-NE1 3.99Å; F90-W136 HydrophobicContact CE2-CB 3.93Å; F90-W136 AromaticContact CE2-CD1 3.84Å; F90-W136 AromaticContact CE2-CD2 3.59Å; F90-W136 HydrophobicContact CE2-CD2 3.59Å; F90-W136 AromaticContact CE2-CE2 3.97Å; F90-W136 HydrophobicContact CE2-CE3 4.07Å; F90-W136 AromaticContact CE2-CG 3.51Å; F90-W136 HydrophobicContact CE2-CG 3.51Å; F90-W136 HydrophobicContact CG-CD2 4.22Å; F90-W136 HydrophobicContact CG-CE3 4.02Å; F90-W136 HydrophobicContact CG-CH2 4.21Å; F90-W136 HydrophobicContact CG-CZ2 4.41Å; F90-W136 HydrophobicContact CG-CZ3 4.02Å; F90-W136 HydrophobicContact CZ-CB 4.16Å; F90-W136 HydrophobicContact CZ-CD2 4.36Å; F90-W136 HydrophobicContact CZ-CG 4.21Å; F90-V141 HydrophobicContact CD1-CG1 4.02Å; F90-V141 HydrophobicContact CE1-CG2 4.22Å; F90-F143 HydrophobicContact CB-CZ 4.38Å; F90-I170 HydrophobicContact CD1-CG2 4.21Å; F90-H171 WeakPolarHBondContact CA-O 3.39Å; F90-I172 HydrophobicContact CD1-CG1 4.09Å; F90-I172 HydrophobicContact CD2-CG2 4.36Å; F90-I172 HydrophobicContact CE1-CD1 3.66Å; F90-I172 HydrophobicContact CE1-CG1 3.61Å; F90-I172 HydrophobicContact CE2-CB 4.44Å; F90-I172 HydrophobicContact CE2-CD1 4.35Å; F90-I172 HydrophobicContact CE2-CG1 4.07Å; F90-I172 HydrophobicContact CE2-CG2 3.74Å; F90-I172 HydrophobicContact CZ-CB 4.39Å; F90-I172 HydrophobicContact CZ-CD1 3.51Å; F90-I172 HydrophobicContact CZ-CG1 3.6Å; F90-I172 HydrophobicContact CZ-CG2 3.98Å
91	L	96.1	Very high	93.6	Very high	33 Å²	33	42 Å²	42	17%	0.173	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	155.4	179.7	-48.9	90.7	0	0	0	110.2	V123 Y124 I125 I170 H171 V173	L91-V123 HydrophobicContact CB-CG1 3.57Å; L91-V123 HydrophobicContact CD2-CG1 3.54Å; L91-V123 HydrophobicContact CG-CG1 4.17Å; L91-Y124 CarbonylContact C-O 3.53Å; L91-Y124 VanDerWaalsContact CA-O 3.26Å; L91-Y124 WeakPolarHBondContact CA-O 3.32Å; L91-I125 HydrophobicContact CD2-CG1 3.97Å; L91-I125 HydrophobicContact CG-CG1 4.42Å; L91-I170 CarbonylContact O-C 3.49Å; L91-I170 WeakPolarHBondContact O-CA 3.44Å; L91-H171 HydrophobicContact CB-CB 4.24Å; L91-H171 HydrophobicContact CD1-CB 4.3Å; L91-H171 PolarHBondContact N-O 2.87Å; L91-H171 PolarHBondContact O-N 3.02Å; L91-V173 HydrophobicContact CD1-CB 4.16Å; L91-V173 HydrophobicContact CD1-CG2 3.47Å; L91-V173 VanDerWaalsContact CD1-CG2 3.47Å
92	L	96.4	Very high	93.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	126.8	177.4	172.4	64.9	0	0	0	108.8	M71 L75 F94 Y124 F143 V146 P168 R169 I170	M71-L92 HydrophobicContact CE-CD2 4.48Å; L75-L92 HydrophobicContact CD2-CD1 3.57Å; L75-L92 HydrophobicContact CD2-CD2 4.12Å; L92-F94 HydrophobicContact CD1-CE2 4.5Å; L92-F94 HydrophobicContact CD2-CE2 4.04Å; L92-F94 HydrophobicContact CD2-CZ 4.01Å; L92-F94 HydrophobicContact CG-CE2 3.97Å; L92-F94 HydrophobicContact CG-CZ 4.28Å; L92-Y124 HydrophobicContact CB-CD1 4.27Å; L92-Y124 PolarHBondContact N-O 3.11Å; L92-Y124 PolarHBondContact O-N 3.45Å; L92-F143 HydrophobicContact CB-CD1 3.69Å; L92-F143 HydrophobicContact CB-CE1 3.62Å; L92-F143 HydrophobicContact CB-CG 4.48Å; L92-F143 HydrophobicContact CB-CZ 4.34Å; L92-F143 HydrophobicContact CD2-CB 3.92Å; L92-F143 HydrophobicContact CD2-CD1 3.77Å; L92-F143 HydrophobicContact CD2-CG 3.9Å; L92-F143 HydrophobicContact CG-CD1 4.34Å; L92-V146 HydrophobicContact CD2-CB 4.46Å; L92-V146 HydrophobicContact CD2-CG1 4.29Å; L92-V146 HydrophobicContact CD2-CG2 4.3Å; L92-P168 HydrophobicContact CD1-CB 4.08Å; L92-R169 WeakPolarHBondContact CA-O 3.42Å; L92-I170 HydrophobicContact CD1-CG1 4.11Å
93	D	95.2	Very high	93.9	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	177.9	167.2	88.2	-21.6	0	0	0	110.7	S121 V123 R169 H171	D93-S121 WeakPolarHBondContact CB-OG 3.41Å; D93-S121 PolarHBondContact OD2-OG 3.22Å; D93-V123 HydrophobicContact CB-CG2 4.26Å; D93-R169 PolarHBondContact N-O 3.38Å; D93-R169 PolarHBondContact O-N 3.34Å; D93-R169 VanDerWaalsContact OD1-CB 3.3Å; D93-R169 WeakPolarHBondContact OD1-CB 3.43Å; D93-R169 IonicContact OD1-CZ 3.97Å; D93-R169 IonicContact OD1-NE 3.7Å; D93-R169 PolarHBondContact OD1-NE 2.91Å; D93-R169 IonicContact OD1-NH2 3.22Å; D93-R169 IonicContact OD2-CZ 3.94Å; D93-R169 IonicContact OD2-NE 3.72Å; D93-R169 IonicContact OD2-NH2 3.85Å; D93-R169 PolarHBondContact OD2-NH2 2.7Å; D93-H171 IonicContact OD1-CD2 3.71Å; D93-H171 IonicContact OD1-NE2 3.98Å; D93-H171 PolarHBondContact OD1-NE2 2.66Å; D93-H171 VanDerWaalsContact OD1-NE2 3.16Å; D93-H171 IonicContact OD2-NE2 3.16Å
94	F	95.6	Very high	94.2	Very high	11 Å²	11	47.9 Å²	47.9	5%	0.048	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	114.1	-179.1	-66.5	-99.7	0	0	0	108.4	M71 L92 L148 I158 L160 Y166 E167 P168 F192	M71-F94 HydrophobicContact CE-CZ 4.27Å; M71-F94 HydrophobicContact SD-CE1 3.71Å; M71-F94 HydrophobicContact SD-CZ 3.54Å; M71-F94 VanDerWaalsContact SD-CZ 3.54Å; L92-F94 HydrophobicContact CD1-CE2 4.5Å; L92-F94 HydrophobicContact CD2-CE2 4.04Å; L92-F94 HydrophobicContact CD2-CZ 4.01Å; L92-F94 HydrophobicContact CG-CE2 3.97Å; L92-F94 HydrophobicContact CG-CZ 4.28Å; F94-L148 HydrophobicContact CE1-CD2 4.31Å; F94-L148 HydrophobicContact CE2-CD2 3.91Å; F94-L148 HydrophobicContact CZ-CD2 3.73Å; F94-I158 HydrophobicContact CD2-CB 4.49Å; F94-I158 HydrophobicContact CD2-CD1 3.76Å; F94-I158 HydrophobicContact CD2-CG2 3.74Å; F94-I158 HydrophobicContact CE2-CB 4.45Å; F94-I158 HydrophobicContact CE2-CD1 3.5Å; F94-I158 VanDerWaalsContact CE2-CD1 3.5Å; F94-I158 HydrophobicContact CE2-CG2 4.16Å; F94-L160 HydrophobicContact CB-CD2 3.8Å; F94-L160 HydrophobicContact CG-CD2 4.16Å; F94-Y166 HydrophobicContact CB-CD1 4.12Å; F94-E167 WeakPolarHBondContact CA-O 3.44Å; F94-P168 HydrophobicContact CD1-CB 4.33Å; F94-P168 HydrophobicContact CD1-CG 4.17Å; F94-P168 HydrophobicContact CE1-CB 4.1Å; F94-P168 HydrophobicContact CE1-CG 3.89Å; F94-F192 AromaticContact CD1-CE1 3.68Å; F94-F192 HydrophobicContact CD1-CE1 3.68Å; F94-F192 AromaticContact CD1-CZ 3.63Å; F94-F192 HydrophobicContact CD1-CZ 3.63Å; F94-F192 AromaticContact CE1-CE1 3.57Å; F94-F192 HydrophobicContact CE1-CE1 3.57Å; F94-F192 AromaticContact CE1-CZ 3.64Å; F94-F192 HydrophobicContact CE1-CZ 3.64Å
95	V	93.8	Very high	94.3	Very high	39 Å²	39	47.7 Å²	47.7	24%	0.236	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	144.6	175.5	-62.5	0	0	0	0	109.6	A97 Y166 E167	V95-A97 PolarHBondContact O-N 3.14Å; V95-Y166 CarbonylContact O-C 3.56Å; V95-Y166 VanDerWaalsContact O-CA 3.28Å; V95-Y166 WeakPolarHBondContact O-CA 3.48Å; V95-E167 HydrophobicContact CG2-CB 3.89Å; V95-E167 WeakPolarHBondContact CG2-O 3.33Å; V95-E167 PolarHBondContact N-O 2.87Å; V95-E167 PolarHBondContact O-N 2.87Å
96	S	93.6	Very high	94.4	Very high	34 Å²	34	49.1 Å²	49.1	24%	0.238	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	124.7	169.9	-68	0	0	0	0	109.3	D98 Q118	S96-D98 VanDerWaalsContact C-N 3.35Å; S96-Q118 VanDerWaalsContact CB-NE2 3.32Å
97	A	93.6	Very high	94.6	Very high	37 Å²	37	50.9 Å²	50.9	31%	0.306	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	-25.9	179.8	0	0	0	0	0	112	V95 K165	V95-A97 PolarHBondContact O-N 3.14Å; A97-K165 HydrophobicContact CB-CB 4.16Å; A97-K165 HydrophobicContact CB-CD 3.85Å; A97-K165 HydrophobicContact CB-CG 3.82Å; A97-K165 PolarHBondContact N-O 2.74Å
98	D	91.3	Very high	94.7	Very high	30 Å²	30	53.5 Å²	53.5	16%	0.16	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	173	172.4	58.7	58.5	0	0	0	110.7	S96 H100 W102 K165	S96-D98 VanDerWaalsContact C-N 3.35Å; D98-H100 WeakPolarHBondContact OD1-CB 3.25Å; D98-H100 PolarHBondContact OD1-N 3.48Å; D98-H100 VanDerWaalsContact OD1-N 3.08Å; D98-H100 IonicContact OD1-ND1 2.61Å; D98-W102 PolarHBondContact OD1-NE1 2.84Å; D98-W102 WeakPolarHBondContact OD2-CZ2 3.44Å; D98-W102 PolarHBondContact OD2-NE1 2.95Å; D98-K165 WeakPolarHBondContact OD2-CE 3.45Å; D98-K165 IonicContact OD2-NZ 3.67Å; D98-K165 PolarHBondContact OD2-NZ 2.99Å
99	N	88.9	Confident	94.8	Very high	106 Å²	106	54.8 Å²	54.8	57%	0.567	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	16.6	-179.3	-65.9	-24.8	0	0	0	112.7	Q118	N99-Q118 PolarHBondContact OD1-NE2 3.23Å; N99-Q118 VanDerWaalsContact OD1-NE2 3.14Å
100	H	90.1	Very high	94.7	Very high	97 Å²	97	55.9 Å²	55.9	45%	0.449	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	139.6	-178.7	-56.7	114.2	0	0	0	110.8	D98 W102 P111 H164	D98-H100 WeakPolarHBondContact OD1-CB 3.25Å; D98-H100 PolarHBondContact OD1-N 3.48Å; D98-H100 VanDerWaalsContact OD1-N 3.08Å; D98-H100 IonicContact OD1-ND1 2.61Å; H100-W102 VanDerWaalsContact O-CD1 3.24Å; H100-P111 HydrophobicContact CB-CB 4Å; H100-H164 PolarHBondContact O-CD2 2.78Å
101	R	93.7	Very high	94.6	Very high	111 Å²	111	59.4 Å²	59.4	42%	0.419	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	135.7	154.9	-173.8	175.1	178.1	-155.6	-1.7	107.6	G112 L163	R101-G112 CarbonylContact C-O 3.59Å; R101-G112 WeakPolarHBondContact CB-O 3.47Å; R101-G112 CarbonylContact O-C 3.48Å; R101-G112 PolarHBondContact O-N 3.21Å; R101-L163 CarbonylContact C-O 3.59Å; R101-L163 HydrophobicContact CG-CB 4.12Å
102	W	95.3	Very high	94	Very high	34 Å²	34	58.9 Å²	58.9	13%	0.129	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	153.2	-175	-70.4	81.9	0	0	0	111	D98 H100 W109 L163 I193	D98-W102 PolarHBondContact OD1-NE1 2.84Å; D98-W102 WeakPolarHBondContact OD2-CZ2 3.44Å; D98-W102 PolarHBondContact OD2-NE1 2.95Å; H100-W102 VanDerWaalsContact O-CD1 3.24Å; W102-W109 HydrophobicContact CB-CE3 3.73Å; W102-W109 HydrophobicContact CB-CZ3 3.83Å; W102-W109 HydrophobicContact CE3-CB 3.92Å; W102-W109 HydrophobicContact CZ3-CB 4.2Å; W102-W109 WeakPolarHBondContact CZ3-O 3.4Å; W102-L163 PolarHBondContact N-O 2.94Å; W102-L163 WeakPolarHBondContact O-CB 3.24Å; W102-I193 HydrophobicContact CB-CD1 4.09Å; W102-I193 HydrophobicContact CD2-CD1 4.03Å; W102-I193 HydrophobicContact CE3-CD1 4.31Å; W102-I193 HydrophobicContact CG-CD1 3.91Å
103	K	95.9	Very high	93	Very high	107 Å²	107	61.8 Å²	61.8	47%	0.465	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	147.3	168.4	62.6	176.7	-176.2	176.2	0	109.3	V105 V110	K103-V105 HydrophobicContact CB-CG2 4.48Å; K103-V105 HydrophobicContact CD-CG2 3.86Å; K103-V105 HydrophobicContact CG-CG2 3.97Å; K103-V110 HydrophobicContact CD-CG2 4.13Å; K103-V110 VanDerWaalsContact CE-CG2 3.43Å; K103-V110 HydrophobicContact CG-CG2 3.54Å; K103-V110 PolarHBondContact N-O 3.02Å; K103-V110 PolarHBondContact O-N 3.35Å
104	Y	97	Very high	92.1	Very high	57 Å²	57	70.8 Å²	70.8	22%	0.224	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	118.2	175.6	-166.4	-109.1	0	0	0	109.1	G107 E108 W109 Q199 N200	Y104-G107 VanDerWaalsContact CE2-O 3.26Å; Y104-G107 WeakPolarHBondContact CE2-O 3.47Å; Y104-G107 VanDerWaalsContact CZ-CA 3.5Å; Y104-G107 VanDerWaalsContact CZ-O 3.24Å; Y104-G107 VanDerWaalsContact OH-CA 3.29Å; Y104-G107 WeakPolarHBondContact OH-CA 3.37Å; Y104-G107 PolarHBondContact OH-O 3.36Å; Y104-E108 CarbonylContact C-O 3.4Å; Y104-E108 WeakPolarHBondContact CA-O 3.45Å; Y104-E108 VanDerWaalsContact CD2-C 3.44Å; Y104-E108 WeakPolarHBondContact CD2-O 3.43Å; Y104-W109 AromaticContact CD2-CD1 3.68Å; Y104-W109 AromaticContact CD2-CD2 3.83Å; Y104-W109 HydrophobicContact CD2-CD2 3.83Å; Y104-W109 AromaticContact CD2-CE2 3.82Å; Y104-W109 AromaticContact CD2-CG 3.79Å; Y104-W109 HydrophobicContact CD2-CG 3.79Å; Y104-W109 AromaticContact CD2-NE1 3.68Å; Y104-W109 AromaticContact CE2-CD1 3.93Å; Y104-W109 HydrophobicContact CE2-CG 4.4Å; Y104-Q199 HydrophobicContact CD1-CB 3.7Å; Y104-Q199 HydrophobicContact CD2-CB 4.29Å; Y104-Q199 HydrophobicContact CE1-CB 4.38Å; Y104-Q199 WeakPolarHBondContact CE1-O 3.18Å; Y104-Q199 HydrophobicContact CG-CB 3.63Å; Y104-N200 HydrophobicContact CE2-CB 4.12Å
105	V	96.4	Very high	91	Very high	60 Å²	60	75 Å²	75	36%	0.364	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	133.6	-176.4	-175.9	0	0	0	0	108.2	K103 G107 E108 V110	K103-V105 HydrophobicContact CB-CG2 4.48Å; K103-V105 HydrophobicContact CD-CG2 3.86Å; K103-V105 HydrophobicContact CG-CG2 3.97Å; V105-G107 PolarHBondContact O-N 3.28Å; V105-E108 PolarHBondContact N-O 3Å; V105-E108 PolarHBondContact O-N 3.15Å; V105-V110 HydrophobicContact CG2-CG2 4.46Å
106	N	94.7	Very high	90.1	Very high	163 Å²	163	77.8 Å²	77.8	87%	0.872	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	36.8	177.9	-58	-18.8	0	0	0	114.3	E108	N106-E108 VanDerWaalsContact C-N 3.33Å
107	G	94.9	Very high	89	Confident	46 Å²	46	81.4 Å²	81.4	47%	0.474	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.6	1.7	179.2	0	0	0	0	0	115	Y104 V105	Y104-G107 VanDerWaalsContact CE2-O 3.26Å; Y104-G107 WeakPolarHBondContact CE2-O 3.47Å; Y104-G107 VanDerWaalsContact CZ-CA 3.5Å; Y104-G107 VanDerWaalsContact CZ-O 3.24Å; Y104-G107 VanDerWaalsContact OH-CA 3.29Å; Y104-G107 WeakPolarHBondContact OH-CA 3.37Å; Y104-G107 PolarHBondContact OH-O 3.36Å; V105-G107 PolarHBondContact O-N 3.28Å
108	E	96.6	Very high	87.7	Confident	136 Å²	136	85.3 Å²	85.3	64%	0.636	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.8	147.2	-175.1	-64.7	-172.1	161.8	0	0	113.3	Y104 V105 N106	Y104-E108 CarbonylContact C-O 3.4Å; Y104-E108 WeakPolarHBondContact CA-O 3.45Å; Y104-E108 VanDerWaalsContact CD2-C 3.44Å; Y104-E108 WeakPolarHBondContact CD2-O 3.43Å; V105-E108 PolarHBondContact N-O 3Å; V105-E108 PolarHBondContact O-N 3.15Å; N106-E108 VanDerWaalsContact C-N 3.33Å
109	W	97.1	Very high	86.4	Confident	27 Å²	27	85.9 Å²	85.9	10%	0.102	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	116.9	171	-80.6	107	0	0	0	109.8	T59 E61 W102 Y104 L163 I193 V195 Q199	T59-W109 HydrophobicContact CG2-CB 4.46Å; T59-W109 HydrophobicContact CG2-CG 4.03Å; E61-W109 HydrophobicContact CG-CZ2 4.06Å; E61-W109 WeakPolarHBondContact OE1-CZ2 3.16Å; E61-W109 PolarHBondContact OE1-NE1 2.94Å; W102-W109 HydrophobicContact CB-CE3 3.73Å; W102-W109 HydrophobicContact CB-CZ3 3.83Å; W102-W109 HydrophobicContact CE3-CB 3.92Å; W102-W109 HydrophobicContact CZ3-CB 4.2Å; W102-W109 WeakPolarHBondContact CZ3-O 3.4Å; Y104-W109 AromaticContact CD2-CD1 3.68Å; Y104-W109 AromaticContact CD2-CD2 3.83Å; Y104-W109 HydrophobicContact CD2-CD2 3.83Å; Y104-W109 AromaticContact CD2-CE2 3.82Å; Y104-W109 AromaticContact CD2-CG 3.79Å; Y104-W109 HydrophobicContact CD2-CG 3.79Å; Y104-W109 AromaticContact CD2-NE1 3.68Å; Y104-W109 AromaticContact CE2-CD1 3.93Å; Y104-W109 HydrophobicContact CE2-CG 4.4Å; W109-L163 HydrophobicContact CH2-CD2 4.11Å; W109-L163 HydrophobicContact CZ3-CD2 4.18Å; W109-I193 HydrophobicContact CB-CD1 4.38Å; W109-I193 HydrophobicContact CD2-CD1 3.51Å; W109-I193 HydrophobicContact CE3-CD1 3.67Å; W109-I193 HydrophobicContact CG-CD1 3.86Å; W109-I193 HydrophobicContact CH2-CB 4.47Å; W109-I193 HydrophobicContact CH2-CD1 4.41Å; W109-I193 HydrophobicContact CH2-CG2 3.77Å; W109-I193 HydrophobicContact CZ2-CB 4.44Å; W109-I193 HydrophobicContact CZ2-CD1 4.31Å; W109-I193 HydrophobicContact CZ2-CG2 4.22Å; W109-I193 HydrophobicContact CZ3-CD1 4.11Å; W109-I193 HydrophobicContact CZ3-CG2 4Å; W109-V195 HydrophobicContact CH2-CG1 3.74Å; W109-V195 HydrophobicContact CZ2-CG1 3.98Å; W109-Q199 HydrophobicContact CH2-CB 4.22Å; W109-Q199 HydrophobicContact CH2-CG 3.66Å; W109-Q199 HydrophobicContact CZ2-CB 3.78Å; W109-Q199 HydrophobicContact CZ2-CG 3.68Å
110	V	95.9	Very high	85.2	Confident	45 Å²	45	83.5 Å²	83.5	27%	0.273	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	144.3	178	-60	0	0	0	0	111.1	K103 V105 G112	K103-V110 HydrophobicContact CD-CG2 4.13Å; K103-V110 VanDerWaalsContact CE-CG2 3.43Å; K103-V110 HydrophobicContact CG-CG2 3.54Å; K103-V110 PolarHBondContact N-O 3.02Å; K103-V110 PolarHBondContact O-N 3.35Å; V105-V110 HydrophobicContact CG2-CG2 4.46Å; V110-G112 PolarHBondContact O-N 3.19Å
111	P	94.4	Very high	84.1	Confident	74 Å²	74	80.4 Å²	80.4	48%	0.481	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	134.9	171.8	27.2	-33.2	0	0	0	109.5	H100	H100-P111 HydrophobicContact CB-CB 4Å
112	G	83.6	Confident	83.6	Confident	23 Å²	23	77.6 Å²	77.6	24%	0.237	44%	0.441	C	S	.	.			trans	-161.2	117.3	-175.8	0	0	0	0	0	112.8	R101 V110	R101-G112 CarbonylContact C-O 3.59Å; R101-G112 WeakPolarHBondContact CB-O 3.47Å; R101-G112 CarbonylContact O-C 3.48Å; R101-G112 PolarHBondContact O-N 3.21Å; V110-G112 PolarHBondContact O-N 3.19Å
113	G	76.4	Confident	83.3	Confident	60 Å²	60	77.7 Å²	77.7	62%	0.619	45%	0.446	S	S	*	.	S	Bend	trans	124.7	169	174	0	0	0	0	0	112.8
114	K	75	Confident	83.2	Confident	189 Å²	189	74 Å²	74	82%	0.822	43%	0.429	S	S	*	.	S	Bend	trans	-71.2	142.6	169.5	-65.3	-176.8	179.5	-178	0	108.6	E116	K114-E116 PolarHBondContact O-N 3.39Å
115	P	72.4	Confident	83.1	Confident	100 Å²	100	76.2 Å²	76.2	65%	0.649	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-52.2	125.5	171.8	-25.5	34.2	0	0	0	110.2
116	E	74.4	Confident	83.1	Confident	98 Å²	98	73.9 Å²	73.9	46%	0.458	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-89.7	142	175.3	-165.3	166.3	-175.6	0	0	108.9	K114 Q118 H164	K114-E116 PolarHBondContact O-N 3.39Å; E116-Q118 PolarHBondContact O-N 3.21Å; E116-H164 IonicContact OE2-CE1 2.7Å; E116-H164 PolarHBondContact OE2-CE1 3.43Å
117	P	72.4	Confident	83.2	Confident	109 Å²	109	69.3 Å²	69.3	71%	0.708	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-55.6	131.7	177	-24.6	33.9	0	0	0	111	T119	P117-T119 PolarHBondContact O-N 3.31Å
118	Q	64.9	Low	83.3	Confident	119 Å²	119	70.4 Å²	70.4	56%	0.556	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-62.3	124.5	176.8	-70.1	-169.2	-7.2	0	0	109.5	S96 N99 E116	S96-Q118 VanDerWaalsContact CB-NE2 3.32Å; N99-Q118 PolarHBondContact OD1-NE2 3.23Å; N99-Q118 VanDerWaalsContact OD1-NE2 3.14Å; E116-Q118 PolarHBondContact O-N 3.21Å
119	T	64.3	Low	83.3	Confident	43 Å²	43	65 Å²	65	26%	0.264	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-71.8	143	175.2	45.3	0	0	0	0	109.8	P117 S121 M159 N161	P117-T119 PolarHBondContact O-N 3.31Å; T119-S121 PolarHBondContact O-N 3.38Å; T119-M159 HydrophobicContact CG2-CE 3.62Å; T119-M159 HydrophobicContact CG2-SD 4.5Å; T119-N161 WeakPolarHBondContact CG2-ND2 3.45Å
120	P	64.6	Low	83.3	Confident	56 Å²	56	67.2 Å²	67.2	36%	0.364	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-59.6	136.3	-177.1	-23.7	35.1	0	0	0	111.2	Q14 C122	Q14-P120 HydrophobicContact CG-CB 4.2Å; Q14-P120 HydrophobicContact CG-CG 4.11Å; Q14-P120 VanDerWaalsContact NE2-CB 3.3Å; P120-C122 PolarHBondContact O-N 3.23Å
121	S	65.9	Low	83.4	Confident	32 Å²	32	67.2 Å²	67.2	22%	0.224	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-63.9	117.8	-177.1	-172.6	0	0	0	0	109.6	D93 T119	D93-S121 WeakPolarHBondContact CB-OG 3.41Å; D93-S121 PolarHBondContact OD2-OG 3.22Å; T119-S121 PolarHBondContact O-N 3.38Å
122	C	82.4	Confident	83.5	Confident	51 Å²	51	68.8 Å²	68.8	35%	0.345	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-90.8	129.7	170.9	-170.4	0	0	0	0	108.4	P120	P120-C122 PolarHBondContact O-N 3.23Å
123	V	89.3	Confident	84	Confident	37 Å²	37	67.7 Å²	67.7	22%	0.224	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-96	132.1	-178.3	-174.4	0	0	0	0	110.2	V17 L21 L91 D93	V17-V123 HydrophobicContact CG1-CG2 4.48Å; L21-V123 HydrophobicContact CD1-CG2 4.43Å; L21-V123 HydrophobicContact CD2-CG2 3.73Å; L21-V123 HydrophobicContact CG-CG2 4.34Å; L91-V123 HydrophobicContact CB-CG1 3.57Å; L91-V123 HydrophobicContact CD2-CG1 3.54Å; L91-V123 HydrophobicContact CG-CG1 4.17Å; D93-V123 HydrophobicContact CB-CG2 4.26Å
124	Y	94.1	Very high	85	Confident	28 Å²	28	67.2 Å²	67.2	11%	0.11	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	124.6	168.3	172.5	-90.7	0	0	0	109.6	L91 L92 P127 F143 V146 I158	L91-Y124 CarbonylContact C-O 3.53Å; L91-Y124 VanDerWaalsContact CA-O 3.26Å; L91-Y124 WeakPolarHBondContact CA-O 3.32Å; L92-Y124 HydrophobicContact CB-CD1 4.27Å; L92-Y124 PolarHBondContact N-O 3.11Å; L92-Y124 PolarHBondContact O-N 3.45Å; Y124-P127 WeakPolarHBondContact OH-CD 3.43Å; Y124-F143 AromaticContact CD1-CD1 3.81Å; Y124-F143 HydrophobicContact CD1-CD1 3.81Å; Y124-F143 HydrophobicContact CD1-CE1 4.27Å; Y124-F143 AromaticContact CE1-CD1 3.73Å; Y124-F143 HydrophobicContact CE1-CD1 3.73Å; Y124-F143 HydrophobicContact CE1-CE1 4.36Å; Y124-V146 HydrophobicContact CD1-CB 4.42Å; Y124-V146 HydrophobicContact CD1-CG2 4.4Å; Y124-V146 HydrophobicContact CD2-CB 4.17Å; Y124-V146 HydrophobicContact CD2-CG2 3.88Å; Y124-V146 HydrophobicContact CE1-CB 4.45Å; Y124-V146 HydrophobicContact CE2-CB 4.19Å; Y124-V146 HydrophobicContact CE2-CG2 4.39Å; Y124-V146 HydrophobicContact CG-CB 4.27Å; Y124-V146 HydrophobicContact CG-CG2 3.87Å; Y124-I158 VanDerWaalsContact CB-CD1 3.43Å
125	I	95	Very high	86.1	Confident	104 Å²	104	60.1 Å²	60.1	53%	0.533	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	127.3	174.1	-58.1	172.4	0	0	0	108.1	L91	L91-I125 HydrophobicContact CD2-CG1 3.97Å; L91-I125 HydrophobicContact CG-CG1 4.42Å
126	H	97	Very high	87.3	Confident	11 Å²	11	55.5 Å²	55.5	5%	0.051	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-60.1	132.6	175.7	-171.5	-80.4	0	0	0	109.7	F90 D128 S129 W136 S142 F143	F90-H126 HydrophobicContact CB-CB 3.89Å; F90-H126 VanDerWaalsContact O-CB 3.25Å; F90-H126 WeakPolarHBondContact O-CB 3.26Å; F90-H126 PolarHBondContact O-N 3.15Å; H126-D128 IonicContact CE1-OD1 3.4Å; H126-D128 IonicContact CE1-OD2 2.97Å; H126-D128 WeakPolarHBondContact ND1-CB 3.29Å; H126-D128 PolarHBondContact ND1-N 3.48Å; H126-D128 PolarHBondContact O-N 2.74Å; H126-D128 VanDerWaalsContact O-N 3.11Å; H126-S129 WeakPolarHBondContact O-CB 3.46Å; H126-S129 PolarHBondContact O-N 2.8Å; H126-S129 PolarHBondContact O-OG 3.46Å; H126-W136 HydrophobicContact CB-CH2 4.08Å; H126-W136 HydrophobicContact CB-CZ3 4.44Å; H126-W136 AromaticContact CE1-CZ3 3.8Å; H126-W136 AromaticContact CG-CH2 3.86Å; H126-W136 AromaticContact CG-CZ3 3.86Å; H126-W136 AromaticContact ND1-CH2 3.4Å; H126-W136 WeakPolarHBondContact ND1-CH2 3.33Å; H126-W136 AromaticContact ND1-CZ3 3.43Å; H126-W136 WeakPolarHBondContact ND1-CZ3 3.5Å; H126-S142 PolarHBondContact NE2-O 2.84Å; H126-F143 HydrophobicContact CB-CE1 4.06Å; H126-F143 AromaticContact CD2-CE1 4Å
127	P	96.6	Very high	88.4	Confident	68 Å²	68	53.6 Å²	53.6	44%	0.442	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-23.3	-170.6	25	-37.3	0	0	0	114.2	Y124 S129 K145	Y124-P127 WeakPolarHBondContact OH-CD 3.43Å; P127-S129 PolarHBondContact O-N 3.03Å; P127-K145 HydrophobicContact CG-CD 4.4Å
128	D	97.6	Very high	89.6	Confident	68 Å²	68	55.5 Å²	55.5	36%	0.364	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	-4.1	176.2	-62.3	11	0	0	0	112.8	H126 P130 N131 H135 W136	H126-D128 IonicContact CE1-OD1 3.4Å; H126-D128 IonicContact CE1-OD2 2.97Å; H126-D128 WeakPolarHBondContact ND1-CB 3.29Å; H126-D128 PolarHBondContact ND1-N 3.48Å; H126-D128 PolarHBondContact O-N 2.74Å; H126-D128 VanDerWaalsContact O-N 3.11Å; D128-P130 CarbonylContact O-C 3.59Å; D128-N131 WeakPolarHBondContact O-CB 3.37Å; D128-N131 PolarHBondContact O-ND2 2.95Å; D128-H135 IonicContact OD2-CE1 3.81Å; D128-H135 IonicContact OD2-NE2 3.57Å; D128-H135 PolarHBondContact OD2-NE2 2.84Å; D128-W136 HydrophobicContact CB-CH2 3.77Å; D128-W136 HydrophobicContact CB-CZ2 4.42Å; D128-W136 HydrophobicContact CB-CZ3 4.18Å
129	S	96.8	Very high	91.2	Very high	23 Å²	23	52.2 Å²	52.2	16%	0.161	30%	0.297	C	S	.	.			trans	-78.9	143.9	179.5	-54.4	0	0	0	0	112.3	F90 H126 P127	F90-S129 PolarHBondContact N-OG 2.89Å; F90-S129 PolarHBondContact O-OG 2.88Å; H126-S129 WeakPolarHBondContact O-CB 3.46Å; H126-S129 PolarHBondContact O-N 2.8Å; H126-S129 PolarHBondContact O-OG 3.46Å; P127-S129 PolarHBondContact O-N 3.03Å
130	P	96.8	Very high	92.8	Very high	74 Å²	74	52.9 Å²	52.9	48%	0.481	30%	0.302	S	S	.	.	S	Bend	cis	-76.6	150.1	-11.5	32.9	-35	0	0	0	111.8	Y88 D128 V175	Y88-P130 CarbonylContact O-C 3.49Å; Y88-P130 WeakPolarHBondContact O-CA 3.28Å; D128-P130 CarbonylContact O-C 3.59Å; P130-V175 HydrophobicContact CB-CG2 4.1Å
131	N	97.8	Very high	94.4	Very high	44 Å²	44	50.6 Å²	50.6	24%	0.235	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	165	174.8	-135	-62.1	0	0	0	113.2	M87 Y88 D128 H135 W136	M87-N131 CarbonylContact C-O 3.49Å; M87-N131 WeakPolarHBondContact CA-O 3.46Å; Y88-N131 PolarHBondContact N-O 2.84Å; Y88-N131 PolarHBondContact O-N 3.37Å; D128-N131 WeakPolarHBondContact O-CB 3.37Å; D128-N131 PolarHBondContact O-ND2 2.95Å; N131-H135 HydrophobicContact CB-CB 4.12Å; N131-H135 VanDerWaalsContact CG-CD2 3.48Å; N131-H135 VanDerWaalsContact CG-CG 3.44Å; N131-H135 WeakPolarHBondContact OD1-CB 3.42Å; N131-W136 HydrophobicContact CB-CZ2 3.88Å; N131-W136 PolarHBondContact O-NE1 3.11Å; N131-W136 VanDerWaalsContact O-NE1 3.11Å
132	F	96.1	Very high	96	Very high	107 Å²	107	50.7 Å²	50.7	47%	0.469	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	148.2	176.8	-69.8	-68.6	0	0	0	112.5	N85 A86 M87 A134 H135 W136	N85-F132 WeakPolarHBondContact O-CD1 3.2Å; N85-F132 WeakPolarHBondContact O-CE1 3.46Å; A86-F132 CarbonylContact O-C 3.42Å; A86-F132 VanDerWaalsContact O-CA 3.29Å; A86-F132 WeakPolarHBondContact O-CA 3.24Å; M87-F132 HydrophobicContact CG-CD1 4.21Å; M87-F132 HydrophobicContact CG-CE1 4.1Å; F132-A134 PolarHBondContact O-N 3.22Å; F132-H135 WeakPolarHBondContact O-CA 3.33Å; F132-H135 VanDerWaalsContact O-CB 3.31Å; F132-H135 WeakPolarHBondContact O-CB 3.44Å; F132-H135 PolarHBondContact O-N 3.22Å; F132-W136 PolarHBondContact O-N 2.96Å
133	G	95.1	Very high	96.7	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-53.9	-37.7	174.3	0	0	0	0	0	112.4	D83 A86 H135 W136 M137	D83-G133 WeakPolarHBondContact O-CA 3.44Å; A86-G133 PolarHBondContact O-N 3.46Å; G133-H135 VanDerWaalsContact C-N 3.27Å; G133-H135 PolarHBondContact O-N 3.13Å; G133-W136 PolarHBondContact O-N 2.91Å; G133-W136 VanDerWaalsContact O-N 3.16Å; G133-M137 WeakPolarHBondContact O-CG 3.32Å; G133-M137 PolarHBondContact O-N 3.17Å
134	A	96.5	Very high	97.1	Very high	51 Å²	51	48.8 Å²	48.8	42%	0.421	28%	0.276	S	S	.	.	H	α-helix	trans	-58	-37.6	174.2	0	0	0	0	0	112.8	P84 F132 K138	P84-A134 HydrophobicContact CB-CB 4.05Å; P84-A134 WeakPolarHBondContact O-CB 3.39Å; P84-A134 PolarHBondContact O-N 2.81Å; P84-A134 VanDerWaalsContact O-N 3.13Å; F132-A134 PolarHBondContact O-N 3.22Å; A134-K138 PolarHBondContact O-N 3.21Å
135	H	98.1	Very high	97.2	Very high	40 Å²	40	53.3 Å²	53.3	19%	0.185	30%	0.296	C	S	.	.	H	α-helix	trans	-66.8	-42.4	176.9	174.4	91.1	0	0	0	111.7	D128 N131 F132 G133 K138	D128-H135 IonicContact OD2-CE1 3.81Å; D128-H135 IonicContact OD2-NE2 3.57Å; D128-H135 PolarHBondContact OD2-NE2 2.84Å; N131-H135 HydrophobicContact CB-CB 4.12Å; N131-H135 VanDerWaalsContact CG-CD2 3.48Å; N131-H135 VanDerWaalsContact CG-CG 3.44Å; N131-H135 WeakPolarHBondContact OD1-CB 3.42Å; F132-H135 WeakPolarHBondContact O-CA 3.33Å; F132-H135 VanDerWaalsContact O-CB 3.31Å; F132-H135 WeakPolarHBondContact O-CB 3.44Å; F132-H135 PolarHBondContact O-N 3.22Å; G133-H135 VanDerWaalsContact C-N 3.27Å; G133-H135 PolarHBondContact O-N 3.13Å; H135-K138 PolarHBondContact CE1-NZ 3.22Å; H135-K138 PolarHBondContact ND1-NZ 3.39Å; H135-K138 WeakPolarHBondContact O-CD 3.49Å; H135-K138 VanDerWaalsContact O-CG 3.24Å; H135-K138 WeakPolarHBondContact O-CG 3.47Å
136	W	98	Very high	97.2	Very high	3 Å²	3	48.4 Å²	48.4	1%	0.011	27%	0.271	C	S	.	.	H	α-helix	trans	-71.2	-29.5	-178.5	-62.9	114.6	0	0	0	113.5	L82 Y88 F90 H126 D128 N131 F132 G133 V141	L82-W136 HydrophobicContact CD1-CB 3.91Å; Y88-W136 PolarHBondContact O-NE1 3Å; Y88-W136 VanDerWaalsContact O-NE1 3.15Å; F90-W136 HydrophobicContact CB-CH2 3.92Å; F90-W136 HydrophobicContact CB-CZ2 4.33Å; F90-W136 HydrophobicContact CB-CZ3 4.04Å; F90-W136 AromaticContact CD2-CD2 3.5Å; F90-W136 HydrophobicContact CD2-CD2 3.5Å; F90-W136 VanDerWaalsContact CD2-CD2 3.5Å; F90-W136 AromaticContact CD2-CE2 3.55Å; F90-W136 AromaticContact CD2-CE3 3.78Å; F90-W136 HydrophobicContact CD2-CE3 3.78Å; F90-W136 AromaticContact CD2-CG 3.94Å; F90-W136 HydrophobicContact CD2-CG 3.94Å; F90-W136 HydrophobicContact CD2-CH2 4.12Å; F90-W136 AromaticContact CD2-CZ2 3.88Å; F90-W136 HydrophobicContact CD2-CZ2 3.88Å; F90-W136 HydrophobicContact CD2-CZ3 4.08Å; F90-W136 AromaticContact CD2-NE1 3.99Å; F90-W136 HydrophobicContact CE2-CB 3.93Å; F90-W136 AromaticContact CE2-CD1 3.84Å; F90-W136 AromaticContact CE2-CD2 3.59Å; F90-W136 HydrophobicContact CE2-CD2 3.59Å; F90-W136 AromaticContact CE2-CE2 3.97Å; F90-W136 HydrophobicContact CE2-CE3 4.07Å; F90-W136 AromaticContact CE2-CG 3.51Å; F90-W136 HydrophobicContact CE2-CG 3.51Å; F90-W136 HydrophobicContact CG-CD2 4.22Å; F90-W136 HydrophobicContact CG-CE3 4.02Å; F90-W136 HydrophobicContact CG-CH2 4.21Å; F90-W136 HydrophobicContact CG-CZ2 4.41Å; F90-W136 HydrophobicContact CG-CZ3 4.02Å; F90-W136 HydrophobicContact CZ-CB 4.16Å; F90-W136 HydrophobicContact CZ-CD2 4.36Å; F90-W136 HydrophobicContact CZ-CG 4.21Å; H126-W136 HydrophobicContact CB-CH2 4.08Å; H126-W136 HydrophobicContact CB-CZ3 4.44Å; H126-W136 AromaticContact CE1-CZ3 3.8Å; H126-W136 AromaticContact CG-CH2 3.86Å; H126-W136 AromaticContact CG-CZ3 3.86Å; H126-W136 AromaticContact ND1-CH2 3.4Å; H126-W136 WeakPolarHBondContact ND1-CH2 3.33Å; H126-W136 AromaticContact ND1-CZ3 3.43Å; H126-W136 WeakPolarHBondContact ND1-CZ3 3.5Å; D128-W136 HydrophobicContact CB-CH2 3.77Å; D128-W136 HydrophobicContact CB-CZ2 4.42Å; D128-W136 HydrophobicContact CB-CZ3 4.18Å; N131-W136 HydrophobicContact CB-CZ2 3.88Å; N131-W136 PolarHBondContact O-NE1 3.11Å; N131-W136 VanDerWaalsContact O-NE1 3.11Å; F132-W136 PolarHBondContact O-N 2.96Å; G133-W136 PolarHBondContact O-N 2.91Å; G133-W136 VanDerWaalsContact O-N 3.16Å; W136-V141 HydrophobicContact CE3-CG1 3.95Å; W136-V141 HydrophobicContact CE3-CG2 3.79Å; W136-V141 HydrophobicContact CZ3-CG1 3.78Å; W136-V141 HydrophobicContact CZ3-CG2 4.46Å
137	M	97.8	Very high	97.1	Very high	58 Å²	58	51.9 Å²	51.9	29%	0.286	29%	0.286	S	S	.	.	H	α-helix	trans	-88.9	-10.1	-179.8	-62.8	-172.4	-69.1	0	0	113.8	V79 G81 L82 P84 G133 A139	V79-M137 WeakPolarHBondContact O-CG 3.38Å; G81-M137 PolarHBondContact N-SD 3.16Å; G81-M137 VanDerWaalsContact N-SD 3.45Å; L82-M137 HydrophobicContact CB-CE 3.98Å; L82-M137 HydrophobicContact CB-CG 4.27Å; L82-M137 HydrophobicContact CB-SD 3.81Å; L82-M137 HydrophobicContact CD1-CG 4.23Å; L82-M137 HydrophobicContact CG-CG 4.41Å; L82-M137 HydrophobicContact CG-SD 4.37Å; L82-M137 PolarHBondContact N-SD 2.93Å; L82-M137 VanDerWaalsContact N-SD 3.37Å; L82-M137 WeakPolarHBondContact O-CE 3.48Å; P84-M137 HydrophobicContact CG-CE 4.1Å; G133-M137 WeakPolarHBondContact O-CG 3.32Å; G133-M137 PolarHBondContact O-N 3.17Å; M137-A139 VanDerWaalsContact C-N 3.34Å; M137-A139 PolarHBondContact O-N 2.97Å
138	K	97.4	Very high	97.1	Very high	149 Å²	149	48.7 Å²	48.7	65%	0.648	27%	0.265	S	S	*	.	S	Bend	trans	-70.5	-26.9	-175.2	82.4	-167.5	174.6	-176.1	0	114.2	A134 H135	A134-K138 PolarHBondContact O-N 3.21Å; H135-K138 PolarHBondContact CE1-NZ 3.22Å; H135-K138 PolarHBondContact ND1-NZ 3.39Å; H135-K138 WeakPolarHBondContact O-CD 3.49Å; H135-K138 VanDerWaalsContact O-CG 3.24Å; H135-K138 WeakPolarHBondContact O-CG 3.47Å
139	A	97.9	Very high	96.9	Very high	50 Å²	50	45.5 Å²	45.5	41%	0.413	25%	0.248	S	C	.	.	S	Bend	trans	-159.8	163.5	-174.7	0	0	0	0	0	109.9	M137 V141	M137-A139 VanDerWaalsContact C-N 3.34Å; M137-A139 PolarHBondContact O-N 2.97Å; A139-V141 PolarHBondContact O-N 3.02Å
140	P	98.4	Very high	96.7	Very high	57 Å²	57	46.9 Å²	46.9	37%	0.37	25%	0.254	S	S	.	.			trans	-56.3	131	175.2	-21.4	29.8	0	0	0	112.5	V77	V77-P140 CarbonylContact O-C 3.51Å; V77-P140 WeakPolarHBondContact O-CA 3.46Å
141	V	98.6	Very high	96.3	Very high	7 Å²	7	49 Å²	49	4%	0.042	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	121.3	175.3	-175.1	0	0	0	0	108.8	K76 V77 V79 F90 W136 A139 F143	K76-V141 CarbonylContact C-O 3.56Å; K76-V141 VanDerWaalsContact CA-O 3.24Å; K76-V141 WeakPolarHBondContact CA-O 3.45Å; V77-V141 HydrophobicContact CG2-CB 4.03Å; V77-V141 PolarHBondContact N-O 2.91Å; V77-V141 PolarHBondContact O-N 2.92Å; V79-V141 HydrophobicContact CG2-CG2 4.14Å; F90-V141 HydrophobicContact CD1-CG1 4.02Å; F90-V141 HydrophobicContact CE1-CG2 4.22Å; W136-V141 HydrophobicContact CE3-CG1 3.95Å; W136-V141 HydrophobicContact CE3-CG2 3.79Å; W136-V141 HydrophobicContact CZ3-CG1 3.78Å; W136-V141 HydrophobicContact CZ3-CG2 4.46Å; A139-V141 PolarHBondContact O-N 3.02Å; V141-F143 HydrophobicContact CG1-CE2 4.13Å; V141-F143 HydrophobicContact CG1-CZ 4.4Å
142	S	98.4	Very high	95.4	Very high	35 Å²	35	52.9 Å²	52.9	25%	0.245	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	119.5	-169.6	176.9	0	0	0	0	112.9	H126 S144	H126-S142 PolarHBondContact NE2-O 2.84Å; S142-S144 PolarHBondContact O-N 3.25Å; S142-S144 VanDerWaalsContact O-N 3.17Å
143	F	97.9	Very high	94.1	Very high	1 Å²	1	51.2 Å²	51.2	0%	0.004	27%	0.272	C	S	.	.			trans	-87.4	32.7	176.2	-64.7	-92.3	0	0	0	112.8	L75 F90 L92 Y124 H126 V141 K145 V146 I170	L75-F143 HydrophobicContact CB-CB 4.4Å; L75-F143 HydrophobicContact CD2-CD2 4.33Å; L75-F143 HydrophobicContact CG-CD2 4.35Å; L75-F143 PolarHBondContact O-N 2.94Å; F90-F143 HydrophobicContact CB-CZ 4.38Å; L92-F143 HydrophobicContact CB-CD1 3.69Å; L92-F143 HydrophobicContact CB-CE1 3.62Å; L92-F143 HydrophobicContact CB-CG 4.48Å; L92-F143 HydrophobicContact CB-CZ 4.34Å; L92-F143 HydrophobicContact CD2-CB 3.92Å; L92-F143 HydrophobicContact CD2-CD1 3.77Å; L92-F143 HydrophobicContact CD2-CG 3.9Å; L92-F143 HydrophobicContact CG-CD1 4.34Å; Y124-F143 AromaticContact CD1-CD1 3.81Å; Y124-F143 HydrophobicContact CD1-CD1 3.81Å; Y124-F143 HydrophobicContact CD1-CE1 4.27Å; Y124-F143 AromaticContact CE1-CD1 3.73Å; Y124-F143 HydrophobicContact CE1-CD1 3.73Å; Y124-F143 HydrophobicContact CE1-CE1 4.36Å; H126-F143 HydrophobicContact CB-CE1 4.06Å; H126-F143 AromaticContact CD2-CE1 4Å; V141-F143 HydrophobicContact CG1-CE2 4.13Å; V141-F143 HydrophobicContact CG1-CZ 4.4Å; F143-K145 PolarHBondContact O-N 3.14Å; F143-K145 VanDerWaalsContact O-N 3.09Å; F143-V146 WeakPolarHBondContact O-CG1 3.48Å; F143-V146 PolarHBondContact O-N 3.42Å; F143-I170 HydrophobicContact CE2-CD1 3.9Å; F143-I170 HydrophobicContact CE2-CG1 4.06Å; F143-I170 HydrophobicContact CE2-CG2 4.45Å; F143-I170 HydrophobicContact CZ-CG1 4.29Å; F143-I170 HydrophobicContact CZ-CG2 4.2Å
144	S	97.1	Very high	92.8	Very high	47 Å²	47	55.4 Å²	55.4	33%	0.329	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.6	-175.6	60.9	0	0	0	0	116.1	R70 S142	R70-S144 VanDerWaalsContact CD-O 3.29Å; R70-S144 WeakPolarHBondContact CD-O 3.19Å; R70-S144 PolarHBondContact NE-O 3.29Å; S142-S144 PolarHBondContact O-N 3.25Å; S142-S144 VanDerWaalsContact O-N 3.17Å
145	K	95.4	Very high	91.5	Very high	122 Å²	122	55.5 Å²	55.5	53%	0.53	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-10.7	-176.4	-65.7	178.5	-174.3	170.2	0	113.5	P127 F143	P127-K145 HydrophobicContact CG-CD 4.4Å; F143-K145 PolarHBondContact O-N 3.14Å; F143-K145 VanDerWaalsContact O-N 3.09Å
146	V	95.3	Very high	90.5	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.006	34%	0.342	C	S	.	.			trans	-60.6	141.8	177.4	74.9	0	0	0	0	110.2	R70 M71 L92 Y124 F143 I158	R70-V146 WeakPolarHBondContact CA-O 3.29Å; M71-V146 HydrophobicContact CE-CG1 3.67Å; M71-V146 HydrophobicContact CG-CG1 4.12Å; M71-V146 HydrophobicContact SD-CG1 4.22Å; L92-V146 HydrophobicContact CD2-CB 4.46Å; L92-V146 HydrophobicContact CD2-CG1 4.29Å; L92-V146 HydrophobicContact CD2-CG2 4.3Å; Y124-V146 HydrophobicContact CD1-CB 4.42Å; Y124-V146 HydrophobicContact CD1-CG2 4.4Å; Y124-V146 HydrophobicContact CD2-CB 4.17Å; Y124-V146 HydrophobicContact CD2-CG2 3.88Å; Y124-V146 HydrophobicContact CE1-CB 4.45Å; Y124-V146 HydrophobicContact CE2-CB 4.19Å; Y124-V146 HydrophobicContact CE2-CG2 4.39Å; Y124-V146 HydrophobicContact CG-CB 4.27Å; Y124-V146 HydrophobicContact CG-CG2 3.87Å; F143-V146 WeakPolarHBondContact O-CG1 3.48Å; F143-V146 PolarHBondContact O-N 3.42Å; V146-I158 HydrophobicContact CG2-CD1 3.94Å; V146-I158 HydrophobicContact CG2-CG1 4.39Å
147	K	95.5	Very high	90.1	Very high	84 Å²	84	58.2 Å²	58.2	37%	0.365	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	128.7	178.8	-73.4	-175.4	177.9	-175.9	0	110.2	R69 R70 Q157 I158	R69-K147 CarbonylContact O-C 3.59Å; R69-K147 WeakPolarHBondContact O-CA 3.48Å; R70-K147 HydrophobicContact CG-CG 4.29Å; K147-Q157 HydrophobicContact CB-CG 4.18Å; K147-Q157 WeakPolarHBondContact O-CA 3.4Å; K147-I158 PolarHBondContact O-N 3.41Å
148	L	95.9	Very high	89.8	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	128.6	177.3	-50	-176.9	0	0	0	110.2	M62 V64 G68 R69 M71 F94 I158 L160 F192	M62-L148 HydrophobicContact CB-CD1 3.96Å; M62-L148 HydrophobicContact CG-CD1 4.44Å; V64-L148 HydrophobicContact CG1-CB 3.83Å; G68-L148 CarbonylContact C-O 3.52Å; G68-L148 VanDerWaalsContact CA-O 3.27Å; G68-L148 WeakPolarHBondContact CA-O 3.4Å; R69-L148 PolarHBondContact N-O 2.87Å; R69-L148 PolarHBondContact O-N 3.45Å; M71-L148 HydrophobicContact CG-CD1 3.67Å; M71-L148 HydrophobicContact CG-CD2 4.4Å; M71-L148 HydrophobicContact CG-CG 3.94Å; M71-L148 HydrophobicContact SD-CD1 4.08Å; M71-L148 HydrophobicContact SD-CD2 4.41Å; M71-L148 HydrophobicContact SD-CG 4.49Å; F94-L148 HydrophobicContact CE1-CD2 4.31Å; F94-L148 HydrophobicContact CE2-CD2 3.91Å; F94-L148 HydrophobicContact CZ-CD2 3.73Å; L148-I158 WeakPolarHBondContact CA-O 3.32Å; L148-I158 HydrophobicContact CD2-CB 4.33Å; L148-L160 HydrophobicContact CB-CD1 4.4Å; L148-L160 HydrophobicContact CD1-CD1 3.96Å; L148-L160 HydrophobicContact CD2-CD1 3.96Å; L148-L160 HydrophobicContact CG-CD1 4.33Å; L148-F192 HydrophobicContact CD1-CE2 4.15Å; L148-F192 HydrophobicContact CD1-CZ 4.01Å
149	T	94.8	Very high	89.6	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.006	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	158.2	-178.2	-179.8	0	0	0	0	110.9	T65 K66 K151 Q157 I158 M159 L160	T65-T149 VanDerWaalsContact O-CA 3.3Å; T65-T149 WeakPolarHBondContact O-CA 3.27Å; T65-T149 WeakPolarHBondContact O-CB 3.31Å; T65-T149 PolarHBondContact O-OG1 3.45Å; T65-T149 VanDerWaalsContact O-OG1 3.06Å; K66-T149 PolarHBondContact O-OG1 3.19Å; T149-K151 WeakPolarHBondContact CG2-O 3.37Å; T149-K151 PolarHBondContact OG1-N 3.32Å; T149-K151 VanDerWaalsContact OG1-N 3.13Å; T149-K151 PolarHBondContact OG1-O 3.31Å; T149-Q157 HydrophobicContact CG2-CB 3.67Å; T149-I158 WeakPolarHBondContact CG2-O 3.37Å; T149-I158 PolarHBondContact N-O 3.2Å; T149-M159 HydrophobicContact CG2-CB 4.11Å; T149-M159 CarbonylContact O-C 3.52Å; T149-M159 VanDerWaalsContact O-CA 3.28Å; T149-M159 WeakPolarHBondContact O-CA 3.48Å; T149-L160 PolarHBondContact O-N 3.39Å
150	N	92.6	Very high	89.4	Confident	52 Å²	52	47.4 Å²	47.4	28%	0.278	29%	0.293	S	S	.	.	S	Bend	trans	-104.8	15.1	171	66	-14.4	0	0	0	112.2	V64	V64-N150 HydrophobicContact CB-CB 4.31Å; V64-N150 HydrophobicContact CG2-CB 3.92Å
151	K	87.6	Confident	89.1	Confident	120 Å²	120	46 Å²	46	52%	0.522	28%	0.282	S	S	.	.	S	Bend	trans	-138.9	142.7	-180	-64.5	-66.6	177.8	-171.7	0	111	K66 T149 N153	K66-K151 HydrophobicContact CG-CG 4.41Å; T149-K151 WeakPolarHBondContact CG2-O 3.37Å; T149-K151 PolarHBondContact OG1-N 3.32Å; T149-K151 VanDerWaalsContact OG1-N 3.13Å; T149-K151 PolarHBondContact OG1-O 3.31Å; K151-N153 WeakPolarHBondContact CB-OD1 3.41Å; K151-N153 PolarHBondContact O-N 3.23Å; K151-N153 PolarHBondContact O-OD1 2.83Å
152	L	79.8	Confident	88.9	Confident	124 Å²	124	47.1 Å²	47.1	65%	0.649	29%	0.291	S	S	*	.			trans	-78.9	101.3	174.4	-69.2	168.6	0	0	0	109.4	M159	L152-M159 HydrophobicContact CD1-CE 4.44Å; L152-M159 HydrophobicContact CD2-CB 3.88Å; L152-M159 HydrophobicContact CD2-CE 3.8Å; L152-M159 HydrophobicContact CD2-CG 4.08Å; L152-M159 HydrophobicContact CG-CE 4.02Å; L152-M159 HydrophobicContact CG-CG 4.23Å
153	N	68.9	Low	88.8	Confident	72 Å²	72	47.6 Å²	47.6	39%	0.385	29%	0.29	S	S	.	.			trans	-118.6	3.8	-171.4	-54	6.1	0	0	0	113.8	K66 K151 G155	K66-N153 PolarHBondContact O-ND2 3.09Å; K151-N153 WeakPolarHBondContact CB-OD1 3.41Å; K151-N153 PolarHBondContact O-N 3.23Å; K151-N153 PolarHBondContact O-OD1 2.83Å; N153-G155 PolarHBondContact O-N 3.19Å
154	G	67.6	Low	88.7	Confident	88 Å²	88	48 Å²	48	91%	0.907	29%	0.292	S	S	*	.	S	Bend	trans	67.5	2.1	175.6	0	0	0	0	0	117.1
155	G	68	Low	88.6	Confident	53 Å²	53	47.5 Å²	47.5	55%	0.546	28%	0.284	S	S	.	.	S	Bend	trans	-100.8	39.4	-168.7	0	0	0	0	0	116.9	N153 Q157	N153-G155 PolarHBondContact O-N 3.19Å; G155-Q157 PolarHBondContact O-N 3.18Å; G155-Q157 VanDerWaalsContact O-N 3.16Å
156	G	77	Confident	88.7	Confident	61 Å²	61	42 Å²	42	63%	0.629	26%	0.26	S	S	*	.	S	Bend	trans	63.3	20.7	-178.4	0	0	0	0	0	114.2
157	Q	90	Very high	88.8	Confident	40 Å²	40	43.1 Å²	43.1	19%	0.187	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-95.8	149.1	175.5	-56.9	175.3	10.3	0	0	108.8	N67 K147 T149 G155	N67-Q157 PolarHBondContact O-NE2 3Å; N67-Q157 VanDerWaalsContact O-NE2 3.14Å; K147-Q157 HydrophobicContact CB-CG 4.18Å; K147-Q157 WeakPolarHBondContact O-CA 3.4Å; T149-Q157 HydrophobicContact CG2-CB 3.67Å; G155-Q157 PolarHBondContact O-N 3.18Å; G155-Q157 VanDerWaalsContact O-N 3.16Å
158	I	92.4	Very high	88.9	Confident	3 Å²	3	39.2 Å²	39.2	2%	0.015	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	121.7	175.2	-66.3	180	0	0	0	108.5	F94 Y124 V146 K147 L148 T149 L160	F94-I158 HydrophobicContact CD2-CB 4.49Å; F94-I158 HydrophobicContact CD2-CD1 3.76Å; F94-I158 HydrophobicContact CD2-CG2 3.74Å; F94-I158 HydrophobicContact CE2-CB 4.45Å; F94-I158 HydrophobicContact CE2-CD1 3.5Å; F94-I158 VanDerWaalsContact CE2-CD1 3.5Å; F94-I158 HydrophobicContact CE2-CG2 4.16Å; Y124-I158 VanDerWaalsContact CB-CD1 3.43Å; V146-I158 HydrophobicContact CG2-CD1 3.94Å; V146-I158 HydrophobicContact CG2-CG1 4.39Å; K147-I158 PolarHBondContact O-N 3.41Å; L148-I158 WeakPolarHBondContact CA-O 3.32Å; L148-I158 HydrophobicContact CD2-CB 4.33Å; T149-I158 WeakPolarHBondContact CG2-O 3.37Å; T149-I158 PolarHBondContact N-O 3.2Å; I158-L160 HydrophobicContact CG2-CD2 3.89Å; I158-L160 HydrophobicContact CG2-CG 4.26Å
159	M	93.1	Very high	89	Confident	23 Å²	23	42.8 Å²	42.8	11%	0.113	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	126.9	177.2	-169.7	-81.4	-65.5	0	0	109.6	T119 T149 L152	T119-M159 HydrophobicContact CG2-CE 3.62Å; T119-M159 HydrophobicContact CG2-SD 4.5Å; T149-M159 HydrophobicContact CG2-CB 4.11Å; T149-M159 CarbonylContact O-C 3.52Å; T149-M159 VanDerWaalsContact O-CA 3.28Å; T149-M159 WeakPolarHBondContact O-CA 3.48Å; L152-M159 HydrophobicContact CD1-CE 4.44Å; L152-M159 HydrophobicContact CD2-CB 3.88Å; L152-M159 HydrophobicContact CD2-CE 3.8Å; L152-M159 HydrophobicContact CD2-CG 4.08Å; L152-M159 HydrophobicContact CG-CE 4.02Å; L152-M159 HydrophobicContact CG-CG 4.23Å
160	L	93.6	Very high	89.1	Confident	4 Å²	4	42.8 Å²	42.8	2%	0.021	26%	0.262	C	S	.	.			trans	-125.9	144.3	175.3	-57.6	179.6	0	0	0	109.2	V64 F94 L148 T149 I158 Y166 F192 A194	V64-L160 HydrophobicContact CG1-CB 4.4Å; F94-L160 HydrophobicContact CB-CD2 3.8Å; F94-L160 HydrophobicContact CG-CD2 4.16Å; L148-L160 HydrophobicContact CB-CD1 4.4Å; L148-L160 HydrophobicContact CD1-CD1 3.96Å; L148-L160 HydrophobicContact CD2-CD1 3.96Å; L148-L160 HydrophobicContact CG-CD1 4.33Å; T149-L160 PolarHBondContact O-N 3.39Å; I158-L160 HydrophobicContact CG2-CD2 3.89Å; I158-L160 HydrophobicContact CG2-CG 4.26Å; L160-Y166 HydrophobicContact CB-CD2 4.4Å; L160-Y166 HydrophobicContact CB-CE2 3.83Å; L160-Y166 HydrophobicContact CD1-CD2 4.15Å; L160-Y166 HydrophobicContact CD1-CE2 4.4Å; L160-Y166 HydrophobicContact CD1-CG 4.42Å; L160-Y166 HydrophobicContact CD2-CD1 3.93Å; L160-Y166 HydrophobicContact CD2-CD2 4.36Å; L160-Y166 HydrophobicContact CD2-CE1 3.8Å; L160-Y166 HydrophobicContact CD2-CE2 4.23Å; L160-Y166 HydrophobicContact CD2-CG 4.21Å; L160-Y166 HydrophobicContact CG-CE2 4.38Å; L160-F192 HydrophobicContact CD1-CE2 3.9Å; L160-F192 HydrophobicContact CD1-CZ 3.79Å; L160-A194 HydrophobicContact CB-CB 4.26Å; L160-A194 HydrophobicContact CD1-CB 4.43Å
161	N	92.8	Very high	89.3	Confident	26 Å²	26	40.9 Å²	40.9	14%	0.139	25%	0.251	C	S	.	.			trans	-74.2	130.4	170.3	-69.7	-23	0	0	0	109.3	T119 Y166	T119-N161 WeakPolarHBondContact CG2-ND2 3.45Å; N161-Y166 PolarHBondContact N-OH 3.33Å; N161-Y166 WeakPolarHBondContact O-CE2 3.36Å
162	S	94.3	Very high	89.6	Confident	32 Å²	32	35.1 Å²	35.1	22%	0.224	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	152.8	172.1	-59.6	0	0	0	0	110.6	V64 H164 A194	V64-S162 VanDerWaalsContact CG2-OG 3.3Å; V64-S162 WeakPolarHBondContact CG2-OG 3.45Å; S162-H164 PolarHBondContact O-N 3.04Å; S162-H164 PolarHBondContact O-ND1 3.4Å; S162-A194 CarbonylContact C-O 3.48Å; S162-A194 WeakPolarHBondContact CA-O 3.28Å
163	L	95.4	Very high	90.3	Very high	44 Å²	44	30.6 Å²	30.6	23%	0.23	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.9	24.4	-179.2	-53.4	177.6	0	0	0	114.4	R101 W102 W109 A194 V195	R101-L163 CarbonylContact C-O 3.59Å; R101-L163 HydrophobicContact CG-CB 4.12Å; W102-L163 PolarHBondContact N-O 2.94Å; W102-L163 WeakPolarHBondContact O-CB 3.24Å; W109-L163 HydrophobicContact CH2-CD2 4.11Å; W109-L163 HydrophobicContact CZ3-CD2 4.18Å; L163-A194 PolarHBondContact N-O 2.81Å; L163-V195 HydrophobicContact CD2-CG1 4.48Å
164	H	94.8	Very high	91.3	Very high	9 Å²	9	29.5 Å²	29.5	4%	0.042	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	148.5	172	-70	79.5	0	0	0	109.9	H100 E116 S162 Y166 I193 A194	H100-H164 PolarHBondContact O-CD2 2.78Å; E116-H164 IonicContact OE2-CE1 2.7Å; E116-H164 PolarHBondContact OE2-CE1 3.43Å; S162-H164 PolarHBondContact O-N 3.04Å; S162-H164 PolarHBondContact O-ND1 3.4Å; H164-Y166 HydrophobicContact CB-CD2 4.47Å; H164-Y166 HydrophobicContact CB-CE2 3.66Å; H164-Y166 VanDerWaalsContact O-CD2 3.32Å; H164-Y166 WeakPolarHBondContact O-CD2 3.39Å; H164-Y166 WeakPolarHBondContact O-CE2 3.42Å; H164-I193 WeakPolarHBondContact O-CA 3.45Å; H164-A194 PolarHBondContact O-N 2.87Å
165	K	96.6	Very high	92.4	Very high	38 Å²	38	27.5 Å²	27.5	17%	0.165	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	132.9	178.6	-164.3	-174	-67.6	147.5	0	110.2	A97 D98 F192 I193	A97-K165 HydrophobicContact CB-CB 4.16Å; A97-K165 HydrophobicContact CB-CD 3.85Å; A97-K165 HydrophobicContact CB-CG 3.82Å; A97-K165 PolarHBondContact N-O 2.74Å; D98-K165 WeakPolarHBondContact OD2-CE 3.45Å; D98-K165 IonicContact OD2-NZ 3.67Å; D98-K165 PolarHBondContact OD2-NZ 2.99Å; K165-F192 CarbonylContact C-O 3.6Å; K165-F192 WeakPolarHBondContact CA-O 3.44Å; K165-I193 HydrophobicContact CB-CG1 4.14Å; K165-I193 HydrophobicContact CG-CG1 4.16Å
166	Y	97.3	Very high	92.7	Very high	6 Å²	6	27.8 Å²	27.8	2%	0.024	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	150.1	-178	-67.5	-82.1	0	0	0	111.4	F94 V95 L160 N161 H164 Q191 F192 A194	F94-Y166 HydrophobicContact CB-CD1 4.12Å; V95-Y166 CarbonylContact O-C 3.56Å; V95-Y166 VanDerWaalsContact O-CA 3.28Å; V95-Y166 WeakPolarHBondContact O-CA 3.48Å; L160-Y166 HydrophobicContact CB-CD2 4.4Å; L160-Y166 HydrophobicContact CB-CE2 3.83Å; L160-Y166 HydrophobicContact CD1-CD2 4.15Å; L160-Y166 HydrophobicContact CD1-CE2 4.4Å; L160-Y166 HydrophobicContact CD1-CG 4.42Å; L160-Y166 HydrophobicContact CD2-CD1 3.93Å; L160-Y166 HydrophobicContact CD2-CD2 4.36Å; L160-Y166 HydrophobicContact CD2-CE1 3.8Å; L160-Y166 HydrophobicContact CD2-CE2 4.23Å; L160-Y166 HydrophobicContact CD2-CG 4.21Å; L160-Y166 HydrophobicContact CG-CE2 4.38Å; N161-Y166 PolarHBondContact N-OH 3.33Å; N161-Y166 WeakPolarHBondContact O-CE2 3.36Å; H164-Y166 HydrophobicContact CB-CD2 4.47Å; H164-Y166 HydrophobicContact CB-CE2 3.66Å; H164-Y166 VanDerWaalsContact O-CD2 3.32Å; H164-Y166 WeakPolarHBondContact O-CD2 3.39Å; H164-Y166 WeakPolarHBondContact O-CE2 3.42Å; Y166-Q191 VanDerWaalsContact O-CA 3.27Å; Y166-Q191 WeakPolarHBondContact O-CA 3.3Å; Y166-F192 HydrophobicContact CD2-CE2 4.4Å; Y166-F192 PolarHBondContact N-O 2.99Å; Y166-F192 PolarHBondContact O-N 3.16Å; Y166-A194 HydrophobicContact CD2-CB 4.12Å; Y166-A194 HydrophobicContact CE2-CB 4.04Å
167	E	97.4	Very high	92.3	Very high	24 Å²	24	27.4 Å²	27.4	11%	0.112	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	120.6	169	-171.4	165.9	170.3	0	0	109.3	F94 V95 S186 Q191	F94-E167 WeakPolarHBondContact CA-O 3.44Å; V95-E167 HydrophobicContact CG2-CB 3.89Å; V95-E167 WeakPolarHBondContact CG2-O 3.33Å; V95-E167 PolarHBondContact N-O 2.87Å; V95-E167 PolarHBondContact O-N 2.87Å; E167-S186 WeakPolarHBondContact OE1-CB 3.28Å; E167-Q191 HydrophobicContact CB-CG 3.89Å; E167-Q191 HydrophobicContact CG-CG 3.9Å; E167-Q191 PolarHBondContact OE2-NE2 3.06Å
168	P	97.6	Very high	90.8	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.019	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	136.2	169.6	-19.6	29.6	0	0	0	111.4	L75 L92 F94 S186 T190 F192	L75-P168 HydrophobicContact CD2-CB 3.82Å; L92-P168 HydrophobicContact CD1-CB 4.08Å; F94-P168 HydrophobicContact CD1-CB 4.33Å; F94-P168 HydrophobicContact CD1-CG 4.17Å; F94-P168 HydrophobicContact CE1-CB 4.1Å; F94-P168 HydrophobicContact CE1-CG 3.89Å; P168-S186 PolarHBondContact O-OG 3.17Å; P168-T190 VanDerWaalsContact CD-O 3.31Å; P168-T190 WeakPolarHBondContact CD-O 3.39Å; P168-T190 WeakPolarHBondContact CD-OG1 3.47Å; P168-F192 HydrophobicContact CG-CD1 4.48Å; P168-F192 HydrophobicContact CG-CE1 4.07Å
169	R	97.3	Very high	89.4	Confident	75 Å²	75	38.5 Å²	38.5	28%	0.283	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	126.1	175.4	175.9	175.5	68	174.7	4.5	110.6	L92 D93 H171 S186	L92-R169 WeakPolarHBondContact CA-O 3.42Å; D93-R169 PolarHBondContact N-O 3.38Å; D93-R169 PolarHBondContact O-N 3.34Å; D93-R169 VanDerWaalsContact OD1-CB 3.3Å; D93-R169 WeakPolarHBondContact OD1-CB 3.43Å; D93-R169 IonicContact OD1-CZ 3.97Å; D93-R169 IonicContact OD1-NE 3.7Å; D93-R169 PolarHBondContact OD1-NE 2.91Å; D93-R169 IonicContact OD1-NH2 3.22Å; D93-R169 IonicContact OD2-CZ 3.94Å; D93-R169 IonicContact OD2-NE 3.72Å; D93-R169 IonicContact OD2-NH2 3.85Å; D93-R169 PolarHBondContact OD2-NH2 2.7Å; R169-H171 PolarHBondContact NE-CE1 2.88Å; R169-H171 VanDerWaalsContact NE-CE1 3.28Å; R169-H171 PolarHBondContact NE-NE2 2.77Å; R169-S186 WeakPolarHBondContact CB-OG 3.4Å; R169-S186 VanDerWaalsContact CG-OG 3.32Å; R169-S186 WeakPolarHBondContact CG-OG 3.35Å
170	I	97.6	Very high	88.2	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	133.4	-178	-64	165.8	0	0	0	108.5	L75 V77 F90 L91 L92 F143 S184 H185 F187	L75-I170 HydrophobicContact CD2-CD1 3.98Å; L75-I170 HydrophobicContact CD2-CG1 4.12Å; L75-I170 HydrophobicContact CG-CD1 4.28Å; V77-I170 HydrophobicContact CB-CD1 4.32Å; V77-I170 HydrophobicContact CG1-CD1 3.4Å; V77-I170 HydrophobicContact CG2-CD1 3.94Å; F90-I170 HydrophobicContact CD1-CG2 4.21Å; L91-I170 CarbonylContact O-C 3.49Å; L91-I170 WeakPolarHBondContact O-CA 3.44Å; L92-I170 HydrophobicContact CD1-CG1 4.11Å; F143-I170 HydrophobicContact CE2-CD1 3.9Å; F143-I170 HydrophobicContact CE2-CG1 4.06Å; F143-I170 HydrophobicContact CE2-CG2 4.45Å; F143-I170 HydrophobicContact CZ-CG1 4.29Å; F143-I170 HydrophobicContact CZ-CG2 4.2Å; I170-S184 CarbonylContact O-C 3.57Å; I170-S184 WeakPolarHBondContact O-CA 3.46Å; I170-H185 PolarHBondContact N-O 3.31Å; I170-H185 PolarHBondContact O-N 3.26Å; I170-F187 HydrophobicContact CD1-CE2 4.49Å
171	H	95.5	Very high	87.1	Confident	12 Å²	12	44.6 Å²	44.6	6%	0.056	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	133.6	174.2	-54.7	-78.9	0	0	0	110.4	F90 L91 D93 R169 T183 S184	F90-H171 WeakPolarHBondContact CA-O 3.39Å; L91-H171 HydrophobicContact CB-CB 4.24Å; L91-H171 HydrophobicContact CD1-CB 4.3Å; L91-H171 PolarHBondContact N-O 2.87Å; L91-H171 PolarHBondContact O-N 3.02Å; D93-H171 IonicContact OD1-CD2 3.71Å; D93-H171 IonicContact OD1-NE2 3.98Å; D93-H171 PolarHBondContact OD1-NE2 2.66Å; D93-H171 VanDerWaalsContact OD1-NE2 3.16Å; D93-H171 IonicContact OD2-NE2 3.16Å; R169-H171 PolarHBondContact NE-CE1 2.88Å; R169-H171 VanDerWaalsContact NE-CE1 3.28Å; R169-H171 PolarHBondContact NE-NE2 2.77Å; H171-T183 CarbonylContact C-O 3.54Å; H171-T183 WeakPolarHBondContact CA-O 3.26Å; H171-S184 PolarHBondContact CE1-OG 2.7Å; H171-S184 PolarHBondContact ND1-OG 3.09Å
172	I	95.5	Very high	86.6	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	116.4	174.3	-55.2	176.5	0	0	0	107.5	L42 V44 V79 L82 Y88 F90 I182 T183	L42-I172 HydrophobicContact CD1-CD1 4.21Å; L42-I172 HydrophobicContact CD2-CD1 4.31Å; V44-I172 HydrophobicContact CG2-CD1 3.72Å; V79-I172 HydrophobicContact CG1-CD1 4.32Å; L82-I172 HydrophobicContact CD2-CG2 4.11Å; Y88-I172 HydrophobicContact CD1-CG2 3.96Å; F90-I172 HydrophobicContact CD1-CG1 4.09Å; F90-I172 HydrophobicContact CD2-CG2 4.36Å; F90-I172 HydrophobicContact CE1-CD1 3.66Å; F90-I172 HydrophobicContact CE1-CG1 3.61Å; F90-I172 HydrophobicContact CE2-CB 4.44Å; F90-I172 HydrophobicContact CE2-CD1 4.35Å; F90-I172 HydrophobicContact CE2-CG1 4.07Å; F90-I172 HydrophobicContact CE2-CG2 3.74Å; F90-I172 HydrophobicContact CZ-CB 4.39Å; F90-I172 HydrophobicContact CZ-CD1 3.51Å; F90-I172 HydrophobicContact CZ-CG1 3.6Å; F90-I172 HydrophobicContact CZ-CG2 3.98Å; I172-I182 WeakPolarHBondContact O-CA 3.21Å; I172-T183 PolarHBondContact N-O 2.68Å; I172-T183 PolarHBondContact O-N 3.02Å; I172-T183 VanDerWaalsContact O-N 3.08Å
173	V	93.1	Very high	86.4	Confident	28 Å²	28	42.9 Å²	42.9	17%	0.17	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	118.1	-175.1	179.9	0	0	0	0	109.3	Y88 S89 L91 V175 M181 I182	Y88-V173 CarbonylContact C-O 3.59Å; Y88-V173 VanDerWaalsContact CA-O 3.22Å; Y88-V173 WeakPolarHBondContact CA-O 3.21Å; S89-V173 PolarHBondContact N-O 3.21Å; S89-V173 PolarHBondContact O-N 2.93Å; L91-V173 HydrophobicContact CD1-CB 4.16Å; L91-V173 HydrophobicContact CD1-CG2 3.47Å; L91-V173 VanDerWaalsContact CD1-CG2 3.47Å; V173-V175 PolarHBondContact O-N 3.23Å; V173-M181 WeakPolarHBondContact CA-O 3.26Å; V173-I182 HydrophobicContact CG1-CG1 4.25Å; V173-I182 HydrophobicContact CG2-CG1 4.21Å; V173-I182 HydrophobicContact CG2-CG2 3.92Å
174	R	91.2	Very high	86.4	Confident	49 Å²	49	43 Å²	43	19%	0.185	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	127.4	172.3	-170.3	177	179.9	159.6	12.7	109.8	D36 D83 Y88 M181	D36-R174 IonicContact OD1-NH1 3.85Å; D36-R174 IonicContact OD2-CZ 3.99Å; D36-R174 IonicContact OD2-NH1 3.39Å; D36-R174 PolarHBondContact OD2-NH1 2.84Å; D83-R174 IonicContact OD2-NH2 3.11Å; D83-R174 PolarHBondContact OD2-NH2 3.06Å; Y88-R174 HydrophobicContact CD1-CB 3.96Å; Y88-R174 HydrophobicContact CD1-CG 4.29Å; Y88-R174 HydrophobicContact CE1-CB 3.78Å; Y88-R174 HydrophobicContact CE1-CG 3.85Å; R174-M181 HydrophobicContact CB-CB 4.09Å; R174-M181 HydrophobicContact CB-CE 4.48Å; R174-M181 PolarHBondContact N-O 2.9Å
175	V	89	Confident	86.4	Confident	47 Å²	47	44.7 Å²	44.7	29%	0.285	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	126.3	-178.7	-177.1	0	0	0	0	109.5	M87 S89 P130 V173	M87-V175 HydrophobicContact CB-CB 3.96Å; M87-V175 HydrophobicContact CE-CG1 4.35Å; M87-V175 PolarHBondContact O-N 2.92Å; S89-V175 WeakPolarHBondContact OG-CG2 3.36Å; P130-V175 HydrophobicContact CB-CG2 4.1Å; V173-V175 PolarHBondContact O-N 3.23Å
176	G	76.1	Confident	86.4	Confident	59 Å²	59	45.2 Å²	45.2	61%	0.608	25%	0.253	S	S	*	.	S	Bend	trans	79.9	121.3	-179.6	0	0	0	0	0	111.9
177	G	67.6	Low	86.5	Confident	53 Å²	53	45.9 Å²	45.9	55%	0.546	26%	0.257	S	S	.	.	S	Bend	trans	138.9	157.3	-176.7	0	0	0	0	0	111.2	R179	G177-R179 PolarHBondContact O-N 3.01Å
178	P	58.7	Low	86.5	Confident	145 Å²	145	49.4 Å²	49.4	94%	0.942	28%	0.276	S	S	*	.	S	Bend	trans	-71.2	-15.5	178	27.9	-33.3	0	0	0	113
179	R	62.8	Low	86.5	Confident	130 Å²	130	50 Å²	50	49%	0.491	28%	0.278	S	S	.	.	S	Bend	trans	-117.7	123	174	-66.5	-174.4	-178.4	178.4	3.3	109.6	K34 G177 M181	K34-R179 PolarHBondContact O-NH1 2.86Å; G177-R179 PolarHBondContact O-N 3.01Å; R179-M181 PolarHBondContact O-N 3.32Å
180	R	67.8	Low	86.5	Confident	143 Å²	143	46.4 Å²	46.4	54%	0.54	27%	0.265	S	S	.	.			trans	-85.6	107.3	167.1	-76.5	170	-179.4	170.1	2	107.6	E27	E27-R180 VanDerWaalsContact CD-CD 3.45Å; E27-R180 VanDerWaalsContact OE1-CD 3.31Å; E27-R180 WeakPolarHBondContact OE1-CD 3.45Å; E27-R180 IonicContact OE1-CZ 2.82Å; E27-R180 IonicContact OE1-NE 3.41Å; E27-R180 IonicContact OE1-NH1 2.67Å; E27-R180 PolarHBondContact OE1-NH1 3.23Å; E27-R180 VanDerWaalsContact OE1-NH1 3.11Å; E27-R180 WeakPolarHBondContact OE2-CB 3.26Å; E27-R180 WeakPolarHBondContact OE2-CD 3.4Å; E27-R180 IonicContact OE2-NE 3.97Å; E27-R180 IonicContact OE2-NH1 3.89Å; E27-R180 PolarHBondContact OE2-NH1 2.85Å
181	M	71.6	Confident	86.6	Confident	12 Å²	12	48.7 Å²	48.7	6%	0.059	28%	0.275	C	S	.	.			trans	-82.8	126.8	168.6	-179.1	177.8	68.7	0	0	107.7	D36 E39 Y88 V173 R174 R179 T183	D36-M181 HydrophobicContact CB-SD 4.16Å; E39-M181 HydrophobicContact CB-SD 3.75Å; E39-M181 HydrophobicContact CG-SD 4.04Å; Y88-M181 HydrophobicContact CE1-CE 3.83Å; V173-M181 WeakPolarHBondContact CA-O 3.26Å; R174-M181 HydrophobicContact CB-CB 4.09Å; R174-M181 HydrophobicContact CB-CE 4.48Å; R174-M181 PolarHBondContact N-O 2.9Å; R179-M181 PolarHBondContact O-N 3.32Å; M181-T183 HydrophobicContact CG-CG2 4.29Å
182	I	82.6	Confident	86.7	Confident	9 Å²	9	48.2 Å²	48.2	5%	0.046	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	113.5	176.7	-50	167.6	0	0	0	108.3	V24 E27 L28 I172 V173	V24-I182 HydrophobicContact CB-CD1 3.85Å; V24-I182 HydrophobicContact CG1-CB 4.44Å; V24-I182 HydrophobicContact CG1-CD1 3.79Å; V24-I182 HydrophobicContact CG1-CG2 3.67Å; V24-I182 HydrophobicContact CG2-CD1 3.81Å; E27-I182 HydrophobicContact CB-CD1 4.2Å; L28-I182 HydrophobicContact CD1-CB 3.77Å; L28-I182 HydrophobicContact CD1-CG2 3.68Å; L28-I182 VanDerWaalsContact CD1-O 3.3Å; L28-I182 WeakPolarHBondContact CD1-O 3.36Å; L28-I182 WeakPolarHBondContact CG-O 3.46Å; I172-I182 WeakPolarHBondContact O-CA 3.21Å; V173-I182 HydrophobicContact CG1-CG1 4.25Å; V173-I182 HydrophobicContact CG2-CG1 4.21Å; V173-I182 HydrophobicContact CG2-CG2 3.92Å
183	T	90.1	Very high	86.8	Confident	13 Å²	13	48.2 Å²	48.2	8%	0.08	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	143.1	176.9	55.4	0	0	0	0	109.8	E39 L42 H171 I172 M181 H185	E39-T183 HydrophobicContact CG-CG2 3.92Å; L42-T183 HydrophobicContact CD2-CG2 3.85Å; L42-T183 WeakPolarHBondContact CD2-OG1 3.3Å; H171-T183 CarbonylContact C-O 3.54Å; H171-T183 WeakPolarHBondContact CA-O 3.26Å; I172-T183 PolarHBondContact N-O 2.68Å; I172-T183 PolarHBondContact O-N 3.02Å; I172-T183 VanDerWaalsContact O-N 3.08Å; M181-T183 HydrophobicContact CG-CG2 4.29Å; T183-H185 PolarHBondContact OG1-NE2 2.93Å
184	S	94	Very high	87.1	Confident	46 Å²	46	46.9 Å²	46.9	32%	0.322	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	133.1	-175.8	-55.7	0	0	0	0	110.4	I170 H171	I170-S184 CarbonylContact O-C 3.57Å; I170-S184 WeakPolarHBondContact O-CA 3.46Å; H171-S184 PolarHBondContact CE1-OG 2.7Å; H171-S184 PolarHBondContact ND1-OG 3.09Å
185	H	96	Very high	87.4	Confident	45 Å²	45	44.6 Å²	44.6	21%	0.208	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	129.1	-174.7	-57.7	-84.9	0	0	0	110.7	V44 I170 T183	V44-H185 HydrophobicContact CB-CB 4.37Å; V44-H185 HydrophobicContact CG1-CB 4.38Å; I170-H185 PolarHBondContact N-O 3.31Å; I170-H185 PolarHBondContact O-N 3.26Å; T183-H185 PolarHBondContact OG1-NE2 2.93Å
186	S	96.8	Very high	87.8	Confident	49 Å²	49	46.4 Å²	46.4	34%	0.343	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	155.1	177.5	-61.5	0	0	0	0	110.4	E167 P168 R169	E167-S186 WeakPolarHBondContact OE1-CB 3.28Å; P168-S186 PolarHBondContact O-OG 3.17Å; R169-S186 WeakPolarHBondContact CB-OG 3.4Å; R169-S186 VanDerWaalsContact CG-OG 3.32Å; R169-S186 WeakPolarHBondContact CG-OG 3.35Å
187	F	97.9	Very high	88.9	Confident	20 Å²	20	46 Å²	46	9%	0.088	26%	0.259	C	S	.	.			trans	-131.6	113.7	-178	-58.8	-80	0	0	0	109.2	V44 L46 V77 I170 E189 T190	V44-F187 HydrophobicContact CG1-CZ 4.1Å; L46-F187 HydrophobicContact CB-CD1 3.79Å; L46-F187 HydrophobicContact CB-CD2 4.27Å; L46-F187 HydrophobicContact CB-CE1 3.91Å; L46-F187 HydrophobicContact CB-CE2 4.38Å; L46-F187 HydrophobicContact CB-CG 3.98Å; L46-F187 HydrophobicContact CB-CZ 4.21Å; L46-F187 HydrophobicContact CD1-CD2 4.27Å; L46-F187 HydrophobicContact CD1-CG 4.49Å; L46-F187 HydrophobicContact CD2-CB 4.22Å; L46-F187 HydrophobicContact CD2-CG 4.39Å; V77-F187 HydrophobicContact CG1-CE2 3.69Å; V77-F187 HydrophobicContact CG1-CZ 4.17Å; I170-F187 HydrophobicContact CD1-CE2 4.49Å; F187-E189 PolarHBondContact O-N 3.23Å; F187-E189 VanDerWaalsContact O-N 3.14Å; F187-T190 HydrophobicContact CB-CG2 3.8Å; F187-T190 WeakPolarHBondContact O-CB 3.24Å; F187-T190 PolarHBondContact O-N 3.13Å; F187-T190 PolarHBondContact O-OG1 3.37Å
188	L	97.3	Very high	90.3	Very high	99 Å²	99	47 Å²	47	52%	0.518	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-58.7	-30.6	-174.9	-64.6	175.5	0	0	0	113	K56 T190 Q191	K56-L188 WeakPolarHBondContact CE-O 3.1Å; L188-T190 PolarHBondContact O-N 3.27Å; L188-Q191 WeakPolarHBondContact O-CB 3.27Å; L188-Q191 VanDerWaalsContact O-CG 3.32Å; L188-Q191 WeakPolarHBondContact O-CG 3.39Å; L188-Q191 PolarHBondContact O-N 3.05Å
189	E	97.4	Very high	92.2	Very high	15 Å²	15	43.8 Å²	43.8	7%	0.07	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-70.1	-12.6	175.5	65.5	-93.3	-133	0	0	114.5	L46 R49 W52 K56 F187	L46-E189 HydrophobicContact CD2-CG 3.42Å; L46-E189 VanDerWaalsContact CD2-CG 3.42Å; L46-E189 WeakPolarHBondContact CD2-OE1 3.43Å; R49-E189 WeakPolarHBondContact CD-OE1 3.44Å; R49-E189 HydrophobicContact CG-CG 4.42Å; R49-E189 WeakPolarHBondContact CG-OE1 3.42Å; R49-E189 IonicContact CZ-OE1 3.77Å; R49-E189 IonicContact NE-OE1 3.97Å; R49-E189 PolarHBondContact NE-OE1 3.48Å; R49-E189 IonicContact NH1-OE1 3.54Å; R49-E189 PolarHBondContact NH1-OE1 2.83Å; R49-E189 IonicContact NH1-OE2 2.82Å; R49-E189 IonicContact NH2-OE1 2.99Å; W52-E189 HydrophobicContact CB-CG 4.15Å; K56-E189 HydrophobicContact CD-CB 3.93Å; F187-E189 PolarHBondContact O-N 3.23Å; F187-E189 VanDerWaalsContact O-N 3.14Å
190	T	98.6	Very high	93.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-93	1.1	177.3	68.3	0	0	0	0	113.2	L46 W52 L75 P168 F187 L188 F192	L46-T190 HydrophobicContact CD1-CG2 3.75Å; L46-T190 HydrophobicContact CD2-CG2 3.58Å; L46-T190 HydrophobicContact CG-CG2 4.34Å; W52-T190 HydrophobicContact CD2-CG2 3.84Å; W52-T190 HydrophobicContact CE3-CG2 3.96Å; W52-T190 HydrophobicContact CG-CG2 4.23Å; W52-T190 HydrophobicContact CZ2-CG2 4.44Å; W52-T190 HydrophobicContact CZ3-CG2 4.28Å; L75-T190 HydrophobicContact CD1-CG2 4.05Å; P168-T190 VanDerWaalsContact CD-O 3.31Å; P168-T190 WeakPolarHBondContact CD-O 3.39Å; P168-T190 WeakPolarHBondContact CD-OG1 3.47Å; F187-T190 HydrophobicContact CB-CG2 3.8Å; F187-T190 WeakPolarHBondContact O-CB 3.24Å; F187-T190 PolarHBondContact O-N 3.13Å; F187-T190 PolarHBondContact O-OG1 3.37Å; L188-T190 PolarHBondContact O-N 3.27Å; T190-F192 WeakPolarHBondContact O-CD1 3.3Å
191	Q	98.5	Very high	95.3	Very high	49 Å²	49	39.2 Å²	39.2	23%	0.229	21%	0.21	C	C	.	.			trans	-59.8	144.9	174.7	-71	-179.2	3.9	0	0	111.6	N60 Y166 E167 L188	N60-Q191 WeakPolarHBondContact CB-O 3.49Å; Y166-Q191 VanDerWaalsContact O-CA 3.27Å; Y166-Q191 WeakPolarHBondContact O-CA 3.3Å; E167-Q191 HydrophobicContact CB-CG 3.89Å; E167-Q191 HydrophobicContact CG-CG 3.9Å; E167-Q191 PolarHBondContact OE2-NE2 3.06Å; L188-Q191 WeakPolarHBondContact O-CB 3.27Å; L188-Q191 VanDerWaalsContact O-CG 3.32Å; L188-Q191 WeakPolarHBondContact O-CG 3.39Å; L188-Q191 PolarHBondContact O-N 3.05Å
192	F	98.7	Very high	96.6	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.009	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	161.6	177.8	65.3	-88.4	0	0	0	111.8	N60 M62 F94 L148 L160 K165 Y166 P168 T190 A194	N60-F192 HydrophobicContact CB-CB 3.98Å; N60-F192 CarbonylContact O-C 3.6Å; N60-F192 WeakPolarHBondContact O-CA 3.36Å; N60-F192 WeakPolarHBondContact O-CB 3.23Å; M62-F192 HydrophobicContact CB-CD2 3.38Å; M62-F192 HydrophobicContact CB-CE2 3.6Å; M62-F192 HydrophobicContact CB-CG 4.02Å; M62-F192 HydrophobicContact CB-CZ 4.4Å; M62-F192 HydrophobicContact CG-CB 3.83Å; M62-F192 HydrophobicContact CG-CD1 3.85Å; M62-F192 HydrophobicContact CG-CD2 3.28Å; M62-F192 HydrophobicContact CG-CE1 4.24Å; M62-F192 HydrophobicContact CG-CE2 3.72Å; M62-F192 HydrophobicContact CG-CG 3.35Å; M62-F192 HydrophobicContact CG-CZ 4.17Å; F94-F192 AromaticContact CD1-CE1 3.68Å; F94-F192 HydrophobicContact CD1-CE1 3.68Å; F94-F192 AromaticContact CD1-CZ 3.63Å; F94-F192 HydrophobicContact CD1-CZ 3.63Å; F94-F192 AromaticContact CE1-CE1 3.57Å; F94-F192 HydrophobicContact CE1-CE1 3.57Å; F94-F192 AromaticContact CE1-CZ 3.64Å; F94-F192 HydrophobicContact CE1-CZ 3.64Å; L148-F192 HydrophobicContact CD1-CE2 4.15Å; L148-F192 HydrophobicContact CD1-CZ 4.01Å; L160-F192 HydrophobicContact CD1-CE2 3.9Å; L160-F192 HydrophobicContact CD1-CZ 3.79Å; K165-F192 CarbonylContact C-O 3.6Å; K165-F192 WeakPolarHBondContact CA-O 3.44Å; Y166-F192 HydrophobicContact CD2-CE2 4.4Å; Y166-F192 PolarHBondContact N-O 2.99Å; Y166-F192 PolarHBondContact O-N 3.16Å; P168-F192 HydrophobicContact CG-CD1 4.48Å; P168-F192 HydrophobicContact CG-CE1 4.07Å; T190-F192 WeakPolarHBondContact O-CD1 3.3Å; F192-A194 HydrophobicContact CE2-CB 4.27Å
193	I	98.3	Very high	97.3	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	128	167.5	-60.8	175.1	0	0	0	109.1	T59 N60 E61 M62 W102 W109 H164 K165 V195	T59-I193 HydrophobicContact CG2-CD1 3.72Å; T59-I193 HydrophobicContact CG2-CG1 4.27Å; N60-I193 PolarHBondContact O-N 2.85Å; E61-I193 WeakPolarHBondContact CA-O 3.49Å; M62-I193 PolarHBondContact N-O 2.82Å; W102-I193 HydrophobicContact CB-CD1 4.09Å; W102-I193 HydrophobicContact CD2-CD1 4.03Å; W102-I193 HydrophobicContact CE3-CD1 4.31Å; W102-I193 HydrophobicContact CG-CD1 3.91Å; W109-I193 HydrophobicContact CB-CD1 4.38Å; W109-I193 HydrophobicContact CD2-CD1 3.51Å; W109-I193 HydrophobicContact CE3-CD1 3.67Å; W109-I193 HydrophobicContact CG-CD1 3.86Å; W109-I193 HydrophobicContact CH2-CB 4.47Å; W109-I193 HydrophobicContact CH2-CD1 4.41Å; W109-I193 HydrophobicContact CH2-CG2 3.77Å; W109-I193 HydrophobicContact CZ2-CB 4.44Å; W109-I193 HydrophobicContact CZ2-CD1 4.31Å; W109-I193 HydrophobicContact CZ2-CG2 4.22Å; W109-I193 HydrophobicContact CZ3-CD1 4.11Å; W109-I193 HydrophobicContact CZ3-CG2 4Å; H164-I193 WeakPolarHBondContact O-CA 3.45Å; K165-I193 HydrophobicContact CB-CG1 4.14Å; K165-I193 HydrophobicContact CG-CG1 4.16Å; I193-V195 HydrophobicContact CG2-CG1 4.07Å
194	A	97.8	Very high	97.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	128	175.2	0	0	0	0	0	109.9	M62 V64 L160 S162 L163 H164 Y166 F192	M62-A194 CarbonylContact O-C 3.56Å; M62-A194 WeakPolarHBondContact O-CA 3.35Å; V64-A194 HydrophobicContact CG1-CB 4.06Å; L160-A194 HydrophobicContact CB-CB 4.26Å; L160-A194 HydrophobicContact CD1-CB 4.43Å; S162-A194 CarbonylContact C-O 3.48Å; S162-A194 WeakPolarHBondContact CA-O 3.28Å; L163-A194 PolarHBondContact N-O 2.81Å; H164-A194 PolarHBondContact O-N 2.87Å; Y166-A194 HydrophobicContact CD2-CB 4.12Å; Y166-A194 HydrophobicContact CE2-CB 4.04Å; F192-A194 HydrophobicContact CE2-CB 4.27Å
195	V	98.3	Very high	97.8	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	153.4	-176.5	-62.2	0	0	0	0	111.2	E61 M62 I63 V64 W109 L163 I193 A197 Y198 Q199	E61-V195 HydrophobicContact CB-CG2 3.96Å; M62-V195 PolarHBondContact O-N 2.81Å; I63-V195 CarbonylContact C-O 3.56Å; I63-V195 VanDerWaalsContact CA-O 3.24Å; I63-V195 WeakPolarHBondContact CA-O 3.32Å; I63-V195 HydrophobicContact CD1-CG2 3.95Å; V64-V195 WeakPolarHBondContact CG2-O 3.37Å; V64-V195 PolarHBondContact N-O 3.43Å; W109-V195 HydrophobicContact CH2-CG1 3.74Å; W109-V195 HydrophobicContact CZ2-CG1 3.98Å; L163-V195 HydrophobicContact CD2-CG1 4.48Å; I193-V195 HydrophobicContact CG2-CG1 4.07Å; V195-A197 WeakPolarHBondContact CB-O 3.29Å; V195-A197 WeakPolarHBondContact CG2-O 3.49Å; V195-Y198 HydrophobicContact CG2-CD1 4.43Å; V195-Q199 HydrophobicContact CG1-CG 4.34Å
196	T	97.8	Very high	97.8	Very high	85 Å²	85	45 Å²	45	52%	0.521	24%	0.244	S	C	.	.	S	Bend	trans	-86.5	-22	173.5	48.9	0	0	0	0	112.7	V64	V64-T196 HydrophobicContact CG2-CG2 4.24Å
197	A	98.1	Very high	97.9	Very high	52 Å²	52	42.9 Å²	42.9	43%	0.43	23%	0.229	S	C	.	.	S	Bend	trans	-148.5	147.8	173.5	0	0	0	0	0	107.7	V195 Q199	V195-A197 WeakPolarHBondContact CB-O 3.29Å; V195-A197 WeakPolarHBondContact CG2-O 3.49Å; A197-Q199 PolarHBondContact O-NE2 3.31Å
198	Y	98.6	Very high	97.8	Very high	72 Å²	72	44.2 Å²	44.2	28%	0.282	24%	0.236	S	C	.	.			trans	-60.5	141.4	178.1	-66.5	-58.8	0	0	0	110.8	E61 I63 V195 I203 T204 K207	E61-Y198 HydrophobicContact CB-CD1 3.94Å; E61-Y198 HydrophobicContact CB-CE1 4.22Å; E61-Y198 VanDerWaalsContact OE2-CA 3.23Å; E61-Y198 WeakPolarHBondContact OE2-CA 3.38Å; I63-Y198 HydrophobicContact CD1-CD1 4.04Å; I63-Y198 HydrophobicContact CD1-CD2 4.2Å; I63-Y198 HydrophobicContact CD1-CE1 4.02Å; I63-Y198 HydrophobicContact CD1-CE2 4.19Å; I63-Y198 HydrophobicContact CD1-CG 4.12Å; I63-Y198 HydrophobicContact CG1-CD1 4.25Å; I63-Y198 HydrophobicContact CG1-CD2 4.46Å; I63-Y198 HydrophobicContact CG1-CE1 3.71Å; I63-Y198 HydrophobicContact CG1-CE2 3.95Å; V195-Y198 HydrophobicContact CG2-CD1 4.43Å; Y198-I203 HydrophobicContact CD1-CG2 4.07Å; Y198-I203 HydrophobicContact CE1-CG2 4.19Å; Y198-T204 WeakPolarHBondContact CB-OG1 2.96Å; Y198-T204 HydrophobicContact CD2-CG2 4.29Å; Y198-K207 HydrophobicContact CE1-CD 4.42Å; Y198-K207 HydrophobicContact CE1-CG 4.09Å; Y198-K207 HydrophobicContact CE2-CG 4.2Å; Y198-K207 WeakPolarHBondContact OH-CD 3.41Å; Y198-K207 WeakPolarHBondContact OH-CE 3.29Å; Y198-K207 WeakPolarHBondContact OH-CG 3.29Å
199	Q	98.4	Very high	97.7	Very high	78 Å²	78	45.8 Å²	45.8	36%	0.364	24%	0.239	S	C	.	.			trans	-104.1	-48.4	178.6	-56	-60	-62.9	0	0	110.6	E61 Y104 W109 V195 A197	E61-Q199 PolarHBondContact OE2-N 2.93Å; Y104-Q199 HydrophobicContact CD1-CB 3.7Å; Y104-Q199 HydrophobicContact CD2-CB 4.29Å; Y104-Q199 HydrophobicContact CE1-CB 4.38Å; Y104-Q199 WeakPolarHBondContact CE1-O 3.18Å; Y104-Q199 HydrophobicContact CG-CB 3.63Å; W109-Q199 HydrophobicContact CH2-CB 4.22Å; W109-Q199 HydrophobicContact CH2-CG 3.66Å; W109-Q199 HydrophobicContact CZ2-CB 3.78Å; W109-Q199 HydrophobicContact CZ2-CG 3.68Å; V195-Q199 HydrophobicContact CG1-CG 4.34Å; A197-Q199 PolarHBondContact O-NE2 3.31Å
200	N	97.9	Very high	97.6	Very high	14 Å²	14	48.8 Å²	48.8	8%	0.075	25%	0.25	C	S	.	.			trans	-82.6	119	174.4	-173.9	-9.1	0	0	0	111.1	L58 E61 Y104 E202 I203 T204	L58-N200 PolarHBondContact O-ND2 3.31Å; E61-N200 VanDerWaalsContact OE1-CB 3.29Å; E61-N200 WeakPolarHBondContact OE1-CB 3.47Å; E61-N200 PolarHBondContact OE1-N 3.39Å; Y104-N200 HydrophobicContact CE2-CB 4.12Å; N200-E202 VanDerWaalsContact C-N 3.28Å; N200-E202 PolarHBondContact O-N 3.38Å; N200-E202 WeakPolarHBondContact OD1-CB 3.29Å; N200-E202 PolarHBondContact OD1-N 2.96Å; N200-I203 HydrophobicContact CB-CB 4.26Å; N200-I203 HydrophobicContact CB-CG1 3.98Å; N200-I203 WeakPolarHBondContact O-CB 3.4Å; N200-I203 PolarHBondContact O-N 3.22Å; N200-T204 PolarHBondContact O-N 2.92Å; N200-T204 PolarHBondContact O-OG1 3.44Å
201	E	97.3	Very high	97.5	Very high	164 Å²	164	50 Å²	50	77%	0.766	26%	0.257	S	S	*	.	H	α-helix	trans	-65.4	-29.6	177.9	-65.4	-170.1	170.2	0	0	112.7	T204 A205	E201-T204 CarbonylContact O-C 3.33Å; E201-T204 WeakPolarHBondContact O-CA 3.3Å; E201-T204 VanDerWaalsContact O-CB 3.3Å; E201-T204 WeakPolarHBondContact O-CB 3.46Å; E201-T204 PolarHBondContact O-N 3.49Å; E201-T204 VanDerWaalsContact O-N 3.1Å; E201-A205 PolarHBondContact O-N 2.86Å
202	E	97.9	Very high	97.3	Very high	116 Å²	116	52.3 Å²	52.3	54%	0.542	28%	0.276	S	S	.	.	H	α-helix	trans	-67.6	-37.8	177.2	-59.1	-176.1	-170.5	0	0	111.6	L58 N200 T204 A205 L206	L58-E202 HydrophobicContact CD1-CB 3.75Å; L58-E202 VanDerWaalsContact CD2-OE2 3.26Å; L58-E202 WeakPolarHBondContact CD2-OE2 3.5Å; N200-E202 VanDerWaalsContact C-N 3.28Å; N200-E202 PolarHBondContact O-N 3.38Å; N200-E202 WeakPolarHBondContact OD1-CB 3.29Å; N200-E202 PolarHBondContact OD1-N 2.96Å; E202-T204 VanDerWaalsContact C-N 3.31Å; E202-T204 PolarHBondContact O-N 3.1Å; E202-A205 PolarHBondContact O-N 2.86Å; E202-L206 PolarHBondContact O-N 3.23Å
203	I	98.2	Very high	97	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-60.3	-45.7	169.6	-69.2	-70.1	0	0	0	109.4	F55 L58 E61 Y198 N200 A205 L206 K207	F55-I203 HydrophobicContact CD1-CD1 3.94Å; L58-I203 HydrophobicContact CB-CD1 3.58Å; L58-I203 HydrophobicContact CB-CG1 4.09Å; E61-I203 HydrophobicContact CB-CG2 4.09Å; E61-I203 HydrophobicContact CG-CG1 4.47Å; E61-I203 HydrophobicContact CG-CG2 4.37Å; Y198-I203 HydrophobicContact CD1-CG2 4.07Å; Y198-I203 HydrophobicContact CE1-CG2 4.19Å; N200-I203 HydrophobicContact CB-CB 4.26Å; N200-I203 HydrophobicContact CB-CG1 3.98Å; N200-I203 WeakPolarHBondContact O-CB 3.4Å; N200-I203 PolarHBondContact O-N 3.22Å; I203-A205 VanDerWaalsContact C-N 3.31Å; I203-A205 PolarHBondContact O-N 3.15Å; I203-L206 WeakPolarHBondContact O-CB 3.49Å; I203-L206 PolarHBondContact O-N 2.94Å; I203-L206 VanDerWaalsContact O-N 3.15Å; I203-K207 HydrophobicContact CG2-CG 4.18Å; I203-K207 VanDerWaalsContact O-CG 3.26Å; I203-K207 WeakPolarHBondContact O-CG 3.26Å; I203-K207 PolarHBondContact O-N 2.97Å
204	T	97.2	Very high	96.7	Very high	42 Å²	42	61.6 Å²	61.6	26%	0.258	32%	0.32	S	S	.	.	H	α-helix	trans	-57.8	-44.4	177.8	-58.2	0	0	0	0	111.4	Y198 N200 E201 E202 L206 K207 I208	Y198-T204 WeakPolarHBondContact CB-OG1 2.96Å; Y198-T204 HydrophobicContact CD2-CG2 4.29Å; N200-T204 PolarHBondContact O-N 2.92Å; N200-T204 PolarHBondContact O-OG1 3.44Å; E201-T204 CarbonylContact O-C 3.33Å; E201-T204 WeakPolarHBondContact O-CA 3.3Å; E201-T204 VanDerWaalsContact O-CB 3.3Å; E201-T204 WeakPolarHBondContact O-CB 3.46Å; E201-T204 PolarHBondContact O-N 3.49Å; E201-T204 VanDerWaalsContact O-N 3.1Å; E202-T204 VanDerWaalsContact C-N 3.31Å; E202-T204 PolarHBondContact O-N 3.1Å; T204-L206 PolarHBondContact O-N 3.1Å; T204-K207 PolarHBondContact O-N 3.37Å; T204-I208 HydrophobicContact CG2-CD1 3.98Å; T204-I208 WeakPolarHBondContact O-CG1 3.43Å; T204-I208 PolarHBondContact O-N 3.49Å
205	A	96.4	Very high	95.8	Very high	59 Å²	59	67.3 Å²	67.3	49%	0.488	34%	0.344	S	S	.	.	H	α-helix	trans	-60.9	-43.7	175.8	0	0	0	0	0	112.1	E201 E202 I203 I208 K209	E201-A205 PolarHBondContact O-N 2.86Å; E202-A205 PolarHBondContact O-N 2.86Å; I203-A205 VanDerWaalsContact C-N 3.31Å; I203-A205 PolarHBondContact O-N 3.15Å; A205-I208 PolarHBondContact O-N 3.04Å; A205-K209 VanDerWaalsContact O-CB 3.29Å; A205-K209 WeakPolarHBondContact O-CB 3.3Å; A205-K209 PolarHBondContact O-N 3.38Å
206	L	97.1	Very high	95	Very high	28 Å²	28	70.9 Å²	70.9	15%	0.147	37%	0.374	C	S	.	.	H	α-helix	trans	-62	-42.5	173.8	-75.1	-177.8	0	0	0	112.3	K54 F55 L58 E202 I203 T204 K209 Y210	K54-L206 HydrophobicContact CB-CD1 4.44Å; F55-L206 HydrophobicContact CD1-CB 4.35Å; F55-L206 HydrophobicContact CD1-CD1 4.17Å; F55-L206 HydrophobicContact CE1-CB 3.57Å; F55-L206 HydrophobicContact CE1-CD1 4.2Å; F55-L206 HydrophobicContact CZ-CB 3.68Å; L58-L206 HydrophobicContact CD1-CD1 3.63Å; L58-L206 HydrophobicContact CD1-CG 4.33Å; E202-L206 PolarHBondContact O-N 3.23Å; I203-L206 WeakPolarHBondContact O-CB 3.49Å; I203-L206 PolarHBondContact O-N 2.94Å; I203-L206 VanDerWaalsContact O-N 3.15Å; T204-L206 PolarHBondContact O-N 3.1Å; L206-K209 PolarHBondContact O-N 2.9Å; L206-Y210 HydrophobicContact CD2-CD2 4.05Å; L206-Y210 HydrophobicContact CD2-CE2 3.72Å; L206-Y210 WeakPolarHBondContact O-CD2 2.95Å; L206-Y210 PolarHBondContact O-N 3.17Å
207	K	97.6	Very high	94.2	Very high	6 Å²	6	73.6 Å²	73.6	3%	0.026	38%	0.379	C	S	.	.	H	α-helix	trans	-61.8	-45.1	176.5	-60.8	-70.7	-170.3	-153.6	0	110.4	F55 N60 E61 F72 Y198 I203 T204 N211	F55-K207 HydrophobicContact CD1-CD 4.49Å; F55-K207 HydrophobicContact CE1-CD 3.52Å; F55-K207 HydrophobicContact CE1-CG 3.96Å; F55-K207 HydrophobicContact CZ-CD 3.82Å; F55-K207 HydrophobicContact CZ-CG 4.39Å; N60-K207 PolarHBondContact OD1-NZ 3.23Å; E61-K207 WeakPolarHBondContact O-CE 3.22Å; E61-K207 PolarHBondContact O-NZ 2.69Å; F72-K207 HydrophobicContact CD1-CD 3.65Å; F72-K207 HydrophobicContact CE1-CD 4.45Å; F72-K207 PolarHBondContact O-NZ 3.3Å; Y198-K207 HydrophobicContact CE1-CD 4.42Å; Y198-K207 HydrophobicContact CE1-CG 4.09Å; Y198-K207 HydrophobicContact CE2-CG 4.2Å; Y198-K207 WeakPolarHBondContact OH-CD 3.41Å; Y198-K207 WeakPolarHBondContact OH-CE 3.29Å; Y198-K207 WeakPolarHBondContact OH-CG 3.29Å; I203-K207 HydrophobicContact CG2-CG 4.18Å; I203-K207 VanDerWaalsContact O-CG 3.26Å; I203-K207 WeakPolarHBondContact O-CG 3.26Å; I203-K207 PolarHBondContact O-N 2.97Å; T204-K207 PolarHBondContact O-N 3.37Å; K207-N211 WeakPolarHBondContact O-CA 3.41Å; K207-N211 WeakPolarHBondContact O-CB 3.27Å; K207-N211 PolarHBondContact O-N 3Å
208	I	95.8	Very high	93.2	Very high	47 Å²	47	73.7 Å²	73.7	24%	0.241	37%	0.372	C	S	.	.	H	α-helix	trans	-62.2	-45.1	177.7	-69.3	167.3	0	0	0	110.9	T204 A205 A214 F217 L218	T204-I208 HydrophobicContact CG2-CD1 3.98Å; T204-I208 WeakPolarHBondContact O-CG1 3.43Å; T204-I208 PolarHBondContact O-N 3.49Å; A205-I208 PolarHBondContact O-N 3.04Å; I208-A214 HydrophobicContact CG1-CB 4.5Å; I208-F217 HydrophobicContact CD1-CB 4.09Å; I208-F217 HydrophobicContact CG1-CB 4.17Å; I208-F217 HydrophobicContact CG2-CB 3.91Å; I208-L218 HydrophobicContact CG2-CB 4.13Å; I208-L218 HydrophobicContact CG2-CD1 4.25Å
209	K	95.7	Very high	92.1	Very high	132 Å²	132	73.1 Å²	73.1	57%	0.574	37%	0.373	S	S	*	.	H	α-helix	trans	-64.1	-45.3	-177.7	-178.1	174	-179.1	175.4	0	113.2	A205 L206	A205-K209 VanDerWaalsContact O-CB 3.29Å; A205-K209 WeakPolarHBondContact O-CB 3.3Å; A205-K209 PolarHBondContact O-N 3.38Å; L206-K209 PolarHBondContact O-N 2.9Å
210	Y	96.2	Very high	91.1	Very high	78 Å²	78	71.7 Å²	71.7	31%	0.306	38%	0.375	S	S	.	.	H	α-helix	trans	-102.6	-18.9	-169.3	-69.8	-71.9	0	0	0	114.3	L51 K54 F72 L206 P212	L51-Y210 HydrophobicContact CD1-CD1 4.02Å; L51-Y210 HydrophobicContact CD1-CD2 3.87Å; L51-Y210 HydrophobicContact CD1-CE1 4.45Å; L51-Y210 HydrophobicContact CD1-CE2 4.31Å; L51-Y210 HydrophobicContact CD1-CG 3.71Å; K54-Y210 PolarHBondContact NZ-OH 3.48Å; F72-Y210 VanDerWaalsContact CZ-O 3.27Å; F72-Y210 WeakPolarHBondContact CZ-O 3.39Å; L206-Y210 HydrophobicContact CD2-CD2 4.05Å; L206-Y210 HydrophobicContact CD2-CE2 3.72Å; L206-Y210 WeakPolarHBondContact O-CD2 2.95Å; L206-Y210 PolarHBondContact O-N 3.17Å; Y210-P212 VanDerWaalsContact O-CD 3.3Å; Y210-P212 WeakPolarHBondContact O-CD 3.35Å
211	N	96.6	Very high	90	Very high	25 Å²	25	77.8 Å²	77.8	13%	0.134	40%	0.401	C	S	.	.			trans	-87.2	114	178.9	-172	-11.1	0	0	0	110.6	F72 K207 F213 A214	F72-N211 HydrophobicContact CD1-CB 3.97Å; F72-N211 HydrophobicContact CD2-CB 3.78Å; F72-N211 HydrophobicContact CE1-CB 3.87Å; F72-N211 HydrophobicContact CE2-CB 3.7Å; F72-N211 HydrophobicContact CG-CB 3.93Å; F72-N211 VanDerWaalsContact CZ-CA 3.49Å; F72-N211 HydrophobicContact CZ-CB 3.76Å; K207-N211 WeakPolarHBondContact O-CA 3.41Å; K207-N211 WeakPolarHBondContact O-CB 3.27Å; K207-N211 PolarHBondContact O-N 3Å; N211-F213 PolarHBondContact O-N 2.92Å; N211-F213 WeakPolarHBondContact OD1-CD2 3.15Å; N211-F213 PolarHBondContact OD1-N 3.14Å; N211-F213 VanDerWaalsContact OD1-N 3.1Å; N211-A214 HydrophobicContact CB-CB 4.12Å; N211-A214 PolarHBondContact O-N 2.9Å
212	P	93.5	Very high	89	Confident	99 Å²	99	74.7 Å²	74.7	64%	0.643	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-58.3	-27.8	-179.7	-24.4	35.4	0	0	0	113.6	Y210 A214 K215	Y210-P212 VanDerWaalsContact O-CD 3.3Å; Y210-P212 WeakPolarHBondContact O-CD 3.35Å; P212-A214 PolarHBondContact O-N 3.34Å; P212-K215 WeakPolarHBondContact O-CB 3.37Å; P212-K215 PolarHBondContact O-N 2.88Å
213	F	91.8	Very high	87.8	Confident	184 Å²	184	77.5 Å²	77.5	81%	0.807	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-77.4	-7.2	178	-60.1	-74.4	0	0	0	113.7	N211	N211-F213 PolarHBondContact O-N 2.92Å; N211-F213 WeakPolarHBondContact OD1-CD2 3.15Å; N211-F213 PolarHBondContact OD1-N 3.14Å; N211-F213 VanDerWaalsContact OD1-N 3.1Å
214	A	92	Very high	86.4	Confident	13 Å²	13	81.8 Å²	81.8	11%	0.107	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-103.9	4.3	174.7	0	0	0	0	0	112.8	I208 N211 P212 A216 F217	I208-A214 HydrophobicContact CG1-CB 4.5Å; N211-A214 HydrophobicContact CB-CB 4.12Å; N211-A214 PolarHBondContact O-N 2.9Å; P212-A214 PolarHBondContact O-N 3.34Å; A214-A216 PolarHBondContact O-N 3.38Å; A214-A216 VanDerWaalsContact O-N 3.11Å; A214-F217 HydrophobicContact CB-CD2 4.39Å; A214-F217 WeakPolarHBondContact O-CD2 3.4Å; A214-F217 PolarHBondContact O-N 3.38Å
215	K	79.1	Confident	85.1	Confident	120 Å²	120	84 Å²	84	52%	0.522	43%	0.425	S	S	.	.	H	α-helix	trans	-55.5	-32.8	-175.2	-173.5	178.5	177.2	-175.2	0	114.1	P212 F217 L218 D219	P212-K215 WeakPolarHBondContact O-CB 3.37Å; P212-K215 PolarHBondContact O-N 2.88Å; K215-F217 PolarHBondContact O-N 3.33Å; K215-F217 VanDerWaalsContact O-N 3.1Å; K215-L218 WeakPolarHBondContact O-CA 3.27Å; K215-L218 VanDerWaalsContact O-CB 3.27Å; K215-L218 WeakPolarHBondContact O-CB 3.45Å; K215-L218 PolarHBondContact O-N 3.02Å; K215-D219 WeakPolarHBondContact CE-OD1 3.33Å; K215-D219 PolarHBondContact O-N 3.06Å
216	A	82.3	Confident	83.5	Confident	75 Å²	75	87.3 Å²	87.3	62%	0.62	43%	0.43	S	S	*	.	H	α-helix	trans	-57.4	-28.5	178.4	0	0	0	0	0	113.6	A214 A220	A214-A216 PolarHBondContact O-N 3.38Å; A214-A216 VanDerWaalsContact O-N 3.11Å; A216-A220 PolarHBondContact O-N 2.92Å
217	F	80.3	Confident	81.8	Confident	141 Å²	141	92.4 Å²	92.4	62%	0.618	45%	0.451	S	S	*	.	H	α-helix	trans	-78.6	-30.1	175.6	-60.3	-77	0	0	0	112.4	I208 A214 K215 K221	I208-F217 HydrophobicContact CD1-CB 4.09Å; I208-F217 HydrophobicContact CG1-CB 4.17Å; I208-F217 HydrophobicContact CG2-CB 3.91Å; A214-F217 HydrophobicContact CB-CD2 4.39Å; A214-F217 WeakPolarHBondContact O-CD2 3.4Å; A214-F217 PolarHBondContact O-N 3.38Å; K215-F217 PolarHBondContact O-N 3.33Å; K215-F217 VanDerWaalsContact O-N 3.1Å; F217-K221 PolarHBondContact O-N 3.04Å
218	L	77.6	Confident	80.1	Confident	54 Å²	54	95.9 Å²	95.9	28%	0.283	47%	0.47	S	S	.	.	H	α-helix	trans	-66.9	-51.1	173.8	-165.8	83.6	0	0	0	110.1	I208 K215 A220 K221 E222	I208-L218 HydrophobicContact CG2-CB 4.13Å; I208-L218 HydrophobicContact CG2-CD1 4.25Å; K215-L218 WeakPolarHBondContact O-CA 3.27Å; K215-L218 VanDerWaalsContact O-CB 3.27Å; K215-L218 WeakPolarHBondContact O-CB 3.45Å; K215-L218 PolarHBondContact O-N 3.02Å; L218-A220 PolarHBondContact O-N 3.1Å; L218-K221 PolarHBondContact O-N 3.01Å; L218-E222 PolarHBondContact O-N 3.11Å; L218-E222 VanDerWaalsContact O-N 3.09Å
219	D	74.9	Confident	78.3	Confident	60 Å²	60	100.2 Å²	100.2	32%	0.321	49%	0.491	S	S	.	.	H	α-helix	trans	-61.7	-28.3	-178.8	-61.6	-8.6	0	0	0	112.1	K215 R223	K215-D219 WeakPolarHBondContact CE-OD1 3.33Å; K215-D219 PolarHBondContact O-N 3.06Å; D219-R223 WeakPolarHBondContact O-CB 3.35Å; D219-R223 PolarHBondContact O-N 3.09Å
220	A	77.2	Confident	76.5	Confident	48 Å²	48	104 Å²	104	40%	0.397	50%	0.502	S	S	.	.	H	α-helix	trans	-73.6	-37.1	175.4	0	0	0	0	0	112.6	A216 L218 N224	A216-A220 PolarHBondContact O-N 2.92Å; L218-A220 PolarHBondContact O-N 3.1Å; A220-N224 PolarHBondContact O-N 3.1Å
221	K	75.8	Confident	74.7	Confident	142 Å²	142	106.2 Å²	106.2	62%	0.617	52%	0.515	S	S	*	.	H	α-helix	trans	-68.2	-48.8	177.3	-172.1	178	178.5	-179.9	0	110.9	F217 L218 R223 N224 D225	F217-K221 PolarHBondContact O-N 3.04Å; L218-K221 PolarHBondContact O-N 3.01Å; K221-R223 VanDerWaalsContact C-N 3.28Å; K221-R223 PolarHBondContact O-N 3.36Å; K221-N224 WeakPolarHBondContact O-CB 3.47Å; K221-N224 PolarHBondContact O-N 3.16Å; K221-D225 PolarHBondContact O-N 3.43Å; K221-D225 VanDerWaalsContact O-N 3.1Å
222	E	75.9	Confident	72.9	Confident	99 Å²	99	112.6 Å²	112.6	46%	0.463	54%	0.544	S	S	.	.	H	α-helix	trans	-60.2	-37.3	178.9	-67.8	179.6	174.8	0	0	112.3	L218 N224 H226	L218-E222 PolarHBondContact O-N 3.11Å; L218-E222 VanDerWaalsContact O-N 3.09Å; E222-N224 VanDerWaalsContact C-N 3.31Å; E222-N224 PolarHBondContact O-N 2.92Å; E222-H226 PolarHBondContact O-CD2 3.32Å; E222-H226 PolarHBondContact O-N 3.4Å; E222-H226 VanDerWaalsContact O-N 3.11Å
223	R	72.5	Confident	71.2	Confident	175 Å²	175	112 Å²	112	66%	0.66	55%	0.548	S	S	*	.	H	α-helix	trans	-65	-33.9	175.8	-171.8	-177.2	-59	117.2	6.9	113.1	D219 K221 K227	D219-R223 WeakPolarHBondContact O-CB 3.35Å; D219-R223 PolarHBondContact O-N 3.09Å; K221-R223 VanDerWaalsContact C-N 3.28Å; K221-R223 PolarHBondContact O-N 3.36Å; R223-K227 PolarHBondContact O-N 3.18Å
224	N	69.1	Low	69.3	Low	91 Å²	91	110.1 Å²	110.1	49%	0.487	55%	0.546	S	S	.	.	H	α-helix	trans	-72.2	-48.7	179.2	-158	-36.1	0	0	0	110.1	A220 K221 E222 H226 K227 D228	A220-N224 PolarHBondContact O-N 3.1Å; K221-N224 WeakPolarHBondContact O-CB 3.47Å; K221-N224 PolarHBondContact O-N 3.16Å; E222-N224 VanDerWaalsContact C-N 3.31Å; E222-N224 PolarHBondContact O-N 2.92Å; N224-H226 VanDerWaalsContact C-N 3.28Å; N224-H226 PolarHBondContact O-N 3.23Å; N224-K227 WeakPolarHBondContact O-CB 3.44Å; N224-K227 PolarHBondContact O-N 3.04Å; N224-D228 PolarHBondContact O-N 3.36Å; N224-D228 VanDerWaalsContact O-N 3.16Å
225	D	69.4	Low	67.3	Low	87 Å²	87	117.7 Å²	117.7	47%	0.465	58%	0.579	S	S	.	*	H	α-helix	trans	-57.9	-38.7	178.2	-62.8	-16.7	0	0	0	112.2	K221 K227 M229	K221-D225 PolarHBondContact O-N 3.43Å; K221-D225 VanDerWaalsContact O-N 3.1Å; D225-K227 VanDerWaalsContact C-N 3.32Å; D225-K227 PolarHBondContact O-N 3.13Å; D225-M229 WeakPolarHBondContact O-CB 3.44Å; D225-M229 PolarHBondContact O-N 3.22Å; D225-M229 VanDerWaalsContact O-N 3.13Å
226	H	62.7	Low	65.5	Low	130 Å²	130	118.4 Å²	118.4	60%	0.602	59%	0.589	S	S	*	*	H	α-helix	trans	-69.6	-25.3	175.6	-80.7	-58.1	0	0	0	114.6	E222 N224 R230	E222-H226 PolarHBondContact O-CD2 3.32Å; E222-H226 PolarHBondContact O-N 3.4Å; E222-H226 VanDerWaalsContact O-N 3.11Å; N224-H226 VanDerWaalsContact C-N 3.28Å; N224-H226 PolarHBondContact O-N 3.23Å; H226-R230 WeakPolarHBondContact O-CB 3.48Å; H226-R230 PolarHBondContact O-N 3.29Å
227	K	62.9	Low	64.1	Low	134 Å²	134	120.3 Å²	120.3	58%	0.583	59%	0.594	S	S	*	*	H	α-helix	trans	-74.7	-45.7	176.7	-171.6	-170.8	168.1	-154	0	109.8	R223 N224 D225 M229 R230 E231	R223-K227 PolarHBondContact O-N 3.18Å; N224-K227 WeakPolarHBondContact O-CB 3.44Å; N224-K227 PolarHBondContact O-N 3.04Å; D225-K227 VanDerWaalsContact C-N 3.32Å; D225-K227 PolarHBondContact O-N 3.13Å; K227-M229 PolarHBondContact O-N 3.19Å; K227-R230 PolarHBondContact O-N 3.47Å; K227-E231 PolarHBondContact O-N 3.45Å; K227-E231 VanDerWaalsContact O-N 3.1Å
228	D	60.3	Low	62.1	Low	80 Å²	80	122 Å²	122	43%	0.428	60%	0.604	S	S	.	*	H	α-helix	trans	-64.7	-40.2	-179.9	-64	-16.2	0	0	0	111.4	N224 R230 E231 E232	N224-D228 PolarHBondContact O-N 3.36Å; N224-D228 VanDerWaalsContact O-N 3.16Å; D228-R230 VanDerWaalsContact C-N 3.28Å; D228-R230 PolarHBondContact O-N 3.41Å; D228-E231 PolarHBondContact O-N 3.11Å; D228-E232 PolarHBondContact O-N 3.06Å
229	M	58.9	Low	60.5	Low	138 Å²	138	125.5 Å²	125.5	68%	0.68	63%	0.633	S	S	*	*	H	α-helix	trans	-67.7	-26.6	177.1	-147.5	176.2	89.3	0	0	113.4	D225 K227 A233	D225-M229 WeakPolarHBondContact O-CB 3.44Å; D225-M229 PolarHBondContact O-N 3.22Å; D225-M229 VanDerWaalsContact O-N 3.13Å; K227-M229 PolarHBondContact O-N 3.19Å; M229-A233 WeakPolarHBondContact O-CB 3.33Å; M229-A233 PolarHBondContact O-N 3.36Å
230	R	57.4	Low	58.8	Low	210 Å²	210	126 Å²	126	79%	0.792	65%	0.653	S	S	*	*	H	α-helix	trans	-81.7	-24.1	176	-165	176.6	179.8	-147.4	-1.1	112	H226 K227 D228	H226-R230 WeakPolarHBondContact O-CB 3.48Å; H226-R230 PolarHBondContact O-N 3.29Å; K227-R230 PolarHBondContact O-N 3.47Å; D228-R230 VanDerWaalsContact C-N 3.28Å; D228-R230 PolarHBondContact O-N 3.41Å
231	E	59	Low	56.9	Low	125 Å²	125	134.8 Å²	134.8	58%	0.584	68%	0.677	S	S	*	*	H	α-helix	trans	-78.3	-39.5	175.4	-148	153.5	-170.7	0	0	110.4	K227 D228 N234	K227-E231 PolarHBondContact O-N 3.45Å; K227-E231 VanDerWaalsContact O-N 3.1Å; D228-E231 PolarHBondContact O-N 3.11Å; E231-N234 PolarHBondContact O-N 3.04Å
232	E	57.6	Low	55.4	Low	160 Å²	160	133.1 Å²	133.1	75%	0.748	68%	0.683	S	S	*	*	H	α-helix	trans	-70.8	-32.4	172.5	-68.3	-143.3	154.1	0	0	114	D228 N234 E235	D228-E232 PolarHBondContact O-N 3.06Å; E232-N234 PolarHBondContact O-N 3.17Å; E232-E235 PolarHBondContact O-N 3.32Å
233	A	57.5	Low	53.5	Low	87 Å²	87	137.7 Å²	137.7	72%	0.719	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-8	177.7	0	0	0	0	0	114.1	M229	M229-A233 WeakPolarHBondContact O-CB 3.33Å; M229-A233 PolarHBondContact O-N 3.36Å
234	N	53.4	Low	52	Low	144 Å²	144	137.3 Å²	137.3	77%	0.77	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.3	2.8	177.5	-154.6	44.7	0	0	0	113.1	E231 E232 N236	E231-N234 PolarHBondContact O-N 3.04Å; E232-N234 PolarHBondContact O-N 3.17Å; N234-N236 PolarHBondContact O-N 3.19Å
235	E	50	Low	50.3	Low	171 Å²	171	136 Å²	136	80%	0.799	72%	0.722	S	S	*	*			trans	-92.8	89.4	170.6	-63	-143.8	130.3	0	0	110.6	E232	E232-E235 PolarHBondContact O-N 3.32Å
236	N	40.2	Very low	48.7	Very low	136 Å²	136	136.1 Å²	136.1	73%	0.727	73%	0.73	S	S	*	*			trans	-77.5	142.5	166	-172.1	73.5	0	0	0	109.9	N234 Q238	N234-N236 PolarHBondContact O-N 3.19Å; N236-Q238 PolarHBondContact O-N 3.1Å
237	P	53.1	Low	47.4	Very low	114 Å²	114	141.4 Å²	141.4	74%	0.74	75%	0.745	S	S	*	*			trans	-76.4	111.7	-170.6	29.6	-33.2	0	0	0	111.3
238	Q	38.2	Very low	46.2	Very low	177 Å²	177	144 Å²	144	83%	0.827	76%	0.757	S	S	*	*			trans	-126.6	105.9	159.3	-110.4	167.2	-57	0	0	109.6	N236	N236-Q238 PolarHBondContact O-N 3.1Å
239	S	43.5	Very low	45.1	Very low	127 Å²	127	147.2 Å²	147.2	89%	0.888	77%	0.772	S	S	*	*			trans	-38.8	128.5	162.9	41.3	0	0	0	0	113.2
240	G	41.1	Very low	43.6	Very low	71 Å²	71	149.8 Å²	149.8	73%	0.732	78%	0.782	S	S	*	*			trans	158.6	92.7	161.4	0	0	0	0	0	114.9
241	Y	36.3	Very low	42.3	Very low	233 Å²	233	142.6 Å²	142.6	91%	0.914	77%	0.773	S	S	*	*			trans	77.8	113.3	157.7	-108.5	-100.7	0	0	0	119.6
242	S	45	Very low	41.1	Very low	106 Å²	106	144 Å²	144	74%	0.741	79%	0.79	S	S	*	*			trans	-28	132.9	159.2	-47.5	0	0	0	0	116.4
243	Q	34.6	Very low	39.9	Very low	196 Å²	196	139.9 Å²	139.9	92%	0.916	79%	0.791	S	S	*	*				-160.3	113.1	115.3	-109	-177.4	1.4	0	0	111.8
244	L	42	Very low	39	Very low	167 Å²	167	141.8 Å²	141.8	87%	0.874	79%	0.794	S	S	*	*			trans	-57	129.7	168.6	-178.2	70.3	0	0	0	110.7
245	G	34.2	Very low	38.2	Very low	62 Å²	62	143 Å²	143	64%	0.639	80%	0.8	S	S	*	*			trans	-151.2	44.1	178.5	0	0	0	0	0	113.2	W247	G245-W247 PolarHBondContact O-N 3.24Å
246	S	34.4	Very low	37.7	Very low	91 Å²	91	140.6 Å²	140.6	64%	0.636	80%	0.8	S	S	*	*			trans	-67.2	114.9	165.9	-61.8	0	0	0	0	109.8	F248	S246-F248 PolarHBondContact O-N 3.36Å
247	W	36.2	Very low	38.7	Very low	240 Å²	240	139.7 Å²	139.7	91%	0.909	80%	0.802	S	S	*	*			trans	-80.7	91.4	167.5	-67.2	96.6	0	0	0	109.7	G245	G245-W247 PolarHBondContact O-N 3.24Å
248	F	37.4	Very low	38.8	Very low	190 Å²	190	139.2 Å²	139.2	83%	0.833	80%	0.799	S	S	*	*			trans	-117.7	131.7	152.2	-74.2	-74.2	0	0	0	108	S246	S246-F248 PolarHBondContact O-N 3.36Å
249	I	36.5	Very low	38.5	Very low	146 Å²	146	136.3 Å²	136.3	75%	0.749	79%	0.794	S	S	*	*			trans	-116.5	114.9	159.8	-61.8	-172.6	0	0	0	108.2
250	H	27.7	Very low	38.1	Very low	193 Å²	193	135.2 Å²	135.2	89%	0.894	79%	0.786	S	S	*	*			trans	-153	133.2	137.3	-112.3	59.5	0	0	0	110.1
251	G	29.6	Very low	38.7	Very low	58 Å²	58	137.2 Å²	137.2	60%	0.598	79%	0.786	S	S	*	*			trans	107.5	103.8	139.7	0	0	0	0	0	119.5
252	T	33.9	Very low	38.6	Very low	154 Å²	154	134.5 Å²	134.5	95%	0.945	78%	0.781	S	S	*	*			trans	70	132.3	134	61.5	0	0	0	0	121.4
253	G	33.2	Very low	38.2	Very low	74 Å²	74	132.8 Å²	132.8	76%	0.763	77%	0.769	S	S	*	*			trans	142.5	91.8	148.7	0	0	0	0	0	116.9
254	T	38.7	Very low	38.4	Very low	127 Å²	127	131.1 Å²	131.1	78%	0.779	76%	0.761	S	S	*	*			trans	-12.9	139.4	155	53	0	0	0	0	119.9
255	L	37.3	Very low	38.2	Very low	170 Å²	170	132.4 Å²	132.4	89%	0.89	76%	0.76	S	S	*	*				169.5	128.3	117.8	-84.9	153.8	0	0	0	111.1
256	C	37.8	Very low	38	Very low	120 Å²	120	132.9 Å²	132.9	81%	0.811	77%	0.765	S	S	*	*			trans	-82.8	-167	170	-46.1	0	0	0	0	110.8
257	P	62.2	Low	38.2	Very low	117 Å²	117	134.2 Å²	134.2	76%	0.76	77%	0.774	S	S	*	*			cis	-127.8	-155.2	-27.5	31.5	-6.7	0	0	0	109.4
258	P	54.7	Low	39.2	Very low	104 Å²	104	128.2 Å²	128.2	68%	0.675	77%	0.767	S	S	*	*			cis	-144	164.5	7.2	46.2	-25.6	0	0	0	120.4
259	T	32.8	Very low	39.1	Very low	117 Å²	117	127.4 Å²	127.4	72%	0.718	77%	0.769	S	S	*	*			trans	43.9	108.4	139.3	56	0	0	0	0	120.8
260	S	35.8	Very low	39.2	Very low	104 Å²	104	124.5 Å²	124.5	73%	0.727	77%	0.767	S	S	*	*				72.3	158	81	72.3	0	0	0	0	115.8
261	P	53.3	Low	39.6	Very low	113 Å²	113	123.8 Å²	123.8	73%	0.734	77%	0.768	S	S	*	*			cis	-141.2	-167.2	-15.4	31.5	-7.2	0	0	0	115.2
262	H	33.2	Very low	39.9	Very low	176 Å²	176	126.5 Å²	126.5	82%	0.815	78%	0.779	S	S	*	*			trans	94.2	140	159.7	-97.8	30.7	0	0	0	119
263	S	36.5	Very low	41.2	Very low	70 Å²	70	124.9 Å²	124.9	49%	0.49	77%	0.77	S	S	.	*			cis	178.9	154	-26.5	53.8	0	0	0	0	108
264	Q	38.2	Very low	41.2	Very low	161 Å²	161	126.1 Å²	126.1	75%	0.752	77%	0.768	S	S	*	*			trans	79.4	141.7	154.6	-69.4	175.5	28.4	0	0	117.6
265	F	38	Very low	41.1	Very low	193 Å²	193	128.9 Å²	128.9	85%	0.846	77%	0.771	S	S	*	*			cis	-162.2	153.5	10.6	-123.8	-69.7	0	0	0	109.1
266	G	31.6	Very low	40.9	Very low	72 Å²	72	124.5 Å²	124.5	74%	0.742	77%	0.767	S	S	*	*			trans	120.9	101.4	144.1	0	0	0	0	0	119.3
267	S	37.3	Very low	40.7	Very low	119 Å²	119	125.5 Å²	125.5	83%	0.832	77%	0.774	S	S	*	*			trans	-109.6	-168.1	160.4	-39.1	0	0	0	0	109.1
268	P	56.9	Low	39.4	Very low	115 Å²	115	126.8 Å²	126.8	75%	0.747	77%	0.77	S	S	*	*			cis	-131.2	167	-42	32.9	-16.7	0	0	0	112.2
269	I	36.1	Very low	38.4	Very low	173 Å²	173	131.1 Å²	131.1	89%	0.887	77%	0.773	S	S	*	*			trans	-146.8	132	146.4	-58.2	-174.8	0	0	0	110.2
270	A	39.4	Very low	38.4	Very low	84 Å²	84	136.3 Å²	136.3	69%	0.694	78%	0.781	S	S	*	*			trans	-118.5	144.9	166.6	0	0	0	0	0	108.8
271	L	36.3	Very low	38.2	Very low	178 Å²	178	136.3 Å²	136.3	93%	0.932	78%	0.781	S	S	*	*			trans	-157.4	144.8	148.7	-79.3	-171.6	0	0	0	110.5
272	S	34.8	Very low	37.3	Very low	116 Å²	116	136.3 Å²	136.3	81%	0.811	78%	0.783	S	S	*	*			trans	-102	-149.9	-170.8	-54.5	0	0	0	0	112.2
273	P	61.8	Low	37.7	Very low	119 Å²	119	135.4 Å²	135.4	77%	0.773	78%	0.783	S	S	*	*				-117.5	177.6	-107.1	36	-16.2	0	0	0	113.8
274	S	32.1	Very low	37.7	Very low	101 Å²	101	143.4 Å²	143.4	71%	0.706	80%	0.803	S	S	*	*			trans	-158.9	121.6	166.7	52.5	0	0	0	0	115
275	H	36.4	Very low	37.4	Very low	185 Å²	185	141.6 Å²	141.6	86%	0.856	81%	0.808	S	S	*	*			trans	40.9	129.7	138.1	-44.7	-68.2	0	0	0	118.8
276	G	34.2	Very low	37.4	Very low	78 Å²	78	141.5 Å²	141.5	80%	0.804	81%	0.81	S	S	*	*			cis	98.5	102.3	37.8	0	0	0	0	0	110.7
277	C	32.3	Very low	37.5	Very low	141 Å²	141	149.5 Å²	149.5	95%	0.953	82%	0.817	S	S	*	*			trans	-179.5	148.8	142.8	-142.3	0	0	0	0	113.4
278	E	36.1	Very low	37.5	Very low	143 Å²	143	148.1 Å²	148.1	67%	0.668	81%	0.808	S	S	*	*			trans	-82.4	164.5	-178.9	-74.8	-160.8	164.4	0	0	115.6
279	R	34.1	Very low	36.6	Very low	196 Å²	196	149.6 Å²	149.6	74%	0.74	82%	0.815	S	S	*	*			trans	59.4	120.6	147.6	-78.4	176.3	-152.1	-154.1	-5	119.7
280	Y	31.8	Very low	37.3	Very low	226 Å²	226	146.3 Å²	146.3	89%	0.886	80%	0.804	S	S	*	*				-171.5	150.5	97.3	-112.4	-89.1	0	0	0	111.4
281	S	32.6	Very low	37.3	Very low	104 Å²	104	152.9 Å²	152.9	73%	0.727	81%	0.813	S	S	*	*			trans	-76.8	166.8	-173.9	-56.1	0	0	0	0	115.2
282	S	33	Very low	37.2	Very low	112 Å²	112	149.4 Å²	149.4	78%	0.783	80%	0.803	S	S	*	*			trans	92.8	116.9	150.5	72.6	0	0	0	0	118
283	L	42.6	Very low	37.3	Very low	157 Å²	157	149.1 Å²	149.1	82%	0.822	80%	0.801	S	S	*	*				-178.1	107.9	122.6	-87.7	169	0	0	0	107.7
284	R	35.3	Very low	36.8	Very low	239 Å²	239	149.3 Å²	149.3	90%	0.902	80%	0.803	S	S	*	*				70.6	103.5	107	-115.2	-176.4	-166.7	-149	3.7	115
285	S	33.5	Very low	37.1	Very low	122 Å²	122	153.6 Å²	153.6	85%	0.853	81%	0.805	S	S	*	*				-170.9	123.8	118.9	-163.6	0	0	0	0	111.5
286	H	36.5	Very low	37.2	Very low	191 Å²	191	149.5 Å²	149.5	88%	0.884	80%	0.803	S	S	*	*			trans	-104.8	138	169.6	-92.7	-86.8	0	0	0	109.7
287	R	35.5	Very low	37.3	Very low	240 Å²	240	152.1 Å²	152.1	91%	0.906	79%	0.794	S	S	*	*			trans	-152.6	153.6	140.6	-110.8	-162.3	170.2	-149.6	-2.3	106.5
288	S	35.5	Very low	37.2	Very low	91 Å²	91	157.5 Å²	157.5	64%	0.636	79%	0.794	S	S	*	*			cis	-175.5	121.8	-37.3	43	0	0	0	0	103.5
289	V	39.3	Very low	37.1	Very low	146 Å²	146	156.5 Å²	156.5	89%	0.885	80%	0.798	S	S	*	*			trans	-129.9	138.7	172.1	-126.2	0	0	0	0	109.1
290	P	51	Low	37.1	Very low	103 Å²	103	154.5 Å²	154.5	67%	0.669	80%	0.802	S	S	*	*			trans	-100	131.3	-161.6	37.2	-29.3	0	0	0	113.5
291	Y	39	Very low	37.3	Very low	222 Å²	222	148.9 Å²	148.9	87%	0.871	80%	0.796	S	S	*	*			trans	57.5	150.6	162.6	-59.9	-83.7	0	0	0	119.3
292	S	34.3	Very low	38.4	Very low	105 Å²	105	149.5 Å²	149.5	73%	0.734	80%	0.797	S	S	*	*			cis	-170.6	128.6	-29.5	-94.4	0	0	0	0	105.8
293	S	35.5	Very low	38.5	Very low	110 Å²	110	151.4 Å²	151.4	77%	0.769	81%	0.805	S	S	*	*			trans	-123.3	124.8	167.7	178.1	0	0	0	0	108.2
294	P	51.9	Low	38	Very low	123 Å²	123	147.1 Å²	147.1	80%	0.799	80%	0.798	S	S	*	*			trans	-84.2	120	176.7	30.8	-27.2	0	0	0	110.7
295	Y	38.8	Very low	37.8	Very low	191 Å²	191	146.6 Å²	146.6	75%	0.749	80%	0.798	S	S	*	*			trans	-47.4	154.1	158.8	-97.8	-108.6	0	0	0	111.6	H297	Y295-H297 AromaticContact CD1-CD2 3.47Å; Y295-H297 VanDerWaalsContact CD1-CD2 3.47Å; Y295-H297 WeakPolarHBondContact CD1-CD2 3.5Å; Y295-H297 AromaticContact CE1-CD2 3.18Å; Y295-H297 WeakPolarHBondContact CE1-CD2 3.18Å; Y295-H297 AromaticContact CE1-NE2 3.5Å; Y295-H297 WeakPolarHBondContact CE1-NE2 3.47Å
296	A	37.3	Very low	37.7	Very low	100 Å²	100	145.2 Å²	145.2	83%	0.826	79%	0.788	S	S	*	*				-156.9	133.7	79.1	0	0	0	0	0	115.5
297	H	36.7	Very low	37.4	Very low	133 Å²	133	143.1 Å²	143.1	62%	0.616	78%	0.783	S	S	*	*			trans	-59.4	152.2	158.6	-78.8	-115.6	0	0	0	112.2	Y295	Y295-H297 AromaticContact CD1-CD2 3.47Å; Y295-H297 VanDerWaalsContact CD1-CD2 3.47Å; Y295-H297 WeakPolarHBondContact CD1-CD2 3.5Å; Y295-H297 AromaticContact CE1-CD2 3.18Å; Y295-H297 WeakPolarHBondContact CE1-CD2 3.18Å; Y295-H297 AromaticContact CE1-NE2 3.5Å; Y295-H297 WeakPolarHBondContact CE1-NE2 3.47Å
298	R	31.3	Very low	37.1	Very low	253 Å²	253	138.6 Å²	138.6	96%	0.955	78%	0.777	S	S	*	*			trans	-140.1	141.7	131.5	-102.4	-173.7	-178.4	-133.2	0.6	111.2
299	T	34.4	Very low	37	Very low	123 Å²	123	138.5 Å²	138.5	76%	0.755	78%	0.777	S	S	*	*			trans	-88.8	141.5	-161.9	40.5	0	0	0	0	113.7
300	N	32.1	Very low	36.7	Very low	154 Å²	154	136.5 Å²	136.5	82%	0.824	77%	0.769	S	S	*	*			trans	-70.4	154.2	153.3	-89.3	7.2	0	0	0	109
301	S	36.5	Very low	35.9	Very low	108 Å²	108	136.7 Å²	136.7	76%	0.755	77%	0.773	S	S	*	*				-174.3	-168.3	64.1	-42	0	0	0	0	110.8
302	P	56.6	Low	35.5	Very low	116 Å²	116	131.3 Å²	131.3	75%	0.753	77%	0.766	S	S	*	*				-128.1	171.8	-116.2	34.1	-10.6	0	0	0	115.7
303	T	34.9	Very low	35.4	Very low	153 Å²	153	134 Å²	134	94%	0.939	77%	0.772	S	S	*	*			trans	172.6	138.5	155.8	41.3	0	0	0	0	105.9
304	G	32.3	Very low	35.3	Very low	66 Å²	66	133.5 Å²	133.5	68%	0.68	77%	0.769	S	S	*	*			cis	158.6	154.7	10	0	0	0	0	0	106.5
305	Y	30.9	Very low	34.3	Very low	228 Å²	228	136.1 Å²	136.1	89%	0.894	77%	0.772	S	S	*	*			trans	88.4	119.4	170.2	-74.2	-88.1	0	0	0	121.6
306	S	31	Very low	34.1	Very low	94 Å²	94	135 Å²	135	66%	0.657	78%	0.778	S	S	*	*			trans	49.1	144.8	136.1	-56.6	0	0	0	0	120.4
307	D	29.6	Very low	34.1	Very low	146 Å²	146	136 Å²	136	78%	0.781	78%	0.777	S	S	*	*			cis	-168.1	151.6	4.8	-119.6	-36.5	0	0	0	107.9
308	N	30.9	Very low	33.7	Very low	145 Å²	145	134.2 Å²	134.2	78%	0.775	78%	0.779	S	S	*	*			trans	60.1	141	140.4	-139.9	17.9	0	0	0	125.1
309	S	32.9	Very low	33.8	Very low	89 Å²	89	129.7 Å²	129.7	62%	0.622	77%	0.768	S	S	*	*			trans	79.1	103.2	149.4	50.2	0	0	0	0	123.2
310	S	33.8	Very low	33.7	Very low	105 Å²	105	130.5 Å²	130.5	73%	0.734	77%	0.768	S	S	*	*				31.1	135.6	119.5	59.5	0	0	0	0	122.9
311	S	32.5	Very low	33.7	Very low	106 Å²	106	129.3 Å²	129.3	74%	0.741	76%	0.762	S	S	*	*				112	132	129.4	67.9	0	0	0	0	121
312	C	30.8	Very low	33.3	Very low	109 Å²	109	135.6 Å²	135.6	74%	0.736	77%	0.769	S	S	*	*			trans	64.7	116.6	142.5	62.6	0	0	0	0	123.9
313	L	33.2	Very low	32.2	Very low	162 Å²	162	133.9 Å²	133.9	85%	0.848	76%	0.76	S	S	*	*				44.4	132.4	121.4	-65.5	172.7	0	0	0	123
314	S	32.7	Very low	31.9	Very low	100 Å²	100	131.2 Å²	131.2	70%	0.699	75%	0.747	S	S	*	*			trans	73.8	127	142.4	73.3	0	0	0	0	119.2
315	M	30.3	Very low	31.9	Very low	178 Å²	178	135.8 Å²	135.8	88%	0.877	76%	0.755	S	S	*	*				176	138.6	98.8	-83.7	-147	175.1	0	0	111
316	L	35.6	Very low	31.8	Very low	166 Å²	166	133.6 Å²	133.6	87%	0.869	75%	0.753	S	S	*	*			trans	-65.9	156.4	165	-74.8	147.3	0	0	0	110.6
317	P	37.9	Very low	32	Very low	123 Å²	123	137.1 Å²	137.1	80%	0.799	76%	0.761	S	S	*	*			trans	-96.1	142.2	152.5	5.9	14.2	0	0	0	111.6
318	S	27.8	Very low	32.5	Very low	95 Å²	95	135.4 Å²	135.4	66%	0.664	76%	0.758	S	S	*	*			trans	-96.1	175.4	176.2	30.8	0	0	0	0	112.5
319	H	33.3	Very low	32.7	Very low	158 Å²	158	134.3 Å²	134.3	73%	0.731	76%	0.757	S	S	*	*			trans	91.9	134.7	164.5	-68	-82.5	0	0	0	116.8
320	D	31.8	Very low	32.7	Very low	140 Å²	140	138.9 Å²	138.9	75%	0.749	77%	0.768	S	S	*	*			cis	-151.9	143.9	19.9	-91.4	-44.2	0	0	0	115.1
321	N	31.6	Very low	32.6	Very low	129 Å²	129	140 Å²	140	69%	0.69	77%	0.771	S	S	*	*			trans	9.6	128.8	138.3	-129.6	1.6	0	0	0	122.5
322	W	29.7	Very low	32.7	Very low	239 Å²	239	140.2 Å²	140.2	91%	0.905	77%	0.772	S	S	*	*				-166	150.2	115.8	-154.8	-98	0	0	0	112.3
323	S	33.2	Very low	32.8	Very low	80 Å²	80	144.2 Å²	144.2	56%	0.559	78%	0.782	S	S	*	*			trans	-93	165.5	-163.5	-58.7	0	0	0	0	115.6
324	S	28.4	Very low	32.8	Very low	97 Å²	97	145.4 Å²	145.4	68%	0.678	79%	0.786	S	S	*	*			trans	86.1	115.5	133.5	48.6	0	0	0	0	121.7
325	L	31.2	Very low	32.6	Very low	162 Å²	162	146.4 Å²	146.4	85%	0.848	79%	0.793	S	S	*	*				102.9	124.9	129.4	-70.8	164.9	0	0	0	120.2
326	Q	29.8	Very low	32.7	Very low	182 Å²	182	145.6 Å²	145.6	85%	0.85	79%	0.789	S	S	*	*			trans	102	111.1	136.6	-142.1	162	-2.1	0	0	118.2
327	M	36	Very low	32.5	Very low	168 Å²	168	143.3 Å²	143.3	83%	0.828	78%	0.782	S	S	*	*			trans	-69.9	153.7	157.9	-75.5	-74.8	-178.4	0	0	110.1
328	P	39.1	Very low	32.2	Very low	110 Å²	110	145.3 Å²	145.3	71%	0.714	78%	0.78	S	S	*	*				-142.3	157	104.8	27	-7.4	0	0	0	115.8
329	T	34.3	Very low	32.3	Very low	122 Å²	122	145.6 Å²	145.6	75%	0.748	78%	0.782	S	S	*	*			trans	-72.2	137.4	173.6	46.9	0	0	0	0	113.5
330	H	33.5	Very low	32.1	Very low	186 Å²	186	143.9 Å²	143.9	86%	0.861	79%	0.788	S	S	*	*			trans	-149.9	143.8	148.9	-69.3	-70.7	0	0	0	112.9
331	T	32.8	Very low	32	Very low	129 Å²	129	141.4 Å²	141.4	79%	0.791	79%	0.787	S	S	*	*			trans	-82.2	152.1	-179.1	26	0	0	0	0	115
332	S	34.2	Very low	32	Very low	110 Å²	110	141 Å²	141	77%	0.769	79%	0.794	S	S	*	*			trans	58.5	122.9	147	-61.3	0	0	0	0	121.3
333	M	32	Very low	32.1	Very low	192 Å²	192	134.8 Å²	134.8	95%	0.946	79%	0.794	S	S	*	*				175.3	152.6	112.2	-94.1	-166.3	-176.6	0	0	112.6
334	M	33	Very low	32	Very low	187 Å²	187	135.7 Å²	135.7	92%	0.921	81%	0.806	S	S	*	*			trans	-84.3	155.7	177.2	-52.1	-124.5	110.9	0	0	111.7
335	S	28.7	Very low	32	Very low	121 Å²	121	139 Å²	139	85%	0.846	82%	0.816	S	S	*	*				169.7	160.8	115.6	-159.7	0	0	0	0	112.9
336	M	33.2	Very low	32	Very low	162 Å²	162	136.2 Å²	136.2	80%	0.798	81%	0.81	S	S	*	*			trans	-66	155.3	-168.7	-63.3	-80.2	-177.3	0	0	116.2
337	T	31.3	Very low	32	Very low	117 Å²	117	133 Å²	133	72%	0.718	81%	0.808	S	S	*	*				161.8	143.7	105.9	40.5	0	0	0	0	116.6
338	H	32.2	Very low	31.8	Very low	166 Å²	166	133.5 Å²	133.5	77%	0.769	81%	0.808	S	S	*	*			trans	67.6	103.2	145.9	-63.1	-56.5	0	0	0	124.8
339	S	29.8	Very low	31.3	Very low	101 Å²	101	138 Å²	138	71%	0.706	81%	0.812	S	S	*	*				37.7	121.5	125.1	53.2	0	0	0	0	122.9
340	S	28.6	Very low	31.3	Very low	122 Å²	122	138 Å²	138	85%	0.853	81%	0.813	S	S	*	*				168.5	155.1	109	51.7	0	0	0	0	113.7
341	A	29.9	Very low	31.1	Very low	88 Å²	88	134.2 Å²	134.2	73%	0.727	81%	0.807	S	S	*	*			trans	84.3	102.9	158.6	0	0	0	0	0	121.2
342	S	31.1	Very low	31	Very low	120 Å²	120	136.2 Å²	136.2	84%	0.839	81%	0.812	S	S	*	*				26.8	118	127.8	47.4	0	0	0	0	120.7
343	A	31.1	Very low	31	Very low	109 Å²	109	141.6 Å²	141.6	90%	0.901	82%	0.815	S	S	*	*			trans	-158.7	152.6	145.5	0	0	0	0	0	112.1
344	A	30.8	Very low	31	Very low	99 Å²	99	137.8 Å²	137.8	82%	0.818	81%	0.808	S	S	*	*			trans	-75.5	167.1	-166.3	0	0	0	0	0	116
345	N	30.2	Very low	30.9	Very low	166 Å²	166	134.8 Å²	134.8	89%	0.888	80%	0.8	S	S	*	*			trans	-28.7	130.9	162	-84.7	-4.9	0	0	0	115.3
346	S	30.7	Very low	30.9	Very low	103 Å²	103	134.2 Å²	134.2	72%	0.72	80%	0.796	S	S	*	*				162.2	100.2	127.6	169.7	0	0	0	0	109
347	S	28.7	Very low	30.8	Very low	115 Å²	115	134 Å²	134	80%	0.804	80%	0.797	S	S	*	*			trans	-114.3	95.6	167.5	-43.9	0	0	0	0	108.5	Y349	S347-Y349 PolarHBondContact O-N 3.44Å
348	Q	33	Very low	30.8	Very low	178 Å²	178	133.6 Å²	133.6	83%	0.832	80%	0.8	S	S	*	*			trans	-63.2	118.9	150	-67.7	179.6	-17.8	0	0	106.8
349	Y	29	Very low	31	Very low	205 Å²	205	131.6 Å²	131.6	80%	0.804	80%	0.801	S	S	*	*			trans	-136.2	116.6	156.5	-101.3	-82.5	0	0	0	110	S347	S347-Y349 PolarHBondContact O-N 3.44Å
350	T	33	Very low	31.2	Very low	123 Å²	123	135.2 Å²	135.2	76%	0.755	81%	0.812	S	S	*	*			trans	-56.2	135.2	155.3	31.5	0	0	0	0	109.7
351	S	29.4	Very low	31.5	Very low	106 Å²	106	135.7 Å²	135.7	74%	0.741	81%	0.81	S	S	*	*			trans	-136	81.1	168	-57.7	0	0	0	0	108.8
352	L	31.9	Very low	31.8	Very low	170 Å²	170	137.6 Å²	137.6	89%	0.89	82%	0.815	S	S	*	*			trans	-73.7	118.5	155.3	-72.7	161.1	0	0	0	106.5
353	W	33.8	Very low	31.9	Very low	223 Å²	223	138.6 Å²	138.6	85%	0.845	82%	0.816	S	S	*	*			trans	-110.4	113.5	161.4	52.2	-80.8	0	0	0	108.7
354	S	31.8	Very low	31.8	Very low	113 Å²	113	138.2 Å²	138.2	79%	0.79	81%	0.806	S	S	*	*			trans	-78.2	136.3	168.5	-64.8	0	0	0	0	109.1	S356	S354-S356 PolarHBondContact O-N 3.45Å
355	V	30.6	Very low	32.1	Very low	123 Å²	123	142.6 Å²	142.6	75%	0.745	81%	0.81	S	S	*	*			trans	-69.8	113.8	174.4	-164.7	0	0	0	0	108.3	N357	V355-N357 PolarHBondContact O-N 3.21Å
356	S	28.8	Very low	32.1	Very low	109 Å²	109	142.5 Å²	142.5	76%	0.762	81%	0.809	S	S	*	*			trans	-84.7	107	171.3	37.1	0	0	0	0	109.9	S354	S354-S356 PolarHBondContact O-N 3.45Å
357	N	30.3	Very low	32.1	Very low	157 Å²	157	141.5 Å²	141.5	84%	0.84	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-71.7	122.7	162.1	-91.3	-4.2	0	0	0	109	V355	V355-N357 PolarHBondContact O-N 3.21Å
358	S	31.6	Very low	32	Very low	110 Å²	110	139.9 Å²	139.9	77%	0.769	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-86.7	129.2	167.9	-64.4	0	0	0	0	109.8
359	P	35.7	Very low	32.1	Very low	123 Å²	123	140 Å²	140	80%	0.799	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-81.3	129.9	171.6	29.4	-28.6	0	0	0	110.8
360	L	35.5	Very low	32.3	Very low	177 Å²	177	135.4 Å²	135.4	93%	0.927	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-67.8	127.3	171.3	-69.9	163.6	0	0	0	110
361	T	34.1	Very low	32.2	Very low	132 Å²	132	134.7 Å²	134.7	81%	0.81	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-89.9	136.6	166.4	43.8	0	0	0	0	109.8
362	P	36.9	Very low	32	Very low	129 Å²	129	135.5 Å²	135.5	84%	0.838	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-86.5	130	173.3	31.6	-28.5	0	0	0	110.5
363	V	32.1	Very low	32.2	Very low	141 Å²	141	136.3 Å²	136.3	86%	0.855	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-82.8	133.2	168.2	135.1	0	0	0	0	109.6
364	S	30.7	Very low	31.9	Very low	100 Å²	100	128.9 Å²	128.9	70%	0.699	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-81.8	138.2	176.2	-177.7	0	0	0	0	111.1
365	Q	36.2	Very low	32	Very low	191 Å²	191	128.7 Å²	128.7	89%	0.893	82%	0.82	S	S	*	*			trans	-124.1	129.4	155	-84	-169.7	-0.4	0	0	109.4
366	N	29.8	Very low	32	Very low	164 Å²	164	130.3 Å²	130.3	88%	0.877	82%	0.82	S	S	*	*			trans	-76.5	145.6	177.5	-104.6	16.7	0	0	0	112.1
367	G	30.4	Very low	32.1	Very low	82 Å²	82	133.5 Å²	133.5	85%	0.845	82%	0.82	S	S	*	*			trans	119.9	112.5	130.6	0	0	0	0	0	117.5
368	G	28.3	Very low	32.3	Very low	82 Å²	82	134.3 Å²	134.3	85%	0.845	82%	0.824	S	S	*	*			trans	148	96.6	155.4	0	0	0	0	0	115.8
369	L	34	Very low	32.3	Very low	181 Å²	181	140.8 Å²	140.8	95%	0.948	83%	0.831	S	S	*	*			trans	-72	144.9	-179.5	-63.4	145.7	0	0	0	113.2
370	S	32.2	Very low	32	Very low	108 Å²	108	138 Å²	138	76%	0.755	83%	0.825	S	S	*	*				-178.1	117.1	126.2	-169.6	0	0	0	0	113.4
371	S	31.1	Very low	31.9	Very low	108 Å²	108	135.3 Å²	135.3	76%	0.755	82%	0.821	S	S	*	*			trans	53.5	115.6	140.1	66.6	0	0	0	0	122.3
372	C	26.8	Very low	31.8	Very low	122 Å²	122	133.2 Å²	133.2	82%	0.824	82%	0.817	S	S	*	*			trans	-70.7	160.8	163.6	-26.2	0	0	0	0	113.3
373	L	34.8	Very low	31.6	Very low	187 Å²	187	131.4 Å²	131.4	98%	0.979	81%	0.807	S	S	*	*			trans	156.5	128.1	145.4	-84.3	167.9	0	0	0	105.3
374	G	29	Very low	31.6	Very low	67 Å²	67	132.1 Å²	132.1	69%	0.691	80%	0.801	S	S	*	*			cis	146.2	143.3	13.7	0	0	0	0	0	106.8
375	S	32.2	Very low	31.7	Very low	110 Å²	110	137.4 Å²	137.4	77%	0.769	81%	0.807	S	S	*	*			trans	69.4	146.4	170.4	-97.4	0	0	0	0	117.9
376	Q	32.2	Very low	32.3	Very low	157 Å²	157	133.8 Å²	133.8	73%	0.734	80%	0.8	S	S	*	*			cis	-169	165.9	-6.7	-118.7	-172.7	26.2	0	0	108.7
377	F	30.7	Very low	32.4	Very low	175 Å²	175	130.7 Å²	130.7	77%	0.768	79%	0.791	S	S	*	*			trans	-25.6	144.4	174.7	-54.5	-88.8	0	0	0	119.7
378	L	33.8	Very low	32.8	Very low	175 Å²	175	134.3 Å²	134.3	92%	0.916	79%	0.791	S	S	*	*				177.1	153.1	101	-93.7	165.7	0	0	0	113.6
379	R	32.5	Very low	34	Very low	245 Å²	245	136 Å²	136	93%	0.925	79%	0.786	S	S	*	*			trans	-85.3	144.4	-178.6	-175.8	-170.9	-141.5	-162.3	4.8	110.3
380	G	29.4	Very low	34.1	Very low	65 Å²	65	136 Å²	136	67%	0.67	78%	0.782	S	S	*	*			trans	147	104.7	154.5	0	0	0	0	0	118.1
381	S	32	Very low	34.1	Very low	120 Å²	120	137 Å²	137	84%	0.839	79%	0.789	S	S	*	*				65.2	116.3	129.1	-46.7	0	0	0	0	122.7
382	A	31.9	Very low	34.4	Very low	89 Å²	89	136.2 Å²	136.2	74%	0.736	79%	0.788	S	S	*	*				68.8	113.1	114.7	0	0	0	0	0	122.1
383	S	33	Very low	34.6	Very low	90 Å²	90	137.7 Å²	137.7	63%	0.629	79%	0.793	S	S	*	*				93	141.8	126.5	-47.9	0	0	0	0	122.9
384	H	32.7	Very low	34.7	Very low	157 Å²	157	133.2 Å²	133.2	73%	0.727	78%	0.784	S	S	*	*			trans	82.4	137	157.9	-48.6	-65.8	0	0	0	116.1
385	Y	33.2	Very low	35.6	Very low	210 Å²	210	136 Å²	136	82%	0.824	79%	0.79	S	S	*	*			cis	-167.1	-165	37.7	-99	-72.7	0	0	0	107.6
386	P	48.9	Very low	36.5	Very low	115 Å²	115	137 Å²	137	75%	0.747	79%	0.793	S	S	*	*			cis	-129.7	-179.5	-49.5	34.5	-17	0	0	0	112.9
387	S	32.2	Very low	36.7	Very low	99 Å²	99	134.9 Å²	134.9	69%	0.692	80%	0.796	S	S	*	*			trans	-81.5	169	176.9	44.9	0	0	0	0	116.1
388	L	38.7	Very low	37	Very low	159 Å²	159	131.5 Å²	131.5	83%	0.832	80%	0.8	S	S	*	*			trans	131	157.7	142.3	-72.7	160.5	0	0	0	113.9
389	P	52.4	Low	37.2	Very low	116 Å²	116	128.9 Å²	128.9	75%	0.753	80%	0.796	S	S	*	*				-135.6	178.4	-60.5	35.8	-16.4	0	0	0	114
390	H	36.3	Very low	38.3	Very low	183 Å²	183	123.3 Å²	123.3	85%	0.847	79%	0.792	S	S	*	*			trans	-66.9	162	177.3	-84.1	-30.5	0	0	0	116.7
391	S	31.6	Very low	38.9	Very low	129 Å²	129	128.9 Å²	128.9	90%	0.902	80%	0.803	S	S	*	*			trans	-152.4	137.2	135.2	-72.6	0	0	0	0	110.9
392	A	37.3	Very low	39.1	Very low	90 Å²	90	134.5 Å²	134.5	74%	0.744	81%	0.808	S	S	*	*			trans	-115.6	157.8	-176.7	0	0	0	0	0	110.6
393	T	31.9	Very low	39.3	Very low	153 Å²	153	137.8 Å²	137.8	94%	0.939	81%	0.812	S	S	*	*			trans	-168.6	139.3	142.7	-2.6	0	0	0	0	112.2
394	A	36.5	Very low	39.2	Very low	94 Å²	94	136.1 Å²	136.1	78%	0.777	81%	0.81	S	S	*	*			trans	-135.9	157.3	170.7	0	0	0	0	0	108.9
395	P	48.5	Very low	39.1	Very low	126 Å²	126	134.1 Å²	134.1	82%	0.818	81%	0.813	S	S	*	*			trans	-115.7	161.1	171.1	37.5	-26.3	0	0	0	114.7
396	P	50.6	Low	39	Very low	129 Å²	129	129.4 Å²	129.4	84%	0.838	81%	0.811	S	S	*	*			trans	-119.1	167.8	-176.8	41.3	-28.7	0	0	0	115.6
397	S	36.9	Very low	38.3	Very low	114 Å²	114	128.1 Å²	128.1	80%	0.797	81%	0.81	S	S	*	*			trans	-163.2	115.9	157.9	62.7	0	0	0	0	109.3
398	A	36	Very low	38.4	Very low	103 Å²	103	129.6 Å²	129.6	85%	0.851	82%	0.815	S	S	*	*				80.1	114.1	61.2	0	0	0	0	0	115
399	S	38	Very low	38	Very low	120 Å²	120	130.4 Å²	130.4	84%	0.839	82%	0.815	S	S	*	*			trans	-94.7	169.6	172.1	-49.5	0	0	0	0	112
400	P	56.3	Low	37.2	Very low	128 Å²	128	131 Å²	131	83%	0.831	82%	0.816	S	S	*	*			trans	-135	157.4	151.4	35.7	-20	0	0	0	115.3
401	M	41.3	Very low	37	Very low	183 Å²	183	131.1 Å²	131.1	90%	0.901	82%	0.817	S	S	*	*			trans	-116	145	162.8	-86.8	-158.7	158.1	0	0	109.2
402	Y	37.2	Very low	37.1	Very low	238 Å²	238	132.2 Å²	132.2	93%	0.933	81%	0.813	S	S	*	*			trans	-164.4	158.9	137.5	-125.5	-89	0	0	0	112
403	D	35.9	Very low	36.8	Very low	157 Å²	157	134 Å²	134	84%	0.84	81%	0.814	S	S	*	*			trans	-87.8	166.8	-164.4	-171.9	18.6	0	0	0	115.4
404	G	30.5	Very low	37	Very low	56 Å²	56	132 Å²	132	58%	0.577	80%	0.801	S	S	*	*			trans	128.5	110.4	148.2	0	0	0	0	0	121.6
405	S	30.3	Very low	36.7	Very low	114 Å²	114	135.8 Å²	135.8	80%	0.797	80%	0.803	S	S	*	*			trans	78.7	109.5	136.1	44	0	0	0	0	124.7
406	S	32.3	Very low	36	Very low	111 Å²	111	139.2 Å²	139.2	78%	0.776	80%	0.801	S	S	*	*				51.9	119.7	123.6	67	0	0	0	0	124.6
407	A	33.9	Very low	35.1	Very low	88 Å²	88	141.5 Å²	141.5	73%	0.727	80%	0.801	S	S	*	*				88	128.4	119.4	0	0	0	0	0	123.4
408	T	33	Very low	35	Very low	131 Å²	131	140.7 Å²	140.7	80%	0.804	80%	0.801	S	S	*	*			trans	88	145.7	140.6	1.7	0	0	0	0	122.7
409	E	31.8	Very low	35.1	Very low	175 Å²	175	141.2 Å²	141.2	82%	0.818	80%	0.798	S	S	*	*			trans	86.1	109.7	165.2	-69.4	-176.4	126	0	0	117.8
410	V	34.8	Very low	35.8	Very low	129 Å²	129	140.5 Å²	140.5	78%	0.782	79%	0.791	S	S	*	*				76.4	109.2	63.3	-179.7	0	0	0	0	113.4
411	Q	32.3	Very low	34.8	Very low	186 Å²	186	143.5 Å²	143.5	87%	0.869	79%	0.793	S	S	*	*			trans	167.2	113.9	150.3	-99.5	168.1	-2.5	0	0	105.9
412	D	32.7	Very low	34.5	Very low	151 Å²	151	138.6 Å²	138.6	81%	0.807	79%	0.79	S	S	*	*			cis	66.5	133.4	48.4	-137.4	1.6	0	0	0	115.4
413	V	31.2	Very low	34.4	Very low	127 Å²	127	139.2 Å²	139.2	77%	0.77	79%	0.791	S	S	*	*			trans	99.6	125	161.6	-166.9	0	0	0	0	120.8
414	V	36.2	Very low	34.7	Very low	111 Å²	111	139.2 Å²	139.2	67%	0.673	79%	0.789	S	S	*	*			trans	-76.6	146.6	174	170	0	0	0	0	112.7	Y416	V414-Y416 HydrophobicContact CG1-CD2 4.43Å
415	Q	30.7	Very low	35.7	Very low	175 Å²	175	142.5 Å²	142.5	82%	0.818	80%	0.801	S	S	*	*			trans	172.6	116.9	135	-99.4	174.5	-41.1	0	0	111.3
416	Y	34.3	Very low	36.3	Very low	197 Å²	197	142.3 Å²	142.3	77%	0.773	80%	0.799	S	S	*	*				79.1	117.1	92.7	-91.6	-90.7	0	0	0	117	V414	V414-Y416 HydrophobicContact CG1-CD2 4.43Å
417	E	32.4	Very low	36.7	Very low	178 Å²	178	141.8 Å²	141.8	83%	0.832	80%	0.802	S	S	*	*			trans	72.5	119.6	135.5	-138.7	176.7	164	0	0	122.3
418	A	33.9	Very low	37	Very low	96 Å²	96	149.1 Å²	149.1	79%	0.793	81%	0.811	S	S	*	*				176.1	117.8	117.6	0	0	0	0	0	111.4
419	S	37	Very low	37.7	Very low	115 Å²	115	149.4 Å²	149.4	80%	0.804	81%	0.813	S	S	*	*			trans	-86.1	164.8	154.6	-58.1	0	0	0	0	108.5
420	P	54.4	Low	38.7	Very low	104 Å²	104	146.5 Å²	146.5	68%	0.675	81%	0.809	S	S	*	*				-155.4	159.1	80.7	37.9	-16.2	0	0	0	118.3
421	H	34.9	Very low	38.9	Very low	191 Å²	191	146.5 Å²	146.5	88%	0.884	81%	0.809	S	S	*	*			trans	67.8	123.6	144.7	-61.3	-37.1	0	0	0	123
422	G	35	Very low	39.7	Very low	81 Å²	81	143.5 Å²	143.5	84%	0.835	80%	0.804	S	S	*	*			trans	-178.6	98.5	152.7	0	0	0	0	0	112
423	R	34.9	Very low	41	Very low	251 Å²	251	141.7 Å²	141.7	95%	0.947	80%	0.8	S	S	*	*			trans	-73.3	145.8	-173.5	-74.9	177.5	173.6	-173.3	-1.8	114.2
424	L	41.4	Very low	42.3	Very low	156 Å²	156	141.4 Å²	141.4	82%	0.817	80%	0.801	S	S	*	*			trans	-54.1	163.8	156.5	-76.7	168.8	0	0	0	112.9
425	P	51.4	Low	43.1	Very low	125 Å²	125	141.2 Å²	141.2	81%	0.812	80%	0.804	S	S	*	*				-149.1	156	72.2	36.1	-13.7	0	0	0	118.9
426	S	43.6	Very low	44	Very low	110 Å²	110	144.9 Å²	144.9	77%	0.769	83%	0.828	S	S	*	*			trans	-66.1	148.8	161.2	-55.9	0	0	0	0	112.4
427	A	41.5	Very low	44.4	Very low	100 Å²	100	142.3 Å²	142.3	83%	0.826	83%	0.831	S	S	*	*			trans	-150.8	136.7	155.9	0	0	0	0	0	111.6
428	W	39	Very low	45.1	Very low	242 Å²	242	140.4 Å²	140.4	92%	0.917	83%	0.831	S	S	*	*			trans	-77.8	153.7	174.2	-76.1	49.4	0	0	0	111.5
429	T	47.6	Very low	45.7	Very low	138 Å²	138	142.8 Å²	142.8	85%	0.847	83%	0.833	S	S	*	*			trans	-141	129.2	163.1	45.8	0	0	0	0	111.2
430	P	54	Low	46.2	Very low	113 Å²	113	144.5 Å²	144.5	73%	0.734	83%	0.834	S	S	*	*			trans	-118.1	157.6	146.3	35.2	-24.2	0	0	0	111.1
431	V	39	Very low	45.7	Very low	129 Å²	129	147 Å²	147	78%	0.782	84%	0.844	S	S	*	*			trans	154.9	109.2	143.9	163.8	0	0	0	0	111.6
432	T	49.1	Very low	46.4	Very low	124 Å²	124	144.1 Å²	144.1	76%	0.761	84%	0.842	S	S	*	*				50.1	144.6	125.4	-26.5	0	0	0	0	122.5
433	P	59.5	Low	47.2	Very low	113 Å²	113	148.6 Å²	148.6	73%	0.734	84%	0.842	S	S	*	*			trans	-103.3	175.3	-167.5	41	-32.1	0	0	0	114.6
434	P	58.9	Low	48.2	Very low	120 Å²	120	140.7 Å²	140.7	78%	0.779	83%	0.834	S	S	*	*			trans	-126.9	173.1	151	35.7	-21.2	0	0	0	111.7
435	S	52.1	Low	48.7	Very low	107 Å²	107	139.4 Å²	139.4	75%	0.748	84%	0.836	S	S	*	*			cis	165.5	120.6	-25.5	-78.5	0	0	0	0	105.2
436	L	49.3	Very low	48.5	Very low	252 Å²	252	140.7 Å²	140.7	100%	1.319	84%	0.838	S	S	*	*			trans	178.4	0	132.6	-97.7	166.7	0	0	0	110.3

Retrieved 436 of 436 residues in 82.7 ms (Link to these results)

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