G4LY24_SCHMA Loading...

Ig-like domain-containing protein

AlphaFold DB , UniProt , Accession G4LY24, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 587 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	34	Very low	40.7	Very low	238 Å²	238	153.9 Å²	153.9	100%	1.172	75%	0.746	S	S	*	*				0	104.8	0	-90.1	171.6	150	0	0	108
2	L	39.5	Very low	41	Very low	157 Å²	157	147.8 Å²	147.8	82%	0.822	73%	0.726	S	S	*	*			trans	167.9	36.9	159.2	-93.4	161.9	0	0	0	111.2
3	F	39.9	Very low	41.2	Very low	214 Å²	214	146.1 Å²	146.1	94%	0.939	72%	0.719	S	S	*	*	S	Bend	trans	-106.6	16.3	174.2	-107.5	-78.8	0	0	0	112.9
4	R	40	Very low	40.9	Very low	223 Å²	223	143.5 Å²	143.5	84%	0.842	71%	0.709	S	S	*	*	S	Bend	trans	-106.9	-14.7	-173.5	-139.6	176.8	-178.2	-175.3	-0.7	115.7
5	D	42.1	Very low	40.7	Very low	119 Å²	119	139.8 Å²	139.8	64%	0.636	70%	0.697	S	S	*	*	S	Bend	trans	-101.3	-3.3	-171.2	-65.4	-21.1	0	0	0	115.4
6	F	41	Very low	40.2	Very low	177 Å²	177	139.2 Å²	139.2	78%	0.776	70%	0.696	S	S	*	*	S	Bend	trans	-92.1	-7.2	-179.8	-110.9	-86	0	0	0	115.3	T9	F6-T9 PolarHBondContact O-OG1 3.06Å
7	L	40.2	Very low	39.9	Very low	135 Å²	135	135.5 Å²	135.5	71%	0.707	69%	0.686	S	S	*	*	S	Bend	trans	-85.3	-12.8	179.3	-91.8	154	0	0	0	113.8
8	L	39.3	Very low	39.8	Very low	136 Å²	136	134.6 Å²	134.6	71%	0.712	68%	0.682	S	S	*	*	H	α-helix	trans	-86.7	-14.7	-178.7	-98.4	142	0	0	0	114.4	T12	L8-T12 PolarHBondContact O-OG1 3.26Å
9	T	45.8	Very low	39.2	Very low	69 Å²	69	137.1 Å²	137.1	42%	0.423	69%	0.689	S	S	.	*	H	α-helix	trans	-88.4	-20.6	179.7	44.6	0	0	0	0	114.1	F6 T12 I13	F6-T9 PolarHBondContact O-OG1 3.06Å; T9-T12 PolarHBondContact O-OG1 2.98Å; T9-T12 VanDerWaalsContact O-OG1 3.14Å; T9-I13 WeakPolarHBondContact O-CG1 3.45Å; T9-I13 PolarHBondContact O-N 3.15Å
10	I	44.5	Very low	38.6	Very low	107 Å²	107	133.8 Å²	133.8	55%	0.549	68%	0.683	S	S	.	*	H	α-helix	trans	-73.9	-35.3	-179.9	-61.8	177.5	0	0	0	111.1	L14	I10-L14 PolarHBondContact O-N 2.94Å
11	N	41.1	Very low	38.1	Very low	118 Å²	118	135.5 Å²	135.5	63%	0.631	69%	0.689	S	S	*	*	H	α-helix	trans	-73	-30.9	179.4	-80.1	-19.1	0	0	0	113.2	L14 V15	N11-L14 PolarHBondContact O-N 3.34Å; N11-V15 VanDerWaalsContact O-CG2 3.29Å; N11-V15 WeakPolarHBondContact O-CG2 3.32Å; N11-V15 PolarHBondContact O-N 3.06Å; N11-V15 VanDerWaalsContact O-N 3.15Å
12	T	44.4	Very low	37.8	Very low	81 Å²	81	129.2 Å²	129.2	50%	0.497	67%	0.666	S	S	.	*	H	α-helix	trans	-74.2	-34.2	177.2	39.4	0	0	0	0	112.6	L8 T9 L14 V15 L16	L8-T12 PolarHBondContact O-OG1 3.26Å; T9-T12 PolarHBondContact O-OG1 2.98Å; T9-T12 VanDerWaalsContact O-OG1 3.14Å; T12-L14 VanDerWaalsContact C-N 3.33Å; T12-V15 PolarHBondContact O-N 3.33Å; T12-L16 PolarHBondContact O-N 2.79Å
13	I	44	Very low	37.2	Very low	125 Å²	125	130.3 Å²	130.3	64%	0.641	66%	0.659	S	S	*	*	H	α-helix	trans	-69.7	-33.5	174.8	-63.6	170.1	0	0	0	110.9	T9	T9-I13 WeakPolarHBondContact O-CG1 3.45Å; T9-I13 PolarHBondContact O-N 3.15Å
14	L	36.3	Very low	36.5	Very low	110 Å²	110	125.3 Å²	125.3	58%	0.576	64%	0.641	S	S	*	*	H	α-helix	trans	-71.2	-39.8	176.6	-139.9	100.9	0	0	0	112.1	I10 N11 T12 L16 S17	I10-L14 PolarHBondContact O-N 2.94Å; N11-L14 PolarHBondContact O-N 3.34Å; T12-L14 VanDerWaalsContact C-N 3.33Å; L14-L16 VanDerWaalsContact C-N 3.33Å; L14-L16 PolarHBondContact O-N 3.34Å; L14-S17 PolarHBondContact O-N 3.18Å; L14-S17 PolarHBondContact O-OG 2.76Å
15	V	38.2	Very low	36	Very low	88 Å²	88	117.9 Å²	117.9	53%	0.533	62%	0.615	S	S	.	*	H	α-helix	trans	-67.6	-32.1	179.4	174.2	0	0	0	0	112.2	N11 T12 S17 I18	N11-V15 VanDerWaalsContact O-CG2 3.29Å; N11-V15 WeakPolarHBondContact O-CG2 3.32Å; N11-V15 PolarHBondContact O-N 3.06Å; N11-V15 VanDerWaalsContact O-N 3.15Å; T12-V15 PolarHBondContact O-N 3.33Å; V15-S17 VanDerWaalsContact C-N 3.32Å; V15-S17 PolarHBondContact O-N 2.84Å; V15-I18 PolarHBondContact O-N 2.81Å
16	L	33.2	Very low	35.7	Very low	130 Å²	130	112.7 Å²	112.7	68%	0.681	59%	0.589	S	S	*	*	H	α-helix	trans	-72.3	-20.6	176.2	-89.7	152.6	0	0	0	114.1	T12 L14	T12-L16 PolarHBondContact O-N 2.79Å; L14-L16 VanDerWaalsContact C-N 3.33Å; L14-L16 PolarHBondContact O-N 3.34Å
17	S	35	Very low	36.1	Very low	76 Å²	76	105.3 Å²	105.3	53%	0.531	56%	0.557	S	S	.	*	H	α-helix	trans	-82.7	-13.4	176.6	62.6	0	0	0	0	114.4	L14 V15	L14-S17 PolarHBondContact O-N 3.18Å; L14-S17 PolarHBondContact O-OG 2.76Å; V15-S17 VanDerWaalsContact C-N 3.32Å; V15-S17 PolarHBondContact O-N 2.84Å
18	I	37.4	Very low	36.7	Very low	120 Å²	120	101.2 Å²	101.2	62%	0.615	54%	0.536	S	S	*	.	H	α-helix	trans	-83.4	-27.9	177.1	-62.3	173.7	0	0	0	111.7	V15	V15-I18 PolarHBondContact O-N 2.81Å
19	F	29.7	Very low	38.1	Very low	182 Å²	182	95.2 Å²	95.2	80%	0.798	50%	0.504	S	S	*	.	H	α-helix	trans	-96.2	-6.5	-178.2	-76.3	-76.8	0	0	0	115.2
20	A	27.4	Very low	39.4	Very low	70 Å²	70	96.5 Å²	96.5	58%	0.579	50%	0.504	S	S	*	.			trans	-117.1	58.5	178.9	0	0	0	0	0	111.1	P22	A20-P22 WeakPolarHBondContact O-CD 3.41Å
21	Q	27	Very low	41	Very low	171 Å²	171	91.5 Å²	91.5	80%	0.799	48%	0.478	S	S	*	.			trans	-76.9	103.4	153.8	-76.1	-171	-17	0	0	106.8	R23	Q21-R23 PolarHBondContact O-N 3.26Å; Q21-R23 VanDerWaalsContact O-N 3.11Å
22	P	28.6	Very low	42.6	Very low	106 Å²	106	87.4 Å²	87.4	69%	0.688	46%	0.459	S	S	*	.			trans	-56.5	125	166.2	25.5	-32.1	0	0	0	106.2	A20 I24	A20-P22 WeakPolarHBondContact O-CD 3.41Å; P22-I24 VanDerWaalsContact C-N 3.33Å; P22-I24 PolarHBondContact O-N 2.94Å
23	R	25.3	Very low	43.9	Very low	180 Å²	180	86.5 Å²	86.5	68%	0.679	45%	0.451	S	S	*	.			trans	-57.8	100.1	175.8	-67.7	-179.5	172.1	167.4	-2	107.8	Q21 H25 D33	Q21-R23 PolarHBondContact O-N 3.26Å; Q21-R23 VanDerWaalsContact O-N 3.11Å; R23-H25 WeakPolarHBondContact CB-NE2 3.44Å; R23-H25 PolarHBondContact O-N 2.83Å; R23-H25 VanDerWaalsContact O-N 3.14Å; R23-D33 IonicContact NE-OD2 2.85Å
24	I	27	Very low	45.2	Very low	109 Å²	109	85 Å²	85	56%	0.559	44%	0.443	S	S	*	.			trans	-65.8	109.9	172.8	-60.5	167.8	0	0	0	105.3	P22	P22-I24 VanDerWaalsContact C-N 3.33Å; P22-I24 PolarHBondContact O-N 2.94Å
25	H	29	Very low	46.9	Very low	66 Å²	66	86.4 Å²	86.4	31%	0.306	45%	0.446	S	S	.	.			trans	-118.1	79.5	-176.8	-76.3	-51.5	0	0	0	108.7	R23 E279	R23-H25 WeakPolarHBondContact CB-NE2 3.44Å; R23-H25 PolarHBondContact O-N 2.83Å; R23-H25 VanDerWaalsContact O-N 3.14Å; H25-E279 PolarHBondContact N-OE1 3.43Å; H25-E279 VanDerWaalsContact O-CG 3.3Å; H25-E279 WeakPolarHBondContact O-CG 3.5Å; H25-E279 PolarHBondContact O-N 3.39Å
26	A	35.3	Very low	48.3	Very low	10 Å²	10	82.6 Å²	82.6	8%	0.083	42%	0.423	C	S	.	.	S	Bend	trans	-71.2	174.8	142.8	0	0	0	0	0	110.5	L28 E419 K420	A26-L28 PolarHBondContact O-N 2.95Å; A26-E419 WeakPolarHBondContact CB-O 3.47Å; A26-K420 VanDerWaalsContact CB-CA 3.49Å
27	I	50.1	Low	50	Low	23 Å²	23	80.4 Å²	80.4	12%	0.118	41%	0.412	C	S	.	.	S	Bend	trans	-76.2	53.1	164.4	-45.4	-177.5	0	0	0	108.5	Y29 I302 I304 Y483	I27-Y29 HydrophobicContact CG2-CD2 4.05Å; I27-Y29 HydrophobicContact CG2-CE2 3.68Å; I27-I302 HydrophobicContact CD1-CD1 3.4Å; I27-I302 HydrophobicContact CD1-CG1 3.27Å; I27-I304 HydrophobicContact CD1-CD1 3.65Å; I27-I304 HydrophobicContact CG1-CD1 4.41Å; I27-I304 HydrophobicContact CG2-CD1 3.43Å; I27-I304 VanDerWaalsContact CG2-CD1 3.43Å; I27-Y483 HydrophobicContact CD1-CE2 3.55Å; I27-Y483 HydrophobicContact CG1-CE2 4.22Å
28	L	52.6	Low	51.5	Low	48 Å²	48	78.2 Å²	78.2	25%	0.251	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	104.1	153.7	-167.3	95.9	0	0	0	103.2	A26 K30 G57 V59	A26-L28 PolarHBondContact O-N 2.95Å; L28-K30 PolarHBondContact O-N 3.32Å; L28-G57 WeakPolarHBondContact CA-O 3.27Å; L28-V59 HydrophobicContact CD1-CG2 3.69Å; L28-V59 HydrophobicContact CD2-CB 3.71Å; L28-V59 HydrophobicContact CD2-CG2 3.38Å; L28-V59 HydrophobicContact CG-CB 4.15Å; L28-V59 HydrophobicContact CG-CG2 3.64Å
29	Y	69.1	Low	52.9	Low	10 Å²	10	77.1 Å²	77.1	4%	0.039	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	120.8	168.6	-72.6	-101.7	0	0	0	106.3	I27 Y50 L51 L52 D56 G57 L58 V59 N275	I27-Y29 HydrophobicContact CG2-CD2 4.05Å; I27-Y29 HydrophobicContact CG2-CE2 3.68Å; Y29-Y50 AromaticContact CD1-CD1 3.7Å; Y29-Y50 HydrophobicContact CD1-CD1 3.7Å; Y29-Y50 HydrophobicContact CD1-CE1 4.2Å; Y29-Y50 HydrophobicContact CG-CD1 4.27Å; Y29-L51 PolarHBondContact OH-O 3.36Å; Y29-L52 HydrophobicContact CD1-CD2 3.95Å; Y29-L52 HydrophobicContact CD2-CD2 3.2Å; Y29-L52 HydrophobicContact CE1-CD2 4.07Å; Y29-L52 HydrophobicContact CE2-CD2 3.4Å; Y29-L52 VanDerWaalsContact CE2-CD2 3.4Å; Y29-L52 HydrophobicContact CG-CD2 3.48Å; Y29-L52 VanDerWaalsContact CG-CD2 3.48Å; Y29-D56 HydrophobicContact CE2-CB 4.38Å; Y29-G57 PolarHBondContact N-O 2.87Å; Y29-L58 VanDerWaalsContact CB-CD1 3.42Å; Y29-L58 CarbonylContact O-C 3.47Å; Y29-L58 WeakPolarHBondContact O-CA 3.48Å; Y29-L58 WeakPolarHBondContact O-CD1 3.3Å; Y29-V59 PolarHBondContact O-N 3.37Å; Y29-N275 WeakPolarHBondContact CD1-ND2 3.42Å; Y29-N275 WeakPolarHBondContact CE1-ND2 3.46Å
30	K	73.3	Confident	54.4	Low	97 Å²	97	71.1 Å²	71.1	42%	0.422	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	134.5	179	-160.1	-169.2	-179.6	-165.3	0	108.2	L28 D33 Y50 V59	L28-K30 PolarHBondContact O-N 3.32Å; K30-D33 WeakPolarHBondContact CE-OD1 3.35Å; K30-D33 IonicContact NZ-OD1 2.71Å; K30-D33 PolarHBondContact NZ-OD1 3.49Å; K30-D33 IonicContact NZ-OD2 3.38Å; K30-Y50 PolarHBondContact O-OH 3.12Å; K30-V59 WeakPolarHBondContact CA-O 3.46Å
31	S	77.9	Confident	55.6	Low	1 Å²	1	74.9 Å²	74.9	1%	0.007	39%	0.389	C	S	.	.			trans	-52.6	148.6	162.7	62.6	0	0	0	0	110.5	E48 Y50 V59 S61	S31-E48 WeakPolarHBondContact CA-OE2 3.31Å; S31-E48 WeakPolarHBondContact CB-OE2 3.33Å; S31-Y50 WeakPolarHBondContact CA-OH 3.33Å; S31-Y50 PolarHBondContact N-OH 3.25Å; S31-V59 PolarHBondContact N-O 2.99Å; S31-S61 PolarHBondContact OG-N 3.35Å; S31-S61 PolarHBondContact OG-O 3.35Å
32	S	73.9	Confident	56.9	Low	33 Å²	33	75.3 Å²	75.3	23%	0.231	39%	0.389	C	S	.	.			trans	-52.2	150.9	176.7	63.2	0	0	0	0	111.6	I34 E48 N63 R213	S32-I34 PolarHBondContact O-N 2.87Å; S32-E48 WeakPolarHBondContact CA-OE1 3.46Å; S32-E48 WeakPolarHBondContact CB-OE1 3.22Å; S32-E48 PolarHBondContact N-OE1 3.31Å; S32-E48 PolarHBondContact N-OE2 2.97Å; S32-E48 PolarHBondContact OG-OE1 3.36Å; S32-N63 PolarHBondContact O-ND2 3.47Å; S32-R213 PolarHBondContact O-NH1 3.31Å; S32-R213 PolarHBondContact O-NH2 3.48Å; S32-R213 PolarHBondContact OG-NH2 3.03Å; S32-R213 VanDerWaalsContact OG-NH2 3.16Å
33	D	71.4	Confident	58.6	Low	62 Å²	62	73 Å²	73	33%	0.332	37%	0.369	S	S	.	.			trans	-80.3	15.5	176.5	-68.2	-32.8	0	0	0	113.2	R23 K30 H35 N63	R23-D33 IonicContact NE-OD2 2.85Å; K30-D33 WeakPolarHBondContact CE-OD1 3.35Å; K30-D33 IonicContact NZ-OD1 2.71Å; K30-D33 PolarHBondContact NZ-OD1 3.49Å; K30-D33 IonicContact NZ-OD2 3.38Å; D33-H35 PolarHBondContact O-CD2 3.13Å; D33-H35 PolarHBondContact O-N 2.58Å; D33-H35 VanDerWaalsContact O-N 3.09Å; D33-N63 VanDerWaalsContact CA-ND2 3.35Å; D33-N63 WeakPolarHBondContact CA-ND2 3.43Å
34	I	72.2	Confident	61.1	Low	94 Å²	94	72.6 Å²	72.6	48%	0.482	37%	0.374	S	S	.	.			trans	-63.1	114.3	179.7	-58.9	168.1	0	0	0	109.6	S32 N63 R213	S32-I34 PolarHBondContact O-N 2.87Å; I34-N63 VanDerWaalsContact O-CB 3.31Å; I34-N63 WeakPolarHBondContact O-CB 3.12Å; I34-N63 PolarHBondContact O-ND2 3.45Å; I34-R213 PolarHBondContact O-NH2 2.96Å
35	H	70.6	Confident	63.7	Low	138 Å²	138	68.9 Å²	68.9	64%	0.639	36%	0.357	S	S	*	.			trans	-75.5	131.7	179	-74.9	-72.8	0	0	0	111.7	D33 N37 N63	D33-H35 PolarHBondContact O-CD2 3.13Å; D33-H35 PolarHBondContact O-N 2.58Å; D33-H35 VanDerWaalsContact O-N 3.09Å; H35-N37 PolarHBondContact O-N 3.38Å; H35-N63 WeakPolarHBondContact CA-O 3.09Å; H35-N63 PolarHBondContact ND1-O 2.95Å
36	F	67.4	Low	66.5	Low	9 Å²	9	67 Å²	67	4%	0.039	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-76.6	119.1	170.8	176.3	-90	0	0	0	108.9	C38 H43 N63 V64 C65 F207 I212	F36-C38 PolarHBondContact O-N 2.72Å; F36-H43 HydrophobicContact CD2-CB 4.29Å; F36-H43 AromaticContact CD2-CD2 3.18Å; F36-H43 WeakPolarHBondContact CD2-CD2 3.23Å; F36-H43 AromaticContact CD2-CE1 3.6Å; F36-H43 AromaticContact CD2-CG 3.5Å; F36-H43 VanDerWaalsContact CD2-CG 3.5Å; F36-H43 AromaticContact CD2-ND1 3.72Å; F36-H43 AromaticContact CD2-NE2 3.27Å; F36-H43 VanDerWaalsContact CD2-NE2 3.27Å; F36-H43 WeakPolarHBondContact CD2-NE2 3.33Å; F36-H43 HydrophobicContact CE2-CB 3.5Å; F36-H43 VanDerWaalsContact CE2-CB 3.5Å; F36-H43 AromaticContact CE2-CD2 3.32Å; F36-H43 WeakPolarHBondContact CE2-CD2 3.39Å; F36-H43 AromaticContact CE2-CE1 3.98Å; F36-H43 AromaticContact CE2-CG 3.17Å; F36-H43 AromaticContact CE2-ND1 3.6Å; F36-H43 AromaticContact CE2-NE2 3.85Å; F36-H43 HydrophobicContact CZ-CB 4.23Å; F36-N63 PolarHBondContact N-O 3.36Å; F36-V64 HydrophobicContact CB-CG2 4.43Å; F36-V64 HydrophobicContact CD1-CG1 4.28Å; F36-V64 HydrophobicContact CD1-CG2 4.49Å; F36-C65 PolarHBondContact O-SG 3.47Å; F36-F207 AromaticContact CE1-CD1 3.74Å; F36-F207 HydrophobicContact CE1-CD1 3.74Å; F36-F207 HydrophobicContact CE1-CE1 4.09Å; F36-F207 HydrophobicContact CZ-CD1 4.26Å; F36-I212 HydrophobicContact CD2-CB 3.73Å; F36-I212 HydrophobicContact CD2-CD1 4.47Å; F36-I212 HydrophobicContact CD2-CG2 3.55Å; F36-I212 HydrophobicContact CE1-CG2 4.36Å; F36-I212 HydrophobicContact CE2-CB 3.89Å; F36-I212 HydrophobicContact CE2-CG2 3.21Å; F36-I212 HydrophobicContact CG-CB 4.47Å; F36-I212 HydrophobicContact CG-CD1 4.41Å; F36-I212 HydrophobicContact CG-CG2 4.29Å; F36-I212 HydrophobicContact CZ-CG2 3.68Å
37	N	69.3	Low	69	Low	84 Å²	84	69.9 Å²	69.9	45%	0.449	36%	0.359	S	S	.	.			trans	-81.9	109.3	176.2	-175.7	8.9	0	0	0	110.9	H35 S39 S40	H35-N37 PolarHBondContact O-N 3.38Å; N37-S39 VanDerWaalsContact CG-OG 3.3Å; N37-S39 PolarHBondContact ND2-OG 3.13Å; N37-S39 VanDerWaalsContact ND2-OG 3.1Å; N37-S39 PolarHBondContact O-N 2.83Å; N37-S39 VanDerWaalsContact O-N 3.15Å; N37-S39 PolarHBondContact OD1-N 3.04Å; N37-S39 VanDerWaalsContact OD1-N 3.16Å; N37-S39 PolarHBondContact OD1-OG 2.95Å; N37-S40 PolarHBondContact O-N 3.19Å
38	C	67.4	Low	71	Confident	30 Å²	30	69.7 Å²	69.7	20%	0.203	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-14.6	-179.9	-67.1	0	0	0	0	115.1	F36 V64 C65 Y68	F36-C38 PolarHBondContact O-N 2.72Å; C38-V64 WeakPolarHBondContact SG-CG1 3.44Å; C38-C65 HydrophobicContact CB-CB 4.39Å; C38-Y68 HydrophobicContact CB-CD2 4.26Å; C38-Y68 HydrophobicContact CB-CE2 4.27Å
39	S	65.6	Low	72.9	Confident	97 Å²	97	67.9 Å²	67.9	68%	0.678	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-8.7	178.3	60.6	0	0	0	0	114	N37	N37-S39 VanDerWaalsContact CG-OG 3.3Å; N37-S39 PolarHBondContact ND2-OG 3.13Å; N37-S39 VanDerWaalsContact ND2-OG 3.1Å; N37-S39 PolarHBondContact O-N 2.83Å; N37-S39 VanDerWaalsContact O-N 3.15Å; N37-S39 PolarHBondContact OD1-N 3.04Å; N37-S39 VanDerWaalsContact OD1-N 3.16Å; N37-S39 PolarHBondContact OD1-OG 2.95Å
40	S	62.3	Low	74	Confident	55 Å²	55	68.7 Å²	68.7	39%	0.385	35%	0.352	S	S	.	.			trans	-77.2	127.8	178.4	-165	0	0	0	0	111.2	N37 F42	N37-S40 PolarHBondContact O-N 3.19Å; S40-F42 PolarHBondContact O-N 3.44Å; S40-F42 PolarHBondContact OG-N 3.44Å; S40-F42 PolarHBondContact OG-O 3.09Å
41	L	51.3	Low	75	Confident	149 Å²	149	64.4 Å²	64.4	78%	0.78	33%	0.334	S	S	*	.	S	Bend	trans	-71.5	-20.2	170.6	-76.5	162.2	0	0	0	112.7
42	F	55.8	Low	75.6	Confident	180 Å²	180	64.5 Å²	64.5	79%	0.789	33%	0.334	S	S	*	.			trans	-130.6	116.2	-179	-61.9	-78.6	0	0	0	108.7	S40	S40-F42 PolarHBondContact O-N 3.44Å; S40-F42 PolarHBondContact OG-N 3.44Å; S40-F42 PolarHBondContact OG-O 3.09Å
43	H	64.7	Low	76.3	Confident	58 Å²	58	63.2 Å²	63.2	27%	0.269	33%	0.325	S	S	.	.			trans	-124.6	131	173.7	-177	-81.3	0	0	0	110.2	F36	F36-H43 HydrophobicContact CD2-CB 4.29Å; F36-H43 AromaticContact CD2-CD2 3.18Å; F36-H43 WeakPolarHBondContact CD2-CD2 3.23Å; F36-H43 AromaticContact CD2-CE1 3.6Å; F36-H43 AromaticContact CD2-CG 3.5Å; F36-H43 VanDerWaalsContact CD2-CG 3.5Å; F36-H43 AromaticContact CD2-ND1 3.72Å; F36-H43 AromaticContact CD2-NE2 3.27Å; F36-H43 VanDerWaalsContact CD2-NE2 3.27Å; F36-H43 WeakPolarHBondContact CD2-NE2 3.33Å; F36-H43 HydrophobicContact CE2-CB 3.5Å; F36-H43 VanDerWaalsContact CE2-CB 3.5Å; F36-H43 AromaticContact CE2-CD2 3.32Å; F36-H43 WeakPolarHBondContact CE2-CD2 3.39Å; F36-H43 AromaticContact CE2-CE1 3.98Å; F36-H43 AromaticContact CE2-CG 3.17Å; F36-H43 AromaticContact CE2-ND1 3.6Å; F36-H43 AromaticContact CE2-NE2 3.85Å; F36-H43 HydrophobicContact CZ-CB 4.23Å
44	Q	76.2	Confident	77.1	Confident	172 Å²	172	62.4 Å²	62.4	80%	0.804	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-81.1	120.6	172.7	-175.3	177	8.8	0	0	109.6	V46	Q44-V46 PolarHBondContact O-N 3.15Å
45	T	82.5	Confident	77.6	Confident	31 Å²	31	58.4 Å²	58.4	19%	0.19	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-51.8	126	174.5	-52.9	0	0	0	0	110.8	Y47 V211 I212 A214	T45-Y47 HydrophobicContact CG2-CD2 4.35Å; T45-Y47 HydrophobicContact CG2-CE1 4.25Å; T45-Y47 HydrophobicContact CG2-CE2 3.82Å; T45-Y47 WeakPolarHBondContact O-CD2 3.46Å; T45-Y47 WeakPolarHBondContact O-CE2 3.46Å; T45-Y47 PolarHBondContact O-N 3.39Å; T45-V211 WeakPolarHBondContact CB-O 3.23Å; T45-V211 HydrophobicContact CG2-CB 4.37Å; T45-V211 HydrophobicContact CG2-CG1 3.71Å; T45-V211 WeakPolarHBondContact CG2-O 3.15Å; T45-V211 PolarHBondContact OG1-O 3.5Å; T45-I212 WeakPolarHBondContact CA-O 3.21Å; T45-A214 HydrophobicContact CG2-CB 4.28Å
46	V	86.5	Confident	78.2	Confident	27 Å²	27	52 Å²	52	16%	0.164	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	120.8	175.4	-178.3	0	0	0	0	108.8	Q44 E48 I212 R213 A214	Q44-V46 PolarHBondContact O-N 3.15Å; V46-E48 HydrophobicContact CG1-CG 4.27Å; V46-I212 PolarHBondContact N-O 3.22Å; V46-R213 HydrophobicContact CB-CG 4.19Å; V46-R213 CarbonylContact O-C 3.56Å; V46-R213 WeakPolarHBondContact O-CA 3.47Å; V46-A214 PolarHBondContact O-N 3.49Å
47	Y	88.8	Confident	79	Confident	69 Å²	69	51.6 Å²	51.6	27%	0.271	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	128	176.3	-67.3	-88	0	0	0	110.1	T45 A214 L333 F334 P337	T45-Y47 HydrophobicContact CG2-CD2 4.35Å; T45-Y47 HydrophobicContact CG2-CE1 4.25Å; T45-Y47 HydrophobicContact CG2-CE2 3.82Å; T45-Y47 WeakPolarHBondContact O-CD2 3.46Å; T45-Y47 WeakPolarHBondContact O-CE2 3.46Å; T45-Y47 PolarHBondContact O-N 3.39Å; Y47-A214 WeakPolarHBondContact CA-O 3.32Å; Y47-A214 HydrophobicContact CD1-CB 3.69Å; Y47-A214 HydrophobicContact CE1-CB 3.72Å; Y47-L333 HydrophobicContact CE1-CB 4.46Å; Y47-L333 HydrophobicContact CE1-CD2 4.31Å; Y47-F334 HydrophobicContact CD1-CD1 4.35Å; Y47-F334 AromaticContact CD1-CE1 3.91Å; Y47-F334 HydrophobicContact CD1-CE1 3.91Å; Y47-F334 HydrophobicContact CD1-CE2 4.28Å; Y47-F334 AromaticContact CD1-CZ 3.88Å; Y47-F334 HydrophobicContact CD1-CZ 3.88Å; Y47-F334 HydrophobicContact CG-CD1 4.49Å; Y47-F334 HydrophobicContact CG-CE1 4.39Å; Y47-P337 WeakPolarHBondContact O-CG 3.45Å
48	E	91.8	Very high	79.9	Confident	20 Å²	20	47.6 Å²	47.6	9%	0.093	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	153.7	-180	-81.8	174.2	177.6	0	0	109.9	S31 S32 V46 Y50 A214 W215 S216 F334	S31-E48 WeakPolarHBondContact CA-OE2 3.31Å; S31-E48 WeakPolarHBondContact CB-OE2 3.33Å; S32-E48 WeakPolarHBondContact CA-OE1 3.46Å; S32-E48 WeakPolarHBondContact CB-OE1 3.22Å; S32-E48 PolarHBondContact N-OE1 3.31Å; S32-E48 PolarHBondContact N-OE2 2.97Å; S32-E48 PolarHBondContact OG-OE1 3.36Å; V46-E48 HydrophobicContact CG1-CG 4.27Å; E48-Y50 HydrophobicContact CB-CE2 4.16Å; E48-Y50 PolarHBondContact OE2-OH 3.14Å; E48-A214 PolarHBondContact N-O 2.91Å; E48-W215 VanDerWaalsContact CB-CD1 3.48Å; E48-W215 CarbonylContact O-C 3.57Å; E48-W215 VanDerWaalsContact O-CA 3.25Å; E48-W215 WeakPolarHBondContact O-CA 3.32Å; E48-W215 VanDerWaalsContact OE2-CD1 3.22Å; E48-W215 PolarHBondContact OE2-NE1 2.82Å; E48-S216 PolarHBondContact O-N 2.91Å; E48-F334 WeakPolarHBondContact O-CE1 3.35Å
49	S	92.7	Very high	80.9	Confident	10 Å²	10	46.6 Å²	46.6	7%	0.07	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	136	-176.6	65.2	0	0	0	0	111.1	S216 H308 G338 P340	S49-S216 CarbonylContact C-O 3.56Å; S49-S216 WeakPolarHBondContact CA-O 3.27Å; S49-H308 PolarHBondContact OG-CE1 3.47Å; S49-G338 PolarHBondContact OG-O 2.82Å; S49-P340 WeakPolarHBondContact OG-CD 3.11Å
50	Y	92.9	Very high	82.1	Confident	26 Å²	26	42 Å²	42	10%	0.102	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	135.9	-178.1	-64.8	-71.9	0	0	0	110.6	Y29 K30 S31 E48 L58 L60 W215 S216 T218	Y29-Y50 AromaticContact CD1-CD1 3.7Å; Y29-Y50 HydrophobicContact CD1-CD1 3.7Å; Y29-Y50 HydrophobicContact CD1-CE1 4.2Å; Y29-Y50 HydrophobicContact CG-CD1 4.27Å; K30-Y50 PolarHBondContact O-OH 3.12Å; S31-Y50 WeakPolarHBondContact CA-OH 3.33Å; S31-Y50 PolarHBondContact N-OH 3.25Å; E48-Y50 HydrophobicContact CB-CE2 4.16Å; E48-Y50 PolarHBondContact OE2-OH 3.14Å; Y50-L58 HydrophobicContact CD1-CD1 4.11Å; Y50-L58 HydrophobicContact CD2-CD1 3.82Å; Y50-L58 HydrophobicContact CE1-CD1 4.41Å; Y50-L58 HydrophobicContact CE2-CD1 4.12Å; Y50-L58 HydrophobicContact CG-CD1 3.82Å; Y50-L60 HydrophobicContact CD2-CD2 4.4Å; Y50-L60 HydrophobicContact CE2-CD2 4.09Å; Y50-W215 AromaticContact CE2-CD1 3.71Å; Y50-S216 PolarHBondContact N-O 2.85Å; Y50-T218 PolarHBondContact O-N 3.37Å
51	L	93.3	Very high	83.3	Confident	7 Å²	7	39.7 Å²	39.7	4%	0.037	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	119.2	164.6	-169.8	69.2	0	0	0	107.6	Y29 T218 L220 E225 I306 P340 R342	Y29-L51 PolarHBondContact OH-O 3.36Å; L51-T218 WeakPolarHBondContact CA-O 3.33Å; L51-T218 HydrophobicContact CD1-CG2 3.68Å; L51-L220 HydrophobicContact CD1-CD1 3.72Å; L51-L220 HydrophobicContact CD1-CG 3.88Å; L51-L220 HydrophobicContact CD2-CD1 4.28Å; L51-L220 HydrophobicContact CG-CD1 4.28Å; L51-E225 HydrophobicContact CD2-CG 4.07Å; L51-I306 HydrophobicContact CB-CG2 3.91Å; L51-I306 HydrophobicContact CD2-CD1 4.37Å; L51-I306 HydrophobicContact CD2-CG2 3.76Å; L51-I306 HydrophobicContact CG-CG2 4.5Å; L51-P340 HydrophobicContact CB-CB 3.8Å; L51-P340 HydrophobicContact CB-CG 3.85Å; L51-P340 HydrophobicContact CD1-CB 4.3Å; L51-P340 HydrophobicContact CD2-CB 4.24Å; L51-P340 HydrophobicContact CG-CB 4.35Å; L51-R342 HydrophobicContact CD1-CB 4.45Å; L51-R342 HydrophobicContact CD2-CB 4.48Å
52	L	91.7	Very high	84.9	Confident	3 Å²	3	32.6 Å²	32.6	2%	0.016	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	147.7	-177	-54.7	-178.6	0	0	0	109.4	Y29 D56 L58 A195 V217 T218 V219 L220	Y29-L52 HydrophobicContact CD1-CD2 3.95Å; Y29-L52 HydrophobicContact CD2-CD2 3.2Å; Y29-L52 HydrophobicContact CE1-CD2 4.07Å; Y29-L52 HydrophobicContact CE2-CD2 3.4Å; Y29-L52 VanDerWaalsContact CE2-CD2 3.4Å; Y29-L52 HydrophobicContact CG-CD2 3.48Å; Y29-L52 VanDerWaalsContact CG-CD2 3.48Å; L52-D56 WeakPolarHBondContact CA-OD2 3.4Å; L52-D56 HydrophobicContact CB-CB 4.06Å; L52-D56 HydrophobicContact CD2-CB 4.2Å; L52-L58 HydrophobicContact CD1-CB 3.86Å; L52-L58 HydrophobicContact CD1-CD2 4.06Å; L52-L58 HydrophobicContact CD1-CG 4.37Å; L52-A195 HydrophobicContact CB-CB 4.3Å; L52-A195 HydrophobicContact CD1-CB 4Å; L52-V217 HydrophobicContact CD1-CG1 3.87Å; L52-T218 PolarHBondContact N-O 2.75Å; L52-V219 HydrophobicContact CB-CG1 4.44Å; L52-V219 HydrophobicContact CB-CG2 4.25Å; L52-V219 HydrophobicContact CD1-CG2 4.29Å; L52-V219 CarbonylContact O-C 3.56Å; L52-V219 WeakPolarHBondContact O-CA 3Å; L52-L220 PolarHBondContact O-N 3.46Å
53	S	89.1	Confident	86.1	Confident	6 Å²	6	24.6 Å²	24.6	4%	0.042	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	154.4	160.2	-73.1	0	0	0	0	110	G55 D56 L220	S53-G55 PolarHBondContact O-N 2.92Å; S53-D56 PolarHBondContact N-OD2 2.85Å; S53-D56 WeakPolarHBondContact O-CB 3.41Å; S53-D56 PolarHBondContact O-N 2.71Å; S53-L220 CarbonylContact C-O 3.58Å; S53-L220 WeakPolarHBondContact CA-O 3.14Å
54	E	87.7	Confident	86.6	Confident	45 Å²	45	22 Å²	22	21%	0.21	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	134.2	167.7	-64.4	-174.2	158.3	0	0	110.5	A195 N196 T197 V219 L220 P222 N484	E54-A195 CarbonylContact C-O 3.59Å; E54-A195 VanDerWaalsContact CA-O 3.31Å; E54-A195 WeakPolarHBondContact CA-O 3.31Å; E54-N196 PolarHBondContact OE1-OD1 3.35Å; E54-T197 HydrophobicContact CG-CG2 4.34Å; E54-T197 WeakPolarHBondContact OE1-CG2 3.04Å; E54-T197 PolarHBondContact OE1-N 3.02Å; E54-T197 PolarHBondContact OE1-OG1 2.98Å; E54-T197 VanDerWaalsContact OE1-OG1 3.09Å; E54-V219 HydrophobicContact CG-CG1 4.04Å; E54-L220 WeakPolarHBondContact CG-O 3.38Å; E54-L220 PolarHBondContact N-O 3.1Å; E54-P222 HydrophobicContact CB-CG 4.12Å; E54-N484 PolarHBondContact O-ND2 2.81Å
55	G	81.5	Confident	86.2	Confident	11 Å²	11	15.5 Å²	15.5	11%	0.113	8%	0.084	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.2	-11.7	-171.4	0	0	0	0	0	114.9	S53 A195 I418	S53-G55 PolarHBondContact O-N 2.92Å; G55-A195 PolarHBondContact N-O 3.03Å; G55-I418 WeakPolarHBondContact O-CD1 3.34Å
56	D	84.2	Confident	84.9	Confident	4 Å²	4	18.2 Å²	18.2	2%	0.021	10%	0.104	C	C	.	.			trans	-69.5	151.4	175.2	-79.9	-31.6	0	0	0	112.6	Y29 L52 S53 A195 A482	Y29-D56 HydrophobicContact CE2-CB 4.38Å; L52-D56 WeakPolarHBondContact CA-OD2 3.4Å; L52-D56 HydrophobicContact CB-CB 4.06Å; L52-D56 HydrophobicContact CD2-CB 4.2Å; S53-D56 PolarHBondContact N-OD2 2.85Å; S53-D56 WeakPolarHBondContact O-CB 3.41Å; S53-D56 PolarHBondContact O-N 2.71Å; D56-A195 HydrophobicContact CB-CB 4.34Å; D56-A195 VanDerWaalsContact O-CB 3.29Å; D56-A195 WeakPolarHBondContact O-CB 3.34Å; D56-A195 PolarHBondContact O-N 3Å; D56-A482 WeakPolarHBondContact OD1-CA 3.48Å; D56-A482 VanDerWaalsContact OD1-CB 3.28Å; D56-A482 WeakPolarHBondContact OD1-CB 3.18Å; D56-A482 PolarHBondContact OD1-N 2.85Å
57	G	83.9	Confident	83.2	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	139.4	167.8	0	0	0	0	0	111.8	L28 Y29 I192	L28-G57 WeakPolarHBondContact CA-O 3.27Å; Y29-G57 PolarHBondContact N-O 2.87Å; G57-I192 WeakPolarHBondContact CA-O 3.25Å
58	L	87.8	Confident	81.3	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	133.8	175.3	177.8	75.7	0	0	0	110.4	Y29 Y50 L52 L60 R191 I192 V217	Y29-L58 VanDerWaalsContact CB-CD1 3.42Å; Y29-L58 CarbonylContact O-C 3.47Å; Y29-L58 WeakPolarHBondContact O-CA 3.48Å; Y29-L58 WeakPolarHBondContact O-CD1 3.3Å; Y50-L58 HydrophobicContact CD1-CD1 4.11Å; Y50-L58 HydrophobicContact CD2-CD1 3.82Å; Y50-L58 HydrophobicContact CE1-CD1 4.41Å; Y50-L58 HydrophobicContact CE2-CD1 4.12Å; Y50-L58 HydrophobicContact CG-CD1 3.82Å; L52-L58 HydrophobicContact CD1-CB 3.86Å; L52-L58 HydrophobicContact CD1-CD2 4.06Å; L52-L58 HydrophobicContact CD1-CG 4.37Å; L58-L60 HydrophobicContact CD1-CD2 3.94Å; L58-L60 HydrophobicContact CD2-CD1 4.04Å; L58-L60 HydrophobicContact CD2-CD2 3.75Å; L58-L60 HydrophobicContact CD2-CG 3.86Å; L58-L60 HydrophobicContact CG-CD2 3.83Å; L58-L60 HydrophobicContact CG-CG 4.04Å; L58-R191 CarbonylContact O-C 3.56Å; L58-R191 WeakPolarHBondContact O-CA 3.33Å; L58-I192 HydrophobicContact CB-CB 4.2Å; L58-I192 HydrophobicContact CB-CD1 4.42Å; L58-I192 HydrophobicContact CB-CG1 4.48Å; L58-I192 HydrophobicContact CD2-CD1 3.82Å; L58-I192 HydrophobicContact CD2-CG1 4.5Å; L58-I192 PolarHBondContact N-O 2.8Å; L58-I192 PolarHBondContact O-N 2.89Å; L58-V217 HydrophobicContact CD2-CB 4.42Å; L58-V217 HydrophobicContact CD2-CG1 3.91Å; L58-V217 HydrophobicContact CD2-CG2 3.56Å
59	V	88.5	Confident	79.2	Confident	9 Å²	9	29.5 Å²	29.5	6%	0.055	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	115.5	173.3	173.5	0	0	0	0	110.4	L28 Y29 K30 S31 I189 R191	L28-V59 HydrophobicContact CD1-CG2 3.69Å; L28-V59 HydrophobicContact CD2-CB 3.71Å; L28-V59 HydrophobicContact CD2-CG2 3.38Å; L28-V59 HydrophobicContact CG-CB 4.15Å; L28-V59 HydrophobicContact CG-CG2 3.64Å; Y29-V59 PolarHBondContact O-N 3.37Å; K30-V59 WeakPolarHBondContact CA-O 3.46Å; S31-V59 PolarHBondContact N-O 2.99Å; V59-I189 HydrophobicContact CG1-CG2 3.55Å; V59-R191 HydrophobicContact CG1-CG 4.29Å; V59-R191 HydrophobicContact CG2-CB 3.92Å; V59-R191 HydrophobicContact CG2-CG 3.68Å
60	L	90.3	Very high	77	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	111.1	177.3	-57.6	-177.9	0	0	0	108.2	Y50 L58 I189 L190 Y203 W215 V217	Y50-L60 HydrophobicContact CD2-CD2 4.4Å; Y50-L60 HydrophobicContact CE2-CD2 4.09Å; L58-L60 HydrophobicContact CD1-CD2 3.94Å; L58-L60 HydrophobicContact CD2-CD1 4.04Å; L58-L60 HydrophobicContact CD2-CD2 3.75Å; L58-L60 HydrophobicContact CD2-CG 3.86Å; L58-L60 HydrophobicContact CG-CD2 3.83Å; L58-L60 HydrophobicContact CG-CG 4.04Å; L60-I189 CarbonylContact O-C 3.53Å; L60-I189 WeakPolarHBondContact O-CA 3.32Å; L60-L190 HydrophobicContact CB-CB 4.34Å; L60-L190 HydrophobicContact CD1-CD2 4.32Å; L60-L190 PolarHBondContact N-O 2.99Å; L60-L190 PolarHBondContact O-N 3.39Å; L60-Y203 HydrophobicContact CD1-CD1 4.25Å; L60-Y203 HydrophobicContact CD1-CD2 4.33Å; L60-Y203 HydrophobicContact CD1-CG 3.86Å; L60-W215 HydrophobicContact CB-CD2 4.24Å; L60-W215 HydrophobicContact CB-CE3 4.21Å; L60-W215 HydrophobicContact CB-CH2 4.2Å; L60-W215 HydrophobicContact CB-CZ2 4.24Å; L60-W215 HydrophobicContact CB-CZ3 4.19Å; L60-W215 HydrophobicContact CD1-CB 4.27Å; L60-W215 HydrophobicContact CD1-CD2 4.07Å; L60-W215 HydrophobicContact CD1-CE3 3.94Å; L60-W215 HydrophobicContact CD1-CG 4.23Å; L60-W215 HydrophobicContact CD2-CB 4.15Å; L60-W215 HydrophobicContact CD2-CD2 3.81Å; L60-W215 HydrophobicContact CD2-CE3 4.46Å; L60-W215 HydrophobicContact CD2-CG 3.64Å; L60-W215 HydrophobicContact CG-CD2 4.27Å; L60-W215 HydrophobicContact CG-CE3 4.44Å; L60-W215 HydrophobicContact CG-CG 4.46Å; L60-V217 HydrophobicContact CD1-CG2 4.44Å
61	S	88.8	Confident	74.4	Confident	7 Å²	7	43.1 Å²	43.1	5%	0.049	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	131.3	176.4	-174.5	0	0	0	0	109.9	S31 N63 R213 W215	S31-S61 PolarHBondContact OG-N 3.35Å; S31-S61 PolarHBondContact OG-O 3.35Å; S61-N63 VanDerWaalsContact CB-OD1 3.23Å; S61-N63 WeakPolarHBondContact CB-OD1 3.42Å; S61-N63 PolarHBondContact O-N 3.49Å; S61-N63 PolarHBondContact OG-N 3.14Å; S61-N63 PolarHBondContact OG-OD1 3.28Å; S61-R213 PolarHBondContact O-NH1 3.48Å; S61-W215 WeakPolarHBondContact O-CZ2 3.41Å
62	C	84.4	Confident	71.8	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.24	C	C	.	.			trans	-70.4	-22.9	171.6	-56.7	0	0	0	0	112.5	V64 L162 F164 N188 C205 I212	C62-V64 HydrophobicContact CB-CG2 3.84Å; C62-V64 PolarHBondContact O-N 3.2Å; C62-L162 HydrophobicContact CB-CD1 3.81Å; C62-F164 VanDerWaalsContact SG-CE1 3.53Å; C62-F164 WeakPolarHBondContact SG-CZ 3.11Å; C62-N188 HydrophobicContact CB-CB 4.26Å; C62-N188 PolarHBondContact N-O 2.98Å; C62-C205 HydrophobicContact CB-CB 4Å; C62-C205 WeakPolarHBondContact CB-SG 3.45Å; C62-C205 WeakPolarHBondContact SG-CB 3.46Å; C62-C205 CovalentContact SG-SG 2.02Å; C62-C205 PolarHBondContact SG-SG 3.4Å; C62-I212 HydrophobicContact CB-CD1 3.9Å
63	N	81.4	Confident	68.9	Low	12 Å²	12	56.7 Å²	56.7	6%	0.064	28%	0.279	C	S	.	.			trans	48.6	39	-176.7	-62.4	-28.1	0	0	0	114.7	S32 D33 I34 H35 F36 S61 R213	S32-N63 PolarHBondContact O-ND2 3.47Å; D33-N63 VanDerWaalsContact CA-ND2 3.35Å; D33-N63 WeakPolarHBondContact CA-ND2 3.43Å; I34-N63 VanDerWaalsContact O-CB 3.31Å; I34-N63 WeakPolarHBondContact O-CB 3.12Å; I34-N63 PolarHBondContact O-ND2 3.45Å; H35-N63 WeakPolarHBondContact CA-O 3.09Å; H35-N63 PolarHBondContact ND1-O 2.95Å; F36-N63 PolarHBondContact N-O 3.36Å; S61-N63 VanDerWaalsContact CB-OD1 3.23Å; S61-N63 WeakPolarHBondContact CB-OD1 3.42Å; S61-N63 PolarHBondContact O-N 3.49Å; S61-N63 PolarHBondContact OG-N 3.14Å; S61-N63 PolarHBondContact OG-OD1 3.28Å; N63-R213 PolarHBondContact ND2-NH1 2.02Å; N63-R213 PolarHBondContact ND2-NH2 3.22Å
64	V	74.9	Confident	66.2	Low	4 Å²	4	62 Å²	62	2%	0.024	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-71.6	146.3	173.8	-174.5	0	0	0	0	110.3	F36 C38 C62 S66 F69 L162 F207 I212	F36-V64 HydrophobicContact CB-CG2 4.43Å; F36-V64 HydrophobicContact CD1-CG1 4.28Å; F36-V64 HydrophobicContact CD1-CG2 4.49Å; C38-V64 WeakPolarHBondContact SG-CG1 3.44Å; C62-V64 HydrophobicContact CB-CG2 3.84Å; C62-V64 PolarHBondContact O-N 3.2Å; V64-S66 PolarHBondContact O-N 3.35Å; V64-F69 HydrophobicContact CB-CE2 4.04Å; V64-F69 HydrophobicContact CG1-CE2 3.85Å; V64-L162 HydrophobicContact CB-CD1 4.2Å; V64-L162 HydrophobicContact CG2-CD1 3.39Å; V64-F207 HydrophobicContact CG1-CD2 4.1Å; V64-F207 HydrophobicContact CG1-CE2 3.9Å; V64-F207 HydrophobicContact CG1-CZ 4.14Å; V64-F207 HydrophobicContact CG2-CD2 4.47Å; V64-I212 HydrophobicContact CG2-CD1 3.47Å; V64-I212 VanDerWaalsContact CG2-CD1 3.47Å
65	C	67.5	Low	63.6	Low	35 Å²	35	69.4 Å²	69.4	24%	0.236	34%	0.337	C	S	.	.			trans	-45.4	123.2	176.2	-60.2	0	0	0	0	111.1	F36 C38 E67 Y68	F36-C65 PolarHBondContact O-SG 3.47Å; C38-C65 HydrophobicContact CB-CB 4.39Å; C65-E67 PolarHBondContact O-N 3.04Å; C65-Y68 PolarHBondContact O-N 2.87Å
66	S	56.5	Low	61.3	Low	87 Å²	87	75.2 Å²	75.2	61%	0.608	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-62.3	-25.6	-178.4	54.2	0	0	0	0	113.2	V64 Y68 F69	V64-S66 PolarHBondContact O-N 3.35Å; S66-Y68 PolarHBondContact O-N 2.99Å; S66-F69 PolarHBondContact O-N 3.31Å
67	E	49.8	Very low	58.6	Low	157 Å²	157	83.7 Å²	83.7	73%	0.734	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-58.2	-29.4	-177.9	-68.1	-175	163	0	0	113.6	C65	C65-E67 PolarHBondContact O-N 3.04Å
68	Y	49.2	Very low	55.9	Low	138 Å²	138	86.4 Å²	86.4	54%	0.541	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-80.3	-13.3	178.1	-100.1	-89	0	0	0	114.6	C38 C65 S66	C38-Y68 HydrophobicContact CB-CD2 4.26Å; C38-Y68 HydrophobicContact CB-CE2 4.27Å; C65-Y68 PolarHBondContact O-N 2.87Å; S66-Y68 PolarHBondContact O-N 2.99Å
69	F	48.1	Very low	53	Low	59 Å²	59	92.4 Å²	92.4	26%	0.259	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-109	2.7	-174.4	-71.4	-81.5	0	0	0	114.2	V64 S66 D71 L162 F207	V64-F69 HydrophobicContact CB-CE2 4.04Å; V64-F69 HydrophobicContact CG1-CE2 3.85Å; S66-F69 PolarHBondContact O-N 3.31Å; F69-D71 PolarHBondContact O-N 2.94Å; F69-L162 HydrophobicContact CE1-CB 4.2Å; F69-L162 HydrophobicContact CZ-CB 3.69Å; F69-L162 HydrophobicContact CZ-CD1 4.07Å; F69-L162 HydrophobicContact CZ-CG 4.37Å; F69-F207 HydrophobicContact CE2-CE2 4.5Å; F69-F207 HydrophobicContact CZ-CE2 4.37Å
70	K	45.5	Very low	50.3	Low	167 Å²	167	96.3 Å²	96.3	73%	0.726	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-25.5	176.5	-76.2	-173.7	176.8	177.1	0	113.1
71	D	38.6	Very low	47.1	Very low	155 Å²	155	105.5 Å²	105.5	83%	0.829	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.7	17.1	-172.2	-62.2	-25.6	0	0	0	115	F69	F69-D71 PolarHBondContact O-N 2.94Å
72	K	37.8	Very low	44.3	Very low	116 Å²	116	111.2 Å²	111.2	50%	0.504	57%	0.574	S	S	.	*			trans	-122.5	93.5	174.4	-72.3	-170.1	178.9	-177.5	0	111.3	T74	K72-T74 PolarHBondContact O-N 3.48Å
73	E	31	Very low	41.4	Very low	179 Å²	179	117.7 Å²	117.7	84%	0.836	61%	0.608	S	S	*	*			trans	-39.9	134.2	163.2	-74.2	178.7	146.3	0	0	111	W75	E73-W75 PolarHBondContact O-N 2.94Å
74	T	32	Very low	38.8	Very low	117 Å²	117	123.6 Å²	123.6	72%	0.718	64%	0.639	S	S	*	*			trans	-31.1	117.6	172	44.3	0	0	0	0	113.8	K72 E76	K72-T74 PolarHBondContact O-N 3.48Å; T74-E76 PolarHBondContact O-N 2.99Å
75	W	33.8	Very low	36.3	Very low	201 Å²	201	132 Å²	132	76%	0.761	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	38.3	170.9	-70.3	83.5	0	0	0	113.6	E73	E73-W75 PolarHBondContact O-N 2.94Å
76	E	32.5	Very low	34.3	Very low	133 Å²	133	137 Å²	137	62%	0.621	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-13.8	173.8	-74.5	-161.4	151.9	0	0	113.1	T74	T74-E76 PolarHBondContact O-N 2.99Å
77	H	28.7	Very low	32.7	Very low	181 Å²	181	141.3 Å²	141.3	84%	0.838	71%	0.709	S	S	*	*	S	Bend	trans	-132.1	78.3	-176.9	-69.8	68	0	0	0	110.7
78	G	26.9	Very low	31.5	Very low	58 Å²	58	144.7 Å²	144.7	60%	0.598	72%	0.715	S	S	*	*			trans	-151.1	86	177.2	0	0	0	0	0	110.9	A80	G78-A80 PolarHBondContact O-N 3.48Å
79	S	27.4	Very low	30.4	Very low	126 Å²	126	143.3 Å²	143.3	88%	0.881	72%	0.723	S	S	*	*			trans	-58.7	78.9	169	51	0	0	0	0	111.7	K81	S79-K81 PolarHBondContact O-N 3.04Å
80	A	30.7	Very low	29.3	Very low	90 Å²	90	148.7 Å²	148.7	74%	0.744	75%	0.749	S	S	*	*			trans	-89.3	81	164	0	0	0	0	0	108.5	G78 N82	G78-A80 PolarHBondContact O-N 3.48Å; A80-N82 PolarHBondContact O-N 3.45Å
81	K	24.7	Very low	28.3	Very low	193 Å²	193	147.5 Å²	147.5	84%	0.839	76%	0.756	S	S	*	*			trans	-64.5	71.2	157.5	-86.5	-175.9	171.8	-179.6	0	108.6	S79	S79-K81 PolarHBondContact O-N 3.04Å
82	N	28.4	Very low	27.7	Very low	128 Å²	128	146.3 Å²	146.3	68%	0.684	75%	0.754	S	S	*	*			trans	-120.2	87.4	156	-80	-0.3	0	0	0	104.9	A80 L84	A80-N82 PolarHBondContact O-N 3.45Å; N82-L84 PolarHBondContact O-N 3.45Å
83	D	23.5	Very low	27	Very low	136 Å²	136	144.5 Å²	144.5	73%	0.727	77%	0.769	S	S	*	*			trans	-55.5	96.6	161.4	-71.1	-36.9	0	0	0	106.3	F85	D83-F85 HydrophobicContact CB-CD2 3.93Å; D83-F85 HydrophobicContact CB-CE2 4.03Å; D83-F85 PolarHBondContact O-N 2.7Å
84	L	26.8	Very low	26.6	Very low	135 Å²	135	139.2 Å²	139.2	71%	0.707	76%	0.763	S	S	*	*			trans	-75	80	176.2	-155.9	101.9	0	0	0	106.5	N82 I86	N82-L84 PolarHBondContact O-N 3.45Å; L84-I86 HydrophobicContact CD2-CG1 4.48Å; L84-I86 PolarHBondContact O-N 3.41Å; L84-I86 VanDerWaalsContact O-N 3.14Å
85	F	22.4	Very low	26.3	Very low	180 Å²	180	143.6 Å²	143.6	79%	0.789	78%	0.775	S	S	*	*			trans	-66.6	107.9	167.4	-90.6	-88.9	0	0	0	107.8	D83 Q87	D83-F85 HydrophobicContact CB-CD2 3.93Å; D83-F85 HydrophobicContact CB-CE2 4.03Å; D83-F85 PolarHBondContact O-N 2.7Å; F85-Q87 VanDerWaalsContact C-N 3.31Å; F85-Q87 PolarHBondContact O-N 2.97Å
86	I	26.4	Very low	26	Very low	141 Å²	141	137.3 Å²	137.3	72%	0.723	77%	0.772	S	S	*	*			trans	-71.8	92.9	167.4	-58.7	172.1	0	0	0	105.9	L84 R88	L84-I86 HydrophobicContact CD2-CG1 4.48Å; L84-I86 PolarHBondContact O-N 3.41Å; L84-I86 VanDerWaalsContact O-N 3.14Å; I86-R88 PolarHBondContact O-N 2.89Å; I86-R88 VanDerWaalsContact O-N 3.13Å
87	Q	22	Very low	25.6	Very low	177 Å²	177	139.9 Å²	139.9	83%	0.827	79%	0.789	S	S	*	*			trans	-64.2	113.5	169.2	-84.1	-175.8	-12	0	0	108.3	F85 P89	F85-Q87 VanDerWaalsContact C-N 3.31Å; F85-Q87 PolarHBondContact O-N 2.97Å; Q87-P89 WeakPolarHBondContact O-CD 3.31Å
88	R	24.6	Very low	25.4	Very low	228 Å²	228	135 Å²	135	86%	0.86	79%	0.788	S	S	*	*			trans	-64.2	123.5	160.8	-108.7	179.5	-174	152.9	2.3	106.4	I86 E90	I86-R88 PolarHBondContact O-N 2.89Å; I86-R88 VanDerWaalsContact O-N 3.13Å; R88-E90 PolarHBondContact O-N 2.93Å
89	P	27.2	Very low	25.4	Very low	110 Å²	110	137 Å²	137	71%	0.714	80%	0.798	S	S	*	*			trans	-66.4	112.5	166.6	26.1	-28.4	0	0	0	106.9	Q87 T91	Q87-P89 WeakPolarHBondContact O-CD 3.31Å; P89-T91 PolarHBondContact O-N 3.1Å
90	E	24.5	Very low	25.3	Very low	172 Å²	172	135.9 Å²	135.9	80%	0.804	79%	0.791	S	S	*	*			trans	-54.6	124.2	157	-77.5	-176.4	162	0	0	106.7	R88 T92	R88-E90 PolarHBondContact O-N 2.93Å; E90-T92 PolarHBondContact O-N 3.35Å
91	T	25.4	Very low	25.1	Very low	142 Å²	142	139.4 Å²	139.4	87%	0.871	80%	0.797	S	S	*	*			trans	-66.9	82.9	176.1	43.5	0	0	0	0	109	P89 G93	P89-T91 PolarHBondContact O-N 3.1Å; T91-G93 PolarHBondContact O-N 3.46Å
92	T	24.9	Very low	25.2	Very low	129 Å²	129	137.4 Å²	137.4	79%	0.791	79%	0.794	S	S	*	*			trans	-78.8	105.8	160.1	40.3	0	0	0	0	108	E90	E90-T92 PolarHBondContact O-N 3.35Å
93	G	22.5	Very low	25	Very low	79 Å²	79	138.7 Å²	138.7	81%	0.814	80%	0.801	S	S	*	*			trans	-64	159.4	164	0	0	0	0	0	111.9	T91	T91-G93 PolarHBondContact O-N 3.46Å
94	G	24.4	Very low	25	Very low	68 Å²	68	139.3 Å²	139.3	70%	0.701	80%	0.803	S	S	*	*			trans	138.5	89.5	176.8	0	0	0	0	0	108.8
95	Q	25	Very low	24.9	Very low	209 Å²	209	138 Å²	138	98%	0.977	81%	0.806	S	S	*	*				55.6	122.2	87.1	-73.5	-171.5	-5.6	0	0	114.1
96	G	26.2	Very low	25	Very low	68 Å²	68	134.1 Å²	134.1	70%	0.701	80%	0.796	S	S	*	*			trans	137.9	79.6	175.8	0	0	0	0	0	110.4
97	L	25.6	Very low	25.1	Very low	188 Å²	188	130.3 Å²	130.3	98%	0.984	79%	0.786	S	S	*	*				45	102.6	81	-91.8	141.3	0	0	0	112.5
98	G	24.9	Very low	25.6	Very low	78 Å²	78	127.9 Å²	127.9	80%	0.804	79%	0.785	S	S	*	*			trans	168.3	106.9	172.5	0	0	0	0	0	112
99	A	25	Very low	26.1	Very low	99 Å²	99	124.2 Å²	124.2	82%	0.818	77%	0.773	S	S	*	*			trans	-60.3	146.8	178.4	0	0	0	0	0	113.3
100	S	25.4	Very low	26.6	Very low	103 Å²	103	123.6 Å²	123.6	72%	0.72	77%	0.769	S	S	*	*				163	148.7	126.6	48	0	0	0	0	110.1	I102	S100-I102 PolarHBondContact O-N 2.92Å
101	D	26.9	Very low	27.4	Very low	165 Å²	165	121.3 Å²	121.3	88%	0.882	77%	0.767	S	S	*	*			trans	-52.9	103.9	-171.4	-57.8	-62.9	0	0	0	113.2
102	I	27.3	Very low	28.4	Very low	150 Å²	150	116.8 Å²	116.8	77%	0.769	74%	0.741	S	S	*	*			trans	-108.6	105.4	165.1	-59.8	172.6	0	0	0	106.1	S100 L104	S100-I102 PolarHBondContact O-N 2.92Å; I102-L104 PolarHBondContact O-N 2.93Å
103	N	23.5	Very low	29.7	Very low	155 Å²	155	115.6 Å²	115.6	83%	0.829	73%	0.729	S	S	*	*			trans	-21.8	102.5	165.9	-76.3	-32.2	0	0	0	111.3	S105	N103-S105 PolarHBondContact O-N 2.91Å
104	L	24.2	Very low	30.8	Very low	150 Å²	150	118.6 Å²	118.6	79%	0.785	72%	0.722	S	S	*	*			trans	-66.3	88.3	162.2	-98.9	92.4	0	0	0	106.1	I102 V106	I102-L104 PolarHBondContact O-N 2.93Å; L104-V106 HydrophobicContact CB-CG2 4.35Å; L104-V106 PolarHBondContact O-N 3.28Å
105	S	24	Very low	31.9	Very low	108 Å²	108	120.2 Å²	120.2	76%	0.755	71%	0.711	S	S	*	*			trans	-61	94.1	149.6	64.9	0	0	0	0	104.8	N103 A107	N103-S105 PolarHBondContact O-N 2.91Å; S105-A107 PolarHBondContact O-N 3.48Å
106	V	25.9	Very low	33.4	Very low	98 Å²	98	114.5 Å²	114.5	59%	0.594	69%	0.686	S	S	*	*			trans	-62.1	90.3	169	179.6	0	0	0	0	104.6	L104 Y109	L104-V106 HydrophobicContact CB-CG2 4.35Å; L104-V106 PolarHBondContact O-N 3.28Å; V106-Y109 HydrophobicContact CG1-CD2 4.06Å; V106-Y109 HydrophobicContact CG1-CE2 3.99Å
107	A	27.6	Very low	35	Very low	61 Å²	61	118.9 Å²	118.9	50%	0.504	68%	0.682	S	S	.	*			trans	-50.5	129.2	170.1	0	0	0	0	0	105.9	S105 Y109	S105-A107 PolarHBondContact O-N 3.48Å; A107-Y109 VanDerWaalsContact C-N 3.31Å; A107-Y109 WeakPolarHBondContact O-CD2 3.37Å; A107-Y109 PolarHBondContact O-N 3.1Å
108	P	32.8	Very low	36.2	Very low	125 Å²	125	111.7 Å²	111.7	81%	0.812	64%	0.644	S	S	*	*			trans	-60.1	98.9	-175.6	22.5	-31.3	0	0	0	107.9	P110	P108-P110 WeakPolarHBondContact O-CD 3.44Å
109	Y	35.1	Very low	37.7	Very low	151 Å²	151	115 Å²	115	59%	0.592	63%	0.632	S	S	*	*			trans	-62.7	124.4	177.5	-71.3	-78.8	0	0	0	106.5	V106 A107 T111	V106-Y109 HydrophobicContact CG1-CD2 4.06Å; V106-Y109 HydrophobicContact CG1-CE2 3.99Å; A107-Y109 VanDerWaalsContact C-N 3.31Å; A107-Y109 WeakPolarHBondContact O-CD2 3.37Å; A107-Y109 PolarHBondContact O-N 3.1Å; Y109-T111 PolarHBondContact O-N 3.04Å
110	P	37.5	Very low	39.3	Very low	98 Å²	98	114.8 Å²	114.8	64%	0.636	62%	0.616	S	S	*	*			trans	-61.6	111.5	178.8	21.2	-29.8	0	0	0	109.1	P108 S112	P108-P110 WeakPolarHBondContact O-CD 3.44Å; P110-S112 PolarHBondContact O-N 2.84Å; P110-S112 VanDerWaalsContact O-N 3.1Å
111	T	40.7	Very low	40.6	Very low	123 Å²	123	114.5 Å²	114.5	76%	0.755	60%	0.6	S	S	*	*			trans	-83	39.6	-178.3	51.3	0	0	0	0	111.8	Y109 L113	Y109-T111 PolarHBondContact O-N 3.04Å; T111-L113 PolarHBondContact O-N 2.84Å
112	S	47.4	Very low	41.8	Very low	47 Å²	47	113.8 Å²	113.8	33%	0.329	59%	0.589	S	S	.	*			trans	-70.2	135.7	172.2	92.2	0	0	0	0	109.1	P110 E114 H115 I116	P110-S112 PolarHBondContact O-N 2.84Å; P110-S112 VanDerWaalsContact O-N 3.1Å; S112-E114 PolarHBondContact O-N 3.11Å; S112-E114 VanDerWaalsContact O-N 3.1Å; S112-H115 PolarHBondContact O-N 2.75Å; S112-H115 PolarHBondContact OG-ND1 3.33Å; S112-I116 PolarHBondContact O-N 2.62Å
113	L	50.8	Low	43.1	Very low	105 Å²	105	115.3 Å²	115.3	55%	0.55	59%	0.585	S	S	.	*	H	α-helix	trans	-53.1	-33.1	-179	-172.6	73.7	0	0	0	112.1	T111 I116 R117	T111-L113 PolarHBondContact O-N 2.84Å; L113-I116 PolarHBondContact O-N 3.4Å; L113-R117 WeakPolarHBondContact O-CB 3.49Å; L113-R117 VanDerWaalsContact O-CG 3.3Å; L113-R117 WeakPolarHBondContact O-CG 3.48Å; L113-R117 PolarHBondContact O-N 2.66Å
114	E	46.1	Very low	44.6	Very low	141 Å²	141	113.1 Å²	113.1	66%	0.659	57%	0.572	S	S	*	*	H	α-helix	trans	-61.6	-43.6	174.9	-72.7	176.7	142.6	0	0	112.5	S112 R117 L118	S112-E114 PolarHBondContact O-N 3.11Å; S112-E114 VanDerWaalsContact O-N 3.1Å; E114-R117 PolarHBondContact O-N 3.36Å; E114-L118 WeakPolarHBondContact O-CB 3.21Å; E114-L118 PolarHBondContact O-N 3.27Å
115	H	47.4	Very low	45.5	Very low	103 Å²	103	112.6 Å²	112.6	48%	0.477	56%	0.56	S	S	.	*	H	α-helix	trans	-68	-38.7	179	-79	82.2	0	0	0	112.4	S112 R117 L118 R119	S112-H115 PolarHBondContact O-N 2.75Å; S112-H115 PolarHBondContact OG-ND1 3.33Å; H115-R117 VanDerWaalsContact C-N 3.35Å; H115-L118 PolarHBondContact O-N 2.93Å; H115-R119 WeakPolarHBondContact O-CB 3.47Å; H115-R119 PolarHBondContact O-N 2.9Å
116	I	56.9	Low	46.4	Very low	88 Å²	88	115.6 Å²	115.6	45%	0.451	56%	0.562	S	S	.	*	H	α-helix	trans	-61.7	-45.9	174.5	-64.2	174	0	0	0	110	S112 L113 L118 R119 L120	S112-I116 PolarHBondContact O-N 2.62Å; L113-I116 PolarHBondContact O-N 3.4Å; I116-L118 PolarHBondContact O-N 3.1Å; I116-R119 PolarHBondContact O-N 3.5Å; I116-L120 HydrophobicContact CG2-CD1 4.09Å; I116-L120 PolarHBondContact O-N 3.01Å
117	R	59.8	Low	47.2	Very low	161 Å²	161	118.1 Å²	118.1	61%	0.608	57%	0.572	S	S	*	*	H	α-helix	trans	-61.2	-43.4	176.9	-75.4	174.2	175.9	175.1	-0.9	112	L113 E114 H115 R119 L120 R121	L113-R117 WeakPolarHBondContact O-CB 3.49Å; L113-R117 VanDerWaalsContact O-CG 3.3Å; L113-R117 WeakPolarHBondContact O-CG 3.48Å; L113-R117 PolarHBondContact O-N 2.66Å; E114-R117 PolarHBondContact O-N 3.36Å; H115-R117 VanDerWaalsContact C-N 3.35Å; R117-R119 PolarHBondContact O-N 3.24Å; R117-L120 PolarHBondContact O-N 3.35Å; R117-R121 WeakPolarHBondContact O-CB 3.41Å; R117-R121 PolarHBondContact O-N 3.02Å
118	L	51.8	Low	47.8	Very low	37 Å²	37	118.4 Å²	118.4	19%	0.194	56%	0.564	C	S	.	*	H	α-helix	trans	-65.5	-38.3	179.4	-134.1	143.5	0	0	0	112	E114 H115 I116 R121 K122 Y139	E114-L118 WeakPolarHBondContact O-CB 3.21Å; E114-L118 PolarHBondContact O-N 3.27Å; H115-L118 PolarHBondContact O-N 2.93Å; I116-L118 PolarHBondContact O-N 3.1Å; L118-R121 PolarHBondContact O-N 2.94Å; L118-K122 PolarHBondContact O-N 3.48Å; L118-Y139 HydrophobicContact CD1-CD1 3.87Å; L118-Y139 HydrophobicContact CD1-CD2 4.46Å; L118-Y139 HydrophobicContact CD1-CE1 3.48Å; L118-Y139 VanDerWaalsContact CD1-CE1 3.48Å; L118-Y139 HydrophobicContact CD1-CE2 4.11Å; L118-Y139 HydrophobicContact CD1-CG 4.34Å
119	R	55.7	Low	48	Very low	148 Å²	148	117 Å²	117	56%	0.558	56%	0.557	S	S	*	*	H	α-helix	trans	-66.5	-43.6	175.2	-173.6	-177.6	-103.5	167	-5.8	111.9	H115 I116 R117 R121 K122 R123	H115-R119 WeakPolarHBondContact O-CB 3.47Å; H115-R119 PolarHBondContact O-N 2.9Å; I116-R119 PolarHBondContact O-N 3.5Å; R117-R119 PolarHBondContact O-N 3.24Å; R119-R121 VanDerWaalsContact C-N 3.32Å; R119-K122 PolarHBondContact O-N 2.95Å; R119-R123 PolarHBondContact O-N 3.32Å; R119-R123 VanDerWaalsContact O-N 3.09Å
120	L	59.3	Low	48.3	Very low	93 Å²	93	117.7 Å²	117.7	49%	0.487	57%	0.57	S	S	.	*	H	α-helix	trans	-59.8	-44.3	172.8	-84.8	159	0	0	0	110.8	I116 R117 K122 R123 I124	I116-L120 HydrophobicContact CG2-CD1 4.09Å; I116-L120 PolarHBondContact O-N 3.01Å; R117-L120 PolarHBondContact O-N 3.35Å; L120-K122 PolarHBondContact O-N 2.97Å; L120-R123 PolarHBondContact O-N 2.69Å; L120-I124 HydrophobicContact CB-CD1 4.45Å; L120-I124 WeakPolarHBondContact O-CD1 3.46Å; L120-I124 WeakPolarHBondContact O-CG1 3.36Å; L120-I124 PolarHBondContact O-N 3.31Å
121	R	52.3	Low	48.5	Very low	98 Å²	98	115 Å²	115	37%	0.37	55%	0.551	S	S	.	*	H	α-helix	trans	-61	-45.2	178.7	-145.4	176.2	-159.3	174.3	6.6	112.1	R117 L118 R119 R123 W125 E328 E329	R117-R121 WeakPolarHBondContact O-CB 3.41Å; R117-R121 PolarHBondContact O-N 3.02Å; L118-R121 PolarHBondContact O-N 2.94Å; R119-R121 VanDerWaalsContact C-N 3.32Å; R121-R123 VanDerWaalsContact C-N 3.34Å; R121-R123 PolarHBondContact O-N 2.92Å; R121-W125 VanDerWaalsContact O-CD1 3.32Å; R121-W125 PolarHBondContact O-N 2.8Å; R121-E328 IonicContact NH2-OE2 3.7Å; R121-E328 PolarHBondContact NH2-OE2 3.43Å; R121-E329 IonicContact CZ-OE1 3.53Å; R121-E329 VanDerWaalsContact NH1-CG 3.32Å; R121-E329 IonicContact NH1-OE1 2.79Å; R121-E329 PolarHBondContact NH1-OE1 2.83Å
122	K	50.9	Low	48.5	Very low	149 Å²	149	113.3 Å²	113.3	65%	0.648	54%	0.544	S	S	*	.	H	α-helix	trans	-63.3	-34.8	175.2	-77.6	-176	178.4	178.9	0	113.3	L118 R119 L120	L118-K122 PolarHBondContact O-N 3.48Å; R119-K122 PolarHBondContact O-N 2.95Å; L120-K122 PolarHBondContact O-N 2.97Å
123	R	54.5	Low	48.3	Very low	182 Å²	182	114.8 Å²	114.8	69%	0.687	55%	0.554	S	S	*	*	H	α-helix	trans	-75.7	-39.5	179.2	-78.1	-176.1	178	-177.5	-1.1	113	R119 L120 R121 W125	R119-R123 PolarHBondContact O-N 3.32Å; R119-R123 VanDerWaalsContact O-N 3.09Å; L120-R123 PolarHBondContact O-N 2.69Å; R121-R123 VanDerWaalsContact C-N 3.34Å; R121-R123 PolarHBondContact O-N 2.92Å; R123-W125 VanDerWaalsContact C-N 3.35Å
124	I	55.7	Low	47.6	Very low	109 Å²	109	111.1 Å²	111.1	56%	0.559	54%	0.539	S	S	*	.	H	α-helix	trans	-72.7	-31.6	-177.6	-64.3	164.5	0	0	0	110.9	L120	L120-I124 HydrophobicContact CB-CD1 4.45Å; L120-I124 WeakPolarHBondContact O-CD1 3.46Å; L120-I124 WeakPolarHBondContact O-CG1 3.36Å; L120-I124 PolarHBondContact O-N 3.31Å
125	W	43.7	Very low	47.2	Very low	140 Å²	140	106.8 Å²	106.8	53%	0.53	52%	0.52	S	S	.	.			trans	-120.3	73.6	-170.6	-56.3	100.3	0	0	0	112.5	R121 R123 N127 I128	R121-W125 VanDerWaalsContact O-CD1 3.32Å; R121-W125 PolarHBondContact O-N 2.8Å; R123-W125 VanDerWaalsContact C-N 3.35Å; W125-N127 PolarHBondContact O-N 2.87Å; W125-I128 HydrophobicContact CB-CD1 3.43Å; W125-I128 VanDerWaalsContact CB-CD1 3.43Å; W125-I128 HydrophobicContact CB-CG1 3.95Å; W125-I128 HydrophobicContact CG-CD1 4.13Å
126	Q	43	Very low	46.7	Very low	170 Å²	170	105.1 Å²	105.1	79%	0.794	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-20.5	179.7	-70.1	-178.9	-14.1	0	0	114.2	I128	Q126-I128 PolarHBondContact O-N 2.76Å
127	N	42	Very low	45.9	Very low	152 Å²	152	101.2 Å²	101.2	81%	0.813	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	13.4	-176.8	-93.5	-13.5	0	0	0	115.6	W125 S129	W125-N127 PolarHBondContact O-N 2.87Å; N127-S129 PolarHBondContact O-N 3.04Å
128	I	40.3	Very low	45.1	Very low	66 Å²	66	94.5 Å²	94.5	34%	0.338	47%	0.474	S	S	.	.	G	3₁₀ helix	trans	-83	8.5	178.5	-68.2	-180	0	0	0	112.4	W125 Q126 L130 L131	W125-I128 HydrophobicContact CB-CD1 3.43Å; W125-I128 VanDerWaalsContact CB-CD1 3.43Å; W125-I128 HydrophobicContact CB-CG1 3.95Å; W125-I128 HydrophobicContact CG-CD1 4.13Å; Q126-I128 PolarHBondContact O-N 2.76Å; I128-L130 PolarHBondContact O-N 3.47Å; I128-L131 HydrophobicContact CG2-CB 3.52Å; I128-L131 HydrophobicContact CG2-CD2 4.15Å; I128-L131 HydrophobicContact CG2-CG 4.31Å; I128-L131 VanDerWaalsContact O-CB 3.31Å; I128-L131 WeakPolarHBondContact O-CB 3.49Å; I128-L131 PolarHBondContact O-N 2.85Å
129	S	38.1	Very low	44.5	Very low	95 Å²	95	96.8 Å²	96.8	66%	0.664	48%	0.481	S	S	*	.	G	3₁₀ helix	trans	-57	-23	176.2	55.6	0	0	0	0	114.2	N127 L131	N127-S129 PolarHBondContact O-N 3.04Å; S129-L131 VanDerWaalsContact C-N 3.3Å; S129-L131 PolarHBondContact O-N 2.67Å
130	L	40.2	Very low	43.6	Very low	166 Å²	166	92.6 Å²	92.6	87%	0.869	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-74.8	-11.3	173	-90	148.4	0	0	0	114.6	I128	I128-L130 PolarHBondContact O-N 3.47Å
131	L	41.6	Very low	42.3	Very low	43 Å²	43	92.8 Å²	92.8	23%	0.225	47%	0.474	C	S	.	.	G	3₁₀ helix	trans	-98.2	13.8	-171.2	-126.8	98.4	0	0	0	113.9	I128 S129 S133 L135 V325 E326	I128-L131 HydrophobicContact CG2-CB 3.52Å; I128-L131 HydrophobicContact CG2-CD2 4.15Å; I128-L131 HydrophobicContact CG2-CG 4.31Å; I128-L131 VanDerWaalsContact O-CB 3.31Å; I128-L131 WeakPolarHBondContact O-CB 3.49Å; I128-L131 PolarHBondContact O-N 2.85Å; S129-L131 VanDerWaalsContact C-N 3.3Å; S129-L131 PolarHBondContact O-N 2.67Å; L131-S133 VanDerWaalsContact C-N 3.27Å; L131-S133 PolarHBondContact O-N 3.2Å; L131-S133 VanDerWaalsContact O-N 3.1Å; L131-L135 HydrophobicContact CD2-CD1 3.92Å; L131-V325 HydrophobicContact CD1-CG1 4.14Å; L131-V325 HydrophobicContact CD2-CG1 4.19Å; L131-E326 HydrophobicContact CD1-CG 4.48Å
132	S	41.6	Very low	41.3	Very low	87 Å²	87	90.4 Å²	90.4	61%	0.608	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-3.3	-164.3	72.9	0	0	0	0	116.3	P136	S132-P136 WeakPolarHBondContact O-CD 3.41Å; S132-P136 WeakPolarHBondContact O-CG 3.3Å
133	S	42.6	Very low	40.2	Very low	78 Å²	78	91.5 Å²	91.5	55%	0.545	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-27.8	-174.9	63.4	0	0	0	0	114.6	L131	L131-S133 VanDerWaalsContact C-N 3.27Å; L131-S133 PolarHBondContact O-N 3.2Å; L131-S133 VanDerWaalsContact O-N 3.1Å
134	A	36.5	Very low	38.9	Very low	27 Å²	27	88.5 Å²	88.5	22%	0.223	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-34.5	-172.8	0	0	0	0	0	114.7	L137	A134-L137 VanDerWaalsContact O-CB 3.24Å; A134-L137 WeakPolarHBondContact O-CB 3.25Å; A134-L137 PolarHBondContact O-N 3.17Å; A134-L137 VanDerWaalsContact O-N 3.16Å
135	L	37.8	Very low	37.4	Very low	51 Å²	51	92.7 Å²	92.7	27%	0.267	50%	0.499	S	S	.	.	H	α-helix	trans	-66	-39.5	179.6	-101.4	85.4	0	0	0	114.1	L131 L137 L138 Y139	L131-L135 HydrophobicContact CD2-CD1 3.92Å; L135-L137 PolarHBondContact O-N 3.14Å; L135-L138 PolarHBondContact O-N 2.95Å; L135-Y139 PolarHBondContact O-N 3.16Å; L135-Y139 VanDerWaalsContact O-N 3.14Å
136	P	35.3	Very low	36.7	Very low	67 Å²	67	88.9 Å²	88.9	44%	0.435	50%	0.497	S	S	.	.	H	α-helix	trans	-61.4	-29.6	172.9	-24.1	36.1	0	0	0	112	S132 L138 D140	S132-P136 WeakPolarHBondContact O-CD 3.41Å; S132-P136 WeakPolarHBondContact O-CG 3.3Å; P136-L138 PolarHBondContact O-N 2.98Å; P136-D140 VanDerWaalsContact O-CB 3.3Å; P136-D140 WeakPolarHBondContact O-CB 3.17Å; P136-D140 PolarHBondContact O-N 3.06Å
137	L	42.1	Very low	35.8	Very low	7 Å²	7	88.6 Å²	88.6	4%	0.037	50%	0.495	C	S	.	.	H	α-helix	trans	-59.8	-31.9	177.5	-66.1	168.8	0	0	0	112.4	A134 L135 T167 K168 I202 R204 L345	A134-L137 VanDerWaalsContact O-CB 3.24Å; A134-L137 WeakPolarHBondContact O-CB 3.25Å; A134-L137 PolarHBondContact O-N 3.17Å; A134-L137 VanDerWaalsContact O-N 3.16Å; L135-L137 PolarHBondContact O-N 3.14Å; L137-T167 HydrophobicContact CD2-CG2 3.51Å; L137-K168 VanDerWaalsContact CD2-C 3.42Å; L137-K168 WeakPolarHBondContact CD2-O 3.3Å; L137-I202 HydrophobicContact CB-CD1 4.08Å; L137-R204 PolarHBondContact O-NH1 3.29Å; L137-R204 PolarHBondContact O-NH2 2.66Å; L137-L345 HydrophobicContact CD1-CD2 4.22Å
138	L	40.9	Very low	35.2	Very low	19 Å²	19	88 Å²	88	10%	0.099	50%	0.497	C	S	.	.	H	α-helix	trans	-94.8	-42	-173.3	-62.9	156.4	0	0	0	112.2	L135 P136 I202 R204 V330 L333 F334	L135-L138 PolarHBondContact O-N 2.95Å; P136-L138 PolarHBondContact O-N 2.98Å; L138-I202 HydrophobicContact CD2-CD1 3.77Å; L138-I202 HydrophobicContact CG-CD1 4.44Å; L138-R204 PolarHBondContact O-NH2 3.19Å; L138-V330 HydrophobicContact CD1-CB 4.43Å; L138-V330 HydrophobicContact CD1-CG1 3.16Å; L138-V330 HydrophobicContact CD2-CG1 3.69Å; L138-V330 HydrophobicContact CG-CG1 3.9Å; L138-L333 HydrophobicContact CB-CD1 4.34Å; L138-L333 HydrophobicContact CD2-CD1 3.78Å; L138-L333 HydrophobicContact CG-CD1 4.41Å; L138-F334 HydrophobicContact CD2-CE2 4.49Å
139	Y	39.5	Very low	34.7	Very low	86 Å²	86	86.6 Å²	86.6	34%	0.337	49%	0.492	S	S	.	.	H	α-helix	trans	-110.1	18.3	-171	-64.6	-76.3	0	0	0	114.2	L118 L135 V141 E329	L118-Y139 HydrophobicContact CD1-CD1 3.87Å; L118-Y139 HydrophobicContact CD1-CD2 4.46Å; L118-Y139 HydrophobicContact CD1-CE1 3.48Å; L118-Y139 VanDerWaalsContact CD1-CE1 3.48Å; L118-Y139 HydrophobicContact CD1-CE2 4.11Å; L118-Y139 HydrophobicContact CD1-CG 4.34Å; L135-Y139 PolarHBondContact O-N 3.16Å; L135-Y139 VanDerWaalsContact O-N 3.14Å; Y139-V141 PolarHBondContact O-N 3.32Å; Y139-E329 WeakPolarHBondContact CE2-OE2 3.46Å
140	D	38.1	Very low	34.2	Very low	59 Å²	59	86.1 Å²	86.1	32%	0.316	49%	0.486	S	S	.	.			trans	-69	50.6	154.5	-149.4	13	0	0	0	109.6	P136 G142 T173	P136-D140 VanDerWaalsContact O-CB 3.3Å; P136-D140 WeakPolarHBondContact O-CB 3.17Å; P136-D140 PolarHBondContact O-N 3.06Å; D140-G142 PolarHBondContact O-N 3.34Å; D140-G142 VanDerWaalsContact O-N 3.11Å; D140-T173 WeakPolarHBondContact CB-OG1 2.93Å; D140-T173 WeakPolarHBondContact OD2-CB 3.07Å; D140-T173 PolarHBondContact OD2-N 3.27Å; D140-T173 PolarHBondContact OD2-OG1 3.19Å
141	V	32.4	Very low	33.9	Very low	97 Å²	97	86 Å²	86	59%	0.588	48%	0.481	S	S	*	.	S	Bend	trans	-59.1	103.3	144.9	-174.8	0	0	0	0	102	Y139 H143	Y139-V141 PolarHBondContact O-N 3.32Å; V141-H143 VanDerWaalsContact C-N 3.31Å; V141-H143 PolarHBondContact O-N 2.99Å
142	G	30.5	Very low	33.6	Very low	49 Å²	49	87.3 Å²	87.3	51%	0.505	50%	0.499	S	S	.	.			trans	-43.7	96.5	-170.1	0	0	0	0	0	111.8	D140 L144	D140-G142 PolarHBondContact O-N 3.34Å; D140-G142 VanDerWaalsContact O-N 3.11Å; G142-L144 PolarHBondContact O-N 3.49Å
143	H	26.9	Very low	33.1	Very low	171 Å²	171	87 Å²	87	79%	0.792	49%	0.49	S	S	*	.			trans	-72.5	65.8	140.7	-70.2	-52.8	0	0	0	105.2	V141 K145	V141-H143 VanDerWaalsContact C-N 3.31Å; V141-H143 PolarHBondContact O-N 2.99Å; H143-K145 PolarHBondContact O-N 3.31Å
144	L	27.2	Very low	32.7	Very low	120 Å²	120	88 Å²	88	63%	0.628	49%	0.488	S	S	*	.				-37.8	102.4	119.9	-79.2	148.6	0	0	0	103.8	G142 A146	G142-L144 PolarHBondContact O-N 3.49Å; L144-A146 HydrophobicContact CB-CB 4.5Å; L144-A146 PolarHBondContact O-N 3.25Å
145	K	25.4	Very low	32.5	Very low	197 Å²	197	95.4 Å²	95.4	86%	0.857	52%	0.516	S	S	*	.			trans	-56.5	80.2	136	-85.1	-176.5	174	-176.5	0	103.1	H143 E147	H143-K145 PolarHBondContact O-N 3.31Å; K145-E147 PolarHBondContact O-N 3.04Å
146	A	28.4	Very low	32.4	Very low	59 Å²	59	96.6 Å²	96.6	49%	0.488	53%	0.533	S	S	.	.			trans	-55	96.6	148.5	0	0	0	0	0	100.6	L144 V148	L144-A146 HydrophobicContact CB-CB 4.5Å; L144-A146 PolarHBondContact O-N 3.25Å; A146-V148 PolarHBondContact O-N 2.53Å; A146-V148 VanDerWaalsContact O-N 3.13Å
147	E	24.7	Very low	32.4	Very low	164 Å²	164	99.5 Å²	99.5	77%	0.766	54%	0.535	S	S	*	.			trans	-29	119.7	133.5	-158.3	168.7	-144.2	0	0	105.6	K145 T149	K145-E147 PolarHBondContact O-N 3.04Å; E147-T149 PolarHBondContact O-N 2.9Å; E147-T149 PolarHBondContact O-OG1 3.28Å
148	V	28.2	Very low	32.3	Very low	140 Å²	140	106.4 Å²	106.4	85%	0.848	57%	0.572	S	S	*	*			trans	-62.2	80.8	-175	178	0	0	0	0	106.1	A146 P150	A146-V148 PolarHBondContact O-N 2.53Å; A146-V148 VanDerWaalsContact O-N 3.13Å; V148-P150 WeakPolarHBondContact O-CD 3.24Å
149	T	29.8	Very low	32.5	Very low	37 Å²	37	110 Å²	110	23%	0.227	59%	0.591	C	S	.	*			trans	-75	118.3	176.5	35.2	0	0	0	0	104	E147 D153	E147-T149 PolarHBondContact O-N 2.9Å; E147-T149 PolarHBondContact O-OG1 3.28Å; T149-D153 HydrophobicContact CG2-CB 4.49Å
150	P	28.1	Very low	33.1	Very low	85 Å²	85	108.6 Å²	108.6	55%	0.552	59%	0.594	S	S	*	*			trans	-54.2	152.4	-174.7	19.4	-29.8	0	0	0	110.7	V148 A152 D153	V148-P150 WeakPolarHBondContact O-CD 3.24Å; P150-A152 PolarHBondContact O-N 3.38Å; P150-D153 PolarHBondContact O-N 3.3Å
151	E	34.2	Very low	34.6	Very low	162 Å²	162	107 Å²	107	76%	0.757	59%	0.589	S	S	*	*	H	α-helix	trans	-47.2	-25.2	-174.3	-80.7	-177.3	140.3	0	0	115.2	D153 L154 K155	E151-D153 VanDerWaalsContact C-N 3.32Å; E151-D153 PolarHBondContact O-N 3.15Å; E151-L154 PolarHBondContact O-N 2.89Å; E151-K155 PolarHBondContact O-N 2.93Å; E151-K155 VanDerWaalsContact O-N 3.12Å
152	A	35	Very low	36.8	Very low	72 Å²	72	103.5 Å²	103.5	60%	0.595	57%	0.567	S	S	*	*	H	α-helix	trans	-58.6	-40	173	0	0	0	0	0	112.9	P150 K155 A156	P150-A152 PolarHBondContact O-N 3.38Å; A152-K155 PolarHBondContact O-N 3.26Å; A152-A156 PolarHBondContact O-N 2.9Å; A152-A156 VanDerWaalsContact O-N 3.14Å
153	D	32.1	Very low	39.3	Very low	79 Å²	79	104.2 Å²	104.2	42%	0.422	56%	0.555	S	S	.	*	H	α-helix	trans	-79.5	-26.2	179.8	-72	-24.1	0	0	0	112.6	T149 P150 E151 A156 R157	T149-D153 HydrophobicContact CG2-CB 4.49Å; P150-D153 PolarHBondContact O-N 3.3Å; E151-D153 VanDerWaalsContact C-N 3.32Å; E151-D153 PolarHBondContact O-N 3.15Å; D153-A156 PolarHBondContact O-N 2.99Å; D153-R157 PolarHBondContact O-N 3.37Å
154	L	34.2	Very low	42.2	Very low	99 Å²	99	96.2 Å²	96.2	52%	0.518	52%	0.518	S	S	.	.	H	α-helix	trans	-69.4	-35.3	171.1	-82.4	164.8	0	0	0	111.8	E151	E151-L154 PolarHBondContact O-N 2.89Å
155	K	32.5	Very low	45	Very low	184 Å²	184	90.9 Å²	90.9	80%	0.8	49%	0.49	S	S	*	.	H	α-helix	trans	-70.9	-31.4	171.1	-74.6	-179.2	179.6	174.7	0	112.5	E151 A152	E151-K155 PolarHBondContact O-N 2.93Å; E151-K155 VanDerWaalsContact O-N 3.12Å; A152-K155 PolarHBondContact O-N 3.26Å
156	A	35.3	Very low	48	Very low	76 Å²	76	82 Å²	82	63%	0.628	45%	0.453	S	S	*	.	H	α-helix	trans	-76.7	-25.8	176.4	0	0	0	0	0	113.3	A152 D153 N158	A152-A156 PolarHBondContact O-N 2.9Å; A152-A156 VanDerWaalsContact O-N 3.14Å; D153-A156 PolarHBondContact O-N 2.99Å; A156-N158 VanDerWaalsContact C-N 3.25Å; A156-N158 PolarHBondContact O-N 2.91Å
157	R	35.3	Very low	50.8	Low	127 Å²	127	79.3 Å²	79.3	48%	0.479	43%	0.43	S	S	.	.			trans	-72.5	85	166.7	-80	-173.7	178.6	177.5	3.6	109.3	D153 L159	D153-R157 PolarHBondContact O-N 3.37Å; R157-L159 HydrophobicContact CB-CG 4.22Å; R157-L159 PolarHBondContact O-N 2.95Å
158	N	40	Very low	53.8	Low	153 Å²	153	73.9 Å²	73.9	82%	0.818	40%	0.404	S	S	*	.			trans	-60.5	71.2	153.2	-118.6	-23.1	0	0	0	107.7	A156 S160	A156-N158 VanDerWaalsContact C-N 3.25Å; A156-N158 PolarHBondContact O-N 2.91Å; N158-S160 PolarHBondContact O-N 2.87Å
159	L	43.9	Very low	56.2	Low	94 Å²	94	70.5 Å²	70.5	49%	0.492	38%	0.384	S	S	.	.			trans	-53.4	110.4	175.6	-76.7	163.5	0	0	0	105.6	R157 A161	R157-L159 HydrophobicContact CB-CG 4.22Å; R157-L159 PolarHBondContact O-N 2.95Å; L159-A161 PolarHBondContact O-N 2.99Å
160	S	52.6	Low	58.5	Low	56 Å²	56	71.8 Å²	71.8	39%	0.392	41%	0.405	S	S	.	.			trans	-38.7	116.1	177.2	-53.4	0	0	0	0	108.8	N158 L162	N158-S160 PolarHBondContact O-N 2.87Å; S160-L162 PolarHBondContact O-N 3.08Å
161	A	70.2	Confident	61	Low	27 Å²	27	72.3 Å²	72.3	22%	0.223	40%	0.4	C	S	.	.	S	Bend	trans	-54.6	-26.7	-161.6	0	0	0	0	0	113.3	L159 F207 K208	L159-A161 PolarHBondContact O-N 2.99Å; A161-F207 HydrophobicContact CB-CE2 4.18Å; A161-F207 CarbonylContact O-C 3.48Å; A161-F207 WeakPolarHBondContact O-CA 3.5Å; A161-F207 WeakPolarHBondContact O-CD2 3.43Å; A161-K208 PolarHBondContact O-N 3.16Å
162	L	78.8	Confident	63.2	Low	22 Å²	22	68.4 Å²	68.4	12%	0.115	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	133.8	175.7	-175.5	130.9	0	0	0	110.8	C62 V64 F69 S160 F164 G187 N188 I206 F207	C62-L162 HydrophobicContact CB-CD1 3.81Å; V64-L162 HydrophobicContact CB-CD1 4.2Å; V64-L162 HydrophobicContact CG2-CD1 3.39Å; F69-L162 HydrophobicContact CE1-CB 4.2Å; F69-L162 HydrophobicContact CZ-CB 3.69Å; F69-L162 HydrophobicContact CZ-CD1 4.07Å; F69-L162 HydrophobicContact CZ-CG 4.37Å; S160-L162 PolarHBondContact O-N 3.08Å; L162-F164 HydrophobicContact CD2-CE2 4.1Å; L162-G187 WeakPolarHBondContact CD2-O 3.49Å; L162-N188 HydrophobicContact CD1-CB 4.47Å; L162-N188 HydrophobicContact CD2-CB 4.31Å; L162-I206 VanDerWaalsContact CA-O 3.32Å; L162-I206 WeakPolarHBondContact CA-O 3.28Å; L162-F207 HydrophobicContact CB-CD2 4.08Å; L162-F207 HydrophobicContact CD1-CD2 4.1Å
163	Y	82.4	Confident	65.4	Low	65 Å²	65	66.7 Å²	66.7	26%	0.255	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	159.9	172.2	62.9	-85.2	0	0	0	111.7	T165 V175 I206	Y163-T165 HydrophobicContact CD2-CG2 3.82Å; Y163-T165 HydrophobicContact CE2-CG2 3.63Å; Y163-V175 HydrophobicContact CD2-CG1 4.1Å; Y163-I206 HydrophobicContact CD1-CB 4.32Å; Y163-I206 HydrophobicContact CD1-CG2 4.42Å; Y163-I206 HydrophobicContact CD2-CB 4.31Å; Y163-I206 HydrophobicContact CD2-CD1 4.44Å; Y163-I206 HydrophobicContact CE1-CB 3.89Å; Y163-I206 HydrophobicContact CE1-CG2 3.6Å; Y163-I206 HydrophobicContact CE2-CB 3.9Å; Y163-I206 HydrophobicContact CE2-CD1 3.57Å; Y163-I206 HydrophobicContact CE2-CG1 4.24Å; Y163-I206 HydrophobicContact CE2-CG2 4.23Å; Y163-I206 VanDerWaalsContact CZ-CG2 3.49Å; Y163-I206 PolarHBondContact N-O 2.85Å; Y163-I206 PolarHBondContact O-N 2.82Å; Y163-I206 WeakPolarHBondContact OH-CG2 3.32Å
164	F	87.3	Confident	67.7	Low	2 Å²	2	67.6 Å²	67.6	1%	0.009	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	144.5	176.1	-70.3	-98.1	0	0	0	110.9	C62 L162 I176 L185 L190 R204 C205 W215	C62-F164 VanDerWaalsContact SG-CE1 3.53Å; C62-F164 WeakPolarHBondContact SG-CZ 3.11Å; L162-F164 HydrophobicContact CD2-CE2 4.1Å; F164-I176 HydrophobicContact CB-CB 4.19Å; F164-I176 HydrophobicContact CB-CD1 4.09Å; F164-I176 PolarHBondContact O-N 2.88Å; F164-L185 HydrophobicContact CD2-CD1 3.41Å; F164-L185 VanDerWaalsContact CD2-CD1 3.41Å; F164-L185 HydrophobicContact CE2-CD1 3.58Å; F164-L185 HydrophobicContact CG-CD1 4.34Å; F164-L190 HydrophobicContact CD1-CB 3.9Å; F164-L190 HydrophobicContact CD1-CD2 4.09Å; F164-L190 HydrophobicContact CD2-CB 4.42Å; F164-L190 HydrophobicContact CE1-CB 3.67Å; F164-L190 HydrophobicContact CE2-CB 4.22Å; F164-L190 HydrophobicContact CG-CB 4.25Å; F164-L190 HydrophobicContact CG-CD2 4.44Å; F164-L190 HydrophobicContact CZ-CB 3.82Å; F164-R204 CarbonylContact C-O 3.59Å; F164-R204 VanDerWaalsContact CA-O 3.28Å; F164-R204 WeakPolarHBondContact CA-O 3.14Å; F164-C205 HydrophobicContact CD1-CB 4.29Å; F164-C205 HydrophobicContact CE1-CB 4.15Å; F164-W215 HydrophobicContact CD1-CZ3 4.17Å; F164-W215 HydrophobicContact CE1-CH2 4.08Å; F164-W215 AromaticContact CE1-CZ3 3.85Å; F164-W215 HydrophobicContact CE1-CZ3 3.85Å
165	T	86.9	Confident	70	Confident	8 Å²	8	66.3 Å²	66.3	5%	0.049	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	152.3	169.8	64.3	0	0	0	0	110.8	Y163 T173 F174 V175 Y203 R204 I206	Y163-T165 HydrophobicContact CD2-CG2 3.82Å; Y163-T165 HydrophobicContact CE2-CG2 3.63Å; T165-T173 HydrophobicContact CG2-CG2 4.26Å; T165-F174 CarbonylContact C-O 3.48Å; T165-F174 WeakPolarHBondContact CA-O 3.08Å; T165-V175 HydrophobicContact CG2-CG2 4.16Å; T165-Y203 CarbonylContact O-C 3.57Å; T165-Y203 VanDerWaalsContact O-CA 3.3Å; T165-Y203 WeakPolarHBondContact O-CA 3.43Å; T165-R204 PolarHBondContact N-O 2.94Å; T165-R204 PolarHBondContact O-N 3.34Å; T165-R204 WeakPolarHBondContact OG1-CB 3.48Å; T165-I206 HydrophobicContact CG2-CD1 3.83Å
166	V	87.7	Confident	72.4	Confident	12 Å²	12	58.8 Å²	58.8	7%	0.073	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	132.2	172.1	60.9	0	0	0	0	110.2	K168 T173 F174 I176 I202 Y203	V166-K168 HydrophobicContact CG2-CG 4.13Å; V166-T173 WeakPolarHBondContact O-CA 3.39Å; V166-F174 HydrophobicContact CG1-CB 4.34Å; V166-F174 PolarHBondContact N-O 2.83Å; V166-F174 PolarHBondContact O-N 2.91Å; V166-I176 HydrophobicContact CB-CD1 4.06Å; V166-I176 HydrophobicContact CB-CG1 4.39Å; V166-I176 HydrophobicContact CG1-CD1 4.1Å; V166-I176 HydrophobicContact CG1-CG1 3.94Å; V166-I202 CarbonylContact C-O 3.55Å; V166-I202 WeakPolarHBondContact CA-O 3.35Å; V166-Y203 HydrophobicContact CB-CD1 3.93Å; V166-Y203 HydrophobicContact CB-CE1 3.9Å; V166-Y203 HydrophobicContact CB-CG 4.49Å; V166-Y203 HydrophobicContact CG2-CD1 3.95Å; V166-Y203 HydrophobicContact CG2-CD2 4.26Å; V166-Y203 HydrophobicContact CG2-CE1 3.66Å; V166-Y203 HydrophobicContact CG2-CE2 3.97Å; V166-Y203 HydrophobicContact CG2-CG 4.25Å
167	T	87	Confident	74.2	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.006	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	112.6	171.3	-36.8	0	0	0	0	108.5	L137 T173 G201 I202 R204	L137-T167 HydrophobicContact CD2-CG2 3.51Å; T167-T173 WeakPolarHBondContact CG2-OG1 3.26Å; T167-T173 WeakPolarHBondContact OG1-CG2 3.22Å; T167-T173 PolarHBondContact OG1-OG1 2.87Å; T167-G201 CarbonylContact O-C 3.46Å; T167-G201 VanDerWaalsContact O-CA 3.32Å; T167-G201 WeakPolarHBondContact O-CA 3.45Å; T167-I202 PolarHBondContact N-O 2.82Å; T167-I202 PolarHBondContact O-N 2.89Å; T167-R204 PolarHBondContact OG1-NH1 2.97Å
168	K	87.4	Confident	76.1	Confident	51 Å²	51	60.6 Å²	60.6	22%	0.222	34%	0.342	C	S	.	.			trans	-93.8	153.8	-179.1	-62.6	-172.3	-177.3	-169.2	0	110.9	L137 V166 G170 Q171 E198	L137-K168 VanDerWaalsContact CD2-C 3.42Å; L137-K168 WeakPolarHBondContact CD2-O 3.3Å; V166-K168 HydrophobicContact CG2-CG 4.13Å; K168-G170 PolarHBondContact O-N 2.9Å; K168-Q171 HydrophobicContact CB-CB 4.07Å; K168-Q171 HydrophobicContact CB-CG 4.28Å; K168-Q171 PolarHBondContact O-N 2.68Å; K168-E198 WeakPolarHBondContact CE-O 3.47Å; K168-E198 PolarHBondContact NZ-O 3.18Å
169	P	80.4	Confident	77.8	Confident	68 Å²	68	55.7 Å²	55.7	44%	0.442	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	122.9	-178.4	-25.8	34.6	0	0	0	112.6	Q171 T200	P169-Q171 PolarHBondContact O-N 3.23Å; P169-T200 WeakPolarHBondContact CD-O 2.97Å; P169-T200 HydrophobicContact CG-CG2 4.31Å
170	G	76.7	Confident	79.5	Confident	64 Å²	64	54.6 Å²	54.6	66%	0.66	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	8.7	-179.5	0	0	0	0	0	115.5	K168	K168-G170 PolarHBondContact O-N 2.9Å
171	Q	80.8	Confident	80.4	Confident	97 Å²	97	58.4 Å²	58.4	45%	0.453	34%	0.338	S	S	.	.	S	Bend	trans	-117.3	154.2	178.4	-61.9	-173.1	1.6	0	0	111	K168 P169 F174	K168-Q171 HydrophobicContact CB-CB 4.07Å; K168-Q171 HydrophobicContact CB-CG 4.28Å; K168-Q171 PolarHBondContact O-N 2.68Å; P169-Q171 PolarHBondContact O-N 3.23Å; Q171-F174 HydrophobicContact CB-CE2 4.23Å
172	P	79.6	Confident	80.7	Confident	80 Å²	80	58.6 Å²	58.6	52%	0.519	34%	0.337	S	S	.	.			trans	-67.6	165.5	173.5	30	-35.2	0	0	0	111.6	F174	P172-F174 HydrophobicContact CG-CE1 4.28Å; P172-F174 HydrophobicContact CG-CE2 4.03Å; P172-F174 HydrophobicContact CG-CZ 3.69Å; P172-F174 WeakPolarHBondContact O-CD2 3.47Å; P172-F174 VanDerWaalsContact O-CE2 3.25Å; P172-F174 WeakPolarHBondContact O-CE2 3.48Å
173	T	81.4	Confident	80.9	Confident	36 Å²	36	58.2 Å²	58.2	22%	0.221	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	130.5	175.5	-56.5	0	0	0	0	110.9	D140 T165 V166 T167	D140-T173 WeakPolarHBondContact CB-OG1 2.93Å; D140-T173 WeakPolarHBondContact OD2-CB 3.07Å; D140-T173 PolarHBondContact OD2-N 3.27Å; D140-T173 PolarHBondContact OD2-OG1 3.19Å; T165-T173 HydrophobicContact CG2-CG2 4.26Å; V166-T173 WeakPolarHBondContact O-CA 3.39Å; T167-T173 WeakPolarHBondContact CG2-OG1 3.26Å; T167-T173 WeakPolarHBondContact OG1-CG2 3.22Å; T167-T173 PolarHBondContact OG1-OG1 2.87Å
174	F	82	Confident	80.9	Confident	97 Å²	97	57.1 Å²	57.1	43%	0.425	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	140.2	176.2	-62.9	-79	0	0	0	111.1	T165 V166 Q171 P172	T165-F174 CarbonylContact C-O 3.48Å; T165-F174 WeakPolarHBondContact CA-O 3.08Å; V166-F174 HydrophobicContact CG1-CB 4.34Å; V166-F174 PolarHBondContact N-O 2.83Å; V166-F174 PolarHBondContact O-N 2.91Å; Q171-F174 HydrophobicContact CB-CE2 4.23Å; P172-F174 HydrophobicContact CG-CE1 4.28Å; P172-F174 HydrophobicContact CG-CE2 4.03Å; P172-F174 HydrophobicContact CG-CZ 3.69Å; P172-F174 WeakPolarHBondContact O-CD2 3.47Å; P172-F174 VanDerWaalsContact O-CE2 3.25Å; P172-F174 WeakPolarHBondContact O-CE2 3.48Å
175	V	82.1	Confident	80.7	Confident	73 Å²	73	58.8 Å²	58.8	44%	0.442	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	126.7	168.6	-178.7	0	0	0	0	108.8	Y163 T165 K177	Y163-V175 HydrophobicContact CD2-CG1 4.1Å; T165-V175 HydrophobicContact CG2-CG2 4.16Å; V175-K177 HydrophobicContact CB-CG 4.47Å; V175-K177 HydrophobicContact CG1-CG 4.13Å; V175-K177 PolarHBondContact O-N 3Å
176	I	82.4	Confident	80.3	Confident	26 Å²	26	61.3 Å²	61.3	13%	0.133	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	103.5	175.1	-60.3	167.5	0	0	0	107.4	F164 V166 L185 L190 Y203	F164-I176 HydrophobicContact CB-CB 4.19Å; F164-I176 HydrophobicContact CB-CD1 4.09Å; F164-I176 PolarHBondContact O-N 2.88Å; V166-I176 HydrophobicContact CB-CD1 4.06Å; V166-I176 HydrophobicContact CB-CG1 4.39Å; V166-I176 HydrophobicContact CG1-CD1 4.1Å; V166-I176 HydrophobicContact CG1-CG1 3.94Å; I176-L185 HydrophobicContact CG2-CD2 4.45Å; I176-L190 HydrophobicContact CD1-CD1 4.4Å; I176-L190 HydrophobicContact CD1-CD2 3.55Å; I176-L190 HydrophobicContact CG2-CD1 4.19Å; I176-Y203 HydrophobicContact CD1-CD1 3.82Å; I176-Y203 HydrophobicContact CD1-CE1 3.93Å
177	K	72.5	Confident	79.7	Confident	140 Å²	140	63.3 Å²	63.3	61%	0.609	38%	0.383	S	S	*	.			trans	-93.2	-33.1	-174.6	-65.1	-177.5	-179.9	-179.4	0	113.6	V175	V175-K177 HydrophobicContact CB-CG 4.47Å; V175-K177 HydrophobicContact CG1-CG 4.13Å; V175-K177 PolarHBondContact O-N 3Å
178	T	76	Confident	79.5	Confident	101 Å²	101	65.4 Å²	65.4	62%	0.62	39%	0.394	S	S	*	.	S	Bend	trans	-141.9	155.5	-170.7	55.4	0	0	0	0	111.8
179	S	76.6	Confident	79.4	Confident	49 Å²	49	64.8 Å²	64.8	34%	0.343	39%	0.393	S	S	.	.			trans	-64.4	141.4	167.7	-62.9	0	0	0	0	110.5	T183 H184 L185	S179-T183 CarbonylContact C-O 3.53Å; S179-T183 WeakPolarHBondContact CA-O 3.46Å; S179-H184 WeakPolarHBondContact OG-CA 3.17Å; S179-L185 PolarHBondContact OG-N 3.35Å
180	T	77.7	Confident	79.7	Confident	72 Å²	72	61.6 Å²	61.6	44%	0.442	37%	0.372	S	S	.	.			trans	-111.3	-170.5	171.8	72.4	0	0	0	0	110.2	S182 T183	T180-S182 VanDerWaalsContact C-N 3.31Å; T180-S182 PolarHBondContact OG1-N 3.37Å; T180-S182 PolarHBondContact OG1-OG 2.99Å; T180-T183 CarbonylContact C-O 3.58Å; T180-T183 PolarHBondContact N-O 3.5Å; T180-T183 PolarHBondContact OG1-N 3.45Å; T180-T183 PolarHBondContact OG1-OG1 3.33Å
181	T	71.8	Confident	80.2	Confident	136 Å²	136	62.2 Å²	62.2	83%	0.834	36%	0.355	S	S	*	.	S	Bend	trans	-63.8	-37	172.2	51.7	0	0	0	0	112
182	S	77.3	Confident	80.5	Confident	30 Å²	30	57.6 Å²	57.6	21%	0.21	33%	0.333	C	S	.	.	S	Bend	trans	-99.9	-20.3	-176.7	60.9	0	0	0	0	114.3	T180 K193 H199	T180-S182 VanDerWaalsContact C-N 3.31Å; T180-S182 PolarHBondContact OG1-N 3.37Å; T180-S182 PolarHBondContact OG1-OG 2.99Å; S182-K193 WeakPolarHBondContact O-CG 3.36Å; S182-K193 PolarHBondContact O-N 3.03Å; S182-H199 PolarHBondContact OG-CE1 2.75Å; S182-H199 PolarHBondContact OG-NE2 3.29Å
183	T	82	Confident	80.5	Confident	15 Å²	15	56 Å²	56	9%	0.092	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	145	179.7	64.9	0	0	0	0	111.7	S179 T180 R191 I192	S179-T183 CarbonylContact C-O 3.53Å; S179-T183 WeakPolarHBondContact CA-O 3.46Å; T180-T183 CarbonylContact C-O 3.58Å; T180-T183 PolarHBondContact N-O 3.5Å; T180-T183 PolarHBondContact OG1-N 3.45Å; T180-T183 PolarHBondContact OG1-OG1 3.33Å; T183-R191 CarbonylContact C-O 3.57Å; T183-R191 VanDerWaalsContact CA-O 3.26Å; T183-R191 WeakPolarHBondContact CA-O 3.3Å; T183-I192 HydrophobicContact CG2-CG1 4.39Å
184	H	83.3	Confident	80.5	Confident	41 Å²	41	55.9 Å²	55.9	19%	0.19	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	121.2	177.2	177.6	-92.8	0	0	0	109.9	S179 R191 F417	S179-H184 WeakPolarHBondContact OG-CA 3.17Å; H184-R191 HydrophobicContact CB-CB 4.35Å; H184-R191 PolarHBondContact N-O 2.81Å; H184-R191 PolarHBondContact O-N 3.46Å; H184-F417 HydrophobicContact CB-CE1 3.77Å; H184-F417 HydrophobicContact CB-CZ 4.19Å
185	L	81.9	Confident	80.7	Confident	38 Å²	38	51.3 Å²	51.3	20%	0.199	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	124.8	177.3	-179.7	65.1	0	0	0	109.1	F164 I176 S179 L190	F164-L185 HydrophobicContact CD2-CD1 3.41Å; F164-L185 VanDerWaalsContact CD2-CD1 3.41Å; F164-L185 HydrophobicContact CE2-CD1 3.58Å; F164-L185 HydrophobicContact CG-CD1 4.34Å; I176-L185 HydrophobicContact CG2-CD2 4.45Å; S179-L185 PolarHBondContact OG-N 3.35Å; L185-L190 HydrophobicContact CB-CD1 4.46Å; L185-L190 HydrophobicContact CD1-CB 4.38Å; L185-L190 HydrophobicContact CD1-CD1 4.35Å
186	S	78.9	Confident	81	Confident	60 Å²	60	50.5 Å²	50.5	42%	0.42	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	103.8	177.1	-176.9	0	0	0	0	109.4	N188 I189	S186-N188 PolarHBondContact O-N 2.88Å; S186-I189 PolarHBondContact N-O 2.81Å; S186-I189 PolarHBondContact O-N 3.42Å
187	G	76.2	Confident	81.4	Confident	55 Å²	55	51.8 Å²	51.8	57%	0.567	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	-107.3	179	0	0	0	0	0	112.6	L162	L162-G187 WeakPolarHBondContact CD2-O 3.49Å
188	N	82	Confident	82.3	Confident	45 Å²	45	51.4 Å²	51.4	24%	0.241	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	8.8	-179.2	67.9	-14.3	0	0	0	114.5	C62 L162 S186	C62-N188 HydrophobicContact CB-CB 4.26Å; C62-N188 PolarHBondContact N-O 2.98Å; L162-N188 HydrophobicContact CD1-CB 4.47Å; L162-N188 HydrophobicContact CD2-CB 4.31Å; S186-N188 PolarHBondContact O-N 2.88Å
189	I	85.6	Confident	83	Confident	37 Å²	37	47.4 Å²	47.4	19%	0.19	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	127.1	-176.5	-63.9	164.1	0	0	0	110.8	V59 L60 S186 R191	V59-I189 HydrophobicContact CG1-CG2 3.55Å; L60-I189 CarbonylContact O-C 3.53Å; L60-I189 WeakPolarHBondContact O-CA 3.32Å; S186-I189 PolarHBondContact N-O 2.81Å; S186-I189 PolarHBondContact O-N 3.42Å; I189-R191 HydrophobicContact CG2-CG 3.62Å
190	L	87.8	Confident	83.9	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	120.8	166	176.5	67.5	0	0	0	109.3	L60 F164 I176 L185 Y203	L60-L190 HydrophobicContact CB-CB 4.34Å; L60-L190 HydrophobicContact CD1-CD2 4.32Å; L60-L190 PolarHBondContact N-O 2.99Å; L60-L190 PolarHBondContact O-N 3.39Å; F164-L190 HydrophobicContact CD1-CB 3.9Å; F164-L190 HydrophobicContact CD1-CD2 4.09Å; F164-L190 HydrophobicContact CD2-CB 4.42Å; F164-L190 HydrophobicContact CE1-CB 3.67Å; F164-L190 HydrophobicContact CE2-CB 4.22Å; F164-L190 HydrophobicContact CG-CB 4.25Å; F164-L190 HydrophobicContact CG-CD2 4.44Å; F164-L190 HydrophobicContact CZ-CB 3.82Å; I176-L190 HydrophobicContact CD1-CD1 4.4Å; I176-L190 HydrophobicContact CD1-CD2 3.55Å; I176-L190 HydrophobicContact CG2-CD1 4.19Å; L185-L190 HydrophobicContact CB-CD1 4.46Å; L185-L190 HydrophobicContact CD1-CB 4.38Å; L185-L190 HydrophobicContact CD1-CD1 4.35Å; L190-Y203 HydrophobicContact CD2-CD1 3.55Å; L190-Y203 HydrophobicContact CD2-CE1 3.92Å
191	R	86	Confident	84.6	Confident	77 Å²	77	42.5 Å²	42.5	29%	0.291	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	125.6	177.7	-47.7	-166.7	177.5	178.7	-1.1	110.2	L58 V59 T183 H184 I189 E419	L58-R191 CarbonylContact O-C 3.56Å; L58-R191 WeakPolarHBondContact O-CA 3.33Å; V59-R191 HydrophobicContact CG1-CG 4.29Å; V59-R191 HydrophobicContact CG2-CB 3.92Å; V59-R191 HydrophobicContact CG2-CG 3.68Å; T183-R191 CarbonylContact C-O 3.57Å; T183-R191 VanDerWaalsContact CA-O 3.26Å; T183-R191 WeakPolarHBondContact CA-O 3.3Å; H184-R191 HydrophobicContact CB-CB 4.35Å; H184-R191 PolarHBondContact N-O 2.81Å; H184-R191 PolarHBondContact O-N 3.46Å; I189-R191 HydrophobicContact CG2-CG 3.62Å; R191-E419 IonicContact NH1-OE1 3.73Å
192	I	86.7	Confident	85.6	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	113.1	163.4	-52.9	-178.5	0	0	0	106.3	G57 L58 T183 A195 H199	G57-I192 WeakPolarHBondContact CA-O 3.25Å; L58-I192 HydrophobicContact CB-CB 4.2Å; L58-I192 HydrophobicContact CB-CD1 4.42Å; L58-I192 HydrophobicContact CB-CG1 4.48Å; L58-I192 HydrophobicContact CD2-CD1 3.82Å; L58-I192 HydrophobicContact CD2-CG1 4.5Å; L58-I192 PolarHBondContact N-O 2.8Å; L58-I192 PolarHBondContact O-N 2.89Å; T183-I192 HydrophobicContact CG2-CG1 4.39Å; I192-A195 HydrophobicContact CG2-CB 4.38Å; I192-H199 HydrophobicContact CD1-CB 4.25Å
193	K	80.8	Confident	86.3	Confident	45 Å²	45	35 Å²	35	20%	0.196	20%	0.195	C	C	.	.	S	Bend	trans	-73.3	-40.7	-175.9	-48	-170.5	-166.8	-172.1	0	111.8	S182 F417 I418	S182-K193 WeakPolarHBondContact O-CG 3.36Å; S182-K193 PolarHBondContact O-N 3.03Å; K193-F417 HydrophobicContact CB-CD1 4.14Å; K193-F417 HydrophobicContact CD-CD1 3.43Å; K193-F417 VanDerWaalsContact CD-CD1 3.43Å; K193-F417 HydrophobicContact CD-CE1 3.32Å; K193-F417 HydrophobicContact CD-CE2 4.41Å; K193-F417 HydrophobicContact CD-CG 4.06Å; K193-F417 HydrophobicContact CD-CZ 3.85Å; K193-F417 HydrophobicContact CG-CD1 3.4Å; K193-F417 HydrophobicContact CG-CE1 3.52Å; K193-F417 HydrophobicContact CG-CG 4.33Å; K193-F417 VanDerWaalsContact NZ-CZ 3.26Å; K193-I418 WeakPolarHBondContact O-CD1 2.97Å; K193-I418 WeakPolarHBondContact O-CG1 3.39Å
194	C	79.9	Confident	86.7	Confident	35 Å²	35	35.2 Å²	35.2	24%	0.236	19%	0.194	C	C	.	.	S	Bend	trans	-142.5	109.3	178.8	176.7	0	0	0	0	107.8	H199 I414	C194-H199 PolarHBondContact O-CE1 3.48Å; C194-H199 VanDerWaalsContact O-CE1 3.28Å; C194-I414 HydrophobicContact CB-CD1 3.73Å; C194-I414 WeakPolarHBondContact SG-CD1 3.49Å
195	A	86.6	Confident	87	Confident	1 Å²	1	33.2 Å²	33.2	1%	0.008	19%	0.185	C	C	.	.			trans	-64.7	141.8	175.4	0	0	0	0	0	110	L52 E54 G55 D56 I192 V219	L52-A195 HydrophobicContact CB-CB 4.3Å; L52-A195 HydrophobicContact CD1-CB 4Å; E54-A195 CarbonylContact C-O 3.59Å; E54-A195 VanDerWaalsContact CA-O 3.31Å; E54-A195 WeakPolarHBondContact CA-O 3.31Å; G55-A195 PolarHBondContact N-O 3.03Å; D56-A195 HydrophobicContact CB-CB 4.34Å; D56-A195 VanDerWaalsContact O-CB 3.29Å; D56-A195 WeakPolarHBondContact O-CB 3.34Å; D56-A195 PolarHBondContact O-N 3Å; I192-A195 HydrophobicContact CG2-CB 4.38Å; A195-V219 HydrophobicContact CB-CG1 3.79Å; A195-V219 HydrophobicContact CB-CG2 3.97Å
196	N	89.3	Confident	87.1	Confident	56 Å²	56	32.2 Å²	32.2	30%	0.299	18%	0.18	S	C	.	.			trans	-138.3	153.6	176.1	-177.5	4.9	0	0	0	105.3	E54 E198 H199 V219	E54-N196 PolarHBondContact OE1-OD1 3.35Å; N196-E198 PolarHBondContact O-N 2.68Å; N196-H199 PolarHBondContact N-ND1 2.81Å; N196-H199 WeakPolarHBondContact O-CB 3.4Å; N196-H199 PolarHBondContact O-N 3.18Å; N196-V219 VanDerWaalsContact C-CG1 3.47Å; N196-V219 WeakPolarHBondContact O-CB 3.39Å; N196-V219 WeakPolarHBondContact O-CG1 3.18Å; N196-V219 WeakPolarHBondContact O-CG2 3.32Å
197	T	90.9	Very high	87.1	Confident	52 Å²	52	29.7 Å²	29.7	32%	0.319	16%	0.161	S	C	.	.	G	3₁₀ helix	trans	-47.3	-34.4	175.1	42.9	0	0	0	0	113.5	E54 H199 T200 K221	E54-T197 HydrophobicContact CG-CG2 4.34Å; E54-T197 WeakPolarHBondContact OE1-CG2 3.04Å; E54-T197 PolarHBondContact OE1-N 3.02Å; E54-T197 PolarHBondContact OE1-OG1 2.98Å; E54-T197 VanDerWaalsContact OE1-OG1 3.09Å; T197-H199 PolarHBondContact O-N 3.25Å; T197-T200 WeakPolarHBondContact O-CB 3.33Å; T197-T200 PolarHBondContact O-N 2.8Å; T197-T200 VanDerWaalsContact O-N 3.1Å; T197-T200 PolarHBondContact O-OG1 3.4Å; T197-K221 HydrophobicContact CG2-CG 3.8Å
198	E	90.4	Very high	87.1	Confident	133 Å²	133	32.6 Å²	32.6	62%	0.621	16%	0.158	S	C	*	.	G	3₁₀ helix	trans	-63.7	-20.3	175.1	-64.2	-175.8	-178.8	0	0	115.4	K168 N196	K168-E198 WeakPolarHBondContact CE-O 3.47Å; K168-E198 PolarHBondContact NZ-O 3.18Å; N196-E198 PolarHBondContact O-N 2.68Å
199	H	92.1	Very high	86.7	Confident	17 Å²	17	32.7 Å²	32.7	8%	0.079	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-82	-2.8	176.3	-61	115.9	0	0	0	112.5	S182 I192 C194 N196 T197 G201 Y203 V219	S182-H199 PolarHBondContact OG-CE1 2.75Å; S182-H199 PolarHBondContact OG-NE2 3.29Å; I192-H199 HydrophobicContact CD1-CB 4.25Å; C194-H199 PolarHBondContact O-CE1 3.48Å; C194-H199 VanDerWaalsContact O-CE1 3.28Å; N196-H199 PolarHBondContact N-ND1 2.81Å; N196-H199 WeakPolarHBondContact O-CB 3.4Å; N196-H199 PolarHBondContact O-N 3.18Å; T197-H199 PolarHBondContact O-N 3.25Å; H199-G201 PolarHBondContact O-N 3.07Å; H199-Y203 VanDerWaalsContact O-CE2 3.27Å; H199-Y203 WeakPolarHBondContact O-CE2 3.27Å; H199-Y203 PolarHBondContact O-OH 2.7Å; H199-V219 HydrophobicContact CB-CG2 4.15Å
200	T	94.4	Very high	86.4	Confident	17 Å²	17	36 Å²	36	10%	0.104	18%	0.184	C	C	.	.			trans	-62.8	127.5	174.1	-63.3	0	0	0	0	111.1	P169 T197 V217 V219 H344	P169-T200 WeakPolarHBondContact CD-O 2.97Å; P169-T200 HydrophobicContact CG-CG2 4.31Å; T197-T200 WeakPolarHBondContact O-CB 3.33Å; T197-T200 PolarHBondContact O-N 2.8Å; T197-T200 VanDerWaalsContact O-N 3.1Å; T197-T200 PolarHBondContact O-OG1 3.4Å; T200-V217 WeakPolarHBondContact CA-O 3.18Å; T200-V219 PolarHBondContact OG1-N 3.2Å; T200-V219 PolarHBondContact OG1-O 3.4Å; T200-H344 HydrophobicContact CG2-CB 3.64Å; T200-H344 VanDerWaalsContact CG2-CG 3.42Å; T200-H344 WeakPolarHBondContact CG2-ND1 3.42Å
201	G	92.9	Very high	86.2	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	164.9	-175.6	177.9	0	0	0	0	0	113.3	T167 H199 V217	T167-G201 CarbonylContact O-C 3.46Å; T167-G201 VanDerWaalsContact O-CA 3.32Å; T167-G201 WeakPolarHBondContact O-CA 3.45Å; H199-G201 PolarHBondContact O-N 3.07Å; G201-V217 PolarHBondContact N-O 2.94Å; G201-V217 PolarHBondContact O-N 2.86Å
202	I	92.1	Very high	86.1	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.01	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	114.1	174.2	-58.5	-178.3	0	0	0	108.7	L137 L138 V166 T167 R204 W215 L345	L137-I202 HydrophobicContact CB-CD1 4.08Å; L138-I202 HydrophobicContact CD2-CD1 3.77Å; L138-I202 HydrophobicContact CG-CD1 4.44Å; V166-I202 CarbonylContact C-O 3.55Å; V166-I202 WeakPolarHBondContact CA-O 3.35Å; T167-I202 PolarHBondContact N-O 2.82Å; T167-I202 PolarHBondContact O-N 2.89Å; I202-R204 HydrophobicContact CG2-CG 4.27Å; I202-W215 CarbonylContact C-O 3.54Å; I202-W215 WeakPolarHBondContact CA-O 3.48Å; I202-L345 HydrophobicContact CD1-CD1 4.14Å; I202-L345 HydrophobicContact CD1-CD2 3.87Å; I202-L345 HydrophobicContact CG1-CD1 4.42Å; I202-L345 HydrophobicContact CG1-CD2 4.18Å
203	Y	93.4	Very high	86.2	Confident	7 Å²	7	34.5 Å²	34.5	3%	0.027	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	138.4	173.4	-64.8	-101.8	0	0	0	109	L60 T165 V166 I176 L190 H199 A214 W215 V217	L60-Y203 HydrophobicContact CD1-CD1 4.25Å; L60-Y203 HydrophobicContact CD1-CD2 4.33Å; L60-Y203 HydrophobicContact CD1-CG 3.86Å; T165-Y203 CarbonylContact O-C 3.57Å; T165-Y203 VanDerWaalsContact O-CA 3.3Å; T165-Y203 WeakPolarHBondContact O-CA 3.43Å; V166-Y203 HydrophobicContact CB-CD1 3.93Å; V166-Y203 HydrophobicContact CB-CE1 3.9Å; V166-Y203 HydrophobicContact CB-CG 4.49Å; V166-Y203 HydrophobicContact CG2-CD1 3.95Å; V166-Y203 HydrophobicContact CG2-CD2 4.26Å; V166-Y203 HydrophobicContact CG2-CE1 3.66Å; V166-Y203 HydrophobicContact CG2-CE2 3.97Å; V166-Y203 HydrophobicContact CG2-CG 4.25Å; I176-Y203 HydrophobicContact CD1-CD1 3.82Å; I176-Y203 HydrophobicContact CD1-CE1 3.93Å; L190-Y203 HydrophobicContact CD2-CD1 3.55Å; L190-Y203 HydrophobicContact CD2-CE1 3.92Å; H199-Y203 VanDerWaalsContact O-CE2 3.27Å; H199-Y203 WeakPolarHBondContact O-CE2 3.27Å; H199-Y203 PolarHBondContact O-OH 2.7Å; Y203-A214 CarbonylContact O-C 3.53Å; Y203-A214 WeakPolarHBondContact O-CA 3.46Å; Y203-W215 PolarHBondContact N-O 2.94Å; Y203-W215 PolarHBondContact O-N 2.81Å; Y203-V217 HydrophobicContact CD2-CB 3.92Å; Y203-V217 HydrophobicContact CD2-CG2 3.57Å; Y203-V217 HydrophobicContact CE2-CB 3.8Å; Y203-V217 HydrophobicContact CE2-CG1 4.37Å; Y203-V217 HydrophobicContact CE2-CG2 3.88Å
204	R	89.7	Confident	86.7	Confident	19 Å²	19	32.4 Å²	32.4	7%	0.072	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	141.7	175	-57.7	177.3	175.5	80	-2.8	109.9	L137 L138 F164 T165 T167 I202 I206 V211 R213 A214	L137-R204 PolarHBondContact O-NH1 3.29Å; L137-R204 PolarHBondContact O-NH2 2.66Å; L138-R204 PolarHBondContact O-NH2 3.19Å; F164-R204 CarbonylContact C-O 3.59Å; F164-R204 VanDerWaalsContact CA-O 3.28Å; F164-R204 WeakPolarHBondContact CA-O 3.14Å; T165-R204 PolarHBondContact N-O 2.94Å; T165-R204 PolarHBondContact O-N 3.34Å; T165-R204 WeakPolarHBondContact OG1-CB 3.48Å; T167-R204 PolarHBondContact OG1-NH1 2.97Å; I202-R204 HydrophobicContact CG2-CG 4.27Å; R204-I206 HydrophobicContact CB-CG1 4.46Å; R204-V211 HydrophobicContact CB-CG1 4.12Å; R204-V211 HydrophobicContact CG-CG1 4.25Å; R204-R213 CarbonylContact C-O 3.54Å; R204-R213 VanDerWaalsContact CA-O 3.28Å; R204-R213 WeakPolarHBondContact CA-O 3.31Å; R204-A214 HydrophobicContact CG-CB 4.22Å
205	C	89	Confident	87.4	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	127.3	163.2	-172.3	0	0	0	0	108.9	C62 F164 I212 R213 W215	C62-C205 HydrophobicContact CB-CB 4Å; C62-C205 WeakPolarHBondContact CB-SG 3.45Å; C62-C205 WeakPolarHBondContact SG-CB 3.46Å; C62-C205 CovalentContact SG-SG 2.02Å; C62-C205 PolarHBondContact SG-SG 3.4Å; F164-C205 HydrophobicContact CD1-CB 4.29Å; F164-C205 HydrophobicContact CE1-CB 4.15Å; C205-I212 HydrophobicContact CB-CD1 4.29Å; C205-I212 HydrophobicContact CB-CG1 3.92Å; C205-I212 VanDerWaalsContact O-CG1 3.29Å; C205-I212 WeakPolarHBondContact O-CG1 3.32Å; C205-I212 PolarHBondContact O-N 2.69Å; C205-R213 HydrophobicContact CB-CB 4.36Å; C205-R213 PolarHBondContact N-O 2.96Å; C205-R213 PolarHBondContact O-N 2.8Å; C205-W215 HydrophobicContact CB-CH2 3.78Å; C205-W215 HydrophobicContact CB-CZ3 3.75Å
206	I	84	Confident	87.7	Confident	16 Å²	16	30.7 Å²	30.7	8%	0.082	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	123.9	-178.7	-61	172.6	0	0	0	108	L162 Y163 T165 R204 G209 E210 V211	L162-I206 VanDerWaalsContact CA-O 3.32Å; L162-I206 WeakPolarHBondContact CA-O 3.28Å; Y163-I206 HydrophobicContact CD1-CB 4.32Å; Y163-I206 HydrophobicContact CD1-CG2 4.42Å; Y163-I206 HydrophobicContact CD2-CB 4.31Å; Y163-I206 HydrophobicContact CD2-CD1 4.44Å; Y163-I206 HydrophobicContact CE1-CB 3.89Å; Y163-I206 HydrophobicContact CE1-CG2 3.6Å; Y163-I206 HydrophobicContact CE2-CB 3.9Å; Y163-I206 HydrophobicContact CE2-CD1 3.57Å; Y163-I206 HydrophobicContact CE2-CG1 4.24Å; Y163-I206 HydrophobicContact CE2-CG2 4.23Å; Y163-I206 VanDerWaalsContact CZ-CG2 3.49Å; Y163-I206 PolarHBondContact N-O 2.85Å; Y163-I206 PolarHBondContact O-N 2.82Å; Y163-I206 WeakPolarHBondContact OH-CG2 3.32Å; T165-I206 HydrophobicContact CG2-CD1 3.83Å; R204-I206 HydrophobicContact CB-CG1 4.46Å; I206-G209 VanDerWaalsContact CG2-C 3.5Å; I206-E210 CarbonylContact C-O 3.5Å; I206-E210 VanDerWaalsContact CA-O 3.26Å; I206-E210 WeakPolarHBondContact CA-O 3.32Å; I206-V211 HydrophobicContact CD1-CG2 4.45Å; I206-V211 HydrophobicContact CG1-CG2 4.1Å
207	F	79.8	Confident	88	Confident	8 Å²	8	28 Å²	28	4%	0.035	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	123.7	176.7	-178	-107.3	0	0	0	109	F36 V64 F69 A161 L162 G209 E210 I212	F36-F207 AromaticContact CE1-CD1 3.74Å; F36-F207 HydrophobicContact CE1-CD1 3.74Å; F36-F207 HydrophobicContact CE1-CE1 4.09Å; F36-F207 HydrophobicContact CZ-CD1 4.26Å; V64-F207 HydrophobicContact CG1-CD2 4.1Å; V64-F207 HydrophobicContact CG1-CE2 3.9Å; V64-F207 HydrophobicContact CG1-CZ 4.14Å; V64-F207 HydrophobicContact CG2-CD2 4.47Å; F69-F207 HydrophobicContact CE2-CE2 4.5Å; F69-F207 HydrophobicContact CZ-CE2 4.37Å; A161-F207 HydrophobicContact CB-CE2 4.18Å; A161-F207 CarbonylContact O-C 3.48Å; A161-F207 WeakPolarHBondContact O-CA 3.5Å; A161-F207 WeakPolarHBondContact O-CD2 3.43Å; L162-F207 HydrophobicContact CB-CD2 4.08Å; L162-F207 HydrophobicContact CD1-CD2 4.1Å; F207-G209 PolarHBondContact O-N 3.15Å; F207-G209 VanDerWaalsContact O-N 3.08Å; F207-E210 PolarHBondContact N-O 2.96Å; F207-E210 PolarHBondContact O-N 3.02Å; F207-I212 HydrophobicContact CB-CD1 3.99Å; F207-I212 HydrophobicContact CB-CG1 4.39Å; F207-I212 HydrophobicContact CB-CG2 3.79Å
208	K	75.3	Confident	88.2	Confident	116 Å²	116	25.7 Å²	25.7	50%	0.504	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	33.8	-176.6	-62.8	-176.7	176.5	179.7	0	114.4	A161	A161-K208 PolarHBondContact O-N 3.16Å
209	G	73.9	Confident	88.4	Confident	46 Å²	46	19.5 Å²	19.5	47%	0.474	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.5	-8.1	-179.6	0	0	0	0	0	115.2	I206 F207	I206-G209 VanDerWaalsContact CG2-C 3.5Å; F207-G209 PolarHBondContact O-N 3.15Å; F207-G209 VanDerWaalsContact O-N 3.08Å
210	E	78.8	Confident	88.4	Confident	107 Å²	107	19 Å²	19	50%	0.5	10%	0.104	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	136.9	178.2	-63.5	-173.6	167.5	0	0	112	I206 F207 I212	I206-E210 CarbonylContact C-O 3.5Å; I206-E210 VanDerWaalsContact CA-O 3.26Å; I206-E210 WeakPolarHBondContact CA-O 3.32Å; F207-E210 PolarHBondContact N-O 2.96Å; F207-E210 PolarHBondContact O-N 3.02Å; E210-I212 PolarHBondContact O-N 3.41Å
211	V	84.4	Confident	88.2	Confident	43 Å²	43	23.8 Å²	23.8	26%	0.261	12%	0.123	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	107	175.1	-174.8	0	0	0	0	108.9	T45 R204 I206	T45-V211 WeakPolarHBondContact CB-O 3.23Å; T45-V211 HydrophobicContact CG2-CB 4.37Å; T45-V211 HydrophobicContact CG2-CG1 3.71Å; T45-V211 WeakPolarHBondContact CG2-O 3.15Å; T45-V211 PolarHBondContact OG1-O 3.5Å; R204-V211 HydrophobicContact CB-CG1 4.12Å; R204-V211 HydrophobicContact CG-CG1 4.25Å; I206-V211 HydrophobicContact CD1-CG2 4.45Å; I206-V211 HydrophobicContact CG1-CG2 4.1Å
212	I	84.1	Confident	87.9	Confident	1 Å²	1	24.4 Å²	24.4	1%	0.005	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	-31.9	-179.9	58.8	167.1	0	0	0	111.9	F36 T45 V46 C62 V64 C205 F207 E210	F36-I212 HydrophobicContact CD2-CB 3.73Å; F36-I212 HydrophobicContact CD2-CD1 4.47Å; F36-I212 HydrophobicContact CD2-CG2 3.55Å; F36-I212 HydrophobicContact CE1-CG2 4.36Å; F36-I212 HydrophobicContact CE2-CB 3.89Å; F36-I212 HydrophobicContact CE2-CG2 3.21Å; F36-I212 HydrophobicContact CG-CB 4.47Å; F36-I212 HydrophobicContact CG-CD1 4.41Å; F36-I212 HydrophobicContact CG-CG2 4.29Å; F36-I212 HydrophobicContact CZ-CG2 3.68Å; T45-I212 WeakPolarHBondContact CA-O 3.21Å; V46-I212 PolarHBondContact N-O 3.22Å; C62-I212 HydrophobicContact CB-CD1 3.9Å; V64-I212 HydrophobicContact CG2-CD1 3.47Å; V64-I212 VanDerWaalsContact CG2-CD1 3.47Å; C205-I212 HydrophobicContact CB-CD1 4.29Å; C205-I212 HydrophobicContact CB-CG1 3.92Å; C205-I212 VanDerWaalsContact O-CG1 3.29Å; C205-I212 WeakPolarHBondContact O-CG1 3.32Å; C205-I212 PolarHBondContact O-N 2.69Å; F207-I212 HydrophobicContact CB-CD1 3.99Å; F207-I212 HydrophobicContact CB-CG1 4.39Å; F207-I212 HydrophobicContact CB-CG2 3.79Å; E210-I212 PolarHBondContact O-N 3.41Å
213	R	88.7	Confident	87.5	Confident	3 Å²	3	26.4 Å²	26.4	1%	0.011	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	145	-179.4	-61.5	-166.8	164.8	-150.3	-22.1	111.6	S32 I34 V46 S61 N63 R204 C205 W215	S32-R213 PolarHBondContact O-NH1 3.31Å; S32-R213 PolarHBondContact O-NH2 3.48Å; S32-R213 PolarHBondContact OG-NH2 3.03Å; S32-R213 VanDerWaalsContact OG-NH2 3.16Å; I34-R213 PolarHBondContact O-NH2 2.96Å; V46-R213 HydrophobicContact CB-CG 4.19Å; V46-R213 CarbonylContact O-C 3.56Å; V46-R213 WeakPolarHBondContact O-CA 3.47Å; S61-R213 PolarHBondContact O-NH1 3.48Å; N63-R213 PolarHBondContact ND2-NH1 2.02Å; N63-R213 PolarHBondContact ND2-NH2 3.22Å; R204-R213 CarbonylContact C-O 3.54Å; R204-R213 VanDerWaalsContact CA-O 3.28Å; R204-R213 WeakPolarHBondContact CA-O 3.31Å; C205-R213 HydrophobicContact CB-CB 4.36Å; C205-R213 PolarHBondContact N-O 2.96Å; C205-R213 PolarHBondContact O-N 2.8Å; R213-W215 HydrophobicContact CB-CH2 3.65Å; R213-W215 HydrophobicContact CB-CZ2 3.62Å; R213-W215 HydrophobicContact CB-CZ3 4.13Å; R213-W215 HydrophobicContact CG-CH2 4.37Å; R213-W215 HydrophobicContact CG-CZ2 4.14Å
214	A	90.4	Very high	87.3	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.008	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	130.8	173.9	0	0	0	0	0	110.7	T45 V46 Y47 E48 Y203 R204	T45-A214 HydrophobicContact CG2-CB 4.28Å; V46-A214 PolarHBondContact O-N 3.49Å; Y47-A214 WeakPolarHBondContact CA-O 3.32Å; Y47-A214 HydrophobicContact CD1-CB 3.69Å; Y47-A214 HydrophobicContact CE1-CB 3.72Å; E48-A214 PolarHBondContact N-O 2.91Å; Y203-A214 CarbonylContact O-C 3.53Å; Y203-A214 WeakPolarHBondContact O-CA 3.46Å; R204-A214 HydrophobicContact CG-CB 4.22Å
215	W	94.3	Very high	87.4	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	117.5	-177.9	-59.1	-77.9	0	0	0	110.4	E48 Y50 L60 S61 F164 I202 Y203 C205 R213 V217	E48-W215 VanDerWaalsContact CB-CD1 3.48Å; E48-W215 CarbonylContact O-C 3.57Å; E48-W215 VanDerWaalsContact O-CA 3.25Å; E48-W215 WeakPolarHBondContact O-CA 3.32Å; E48-W215 VanDerWaalsContact OE2-CD1 3.22Å; E48-W215 PolarHBondContact OE2-NE1 2.82Å; Y50-W215 AromaticContact CE2-CD1 3.71Å; L60-W215 HydrophobicContact CB-CD2 4.24Å; L60-W215 HydrophobicContact CB-CE3 4.21Å; L60-W215 HydrophobicContact CB-CH2 4.2Å; L60-W215 HydrophobicContact CB-CZ2 4.24Å; L60-W215 HydrophobicContact CB-CZ3 4.19Å; L60-W215 HydrophobicContact CD1-CB 4.27Å; L60-W215 HydrophobicContact CD1-CD2 4.07Å; L60-W215 HydrophobicContact CD1-CE3 3.94Å; L60-W215 HydrophobicContact CD1-CG 4.23Å; L60-W215 HydrophobicContact CD2-CB 4.15Å; L60-W215 HydrophobicContact CD2-CD2 3.81Å; L60-W215 HydrophobicContact CD2-CE3 4.46Å; L60-W215 HydrophobicContact CD2-CG 3.64Å; L60-W215 HydrophobicContact CG-CD2 4.27Å; L60-W215 HydrophobicContact CG-CE3 4.44Å; L60-W215 HydrophobicContact CG-CG 4.46Å; S61-W215 WeakPolarHBondContact O-CZ2 3.41Å; F164-W215 HydrophobicContact CD1-CZ3 4.17Å; F164-W215 HydrophobicContact CE1-CH2 4.08Å; F164-W215 AromaticContact CE1-CZ3 3.85Å; F164-W215 HydrophobicContact CE1-CZ3 3.85Å; I202-W215 CarbonylContact C-O 3.54Å; I202-W215 WeakPolarHBondContact CA-O 3.48Å; Y203-W215 PolarHBondContact N-O 2.94Å; Y203-W215 PolarHBondContact O-N 2.81Å; C205-W215 HydrophobicContact CB-CH2 3.78Å; C205-W215 HydrophobicContact CB-CZ3 3.75Å; R213-W215 HydrophobicContact CB-CH2 3.65Å; R213-W215 HydrophobicContact CB-CZ2 3.62Å; R213-W215 HydrophobicContact CB-CZ3 4.13Å; R213-W215 HydrophobicContact CG-CH2 4.37Å; R213-W215 HydrophobicContact CG-CZ2 4.14Å; W215-V217 HydrophobicContact CB-CG2 4.2Å; W215-V217 PolarHBondContact O-N 2.86Å
216	S	94.2	Very high	87.4	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	102.3	166.9	165.1	0	0	0	0	109	E48 S49 Y50 L345	E48-S216 PolarHBondContact O-N 2.91Å; S49-S216 CarbonylContact C-O 3.56Å; S49-S216 WeakPolarHBondContact CA-O 3.27Å; Y50-S216 PolarHBondContact N-O 2.85Å; S216-L345 WeakPolarHBondContact OG-CD1 3.43Å
217	V	95	Very high	87.7	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	119.3	178.3	-178.8	0	0	0	0	109.1	L52 L58 L60 T200 G201 Y203 W215 V219 H344	L52-V217 HydrophobicContact CD1-CG1 3.87Å; L58-V217 HydrophobicContact CD2-CB 4.42Å; L58-V217 HydrophobicContact CD2-CG1 3.91Å; L58-V217 HydrophobicContact CD2-CG2 3.56Å; L60-V217 HydrophobicContact CD1-CG2 4.44Å; T200-V217 WeakPolarHBondContact CA-O 3.18Å; G201-V217 PolarHBondContact N-O 2.94Å; G201-V217 PolarHBondContact O-N 2.86Å; Y203-V217 HydrophobicContact CD2-CB 3.92Å; Y203-V217 HydrophobicContact CD2-CG2 3.57Å; Y203-V217 HydrophobicContact CE2-CB 3.8Å; Y203-V217 HydrophobicContact CE2-CG1 4.37Å; Y203-V217 HydrophobicContact CE2-CG2 3.88Å; W215-V217 HydrophobicContact CB-CG2 4.2Å; W215-V217 PolarHBondContact O-N 2.86Å; V217-V219 HydrophobicContact CG1-CG2 4.14Å; V217-H344 PolarHBondContact O-CE1 3.16Å
218	T	95.6	Very high	88.1	Confident	3 Å²	3	37.3 Å²	37.3	2%	0.018	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	122.5	172.8	-55.6	0	0	0	0	109	Y50 L51 L52 L220 S343 H344	Y50-T218 PolarHBondContact O-N 3.37Å; L51-T218 WeakPolarHBondContact CA-O 3.33Å; L51-T218 HydrophobicContact CD1-CG2 3.68Å; L52-T218 PolarHBondContact N-O 2.75Å; T218-L220 HydrophobicContact CG2-CD2 4.06Å; T218-L220 HydrophobicContact CG2-CG 4.35Å; T218-S343 WeakPolarHBondContact OG1-CA 3.03Å; T218-H344 HydrophobicContact CG2-CB 4.2Å; T218-H344 PolarHBondContact OG1-N 3.24Å; T218-H344 VanDerWaalsContact OG1-N 3.15Å; T218-H344 PolarHBondContact OG1-ND1 3.07Å
219	V	94.1	Very high	88.6	Confident	4 Å²	4	33.4 Å²	33.4	2%	0.024	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	121.9	174.5	-169.1	0	0	0	0	108.9	L52 E54 A195 N196 H199 T200 V217	L52-V219 HydrophobicContact CB-CG1 4.44Å; L52-V219 HydrophobicContact CB-CG2 4.25Å; L52-V219 HydrophobicContact CD1-CG2 4.29Å; L52-V219 CarbonylContact O-C 3.56Å; L52-V219 WeakPolarHBondContact O-CA 3Å; E54-V219 HydrophobicContact CG-CG1 4.04Å; A195-V219 HydrophobicContact CB-CG1 3.79Å; A195-V219 HydrophobicContact CB-CG2 3.97Å; N196-V219 VanDerWaalsContact C-CG1 3.47Å; N196-V219 WeakPolarHBondContact O-CB 3.39Å; N196-V219 WeakPolarHBondContact O-CG1 3.18Å; N196-V219 WeakPolarHBondContact O-CG2 3.32Å; H199-V219 HydrophobicContact CB-CG2 4.15Å; T200-V219 PolarHBondContact OG1-N 3.2Å; T200-V219 PolarHBondContact OG1-O 3.4Å; V217-V219 HydrophobicContact CG1-CG2 4.14Å
220	L	92.9	Very high	89.2	Confident	7 Å²	7	31.7 Å²	31.7	4%	0.037	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	154.2	177.3	-62.1	-178	0	0	0	110.4	L51 L52 S53 E54 T218 D224 E225 R342	L51-L220 HydrophobicContact CD1-CD1 3.72Å; L51-L220 HydrophobicContact CD1-CG 3.88Å; L51-L220 HydrophobicContact CD2-CD1 4.28Å; L51-L220 HydrophobicContact CG-CD1 4.28Å; L52-L220 PolarHBondContact O-N 3.46Å; S53-L220 CarbonylContact C-O 3.58Å; S53-L220 WeakPolarHBondContact CA-O 3.14Å; E54-L220 WeakPolarHBondContact CG-O 3.38Å; E54-L220 PolarHBondContact N-O 3.1Å; T218-L220 HydrophobicContact CG2-CD2 4.06Å; T218-L220 HydrophobicContact CG2-CG 4.35Å; L220-D224 HydrophobicContact CB-CB 4.03Å; L220-E225 HydrophobicContact CD1-CB 4Å; L220-R342 HydrophobicContact CD1-CB 4.05Å
221	K	90.8	Very high	89.5	Confident	117 Å²	117	29.5 Å²	29.5	51%	0.509	16%	0.156	S	C	.	.			trans	-64.6	154.1	172.2	-63.6	-176.2	176.2	-177.1	0	110.1	T197 G223 D224	T197-K221 HydrophobicContact CG2-CG 3.8Å; K221-G223 PolarHBondContact O-N 2.76Å; K221-D224 WeakPolarHBondContact CB-OD2 3.29Å; K221-D224 PolarHBondContact N-OD2 3.01Å; K221-D224 WeakPolarHBondContact O-CB 3.47Å; K221-D224 PolarHBondContact O-N 3.47Å; K221-D224 VanDerWaalsContact O-N 3.09Å
222	P	85.3	Confident	89.5	Confident	12 Å²	12	28.6 Å²	28.6	8%	0.078	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	131.2	177.3	-20.1	33.1	0	0	0	110.2	E54 D224 I409	E54-P222 HydrophobicContact CB-CG 4.12Å; P222-D224 VanDerWaalsContact C-N 3.34Å; P222-D224 PolarHBondContact O-N 2.76Å; P222-I409 HydrophobicContact CB-CD1 4.12Å; P222-I409 HydrophobicContact CB-CG1 4.49Å; P222-I409 HydrophobicContact CB-CG2 3.6Å; P222-I409 HydrophobicContact CG-CG2 3.97Å; P222-I409 VanDerWaalsContact O-CD1 3.26Å; P222-I409 WeakPolarHBondContact O-CD1 3.28Å
223	G	84.8	Confident	89.4	Confident	44 Å²	44	35.3 Å²	35.3	45%	0.454	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.4	-8.2	-177.8	0	0	0	0	0	116.2	K221 E225	K221-G223 PolarHBondContact O-N 2.76Å; G223-E225 VanDerWaalsContact C-N 3.34Å
224	D	89	Confident	89	Confident	78 Å²	78	39.7 Å²	39.7	42%	0.417	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-34	175	-82.4	-2.7	0	0	0	112.2	L220 K221 P222 P226	L220-D224 HydrophobicContact CB-CB 4.03Å; K221-D224 WeakPolarHBondContact CB-OD2 3.29Å; K221-D224 PolarHBondContact N-OD2 3.01Å; K221-D224 WeakPolarHBondContact O-CB 3.47Å; K221-D224 PolarHBondContact O-N 3.47Å; K221-D224 VanDerWaalsContact O-N 3.09Å; P222-D224 VanDerWaalsContact C-N 3.34Å; P222-D224 PolarHBondContact O-N 2.76Å; D224-P226 WeakPolarHBondContact O-CD 3.4Å
225	E	90.7	Very high	88.6	Confident	9 Å²	9	42.2 Å²	42.2	4%	0.042	22%	0.217	C	C	.	.	S	Bend	trans	-84.1	120.9	175.5	-176.5	61	-159.3	0	0	110.2	L51 L220 G223 F227 R342 S363	L51-E225 HydrophobicContact CD2-CG 4.07Å; L220-E225 HydrophobicContact CD1-CB 4Å; G223-E225 VanDerWaalsContact C-N 3.34Å; E225-F227 HydrophobicContact CB-CD2 4.16Å; E225-F227 HydrophobicContact CB-CE2 3.59Å; E225-F227 HydrophobicContact CB-CZ 4.14Å; E225-F227 HydrophobicContact CG-CD2 4.08Å; E225-F227 HydrophobicContact CG-CE1 4.28Å; E225-F227 HydrophobicContact CG-CE2 3.51Å; E225-F227 HydrophobicContact CG-CZ 3.6Å; E225-F227 VanDerWaalsContact O-CD2 3.29Å; E225-F227 WeakPolarHBondContact O-CD2 3.28Å; E225-F227 PolarHBondContact O-N 2.97Å; E225-F227 VanDerWaalsContact O-N 3.09Å; E225-R342 IonicContact OE1-CZ 3.65Å; E225-R342 IonicContact OE1-NE 2.75Å; E225-R342 IonicContact OE1-NH1 3.89Å; E225-R342 PolarHBondContact OE1-NH1 3.03Å; E225-R342 WeakPolarHBondContact OE2-CB 3.46Å; E225-R342 WeakPolarHBondContact OE2-CD 3.48Å; E225-R342 WeakPolarHBondContact OE2-CG 3.33Å; E225-R342 IonicContact OE2-NE 3.32Å; E225-S363 VanDerWaalsContact OE1-CB 3.29Å; E225-S363 WeakPolarHBondContact OE1-CB 3.48Å; E225-S363 PolarHBondContact OE1-OG 2.81Å
226	P	88.8	Confident	87.9	Confident	60 Å²	60	45.4 Å²	45.4	39%	0.39	23%	0.233	S	C	.	.			trans	-73	107.5	177.3	28.3	-33.1	0	0	0	109.9	D224 P362 S363	D224-P226 WeakPolarHBondContact O-CD 3.4Å; P226-P362 HydrophobicContact CB-CB 4.31Å; P226-P362 CarbonylContact O-C 3.58Å; P226-P362 WeakPolarHBondContact O-CA 3.42Å; P226-P362 WeakPolarHBondContact O-CB 3.2Å; P226-S363 PolarHBondContact O-N 2.9Å
227	F	90	Very high	87.1	Confident	32 Å²	32	47.6 Å²	47.6	14%	0.14	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	128	172.7	-73.6	-78.7	0	0	0	112.3	E225 I304 I306 S363 L365 P481	E225-F227 HydrophobicContact CB-CD2 4.16Å; E225-F227 HydrophobicContact CB-CE2 3.59Å; E225-F227 HydrophobicContact CB-CZ 4.14Å; E225-F227 HydrophobicContact CG-CD2 4.08Å; E225-F227 HydrophobicContact CG-CE1 4.28Å; E225-F227 HydrophobicContact CG-CE2 3.51Å; E225-F227 HydrophobicContact CG-CZ 3.6Å; E225-F227 VanDerWaalsContact O-CD2 3.29Å; E225-F227 WeakPolarHBondContact O-CD2 3.28Å; E225-F227 PolarHBondContact O-N 2.97Å; E225-F227 VanDerWaalsContact O-N 3.09Å; F227-I304 HydrophobicContact CE1-CG2 4.18Å; F227-I306 HydrophobicContact CE1-CD1 3.94Å; F227-I306 HydrophobicContact CZ-CD1 4Å; F227-S363 CarbonylContact C-O 3.58Å; F227-S363 VanDerWaalsContact CA-O 3.32Å; F227-S363 WeakPolarHBondContact CA-O 3.49Å; F227-S363 VanDerWaalsContact CE1-CB 3.48Å; F227-L365 HydrophobicContact CB-CB 4.3Å; F227-L365 HydrophobicContact CD1-CB 4Å; F227-L365 HydrophobicContact CG-CB 4.39Å; F227-P481 HydrophobicContact CD2-CG 4.45Å; F227-P481 HydrophobicContact CE1-CG 3.89Å; F227-P481 VanDerWaalsContact CE2-CD 3.4Å; F227-P481 HydrophobicContact CE2-CG 3.56Å; F227-P481 HydrophobicContact CZ-CG 3.24Å
228	R	88.7	Confident	85.8	Confident	100 Å²	100	53.8 Å²	53.8	38%	0.377	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	112.4	163	178.7	-174.3	177.7	-141.9	2.1	108.4	L230 K256 P362 S363 E364 L365	R228-L230 HydrophobicContact CG-CD2 4.48Å; R228-K256 PolarHBondContact NH1-O 3.27Å; R228-P362 HydrophobicContact CB-CB 4.34Å; R228-P362 HydrophobicContact CB-CG 4.05Å; R228-S363 PolarHBondContact N-O 2.69Å; R228-E364 HydrophobicContact CB-CG 4.42Å; R228-E364 IonicContact CZ-OE1 3.28Å; R228-E364 IonicContact NH1-OE1 3.85Å; R228-E364 PolarHBondContact NH1-OE1 3.28Å; R228-E364 WeakPolarHBondContact O-CA 3.29Å; R228-L365 PolarHBondContact O-N 2.99Å
229	N	87	Confident	83.8	Confident	34 Å²	34	61.2 Å²	61.2	18%	0.182	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	132.3	177.8	-66.8	-26	0	0	0	111.1	F231 L365	N229-F231 HydrophobicContact CB-CE2 4.35Å; N229-F231 HydrophobicContact CB-CZ 4.29Å; N229-L365 WeakPolarHBondContact CA-O 3.45Å
230	L	86.5	Confident	81.5	Confident	11 Å²	11	68.7 Å²	68.7	6%	0.058	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	127.9	-175.4	-78.8	-170.8	0	0	0	107.9	R228 L255 W274 E364 L365 M366 I367	R228-L230 HydrophobicContact CG-CD2 4.48Å; L230-L255 HydrophobicContact CB-CD2 3.43Å; L230-L255 VanDerWaalsContact CB-CD2 3.43Å; L230-L255 HydrophobicContact CD1-CD2 4.22Å; L230-L255 HydrophobicContact CD2-CD2 3.77Å; L230-L255 HydrophobicContact CG-CD2 3.97Å; L230-W274 HydrophobicContact CD1-CH2 4.36Å; L230-E364 HydrophobicContact CD1-CB 4.33Å; L230-L365 PolarHBondContact N-O 3.46Å; L230-M366 HydrophobicContact CB-CB 4.42Å; L230-M366 HydrophobicContact CB-CG 3.72Å; L230-M366 HydrophobicContact CD1-CE 3.72Å; L230-M366 HydrophobicContact CD1-CG 3.89Å; L230-M366 HydrophobicContact CG-CG 4.45Å; L230-M366 CarbonylContact O-C 3.54Å; L230-M366 WeakPolarHBondContact O-CA 3.27Å; L230-I367 PolarHBondContact O-N 3.33Å
231	F	85.1	Confident	78.9	Confident	60 Å²	60	73.9 Å²	73.9	26%	0.263	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	113.4	-178	-61.8	-75.8	0	0	0	110.5	N229 L255 I367 T467 I470	N229-F231 HydrophobicContact CB-CE2 4.35Å; N229-F231 HydrophobicContact CB-CZ 4.29Å; F231-L255 VanDerWaalsContact O-CD1 3.23Å; F231-L255 WeakPolarHBondContact O-CD1 3.28Å; F231-I367 WeakPolarHBondContact CA-O 3.4Å; F231-I367 HydrophobicContact CD1-CB 4.11Å; F231-I367 HydrophobicContact CE1-CB 4.2Å; F231-I367 HydrophobicContact CE1-CD1 4.01Å; F231-I367 HydrophobicContact CE1-CG2 4.48Å; F231-T467 HydrophobicContact CD1-CG2 3.91Å; F231-T467 HydrophobicContact CE1-CG2 4.4Å; F231-I470 HydrophobicContact CE1-CB 4.42Å; F231-I470 HydrophobicContact CE1-CD1 3.94Å; F231-I470 HydrophobicContact CE2-CG2 4.15Å; F231-I470 HydrophobicContact CZ-CB 3.77Å; F231-I470 HydrophobicContact CZ-CD1 3.78Å; F231-I470 HydrophobicContact CZ-CG1 4.37Å; F231-I470 HydrophobicContact CZ-CG2 3.57Å
232	S	82.8	Confident	76.5	Confident	24 Å²	24	74.7 Å²	74.7	17%	0.168	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-93.2	167.8	173.8	-171.1	0	0	0	0	111	D252 I367	S232-D252 PolarHBondContact OG-OD1 3.37Å; S232-I367 PolarHBondContact N-O 3.09Å
233	Q	82	Confident	73.8	Confident	142 Å²	142	81.9 Å²	81.9	66%	0.664	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-70.9	162.3	-179.4	-62.9	-176.8	-5	0	0	111.8	K235	Q233-K235 PolarHBondContact O-N 3.28Å
234	L	81.1	Confident	71.4	Confident	95 Å²	95	88 Å²	88	50%	0.497	43%	0.431	S	S	.	.	P	Polyproline II helix	trans	-60	123.7	175	177.4	75.7	0	0	0	110.3	S369 I371	L234-S369 WeakPolarHBondContact CA-O 3.38Å; L234-S369 VanDerWaalsContact CD1-CB 3.45Å; L234-I371 HydrophobicContact CD1-CD1 4.25Å; L234-I371 HydrophobicContact CD1-CG1 4.21Å; L234-I371 HydrophobicContact CD2-CD1 3.98Å; L234-I371 HydrophobicContact CG-CD1 4.48Å
235	K	83	Confident	68.4	Low	55 Å²	55	88.6 Å²	88.6	24%	0.239	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	127.1	172.3	-172.3	169.5	-177.6	174.1	0	111.5	Q233 I237 E242 S369 C370 I371	Q233-K235 PolarHBondContact O-N 3.28Å; K235-I237 HydrophobicContact CG-CG1 4.47Å; K235-E242 IonicContact NZ-OE1 3.83Å; K235-E242 PolarHBondContact NZ-OE1 2.9Å; K235-E242 IonicContact NZ-OE2 3.7Å; K235-S369 PolarHBondContact N-O 3.1Å; K235-S369 VanDerWaalsContact N-O 3.11Å; K235-C370 VanDerWaalsContact O-CA 3.24Å; K235-C370 WeakPolarHBondContact O-CA 3.36Å; K235-I371 PolarHBondContact O-N 3.47Å
236	I	78.7	Confident	65.8	Low	67 Å²	67	91.2 Å²	91.2	34%	0.344	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	116.2	169	-57.6	170.1	0	0	0	107.8	Q238 F289 F291 I371	I236-Q238 HydrophobicContact CG2-CG 4.25Å; I236-F289 HydrophobicContact CG2-CZ 4.46Å; I236-F291 HydrophobicContact CD1-CE1 3.7Å; I236-F291 HydrophobicContact CD1-CZ 4.04Å; I236-I371 HydrophobicContact CG1-CB 4.48Å; I236-I371 HydrophobicContact CG1-CD1 4.38Å
237	I	78.1	Confident	62.9	Low	46 Å²	46	94.6 Å²	94.6	24%	0.236	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	102.4	179.1	-54.9	176.8	0	0	0	107.6	K235 C280 C370 I371 N372	K235-I237 HydrophobicContact CG-CG1 4.47Å; I237-C280 HydrophobicContact CD1-CB 3.71Å; I237-C370 HydrophobicContact CD1-CB 4.42Å; I237-I371 PolarHBondContact N-O 3.06Å; I237-N372 HydrophobicContact CB-CB 4.25Å; I237-N372 HydrophobicContact CD1-CB 4.43Å
238	Q	67.6	Low	60.2	Low	129 Å²	129	99.2 Å²	99.2	60%	0.603	52%	0.516	S	S	*	.			trans	-88.6	137	170.1	-61.2	-176.5	4	0	0	108.8	I236 K240	I236-Q238 HydrophobicContact CG2-CG 4.25Å; Q238-K240 PolarHBondContact O-N 2.76Å
239	R	53.3	Low	57.7	Low	159 Å²	159	99.4 Å²	99.4	60%	0.6	53%	0.528	S	S	*	.	S	Bend	trans	-68.1	15.7	178.9	-72.3	-173	-171	-169	0.2	115.2	E373 P375	R239-E373 PolarHBondContact NH2-O 2.87Å; R239-P375 VanDerWaalsContact NH2-N 3.12Å
240	K	44.7	Very low	55.7	Low	161 Å²	161	101.2 Å²	101.2	70%	0.7	54%	0.544	S	S	*	.	S	Bend	trans	-72.6	126.8	168.1	-74.6	-179.1	179.6	177.4	0	107	Q238 E242	Q238-K240 PolarHBondContact O-N 2.76Å; K240-E242 PolarHBondContact O-N 3.42Å
241	P	39.1	Very low	53.7	Low	117 Å²	117	107.2 Å²	107.2	76%	0.76	58%	0.576	S	S	*	*			trans	-58.9	110	174.5	23.6	-30.6	0	0	0	107.4	L243	P241-L243 PolarHBondContact O-N 3.4Å
242	E	39.2	Very low	52	Low	134 Å²	134	106.5 Å²	106.5	63%	0.626	58%	0.575	S	S	*	*			trans	-55.8	109.7	161.9	-76.1	175.3	-179.6	0	0	104.5	K235 K240 I244	K235-E242 IonicContact NZ-OE1 3.83Å; K235-E242 PolarHBondContact NZ-OE1 2.9Å; K235-E242 IonicContact NZ-OE2 3.7Å; K240-E242 PolarHBondContact O-N 3.42Å; E242-I244 PolarHBondContact O-N 2.89Å; E242-I244 VanDerWaalsContact O-N 3.16Å
243	L	30.3	Very low	50.3	Low	162 Å²	162	111 Å²	111	85%	0.848	60%	0.597	S	S	*	*			trans	-48.6	128.9	168.8	-96.5	94.1	0	0	0	106	P241 S245	P241-L243 PolarHBondContact O-N 3.4Å; L243-S245 PolarHBondContact O-N 3.13Å
244	I	32.5	Very low	48.9	Very low	173 Å²	173	111.1 Å²	111.1	89%	0.887	60%	0.602	S	S	*	*			trans	-67.4	72.9	174.4	-54.4	169.5	0	0	0	107	E242 G246	E242-I244 PolarHBondContact O-N 2.89Å; E242-I244 VanDerWaalsContact O-N 3.16Å; I244-G246 PolarHBondContact O-N 3.39Å; I244-G246 VanDerWaalsContact O-N 3.12Å
245	S	27.6	Very low	48.1	Very low	91 Å²	91	109.1 Å²	109.1	64%	0.636	59%	0.592	S	S	*	*			trans	-74	90.5	157.6	164.8	0	0	0	0	104.4	L243 N247	L243-S245 PolarHBondContact O-N 3.13Å; S245-N247 PolarHBondContact O-N 2.84Å
246	G	36.1	Very low	47.6	Very low	63 Å²	63	114.9 Å²	114.9	65%	0.649	62%	0.617	S	S	*	*			trans	-60.8	87.8	164	0	0	0	0	0	108.3	I244	I244-G246 PolarHBondContact O-N 3.39Å; I244-G246 VanDerWaalsContact O-N 3.12Å
247	N	28.5	Very low	47.9	Very low	131 Å²	131	113.8 Å²	113.8	70%	0.701	62%	0.615	S	S	*	*	S	Bend	trans	178.7	108.2	156.2	-89.9	-14.9	0	0	0	106.9	S245	S245-N247 PolarHBondContact O-N 2.84Å
248	T	31.7	Very low	48.3	Very low	129 Å²	129	113.8 Å²	113.8	79%	0.791	62%	0.615	S	S	*	*			trans	41.2	82.3	156.2	56.5	0	0	0	0	116	S250	T248-S250 PolarHBondContact O-N 3.25Å
249	T	37.7	Very low	49.3	Very low	104 Å²	104	110.9 Å²	110.9	64%	0.638	61%	0.613	S	S	*	*			trans	-65.3	104.2	158.2	50.1	0	0	0	0	108.1	D251	T249-D251 PolarHBondContact O-N 3.05Å; T249-D251 VanDerWaalsContact O-N 3.1Å
250	S	43.5	Very low	51.2	Low	73 Å²	73	105.5 Å²	105.5	51%	0.51	60%	0.603	S	S	.	*	G	3₁₀ helix	trans	-67.9	7.9	-177.3	53.1	0	0	0	0	115.5	T248 D253	T248-S250 PolarHBondContact O-N 3.25Å; S250-D253 VanDerWaalsContact CA-OD2 3.29Å; S250-D253 WeakPolarHBondContact CA-OD2 3.33Å; S250-D253 VanDerWaalsContact CB-OD2 3.25Å; S250-D253 WeakPolarHBondContact CB-OD2 3.25Å; S250-D253 WeakPolarHBondContact O-CB 3.34Å; S250-D253 VanDerWaalsContact O-CG 3.29Å
251	D	44.7	Very low	53.5	Low	137 Å²	137	101.6 Å²	101.6	73%	0.733	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-84.6	-10.9	-173.9	-77.5	-12.2	0	0	0	114.2	T249	T249-D251 PolarHBondContact O-N 3.05Å; T249-D251 VanDerWaalsContact O-N 3.1Å
252	D	50	Low	56.2	Low	45 Å²	45	102.1 Å²	102.1	24%	0.241	58%	0.575	C	S	.	*	G	3₁₀ helix	trans	-98.6	7	173.2	-83.8	-38.4	0	0	0	112.5	S232 N254 L255 R368	S232-D252 PolarHBondContact OG-OD1 3.37Å; D252-N254 VanDerWaalsContact C-N 3.28Å; D252-N254 PolarHBondContact O-N 2.91Å; D252-L255 PolarHBondContact O-N 2.98Å; D252-R368 IonicContact OD1-NH1 3.76Å; D252-R368 IonicContact OD2-NH1 2.96Å
253	D	46.4	Very low	58.8	Low	118 Å²	118	96.9 Å²	96.9	63%	0.631	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	-14.6	-164	-82.1	-11.8	0	0	0	116.6	S250	S250-D253 VanDerWaalsContact CA-OD2 3.29Å; S250-D253 WeakPolarHBondContact CA-OD2 3.33Å; S250-D253 VanDerWaalsContact CB-OD2 3.25Å; S250-D253 WeakPolarHBondContact CB-OD2 3.25Å; S250-D253 WeakPolarHBondContact O-CB 3.34Å; S250-D253 VanDerWaalsContact O-CG 3.29Å
254	N	53.6	Low	61.7	Low	144 Å²	144	95.5 Å²	95.5	77%	0.77	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-15.9	-179.5	-74.9	-27.5	0	0	0	114	D252	D252-N254 VanDerWaalsContact C-N 3.28Å; D252-N254 PolarHBondContact O-N 2.91Å
255	L	64	Low	64.6	Low	54 Å²	54	93.8 Å²	93.8	28%	0.283	54%	0.536	S	S	.	.	S	Bend	trans	-101	99.2	179.8	-113.2	83.9	0	0	0	111.9	L230 F231 D252 S257	L230-L255 HydrophobicContact CB-CD2 3.43Å; L230-L255 VanDerWaalsContact CB-CD2 3.43Å; L230-L255 HydrophobicContact CD1-CD2 4.22Å; L230-L255 HydrophobicContact CD2-CD2 3.77Å; L230-L255 HydrophobicContact CG-CD2 3.97Å; F231-L255 VanDerWaalsContact O-CD1 3.23Å; F231-L255 WeakPolarHBondContact O-CD1 3.28Å; D252-L255 PolarHBondContact O-N 2.98Å; L255-S257 PolarHBondContact O-N 3.1Å
256	K	72.9	Confident	67.7	Low	175 Å²	175	91 Å²	91	76%	0.761	51%	0.513	S	S	*	.			trans	-68.7	100.4	176.9	-161	171.8	-174.8	175	0	110.8	R228	R228-K256 PolarHBondContact NH1-O 3.27Å
257	S	83.7	Confident	70.4	Confident	45 Å²	45	88.8 Å²	88.8	32%	0.315	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-58.3	160.2	164.6	61.6	0	0	0	0	110.8	L255 A259	L255-S257 PolarHBondContact O-N 3.1Å; S257-A259 PolarHBondContact O-N 2.87Å; S257-A259 VanDerWaalsContact O-N 3.13Å
258	L	87.6	Confident	73.6	Confident	46 Å²	46	82.5 Å²	82.5	24%	0.241	45%	0.453	C	S	.	.	P	Polyproline II helix	trans	-64.5	116.2	177.4	-72.6	170.8	0	0	0	110.2	R361 P362 E364	L258-R361 VanDerWaalsContact CB-NH2 3.32Å; L258-R361 HydrophobicContact CD1-CG 4.25Å; L258-R361 PolarHBondContact O-NH2 2.57Å; L258-P362 HydrophobicContact CD1-CG 4Å; L258-E364 HydrophobicContact CD1-CG 4.05Å; L258-E364 HydrophobicContact CG-CG 4.35Å; L258-E364 WeakPolarHBondContact CG-OE1 3.43Å; L258-E364 PolarHBondContact N-OE1 3.48Å; L258-E364 VanDerWaalsContact N-OE1 3.13Å; L258-E364 PolarHBondContact N-OE2 3.09Å
259	A	88.8	Confident	76.6	Confident	67 Å²	67	79.3 Å²	79.3	55%	0.554	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-54.5	150.6	175.5	0	0	0	0	0	111.8	S257 R361	S257-A259 PolarHBondContact O-N 2.87Å; S257-A259 VanDerWaalsContact O-N 3.13Å; A259-R361 PolarHBondContact O-NH1 3.15Å; A259-R361 PolarHBondContact O-NH2 2.75Å; A259-R361 VanDerWaalsContact O-NH2 3.16Å
260	A	92.9	Very high	79.3	Confident	47 Å²	47	74.4 Å²	74.4	39%	0.388	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-61.4	138.1	171.2	0	0	0	0	0	109.9	Y262 L270	A260-Y262 HydrophobicContact CB-CE2 4.31Å; A260-L270 CarbonylContact C-O 3.52Å; A260-L270 VanDerWaalsContact CA-O 3.29Å; A260-L270 WeakPolarHBondContact CA-O 3.47Å
261	Q	93.3	Very high	81.7	Confident	78 Å²	78	72.8 Å²	72.8	36%	0.364	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	128.6	178.9	-70.2	174.1	0.7	0	0	109.1	L270	Q261-L270 HydrophobicContact CB-CB 4.38Å; Q261-L270 PolarHBondContact N-O 3.38Å; Q261-L270 PolarHBondContact O-N 2.88Å
262	Y	95.2	Very high	83.9	Confident	129 Å²	129	67 Å²	67	51%	0.506	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	107	177.8	-64.9	-91.8	0	0	0	108.8	A260 I264 K269 I312	A260-Y262 HydrophobicContact CB-CE2 4.31Å; Y262-I264 VanDerWaalsContact C-N 3.29Å; Y262-I264 PolarHBondContact O-N 3.44Å; Y262-K269 HydrophobicContact CD1-CB 4.28Å; Y262-K269 HydrophobicContact CD1-CD 4.34Å; Y262-K269 HydrophobicContact CD1-CG 4Å; Y262-K269 HydrophobicContact CE1-CB 4.41Å; Y262-K269 HydrophobicContact CE1-CD 3.65Å; Y262-K269 HydrophobicContact CE1-CG 3.77Å; Y262-K269 WeakPolarHBondContact OH-CE 3.25Å; Y262-I312 HydrophobicContact CD1-CD1 4.22Å; Y262-I312 HydrophobicContact CD1-CG1 4.23Å
263	L	93.5	Very high	85.9	Confident	23 Å²	23	70.4 Å²	70.4	12%	0.12	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	74.1	172.8	-55	-177.9	0	0	0	108.4	N265 N266 N267 L268 L270 P355 E357 I358	L263-N265 PolarHBondContact O-N 2.82Å; L263-N266 HydrophobicContact CB-CB 4.13Å; L263-N266 CarbonylContact O-C 3.54Å; L263-N266 PolarHBondContact O-N 2.83Å; L263-N267 PolarHBondContact O-N 3.05Å; L263-L268 WeakPolarHBondContact CA-O 3.2Å; L263-L268 HydrophobicContact CB-CB 4.4Å; L263-L268 WeakPolarHBondContact CB-O 3.37Å; L263-L268 PolarHBondContact N-O 3.09Å; L263-L268 PolarHBondContact O-N 3.23Å; L263-L268 VanDerWaalsContact O-N 3.16Å; L263-L270 HydrophobicContact CD1-CD1 3.35Å; L263-L270 HydrophobicContact CG-CD1 3.56Å; L263-P355 HydrophobicContact CD1-CB 3.81Å; L263-P355 HydrophobicContact CD1-CG 3.46Å; L263-P355 VanDerWaalsContact CD1-CG 3.46Å; L263-E357 HydrophobicContact CD1-CB 4.13Å; L263-E357 HydrophobicContact CD2-CB 4.12Å; L263-E357 HydrophobicContact CD2-CG 3.95Å; L263-I358 HydrophobicContact CD1-CG1 4.32Å
264	I	92.3	Very high	87.8	Confident	134 Å²	134	67.2 Å²	67.2	69%	0.687	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-54.5	-41.8	-175.7	-58.5	173.3	0	0	0	110.7	Y262 N266 N267 I312	Y262-I264 VanDerWaalsContact C-N 3.29Å; Y262-I264 PolarHBondContact O-N 3.44Å; I264-N266 PolarHBondContact O-N 3.16Å; I264-N266 VanDerWaalsContact O-N 3.15Å; I264-N267 PolarHBondContact O-N 3.05Å; I264-I312 HydrophobicContact CG1-CD1 4.42Å
265	N	92.5	Very high	89.3	Confident	137 Å²	137	62 Å²	62	73%	0.733	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-60.7	-26.1	178.7	-67.1	-14.7	0	0	0	113.9	L263	L263-N265 PolarHBondContact O-N 2.82Å
266	N	93.2	Very high	90.2	Very high	31 Å²	31	63.1 Å²	63.1	17%	0.166	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-101.3	-6.8	179.6	-62.4	89.3	0	0	0	112.7	L263 I264 L268 R319	L263-N266 HydrophobicContact CB-CB 4.13Å; L263-N266 CarbonylContact O-C 3.54Å; L263-N266 PolarHBondContact O-N 2.83Å; I264-N266 PolarHBondContact O-N 3.16Å; I264-N266 VanDerWaalsContact O-N 3.15Å; N266-L268 VanDerWaalsContact C-N 3.28Å; N266-L268 HydrophobicContact CB-CB 4.33Å; N266-L268 HydrophobicContact CB-CD1 4.07Å; N266-L268 HydrophobicContact CB-CG 4.14Å; N266-R319 PolarHBondContact ND2-O 2.85Å; N266-R319 PolarHBondContact O-N 2.75Å
267	N	93.7	Very high	90.7	Very high	17 Å²	17	56.8 Å²	56.8	9%	0.091	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	39.9	-167	-173.5	31.2	0	0	0	112.7	L263 I264 P311 I312 D313 Y316	L263-N267 PolarHBondContact O-N 3.05Å; I264-N267 PolarHBondContact O-N 3.05Å; N267-P311 VanDerWaalsContact O-CA 3.31Å; N267-P311 WeakPolarHBondContact O-CA 3.37Å; N267-I312 PolarHBondContact O-N 3.15Å; N267-I312 VanDerWaalsContact O-N 3.13Å; N267-I312 WeakPolarHBondContact OD1-CB 3.25Å; N267-I312 PolarHBondContact OD1-N 2.95Å; N267-D313 PolarHBondContact ND2-O 2.8Å; N267-D313 PolarHBondContact OD1-N 2.83Å; N267-Y316 PolarHBondContact ND2-O 2.77Å
268	L	94.9	Very high	90.7	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	138.4	-177.9	-65.4	174.8	0	0	0	111.5	L263 N266 V309 I318 L323 L331 M350 P355 I358	L263-L268 WeakPolarHBondContact CA-O 3.2Å; L263-L268 HydrophobicContact CB-CB 4.4Å; L263-L268 WeakPolarHBondContact CB-O 3.37Å; L263-L268 PolarHBondContact N-O 3.09Å; L263-L268 PolarHBondContact O-N 3.23Å; L263-L268 VanDerWaalsContact O-N 3.16Å; N266-L268 VanDerWaalsContact C-N 3.28Å; N266-L268 HydrophobicContact CB-CB 4.33Å; N266-L268 HydrophobicContact CB-CD1 4.07Å; N266-L268 HydrophobicContact CB-CG 4.14Å; L268-V309 HydrophobicContact CB-CG2 4.24Å; L268-V309 HydrophobicContact CD1-CG2 4.42Å; L268-V309 HydrophobicContact CD2-CG2 3.93Å; L268-V309 HydrophobicContact CG-CG2 4.43Å; L268-I318 HydrophobicContact CD1-CG2 4.18Å; L268-I318 HydrophobicContact CD2-CD1 3.99Å; L268-I318 HydrophobicContact CD2-CG1 4.07Å; L268-I318 HydrophobicContact CD2-CG2 4.17Å; L268-I318 HydrophobicContact CG-CG2 4.23Å; L268-L323 HydrophobicContact CD1-CD2 4.2Å; L268-L331 HydrophobicContact CD2-CD1 4.21Å; L268-M350 HydrophobicContact CD1-CE 4.18Å; L268-P355 HydrophobicContact CD1-CG 4.4Å; L268-I358 HydrophobicContact CD1-CD1 3.76Å
269	K	94.1	Very high	90.4	Very high	62 Å²	62	55 Å²	55	27%	0.27	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	126.8	172.7	178.4	-172.6	178.1	177.7	0	108.9	Y262 Y271 V309 T310 I312	Y262-K269 HydrophobicContact CD1-CB 4.28Å; Y262-K269 HydrophobicContact CD1-CD 4.34Å; Y262-K269 HydrophobicContact CD1-CG 4Å; Y262-K269 HydrophobicContact CE1-CB 4.41Å; Y262-K269 HydrophobicContact CE1-CD 3.65Å; Y262-K269 HydrophobicContact CE1-CG 3.77Å; Y262-K269 WeakPolarHBondContact OH-CE 3.25Å; K269-Y271 HydrophobicContact CD-CD1 4.23Å; K269-Y271 HydrophobicContact CG-CD1 4.12Å; K269-V309 WeakPolarHBondContact O-CA 3.46Å; K269-T310 HydrophobicContact CB-CG2 3.96Å; K269-T310 HydrophobicContact CD-CG2 4.13Å; K269-T310 HydrophobicContact CG-CG2 4.44Å; K269-T310 PolarHBondContact N-O 2.8Å; K269-T310 PolarHBondContact O-N 2.78Å; K269-I312 HydrophobicContact CB-CG1 3.9Å
270	L	94.5	Very high	90.3	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	135.6	171.3	-63.7	81.6	0	0	0	109.4	A260 Q261 L263 H308 I358 R361	A260-L270 CarbonylContact C-O 3.52Å; A260-L270 VanDerWaalsContact CA-O 3.29Å; A260-L270 WeakPolarHBondContact CA-O 3.47Å; Q261-L270 HydrophobicContact CB-CB 4.38Å; Q261-L270 PolarHBondContact N-O 3.38Å; Q261-L270 PolarHBondContact O-N 2.88Å; L263-L270 HydrophobicContact CD1-CD1 3.35Å; L263-L270 HydrophobicContact CG-CD1 3.56Å; L270-H308 WeakPolarHBondContact CA-O 2.97Å; L270-I358 HydrophobicContact CD1-CD1 4.48Å; L270-I358 HydrophobicContact CD1-CG1 3.85Å; L270-I358 HydrophobicContact CD2-CB 4.14Å; L270-I358 HydrophobicContact CD2-CG1 3.51Å; L270-I358 HydrophobicContact CG-CG1 3.84Å; L270-R361 HydrophobicContact CD2-CB 4.25Å
271	Y	93.4	Very high	89.8	Confident	39 Å²	39	50.3 Å²	50.3	15%	0.153	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	165	175.3	59.7	-79.2	0	0	0	110	K269 H308 T310 P337 G338	K269-Y271 HydrophobicContact CD-CD1 4.23Å; K269-Y271 HydrophobicContact CG-CD1 4.12Å; Y271-H308 HydrophobicContact CD2-CB 4.36Å; Y271-H308 HydrophobicContact CE1-CB 4.04Å; Y271-H308 HydrophobicContact CE2-CB 3.88Å; Y271-H308 PolarHBondContact N-O 2.92Å; Y271-H308 PolarHBondContact O-N 3.26Å; Y271-T310 HydrophobicContact CD1-CG2 4.46Å; Y271-T310 HydrophobicContact CE1-CG2 3.66Å; Y271-P337 PolarHBondContact OH-O 3.04Å; Y271-G338 PolarHBondContact OH-N 3.14Å
272	T	92.2	Very high	89.4	Confident	17 Å²	17	46.8 Å²	46.8	10%	0.104	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	116.7	175.4	-53.2	0	0	0	0	108.3	W274 G305 I306 R361 E364	T272-W274 HydrophobicContact CG2-CD2 4.16Å; T272-W274 HydrophobicContact CG2-CG 4.44Å; T272-W274 HydrophobicContact CG2-CZ2 3.85Å; T272-G305 VanDerWaalsContact CG2-C 3.42Å; T272-G305 VanDerWaalsContact CG2-CA 3.4Å; T272-I306 CarbonylContact C-O 3.56Å; T272-I306 WeakPolarHBondContact CA-O 3.22Å; T272-R361 PolarHBondContact OG1-NH2 3.3Å; T272-R361 VanDerWaalsContact OG1-NH2 3.08Å; T272-E364 PolarHBondContact OG1-OE2 3.09Å
273	Y	90.8	Very high	88.9	Confident	116 Å²	116	40.7 Å²	40.7	46%	0.455	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	116.1	171.9	-175.9	-91.3	0	0	0	109.2	G305 I306	Y273-G305 CarbonylContact O-C 3.57Å; Y273-G305 WeakPolarHBondContact O-CA 3.28Å; Y273-I306 PolarHBondContact N-O 2.7Å; Y273-I306 PolarHBondContact O-N 3.42Å
274	W	87.7	Confident	88.4	Confident	51 Å²	51	39.6 Å²	39.6	19%	0.193	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	126.1	-174.9	-72.5	99.1	0	0	0	112	L230 T272 R303 G305 E364 M366	L230-W274 HydrophobicContact CD1-CH2 4.36Å; T272-W274 HydrophobicContact CG2-CD2 4.16Å; T272-W274 HydrophobicContact CG2-CG 4.44Å; T272-W274 HydrophobicContact CG2-CZ2 3.85Å; W274-R303 HydrophobicContact CE3-CG 3.91Å; W274-R303 HydrophobicContact CZ3-CG 4.4Å; W274-G305 VanDerWaalsContact CE3-CA 3.4Å; W274-E364 HydrophobicContact CH2-CB 3.45Å; W274-E364 VanDerWaalsContact CH2-CB 3.45Å; W274-E364 HydrophobicContact CZ2-CB 3.81Å; W274-E364 HydrophobicContact CZ2-CG 4.46Å; W274-E364 WeakPolarHBondContact CZ2-OE2 3.41Å; W274-E364 HydrophobicContact CZ3-CB 4.37Å; W274-M366 HydrophobicContact CE3-SD 4.3Å; W274-M366 HydrophobicContact CH2-CB 4.49Å; W274-M366 HydrophobicContact CH2-CE 3.53Å; W274-M366 HydrophobicContact CH2-CG 3.58Å; W274-M366 HydrophobicContact CH2-SD 3.59Å; W274-M366 VanDerWaalsContact CH2-SD 3.59Å; W274-M366 HydrophobicContact CZ2-CE 3.61Å; W274-M366 HydrophobicContact CZ2-SD 4.17Å; W274-M366 HydrophobicContact CZ3-CB 4.18Å; W274-M366 HydrophobicContact CZ3-CE 4.21Å; W274-M366 HydrophobicContact CZ3-CG 3.72Å; W274-M366 HydrophobicContact CZ3-SD 3.66Å
275	N	84.5	Confident	87.7	Confident	35 Å²	35	34 Å²	34	19%	0.187	17%	0.167	C	C	.	.	P	Polyproline II helix	trans	-74.1	170.3	167.7	-71.7	-0.3	0	0	0	111.4	Y29 R303 I304	Y29-N275 WeakPolarHBondContact CD1-ND2 3.42Å; Y29-N275 WeakPolarHBondContact CE1-ND2 3.46Å; N275-R303 WeakPolarHBondContact O-CG 3.32Å; N275-R303 PolarHBondContact O-NE 3.47Å; N275-I304 PolarHBondContact N-O 3.28Å
276	S	82.9	Confident	86.8	Confident	76 Å²	76	33.3 Å²	33.3	53%	0.531	16%	0.158	S	C	.	.	P	Polyproline II helix	trans	-62.4	155.9	167	-58.9	0	0	0	0	111.4
277	W	84.1	Confident	85.5	Confident	43 Å²	43	39.5 Å²	39.5	16%	0.163	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-59.1	138.5	166.4	-75.6	102.6	0	0	0	110.2	Q301 R303 M366 R368	W277-Q301 HydrophobicContact CE3-CB 3.6Å; W277-Q301 HydrophobicContact CZ3-CB 4.09Å; W277-R303 HydrophobicContact CD2-CB 3.7Å; W277-R303 HydrophobicContact CD2-CG 4.31Å; W277-R303 HydrophobicContact CE3-CB 3.55Å; W277-R303 HydrophobicContact CG-CB 4.3Å; W277-R303 HydrophobicContact CH2-CB 4.13Å; W277-R303 HydrophobicContact CZ2-CB 4.25Å; W277-R303 HydrophobicContact CZ3-CB 3.77Å; W277-M366 HydrophobicContact CH2-CB 3.87Å; W277-M366 HydrophobicContact CZ3-CB 4.37Å; W277-R368 VanDerWaalsContact CE2-CZ 3.47Å; W277-R368 HydrophobicContact CE3-CG 4.36Å; W277-R368 HydrophobicContact CH2-CB 4.25Å; W277-R368 HydrophobicContact CH2-CG 3.78Å; W277-R368 HydrophobicContact CZ3-CB 4.41Å; W277-R368 HydrophobicContact CZ3-CG 3.69Å
278	S	83.8	Confident	83.9	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.014	19%	0.19	C	C	.	.	P	Polyproline II helix	trans	-66.8	159.8	168.5	66	0	0	0	0	111.5	Q301 I302 Y483	S278-Q301 VanDerWaalsContact O-CG 3.28Å; S278-Q301 WeakPolarHBondContact O-CG 3.18Å; S278-Q301 PolarHBondContact O-NE2 3.41Å; S278-I302 PolarHBondContact N-O 2.85Å; S278-I302 PolarHBondContact OG-N 2.92Å; S278-I302 PolarHBondContact OG-O 2.86Å; S278-Y483 WeakPolarHBondContact CB-OH 3.49Å; S278-Y483 PolarHBondContact OG-OH 3.35Å
279	E	81.2	Confident	82	Confident	52 Å²	52	42.6 Å²	42.6	24%	0.243	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-53.7	141.1	171.1	-83.8	168.3	-149.3	0	0	112.1	H25 M281	H25-E279 PolarHBondContact N-OE1 3.43Å; H25-E279 VanDerWaalsContact O-CG 3.3Å; H25-E279 WeakPolarHBondContact O-CG 3.5Å; H25-E279 PolarHBondContact O-N 3.39Å; E279-M281 HydrophobicContact CB-CE 3.73Å; E279-M281 HydrophobicContact CB-CG 4.36Å; E279-M281 HydrophobicContact CG-CE 4.43Å; E279-M281 PolarHBondContact O-N 3.09Å; E279-M281 WeakPolarHBondContact OE2-CE 3.22Å
280	C	85.1	Confident	80.1	Confident	5 Å²	5	42.2 Å²	42.2	3%	0.034	21%	0.206	C	C	.	.			trans	-70.1	111.4	174.5	178.8	0	0	0	0	110.2	I237 Q301 C370 N372	I237-C280 HydrophobicContact CD1-CB 3.71Å; C280-Q301 HydrophobicContact CB-CG 3.9Å; C280-C370 WeakPolarHBondContact CA-SG 3.16Å; C280-C370 HydrophobicContact CB-CB 3.8Å; C280-C370 WeakPolarHBondContact CB-SG 3.33Å; C280-C370 VanDerWaalsContact SG-C 3.5Å; C280-C370 WeakPolarHBondContact SG-CB 3.27Å; C280-C370 CovalentContact SG-SG 2.01Å; C280-C370 PolarHBondContact SG-SG 3.26Å; C280-N372 HydrophobicContact CB-CB 3.73Å
281	M	83.5	Confident	78.1	Confident	10 Å²	10	48 Å²	48	5%	0.049	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-136	139.8	-177.4	-69.2	-167.6	-177.7	0	0	114	E279 G299 M300 K420 P421 D510	E279-M281 HydrophobicContact CB-CE 3.73Å; E279-M281 HydrophobicContact CB-CG 4.36Å; E279-M281 HydrophobicContact CG-CE 4.43Å; E279-M281 PolarHBondContact O-N 3.09Å; E279-M281 WeakPolarHBondContact OE2-CE 3.22Å; M281-G299 CarbonylContact O-C 3.46Å; M281-G299 VanDerWaalsContact O-CA 3.26Å; M281-G299 WeakPolarHBondContact O-CA 3.38Å; M281-M300 PolarHBondContact N-O 3.24Å; M281-M300 PolarHBondContact O-N 3.39Å; M281-K420 HydrophobicContact CE-CB 3.74Å; M281-K420 HydrophobicContact CE-CD 3.56Å; M281-K420 HydrophobicContact CE-CG 3.72Å; M281-K420 HydrophobicContact SD-CB 3.91Å; M281-K420 HydrophobicContact SD-CD 4.49Å; M281-P421 HydrophobicContact CB-CB 4.22Å; M281-P421 HydrophobicContact CG-CB 4.39Å; M281-P421 HydrophobicContact CG-CG 4.36Å; M281-P421 HydrophobicContact SD-CB 3.87Å; M281-P421 VanDerWaalsContact SD-CD 3.51Å; M281-P421 HydrophobicContact SD-CG 3.89Å; M281-D510 HydrophobicContact CE-CB 4.28Å; M281-D510 HydrophobicContact CG-CB 4.38Å; M281-D510 HydrophobicContact SD-CB 4.17Å
282	P	85.4	Confident	76.1	Confident	3 Å²	3	52.4 Å²	52.4	2%	0.019	26%	0.262	C	S	.	.	S	Bend	cis	-66.8	159	-9.6	30.5	-37.3	0	0	0	112.3	G299 T423 I458 Q463 P511 Y512	P282-G299 VanDerWaalsContact O-CA 3.29Å; P282-G299 WeakPolarHBondContact O-CA 3.41Å; P282-T423 HydrophobicContact CG-CG2 4.48Å; P282-I458 HydrophobicContact CG-CD1 4.21Å; P282-Q463 VanDerWaalsContact CD-OE1 3.27Å; P282-Q463 VanDerWaalsContact CG-OE1 3.23Å; P282-P511 HydrophobicContact CB-CG 3.77Å; P282-Y512 HydrophobicContact CB-CD2 3.89Å; P282-Y512 HydrophobicContact CB-CE2 4.02Å; P282-Y512 HydrophobicContact CG-CE2 4.48Å
283	C	84.6	Confident	73.9	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.014	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-66.8	160.4	167.2	66.7	0	0	0	0	111.3	N372 C374 D510 Y512	C283-N372 CarbonylContact C-O 3.59Å; C283-N372 WeakPolarHBondContact CA-O 3.31Å; C283-N372 WeakPolarHBondContact CB-O 3.38Å; C283-C374 HydrophobicContact CB-CB 3.98Å; C283-C374 WeakPolarHBondContact CB-SG 3.2Å; C283-C374 WeakPolarHBondContact SG-CA 3.35Å; C283-C374 WeakPolarHBondContact SG-CB 3.26Å; C283-C374 CovalentContact SG-SG 2.03Å; C283-C374 PolarHBondContact SG-SG 2.86Å; C283-D510 WeakPolarHBondContact CB-OD2 3.48Å; C283-D510 PolarHBondContact N-OD1 3.5Å; C283-D510 PolarHBondContact N-OD2 3.42Å; C283-D510 PolarHBondContact SG-OD2 3.14Å; C283-Y512 WeakPolarHBondContact O-CD2 3.41Å; C283-Y512 VanDerWaalsContact O-CE2 3.25Å; C283-Y512 WeakPolarHBondContact O-CE2 3.5Å; C283-Y512 VanDerWaalsContact SG-CB 3.59Å
284	T	82.8	Confident	71.9	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-95.6	123.4	176.4	-51.9	0	0	0	0	109.5	D288 V296 K297 I371 N372 C374	T284-D288 HydrophobicContact CG2-CB 4.14Å; T284-V296 HydrophobicContact CG2-CG1 4.29Å; T284-K297 PolarHBondContact OG1-O 2.79Å; T284-K297 VanDerWaalsContact OG1-O 3.05Å; T284-I371 HydrophobicContact CG2-CG2 4.44Å; T284-N372 PolarHBondContact N-O 3.24Å; T284-C374 PolarHBondContact O-N 3.16Å; T284-C374 PolarHBondContact O-SG 3.22Å; T284-C374 VanDerWaalsContact O-SG 3.41Å
285	P	77.7	Confident	70.1	Confident	15 Å²	15	67.6 Å²	67.6	10%	0.097	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-59.5	147	173.4	-23.4	33.8	0	0	0	112.1	E287 D288 F289 Y512	P285-E287 PolarHBondContact O-N 3.17Å; P285-E287 VanDerWaalsContact O-N 3.16Å; P285-D288 PolarHBondContact O-N 2.99Å; P285-F289 PolarHBondContact O-N 3.1Å; P285-Y512 HydrophobicContact CG-CD1 3.92Å; P285-Y512 HydrophobicContact CG-CD2 4.42Å; P285-Y512 HydrophobicContact CG-CE1 3.55Å; P285-Y512 HydrophobicContact CG-CE2 4.08Å; P285-Y512 HydrophobicContact CG-CG 4.35Å
286	K	72.7	Confident	68.8	Low	123 Å²	123	67.7 Å²	67.7	54%	0.535	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-51.4	-37.8	176.2	-80.6	-177.6	163.1	-174.5	0	113.6	D288 F289 E373 S376	K286-D288 VanDerWaalsContact C-N 3.28Å; K286-D288 PolarHBondContact O-N 2.82Å; K286-F289 VanDerWaalsContact O-CB 3.28Å; K286-F289 WeakPolarHBondContact O-CB 3.41Å; K286-F289 PolarHBondContact O-N 3.04Å; K286-E373 WeakPolarHBondContact CE-OE1 3.29Å; K286-E373 HydrophobicContact CG-CG 3.99Å; K286-E373 WeakPolarHBondContact CG-OE1 3.29Å; K286-E373 IonicContact NZ-OE1 2.68Å; K286-S376 WeakPolarHBondContact CE-OG 3.19Å; K286-S376 PolarHBondContact NZ-OG 2.68Å
287	E	65.8	Low	68	Low	161 Å²	161	67.4 Å²	67.4	75%	0.752	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-64.2	-30.1	-178.9	-66	168.3	-157.4	0	0	113.1	P285	P285-E287 PolarHBondContact O-N 3.17Å; P285-E287 VanDerWaalsContact O-N 3.16Å
288	D	60	Low	67.7	Low	32 Å²	32	66.7 Å²	66.7	17%	0.171	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-94.1	-0.4	178.5	-74.1	-30.6	0	0	0	112.5	T284 P285 K286 S290 R293	T284-D288 HydrophobicContact CG2-CB 4.14Å; P285-D288 PolarHBondContact O-N 2.99Å; K286-D288 VanDerWaalsContact C-N 3.28Å; K286-D288 PolarHBondContact O-N 2.82Å; D288-S290 PolarHBondContact O-N 3.45Å; D288-R293 IonicContact OD1-NH1 2.93Å; D288-R293 PolarHBondContact OD1-NH1 3.17Å
289	F	56.4	Low	67.8	Low	51 Å²	51	66.6 Å²	66.6	22%	0.224	33%	0.327	C	S	.	.			trans	-72.7	-10.8	179.5	-145.1	-91	0	0	0	112.6	I236 P285 K286 F291 I371 E373	I236-F289 HydrophobicContact CG2-CZ 4.46Å; P285-F289 PolarHBondContact O-N 3.1Å; K286-F289 VanDerWaalsContact O-CB 3.28Å; K286-F289 WeakPolarHBondContact O-CB 3.41Å; K286-F289 PolarHBondContact O-N 3.04Å; F289-F291 AromaticContact CD1-CE2 3.83Å; F289-F291 HydrophobicContact CD1-CE2 3.83Å; F289-F291 HydrophobicContact CD1-CZ 4.09Å; F289-F291 AromaticContact CE1-CE2 3.72Å; F289-F291 HydrophobicContact CE1-CE2 3.72Å; F289-F291 AromaticContact CE1-CZ 3.68Å; F289-F291 HydrophobicContact CE1-CZ 3.68Å; F289-F291 HydrophobicContact CZ-CZ 4.24Å; F289-F291 VanDerWaalsContact O-CD2 3.3Å; F289-F291 WeakPolarHBondContact O-CD2 3.23Å; F289-F291 PolarHBondContact O-N 3.18Å; F289-I371 HydrophobicContact CD2-CG2 4.21Å; F289-I371 HydrophobicContact CE2-CG2 3.66Å; F289-I371 HydrophobicContact CZ-CG2 4.29Å; F289-E373 HydrophobicContact CD2-CB 4.41Å; F289-E373 HydrophobicContact CD2-CG 4.38Å; F289-E373 HydrophobicContact CE2-CB 4.04Å; F289-E373 HydrophobicContact CE2-CG 4.46Å
290	S	54	Low	68.1	Low	54 Å²	54	65 Å²	65	38%	0.378	32%	0.32	S	S	.	.			trans	-64.7	102.9	169.1	56.1	0	0	0	0	109.6	D288 T292	D288-S290 PolarHBondContact O-N 3.45Å; S290-T292 PolarHBondContact O-N 3.22Å
291	F	52.6	Low	68.2	Low	122 Å²	122	65.3 Å²	65.3	54%	0.535	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	5.5	-178.6	-66.1	-81.9	0	0	0	115.7	I236 F289	I236-F291 HydrophobicContact CD1-CE1 3.7Å; I236-F291 HydrophobicContact CD1-CZ 4.04Å; F289-F291 AromaticContact CD1-CE2 3.83Å; F289-F291 HydrophobicContact CD1-CE2 3.83Å; F289-F291 HydrophobicContact CD1-CZ 4.09Å; F289-F291 AromaticContact CE1-CE2 3.72Å; F289-F291 HydrophobicContact CE1-CE2 3.72Å; F289-F291 AromaticContact CE1-CZ 3.68Å; F289-F291 HydrophobicContact CE1-CZ 3.68Å; F289-F291 HydrophobicContact CZ-CZ 4.24Å; F289-F291 VanDerWaalsContact O-CD2 3.3Å; F289-F291 WeakPolarHBondContact O-CD2 3.23Å; F289-F291 PolarHBondContact O-N 3.18Å
292	T	49.4	Very low	68.4	Low	131 Å²	131	64.9 Å²	64.9	80%	0.804	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-9.7	-179.3	47.8	0	0	0	0	114.1	S290	S290-T292 PolarHBondContact O-N 3.22Å
293	R	47.2	Very low	68.5	Low	147 Å²	147	68 Å²	68	56%	0.555	33%	0.33	S	S	*	.	S	Bend	trans	-90	126.8	176.2	-69.2	-178.1	177.1	175.4	-1.6	110.8	D288 I295	D288-R293 IonicContact OD1-NH1 2.93Å; D288-R293 PolarHBondContact OD1-NH1 3.17Å; R293-I295 PolarHBondContact O-N 3.15Å
294	E	48.1	Very low	68.7	Low	205 Å²	205	68 Å²	68	96%	0.958	33%	0.33	S	S	*	.	S	Bend	trans	-56.4	-18.9	177.2	-79.1	-176.3	150.5	0	0	114.5
295	I	51.5	Low	69.1	Low	151 Å²	151	68 Å²	68	77%	0.774	33%	0.33	S	S	*	.			trans	-123.5	73	-178.1	-46.5	174.2	0	0	0	109.1	R293 K297	R293-I295 PolarHBondContact O-N 3.15Å; I295-K297 PolarHBondContact O-N 3.41Å
296	V	56.1	Low	69.8	Low	37 Å²	37	67.6 Å²	67.6	22%	0.224	33%	0.327	C	S	.	.			trans	-67.3	118.7	167.2	-175.5	0	0	0	0	107.6	T284 S298 I371	T284-V296 HydrophobicContact CG2-CG1 4.29Å; V296-S298 PolarHBondContact O-N 3.48Å; V296-I371 HydrophobicContact CB-CD1 4.45Å; V296-I371 HydrophobicContact CG1-CD1 3.75Å; V296-I371 HydrophobicContact CG1-CG1 4.09Å
297	K	66.4	Low	70.9	Confident	69 Å²	69	61.7 Å²	61.7	30%	0.3	30%	0.301	S	S	.	.			trans	-59.6	105.6	169.3	-71.4	-174	-179.6	-175.7	0	107.7	T284 I295 I458 Y512	T284-K297 PolarHBondContact OG1-O 2.79Å; T284-K297 VanDerWaalsContact OG1-O 3.05Å; I295-K297 PolarHBondContact O-N 3.41Å; K297-I458 PolarHBondContact NZ-O 3.15Å; K297-Y512 WeakPolarHBondContact CD-OH 3.34Å; K297-Y512 PolarHBondContact NZ-OH 2.66Å
298	S	77.4	Confident	72.3	Confident	28 Å²	28	54.3 Å²	54.3	20%	0.196	27%	0.267	C	S	.	.			trans	-100.2	138.2	179.1	48.5	0	0	0	0	110.3	V296 C370	V296-S298 PolarHBondContact O-N 3.48Å; S298-C370 CarbonylContact C-O 3.59Å; S298-C370 WeakPolarHBondContact CA-O 3.4Å; S298-C370 WeakPolarHBondContact CB-O 3.34Å
299	G	85.7	Confident	74	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.01	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	177.3	165.9	0	0	0	0	0	111.5	M281 P282 S369 C370	M281-G299 CarbonylContact O-C 3.46Å; M281-G299 VanDerWaalsContact O-CA 3.26Å; M281-G299 WeakPolarHBondContact O-CA 3.38Å; P282-G299 VanDerWaalsContact O-CA 3.29Å; P282-G299 WeakPolarHBondContact O-CA 3.41Å; G299-S369 CarbonylContact O-C 3.57Å; G299-S369 WeakPolarHBondContact O-CA 3.11Å; G299-C370 PolarHBondContact N-O 3.45Å; G299-C370 PolarHBondContact O-N 3.2Å; G299-C370 PolarHBondContact O-SG 3.36Å
300	M	87	Confident	75.8	Confident	17 Å²	17	51 Å²	51	8%	0.084	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	139.3	173.2	-175.6	175.4	73.8	0	0	109.6	M281 I302 I367 R368 C370 F466 I479 Y483	M281-M300 PolarHBondContact N-O 3.24Å; M281-M300 PolarHBondContact O-N 3.39Å; M300-I302 HydrophobicContact CE-CG2 4.06Å; M300-I302 HydrophobicContact CG-CG2 4.26Å; M300-I302 HydrophobicContact SD-CG2 4.32Å; M300-I367 HydrophobicContact CG-CG2 3.94Å; M300-I367 HydrophobicContact SD-CG2 3.74Å; M300-R368 WeakPolarHBondContact CA-O 3.12Å; M300-C370 PolarHBondContact N-SG 3.43Å; M300-F466 HydrophobicContact CE-CD2 3.67Å; M300-F466 HydrophobicContact CE-CE2 4.22Å; M300-F466 HydrophobicContact CE-CG 4.48Å; M300-F466 HydrophobicContact SD-CB 3.88Å; M300-F466 HydrophobicContact SD-CD2 3.75Å; M300-F466 HydrophobicContact SD-CG 4.22Å; M300-I479 HydrophobicContact CE-CD1 3.75Å; M300-Y483 HydrophobicContact CE-CD1 3.84Å; M300-Y483 HydrophobicContact CE-CE1 3.54Å
301	Q	87.7	Confident	77.6	Confident	13 Å²	13	48.9 Å²	48.9	6%	0.061	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	146.4	162	-63.3	-176.1	-59.5	0	0	108.8	W277 S278 C280 R368 C370	W277-Q301 HydrophobicContact CE3-CB 3.6Å; W277-Q301 HydrophobicContact CZ3-CB 4.09Å; S278-Q301 VanDerWaalsContact O-CG 3.28Å; S278-Q301 WeakPolarHBondContact O-CG 3.18Å; S278-Q301 PolarHBondContact O-NE2 3.41Å; C280-Q301 HydrophobicContact CB-CG 3.9Å; Q301-R368 HydrophobicContact CB-CG 4.21Å; Q301-R368 PolarHBondContact N-O 2.9Å; Q301-R368 PolarHBondContact O-N 3.07Å; Q301-C370 HydrophobicContact CG-CB 4.01Å
302	I	87.5	Confident	79.5	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	150.2	166.9	72	-176.4	0	0	0	109.7	I27 S278 M300 L365 M366 I367 Y483	I27-I302 HydrophobicContact CD1-CD1 3.4Å; I27-I302 HydrophobicContact CD1-CG1 3.27Å; S278-I302 PolarHBondContact N-O 2.85Å; S278-I302 PolarHBondContact OG-N 2.92Å; S278-I302 PolarHBondContact OG-O 2.86Å; M300-I302 HydrophobicContact CE-CG2 4.06Å; M300-I302 HydrophobicContact CG-CG2 4.26Å; M300-I302 HydrophobicContact SD-CG2 4.32Å; I302-L365 HydrophobicContact CB-CD1 4.22Å; I302-L365 HydrophobicContact CD1-CD1 4.24Å; I302-L365 HydrophobicContact CG1-CD1 4.47Å; I302-M366 CarbonylContact C-O 3.53Å; I302-M366 WeakPolarHBondContact CA-O 2.87Å; I302-I367 HydrophobicContact CG2-CB 4.45Å; I302-I367 HydrophobicContact CG2-CG1 4.01Å; I302-I367 HydrophobicContact CG2-CG2 4.31Å; I302-Y483 HydrophobicContact CD1-CD1 4.45Å; I302-Y483 HydrophobicContact CD1-CD2 4.03Å; I302-Y483 HydrophobicContact CD1-CE1 3.96Å; I302-Y483 HydrophobicContact CD1-CE2 3.49Å; I302-Y483 VanDerWaalsContact CD1-CE2 3.49Å; I302-Y483 HydrophobicContact CD1-CG 4.47Å; I302-Y483 VanDerWaalsContact CD1-CZ 3.43Å; I302-Y483 HydrophobicContact CG1-CE1 4.44Å; I302-Y483 HydrophobicContact CG1-CE2 4.14Å; I302-Y483 WeakPolarHBondContact CG1-OH 3.46Å
303	R	88	Confident	81.3	Confident	70 Å²	70	42.8 Å²	42.8	26%	0.264	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	130.4	173.6	-169.6	-170.4	-175.1	-179.1	-0.8	107.7	W274 N275 W277 M366	W274-R303 HydrophobicContact CE3-CG 3.91Å; W274-R303 HydrophobicContact CZ3-CG 4.4Å; N275-R303 WeakPolarHBondContact O-CG 3.32Å; N275-R303 PolarHBondContact O-NE 3.47Å; W277-R303 HydrophobicContact CD2-CB 3.7Å; W277-R303 HydrophobicContact CD2-CG 4.31Å; W277-R303 HydrophobicContact CE3-CB 3.55Å; W277-R303 HydrophobicContact CG-CB 4.3Å; W277-R303 HydrophobicContact CH2-CB 4.13Å; W277-R303 HydrophobicContact CZ2-CB 4.25Å; W277-R303 HydrophobicContact CZ3-CB 3.77Å; R303-M366 HydrophobicContact CB-CB 4.14Å; R303-M366 PolarHBondContact N-O 2.96Å; R303-M366 PolarHBondContact O-N 2.93Å
304	I	88.8	Confident	83.3	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	126.9	-172	-59.3	149.8	0	0	0	108.6	I27 F227 N275 I306 L365 P481	I27-I304 HydrophobicContact CD1-CD1 3.65Å; I27-I304 HydrophobicContact CG1-CD1 4.41Å; I27-I304 HydrophobicContact CG2-CD1 3.43Å; I27-I304 VanDerWaalsContact CG2-CD1 3.43Å; F227-I304 HydrophobicContact CE1-CG2 4.18Å; N275-I304 PolarHBondContact N-O 3.28Å; I304-I306 HydrophobicContact CG2-CD1 3.45Å; I304-I306 VanDerWaalsContact CG2-CD1 3.45Å; I304-I306 HydrophobicContact CG2-CG1 3.94Å; I304-L365 HydrophobicContact CG1-CD1 3.66Å; I304-P481 HydrophobicContact CD1-CB 3.63Å; I304-P481 HydrophobicContact CD1-CG 4.35Å; I304-P481 HydrophobicContact CG1-CB 4.05Å; I304-P481 HydrophobicContact CG1-CG 4.28Å; I304-P481 HydrophobicContact CG2-CG 4.24Å
305	G	91.7	Very high	85.2	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	106	175	0	0	0	0	0	110	T272 Y273 W274 S363 E364	T272-G305 VanDerWaalsContact CG2-C 3.42Å; T272-G305 VanDerWaalsContact CG2-CA 3.4Å; Y273-G305 CarbonylContact O-C 3.57Å; Y273-G305 WeakPolarHBondContact O-CA 3.28Å; W274-G305 VanDerWaalsContact CE3-CA 3.4Å; G305-S363 CarbonylContact O-C 3.54Å; G305-S363 WeakPolarHBondContact O-CA 3.09Å; G305-S363 WeakPolarHBondContact O-CB 3.36Å; G305-E364 WeakPolarHBondContact CA-O 3.04Å; G305-E364 PolarHBondContact N-O 3.21Å; G305-E364 PolarHBondContact O-N 3.37Å
306	I	92.8	Very high	86.9	Confident	5 Å²	5	38 Å²	38	3%	0.026	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	136.9	-178.8	-57.6	-56.7	0	0	0	110.3	L51 F227 T272 Y273 I304 H308 P340	L51-I306 HydrophobicContact CB-CG2 3.91Å; L51-I306 HydrophobicContact CD2-CD1 4.37Å; L51-I306 HydrophobicContact CD2-CG2 3.76Å; L51-I306 HydrophobicContact CG-CG2 4.5Å; F227-I306 HydrophobicContact CE1-CD1 3.94Å; F227-I306 HydrophobicContact CZ-CD1 4Å; T272-I306 CarbonylContact C-O 3.56Å; T272-I306 WeakPolarHBondContact CA-O 3.22Å; Y273-I306 PolarHBondContact N-O 2.7Å; Y273-I306 PolarHBondContact O-N 3.42Å; I304-I306 HydrophobicContact CG2-CD1 3.45Å; I304-I306 VanDerWaalsContact CG2-CD1 3.45Å; I304-I306 HydrophobicContact CG2-CG1 3.94Å; I306-H308 PolarHBondContact O-CD2 2.84Å; I306-H308 PolarHBondContact O-N 2.86Å; I306-P340 HydrophobicContact CG2-CB 4.02Å; I306-P340 HydrophobicContact CG2-CG 4.49Å
307	C	94.4	Very high	88.5	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	117.9	168.8	179.6	0	0	0	0	109.5	P340 C341 S363	C307-P340 CarbonylContact O-C 3.57Å; C307-P340 VanDerWaalsContact O-CA 3.28Å; C307-P340 WeakPolarHBondContact O-CA 3.49Å; C307-C341 HydrophobicContact CB-CB 3.76Å; C307-C341 WeakPolarHBondContact CB-SG 3.47Å; C307-C341 PolarHBondContact O-N 3.22Å; C307-C341 PolarHBondContact O-SG 3.2Å; C307-C341 WeakPolarHBondContact SG-CB 3.23Å; C307-C341 CovalentContact SG-SG 2.05Å; C307-C341 PolarHBondContact SG-SG 3.5Å; C307-S363 PolarHBondContact N-OG 2.85Å; C307-S363 VanDerWaalsContact N-OG 3.1Å
308	H	95.2	Very high	89.7	Confident	6 Å²	6	36.5 Å²	36.5	3%	0.028	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	149	173	-82.6	-132.8	0	0	0	110.9	S49 L270 Y271 I306 P337 L339	S49-H308 PolarHBondContact OG-CE1 3.47Å; L270-H308 WeakPolarHBondContact CA-O 2.97Å; Y271-H308 HydrophobicContact CD2-CB 4.36Å; Y271-H308 HydrophobicContact CE1-CB 4.04Å; Y271-H308 HydrophobicContact CE2-CB 3.88Å; Y271-H308 PolarHBondContact N-O 2.92Å; Y271-H308 PolarHBondContact O-N 3.26Å; I306-H308 PolarHBondContact O-CD2 2.84Å; I306-H308 PolarHBondContact O-N 2.86Å; H308-P337 PolarHBondContact ND1-O 3.02Å; H308-L339 CarbonylContact C-O 3.59Å; H308-L339 VanDerWaalsContact CA-O 3.26Å; H308-L339 WeakPolarHBondContact CA-O 3.09Å
309	V	95.3	Very high	90.2	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134.5	173.1	58.5	0	0	0	0	109.9	L268 K269 L331 G338 L339 I346 I358	L268-V309 HydrophobicContact CB-CG2 4.24Å; L268-V309 HydrophobicContact CD1-CG2 4.42Å; L268-V309 HydrophobicContact CD2-CG2 3.93Å; L268-V309 HydrophobicContact CG-CG2 4.43Å; K269-V309 WeakPolarHBondContact O-CA 3.46Å; V309-L331 HydrophobicContact CG1-CD2 4.06Å; V309-G338 WeakPolarHBondContact O-CA 3.49Å; V309-L339 WeakPolarHBondContact CG1-O 3.17Å; V309-L339 PolarHBondContact N-O 2.89Å; V309-L339 PolarHBondContact O-N 2.87Å; V309-I346 HydrophobicContact CG1-CD1 3.34Å; V309-I358 HydrophobicContact CG2-CD1 4.09Å
310	T	94.3	Very high	90.5	Very high	13 Å²	13	46 Å²	46	8%	0.08	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	151.6	175.9	-169.3	0	0	0	0	109.4	K269 Y271 S335	K269-T310 HydrophobicContact CB-CG2 3.96Å; K269-T310 HydrophobicContact CD-CG2 4.13Å; K269-T310 HydrophobicContact CG-CG2 4.44Å; K269-T310 PolarHBondContact N-O 2.8Å; K269-T310 PolarHBondContact O-N 2.78Å; Y271-T310 HydrophobicContact CD1-CG2 4.46Å; Y271-T310 HydrophobicContact CE1-CG2 3.66Å; T310-S335 PolarHBondContact OG1-O 3.44Å
311	P	93.5	Very high	90.6	Very high	9 Å²	9	51.2 Å²	51.2	6%	0.058	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	141.7	168.7	25.1	-35.2	0	0	0	110.8	N267 I314 L331	N267-P311 VanDerWaalsContact O-CA 3.31Å; N267-P311 WeakPolarHBondContact O-CA 3.37Å; P311-I314 HydrophobicContact CG-CG2 3.9Å; P311-L331 WeakPolarHBondContact CD-O 3.33Å
312	I	90.9	Very high	90.7	Very high	73 Å²	73	55.1 Å²	55.1	37%	0.374	26%	0.259	S	S	.	.	S	Bend	trans	-68	-44.7	171.8	-62.7	166.2	0	0	0	108.9	Y262 I264 N267 K269	Y262-I312 HydrophobicContact CD1-CD1 4.22Å; Y262-I312 HydrophobicContact CD1-CG1 4.23Å; I264-I312 HydrophobicContact CG1-CD1 4.42Å; N267-I312 PolarHBondContact O-N 3.15Å; N267-I312 VanDerWaalsContact O-N 3.13Å; N267-I312 WeakPolarHBondContact OD1-CB 3.25Å; N267-I312 PolarHBondContact OD1-N 2.95Å; K269-I312 HydrophobicContact CB-CG1 3.9Å
313	D	88.8	Confident	90.8	Very high	52 Å²	52	55.1 Å²	55.1	28%	0.278	26%	0.259	S	S	.	.			trans	-130.4	124.6	174.3	-171.9	-25	0	0	0	110.3	N267 F315 Y316	N267-D313 PolarHBondContact ND2-O 2.8Å; N267-D313 PolarHBondContact OD1-N 2.83Å; D313-F315 PolarHBondContact O-N 2.75Å; D313-F315 WeakPolarHBondContact OD1-CB 3.48Å; D313-F315 VanDerWaalsContact OD1-CD2 3.25Å; D313-F315 WeakPolarHBondContact OD1-CD2 3.43Å; D313-F315 PolarHBondContact OD1-N 3.41Å; D313-Y316 HydrophobicContact CB-CD2 3.77Å; D313-Y316 VanDerWaalsContact CG-CD2 3.46Å; D313-Y316 PolarHBondContact O-N 3.28Å; D313-Y316 WeakPolarHBondContact OD2-CD2 3.25Å; D313-Y316 WeakPolarHBondContact OD2-CE2 3.3Å
314	I	87.7	Confident	90.9	Very high	71 Å²	71	52 Å²	52	36%	0.364	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-18	180	59.6	171.6	0	0	0	113.6	P311 K332	P311-I314 HydrophobicContact CG-CG2 3.9Å; I314-K332 WeakPolarHBondContact O-CE 3.45Å; I314-K332 PolarHBondContact O-NZ 2.78Å
315	F	87.8	Confident	90.8	Very high	173 Å²	173	54.2 Å²	54.2	76%	0.759	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-24.4	-179.4	-59.8	-68.6	0	0	0	112.7	D313	D313-F315 PolarHBondContact O-N 2.75Å; D313-F315 WeakPolarHBondContact OD1-CB 3.48Å; D313-F315 VanDerWaalsContact OD1-CD2 3.25Å; D313-F315 WeakPolarHBondContact OD1-CD2 3.43Å; D313-F315 PolarHBondContact OD1-N 3.41Å
316	Y	87.6	Confident	90.4	Very high	160 Å²	160	56.6 Å²	56.6	63%	0.627	27%	0.273	S	S	*	.	S	Bend	trans	-89.2	140.6	174.6	-70.2	-88.1	0	0	0	111.5	N267 D313	N267-Y316 PolarHBondContact ND2-O 2.77Å; D313-Y316 HydrophobicContact CB-CD2 3.77Å; D313-Y316 VanDerWaalsContact CG-CD2 3.46Å; D313-Y316 PolarHBondContact O-N 3.28Å; D313-Y316 WeakPolarHBondContact OD2-CD2 3.25Å; D313-Y316 WeakPolarHBondContact OD2-CE2 3.3Å
317	S	89.3	Confident	90.3	Very high	70 Å²	70	56.4 Å²	56.4	49%	0.49	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-74.1	142.6	176.7	-65.7	0	0	0	0	112.1	E328	S317-E328 WeakPolarHBondContact CA-OE1 3.41Å; S317-E328 PolarHBondContact OG-OE1 2.98Å; S317-E328 VanDerWaalsContact OG-OE1 3.06Å
318	I	91.5	Very high	90	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.021	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-66	144.1	175.3	-63.2	169	0	0	0	109.5	L268 L323 A324 E328 L331	L268-I318 HydrophobicContact CD1-CG2 4.18Å; L268-I318 HydrophobicContact CD2-CD1 3.99Å; L268-I318 HydrophobicContact CD2-CG1 4.07Å; L268-I318 HydrophobicContact CD2-CG2 4.17Å; L268-I318 HydrophobicContact CG-CG2 4.23Å; I318-L323 HydrophobicContact CG2-CD2 3.76Å; I318-L323 HydrophobicContact CG2-CG 4.03Å; I318-A324 HydrophobicContact CB-CB 4.14Å; I318-A324 WeakPolarHBondContact O-CB 3.46Å; I318-E328 HydrophobicContact CD1-CB 4.39Å; I318-L331 HydrophobicContact CD1-CB 4.12Å; I318-L331 HydrophobicContact CD1-CD1 3.44Å; I318-L331 VanDerWaalsContact CD1-CD1 3.44Å; I318-L331 HydrophobicContact CD1-CG 4.43Å
319	R	88.6	Confident	89.6	Confident	171 Å²	171	58 Å²	58	65%	0.645	28%	0.28	S	S	*	.	S	Bend	trans	-116.3	147.9	175.6	-63.5	-179.6	178.8	-178.8	-0.1	111.1	N266	N266-R319 PolarHBondContact ND2-O 2.85Å; N266-R319 PolarHBondContact O-N 2.75Å
320	P	92.3	Very high	89.3	Confident	58 Å²	58	58.2 Å²	58.2	38%	0.377	28%	0.281	S	S	.	.	S	Bend	cis	-68.9	162.4	-3.1	30.9	-36.6	0	0	0	112.5	M322 L323 A324 Y353	P320-M322 PolarHBondContact O-N 2.85Å; P320-M322 VanDerWaalsContact O-N 3.15Å; P320-L323 HydrophobicContact CG-CB 4.15Å; P320-L323 WeakPolarHBondContact O-CA 3.41Å; P320-L323 VanDerWaalsContact O-CB 3.32Å; P320-L323 WeakPolarHBondContact O-CB 3.38Å; P320-L323 PolarHBondContact O-N 2.67Å; P320-A324 PolarHBondContact O-N 3.19Å; P320-Y353 WeakPolarHBondContact CD-O 3.35Å; P320-Y353 WeakPolarHBondContact CG-O 3.23Å
321	H	88.8	Confident	89.2	Confident	126 Å²	126	57.6 Å²	57.6	58%	0.583	28%	0.277	S	S	*	.	H	α-helix	trans	-51.4	-41	-177.7	177.2	-91.9	0	0	0	113	L323 A324 V325	H321-L323 VanDerWaalsContact C-N 3.26Å; H321-L323 PolarHBondContact O-N 3.45Å; H321-A324 WeakPolarHBondContact O-CA 3.35Å; H321-A324 WeakPolarHBondContact O-CB 3.4Å; H321-A324 PolarHBondContact O-N 2.79Å; H321-V325 VanDerWaalsContact CE1-CG2 3.42Å; H321-V325 WeakPolarHBondContact CE1-CG2 3.36Å; H321-V325 WeakPolarHBondContact O-CG2 3.36Å; H321-V325 PolarHBondContact O-N 2.81Å
322	M	89.2	Confident	88.9	Confident	94 Å²	94	60.6 Å²	60.6	46%	0.463	29%	0.289	S	S	.	.	H	α-helix	trans	-59.1	-34.4	177.1	-66	-57.1	-64.4	0	0	113.4	P320 Y353	P320-M322 PolarHBondContact O-N 2.85Å; P320-M322 VanDerWaalsContact O-N 3.15Å; M322-Y353 HydrophobicContact CB-CD1 3.91Å; M322-Y353 HydrophobicContact CB-CD2 4.23Å; M322-Y353 HydrophobicContact CB-CE1 4.1Å; M322-Y353 HydrophobicContact CB-CE2 4.42Å; M322-Y353 HydrophobicContact CB-CG 3.97Å
323	L	91	Very high	88.8	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-70.4	-40.8	174.4	-177.8	63.8	0	0	0	111.1	L268 I318 P320 H321 V325 E326 T327 M350	L268-L323 HydrophobicContact CD1-CD2 4.2Å; I318-L323 HydrophobicContact CG2-CD2 3.76Å; I318-L323 HydrophobicContact CG2-CG 4.03Å; P320-L323 HydrophobicContact CG-CB 4.15Å; P320-L323 WeakPolarHBondContact O-CA 3.41Å; P320-L323 VanDerWaalsContact O-CB 3.32Å; P320-L323 WeakPolarHBondContact O-CB 3.38Å; P320-L323 PolarHBondContact O-N 2.67Å; H321-L323 VanDerWaalsContact C-N 3.26Å; H321-L323 PolarHBondContact O-N 3.45Å; L323-V325 VanDerWaalsContact C-N 3.35Å; L323-V325 PolarHBondContact O-N 2.88Å; L323-E326 PolarHBondContact O-N 2.82Å; L323-T327 HydrophobicContact CD1-CG2 3.85Å; L323-T327 WeakPolarHBondContact O-CB 3.13Å; L323-T327 PolarHBondContact O-N 2.91Å; L323-T327 PolarHBondContact O-OG1 3.05Å; L323-M350 HydrophobicContact CD1-CE 4.04Å; L323-M350 HydrophobicContact CD1-CG 4.44Å; L323-M350 HydrophobicContact CD1-SD 3.84Å; L323-M350 HydrophobicContact CD2-CE 4.15Å; L323-M350 HydrophobicContact CD2-SD 4.03Å; L323-M350 HydrophobicContact CG-CE 4.4Å; L323-M350 HydrophobicContact CG-SD 4.49Å
324	A	88.7	Confident	88.8	Confident	4 Å²	4	56.8 Å²	56.8	3%	0.033	27%	0.269	C	S	.	.	H	α-helix	trans	-59.4	-45.7	177.3	0	0	0	0	0	111.4	I318 P320 H321 E326 T327 E328	I318-A324 HydrophobicContact CB-CB 4.14Å; I318-A324 WeakPolarHBondContact O-CB 3.46Å; P320-A324 PolarHBondContact O-N 3.19Å; H321-A324 WeakPolarHBondContact O-CA 3.35Å; H321-A324 WeakPolarHBondContact O-CB 3.4Å; H321-A324 PolarHBondContact O-N 2.79Å; A324-E326 PolarHBondContact O-N 3.44Å; A324-T327 PolarHBondContact O-N 3.36Å; A324-E328 HydrophobicContact CB-CB 4.29Å; A324-E328 WeakPolarHBondContact O-CB 3.4Å; A324-E328 PolarHBondContact O-N 3.28Å
325	V	86.6	Confident	88.8	Confident	49 Å²	49	55.2 Å²	55.2	30%	0.297	27%	0.265	S	S	.	.	H	α-helix	trans	-54.7	-39.5	-180	172.8	0	0	0	0	112.2	L131 H321 L323	L131-V325 HydrophobicContact CD1-CG1 4.14Å; L131-V325 HydrophobicContact CD2-CG1 4.19Å; H321-V325 VanDerWaalsContact CE1-CG2 3.42Å; H321-V325 WeakPolarHBondContact CE1-CG2 3.36Å; H321-V325 WeakPolarHBondContact O-CG2 3.36Å; H321-V325 PolarHBondContact O-N 2.81Å; L323-V325 VanDerWaalsContact C-N 3.35Å; L323-V325 PolarHBondContact O-N 2.88Å
326	E	85.3	Confident	88.5	Confident	51 Å²	51	50.1 Å²	50.1	24%	0.238	26%	0.261	C	S	.	.	H	α-helix	trans	-90.9	-26.6	-176.8	-63.6	-174.3	-174.8	0	0	113.9	L131 L323 A324 S349	L131-E326 HydrophobicContact CD1-CG 4.48Å; L323-E326 PolarHBondContact O-N 2.82Å; A324-E326 PolarHBondContact O-N 3.44Å; E326-S349 VanDerWaalsContact CB-OG 3.28Å; E326-S349 WeakPolarHBondContact CB-OG 3.32Å; E326-S349 WeakPolarHBondContact OE2-CA 3.26Å; E326-S349 WeakPolarHBondContact OE2-CB 3.41Å; E326-S349 PolarHBondContact OE2-OG 2.9Å
327	T	88.9	Confident	88.4	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-122.9	-14.3	-167.2	66	0	0	0	0	115.5	L323 A324 E329 V330 L331 I346	L323-T327 HydrophobicContact CD1-CG2 3.85Å; L323-T327 WeakPolarHBondContact O-CB 3.13Å; L323-T327 PolarHBondContact O-N 2.91Å; L323-T327 PolarHBondContact O-OG1 3.05Å; A324-T327 PolarHBondContact O-N 3.36Å; T327-E329 PolarHBondContact O-N 2.81Å; T327-V330 WeakPolarHBondContact O-CG2 3.47Å; T327-V330 PolarHBondContact O-N 3.02Å; T327-L331 WeakPolarHBondContact O-CB 3.4Å; T327-L331 WeakPolarHBondContact O-CG 3.36Å; T327-L331 PolarHBondContact O-N 3.2Å; T327-I346 HydrophobicContact CG2-CB 4.05Å; T327-I346 HydrophobicContact CG2-CG2 3.87Å
328	E	88.2	Confident	88.5	Confident	11 Å²	11	41 Å²	41	5%	0.051	22%	0.22	C	C	.	.	H	α-helix	trans	-63.8	-41.6	-170.9	-175.2	179.1	-161.6	0	0	112.5	R121 S317 I318 A324 K332	R121-E328 IonicContact NH2-OE2 3.7Å; R121-E328 PolarHBondContact NH2-OE2 3.43Å; S317-E328 WeakPolarHBondContact CA-OE1 3.41Å; S317-E328 PolarHBondContact OG-OE1 2.98Å; S317-E328 VanDerWaalsContact OG-OE1 3.06Å; I318-E328 HydrophobicContact CD1-CB 4.39Å; A324-E328 HydrophobicContact CB-CB 4.29Å; A324-E328 WeakPolarHBondContact O-CB 3.4Å; A324-E328 PolarHBondContact O-N 3.28Å; E328-K332 HydrophobicContact CG-CD 4.05Å; E328-K332 WeakPolarHBondContact O-CB 3.31Å; E328-K332 VanDerWaalsContact O-CG 3.25Å; E328-K332 WeakPolarHBondContact O-CG 3.36Å; E328-K332 PolarHBondContact O-N 2.05Å; E328-K332 VanDerWaalsContact OE1-CE 3.31Å; E328-K332 WeakPolarHBondContact OE1-CE 3.28Å; E328-K332 IonicContact OE1-NZ 2.66Å; E328-K332 PolarHBondContact OE1-NZ 2.79Å
329	E	87.1	Confident	88.6	Confident	30 Å²	30	40.8 Å²	40.8	14%	0.14	22%	0.219	C	C	.	.	H	α-helix	trans	-65.4	-46.7	179.9	-67.1	-177.5	166.8	0	0	111.8	R121 Y139 T327 L331 K332 L333	R121-E329 IonicContact CZ-OE1 3.53Å; R121-E329 VanDerWaalsContact NH1-CG 3.32Å; R121-E329 IonicContact NH1-OE1 2.79Å; R121-E329 PolarHBondContact NH1-OE1 2.83Å; Y139-E329 WeakPolarHBondContact CE2-OE2 3.46Å; T327-E329 PolarHBondContact O-N 2.81Å; E329-L331 PolarHBondContact O-N 2.9Å; E329-K332 PolarHBondContact O-N 2.86Å; E329-L333 WeakPolarHBondContact O-CG 3.16Å; E329-L333 PolarHBondContact O-N 2.78Å
330	V	89.9	Confident	89	Confident	3 Å²	3	32.7 Å²	32.7	2%	0.018	19%	0.188	C	C	.	.	H	α-helix	trans	-64.1	-42.5	177.9	-65.5	0	0	0	0	111.9	L138 T327 K332 L333 F334 L339 L345 I346	L138-V330 HydrophobicContact CD1-CB 4.43Å; L138-V330 HydrophobicContact CD1-CG1 3.16Å; L138-V330 HydrophobicContact CD2-CG1 3.69Å; L138-V330 HydrophobicContact CG-CG1 3.9Å; T327-V330 WeakPolarHBondContact O-CG2 3.47Å; T327-V330 PolarHBondContact O-N 3.02Å; V330-K332 VanDerWaalsContact C-N 3.31Å; V330-K332 PolarHBondContact O-N 3.4Å; V330-L333 PolarHBondContact O-N 3.18Å; V330-F334 WeakPolarHBondContact O-CD2 3.26Å; V330-F334 PolarHBondContact O-N 3.23Å; V330-L339 HydrophobicContact CB-CD1 4.07Å; V330-L339 HydrophobicContact CG2-CD1 4.09Å; V330-L345 HydrophobicContact CB-CB 4.48Å; V330-L345 HydrophobicContact CG1-CB 4.31Å; V330-L345 HydrophobicContact CG1-CD1 4.43Å; V330-L345 HydrophobicContact CG2-CB 4.49Å; V330-I346 HydrophobicContact CG2-CG2 3.51Å
331	L	90.8	Very high	89.1	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-70	-30.1	-179	-77.3	170.5	0	0	0	112.2	L268 V309 P311 I318 T327 E329 S335 L339 I346 M350	L268-L331 HydrophobicContact CD2-CD1 4.21Å; V309-L331 HydrophobicContact CG1-CD2 4.06Å; P311-L331 WeakPolarHBondContact CD-O 3.33Å; I318-L331 HydrophobicContact CD1-CB 4.12Å; I318-L331 HydrophobicContact CD1-CD1 3.44Å; I318-L331 VanDerWaalsContact CD1-CD1 3.44Å; I318-L331 HydrophobicContact CD1-CG 4.43Å; T327-L331 WeakPolarHBondContact O-CB 3.4Å; T327-L331 WeakPolarHBondContact O-CG 3.36Å; T327-L331 PolarHBondContact O-N 3.2Å; E329-L331 PolarHBondContact O-N 2.9Å; L331-S335 VanDerWaalsContact O-CA 3.28Å; L331-S335 WeakPolarHBondContact O-CA 3.41Å; L331-S335 WeakPolarHBondContact O-CB 3.4Å; L331-S335 PolarHBondContact O-N 3.36Å; L331-S335 VanDerWaalsContact O-N 3.1Å; L331-L339 HydrophobicContact CD2-CB 4.22Å; L331-L339 HydrophobicContact CD2-CD1 3.94Å; L331-L339 HydrophobicContact CD2-CG 4.32Å; L331-L339 HydrophobicContact CG-CD1 4.39Å; L331-I346 HydrophobicContact CD2-CD1 4.32Å; L331-I346 HydrophobicContact CD2-CG2 4.48Å; L331-I346 HydrophobicContact CG-CG2 4.25Å; L331-M350 HydrophobicContact CD1-CE 3.8Å
332	K	88.8	Confident	89.3	Confident	71 Å²	71	25.4 Å²	25.4	31%	0.309	15%	0.149	S	C	.	.	H	α-helix	trans	-71.8	-43.4	171.9	-74.1	179.6	-172.2	-172.1	0	112.1	I314 E328 E329 V330 F334 S335	I314-K332 WeakPolarHBondContact O-CE 3.45Å; I314-K332 PolarHBondContact O-NZ 2.78Å; E328-K332 HydrophobicContact CG-CD 4.05Å; E328-K332 WeakPolarHBondContact O-CB 3.31Å; E328-K332 VanDerWaalsContact O-CG 3.25Å; E328-K332 WeakPolarHBondContact O-CG 3.36Å; E328-K332 PolarHBondContact O-N 2.05Å; E328-K332 VanDerWaalsContact OE1-CE 3.31Å; E328-K332 WeakPolarHBondContact OE1-CE 3.28Å; E328-K332 IonicContact OE1-NZ 2.66Å; E328-K332 PolarHBondContact OE1-NZ 2.79Å; E329-K332 PolarHBondContact O-N 2.86Å; V330-K332 VanDerWaalsContact C-N 3.31Å; V330-K332 PolarHBondContact O-N 3.4Å; K332-F334 PolarHBondContact O-N 2.96Å; K332-S335 VanDerWaalsContact O-CB 3.25Å; K332-S335 WeakPolarHBondContact O-CB 3.49Å; K332-S335 PolarHBondContact O-N 2.92Å; K332-S335 PolarHBondContact O-OG 3.41Å
333	L	87.7	Confident	89.5	Confident	43 Å²	43	21 Å²	21	23%	0.225	13%	0.127	C	C	.	.	H	α-helix	trans	-60.5	-43.1	177.2	-74.7	166.3	0	0	0	112.2	Y47 L138 E329 V330	Y47-L333 HydrophobicContact CE1-CB 4.46Å; Y47-L333 HydrophobicContact CE1-CD2 4.31Å; L138-L333 HydrophobicContact CB-CD1 4.34Å; L138-L333 HydrophobicContact CD2-CD1 3.78Å; L138-L333 HydrophobicContact CG-CD1 4.41Å; E329-L333 WeakPolarHBondContact O-CG 3.16Å; E329-L333 PolarHBondContact O-N 2.78Å; V330-L333 PolarHBondContact O-N 3.18Å
334	F	90.2	Very high	89.6	Confident	2 Å²	2	22.8 Å²	22.8	1%	0.009	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	22	178.4	-67.4	-88.4	0	0	0	113.1	Y47 E48 L138 V330 K332 G336 G338 L339 L345	Y47-F334 HydrophobicContact CD1-CD1 4.35Å; Y47-F334 AromaticContact CD1-CE1 3.91Å; Y47-F334 HydrophobicContact CD1-CE1 3.91Å; Y47-F334 HydrophobicContact CD1-CE2 4.28Å; Y47-F334 AromaticContact CD1-CZ 3.88Å; Y47-F334 HydrophobicContact CD1-CZ 3.88Å; Y47-F334 HydrophobicContact CG-CD1 4.49Å; Y47-F334 HydrophobicContact CG-CE1 4.39Å; E48-F334 WeakPolarHBondContact O-CE1 3.35Å; L138-F334 HydrophobicContact CD2-CE2 4.49Å; V330-F334 WeakPolarHBondContact O-CD2 3.26Å; V330-F334 PolarHBondContact O-N 3.23Å; K332-F334 PolarHBondContact O-N 2.96Å; F334-G336 PolarHBondContact O-N 3.36Å; F334-G338 CarbonylContact O-C 3.5Å; F334-G338 WeakPolarHBondContact O-CA 3.49Å; F334-G338 PolarHBondContact O-N 3.41Å; F334-L339 HydrophobicContact CB-CD1 4.44Å; F334-L339 HydrophobicContact CB-CD2 3.64Å; F334-L339 HydrophobicContact CB-CG 3.72Å; F334-L339 HydrophobicContact CD1-CD2 4.01Å; F334-L339 HydrophobicContact CD2-CD1 4.47Å; F334-L339 HydrophobicContact CD2-CD2 3.79Å; F334-L339 HydrophobicContact CD2-CG 4.38Å; F334-L339 HydrophobicContact CE2-CD2 4.47Å; F334-L339 HydrophobicContact CG-CD2 3.54Å; F334-L339 HydrophobicContact CG-CG 4.15Å; F334-L345 HydrophobicContact CD2-CD1 4.49Å; F334-L345 HydrophobicContact CE2-CD1 4.01Å
335	S	85.8	Confident	89.7	Confident	39 Å²	39	23 Å²	23	27%	0.273	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-30.1	-174.2	50.9	0	0	0	0	114.3	T310 L331 K332	T310-S335 PolarHBondContact OG1-O 3.44Å; L331-S335 VanDerWaalsContact O-CA 3.28Å; L331-S335 WeakPolarHBondContact O-CA 3.41Å; L331-S335 WeakPolarHBondContact O-CB 3.4Å; L331-S335 PolarHBondContact O-N 3.36Å; L331-S335 VanDerWaalsContact O-N 3.1Å; K332-S335 VanDerWaalsContact O-CB 3.25Å; K332-S335 WeakPolarHBondContact O-CB 3.49Å; K332-S335 PolarHBondContact O-N 2.92Å; K332-S335 PolarHBondContact O-OG 3.41Å
336	G	83.3	Confident	90	Very high	66 Å²	66	20.7 Å²	20.7	68%	0.68	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-70.5	178.6	0	0	0	0	0	113.2	F334 G338	F334-G336 PolarHBondContact O-N 3.36Å; G336-G338 VanDerWaalsContact C-N 3.31Å
337	P	84.2	Confident	90.1	Very high	37 Å²	37	22.6 Å²	22.6	24%	0.24	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-10.2	176.5	33.1	-37.6	0	0	0	114	Y47 Y271 H308	Y47-P337 WeakPolarHBondContact O-CG 3.45Å; Y271-P337 PolarHBondContact OH-O 3.04Å; H308-P337 PolarHBondContact ND1-O 3.02Å
338	G	91.4	Very high	90.2	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.01	15%	0.154	C	C	.	.			trans	72.1	177.9	-167.2	0	0	0	0	0	112.2	S49 Y271 V309 F334 G336	S49-G338 PolarHBondContact OG-O 2.82Å; Y271-G338 PolarHBondContact OH-N 3.14Å; V309-G338 WeakPolarHBondContact O-CA 3.49Å; F334-G338 CarbonylContact O-C 3.5Å; F334-G338 WeakPolarHBondContact O-CA 3.49Å; F334-G338 PolarHBondContact O-N 3.41Å; G336-G338 VanDerWaalsContact C-N 3.31Å
339	L	94.8	Very high	90.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	146.1	169.3	-74.1	175.5	0	0	0	110.3	H308 V309 V330 L331 F334 C341 L345 I346	H308-L339 CarbonylContact C-O 3.59Å; H308-L339 VanDerWaalsContact CA-O 3.26Å; H308-L339 WeakPolarHBondContact CA-O 3.09Å; V309-L339 WeakPolarHBondContact CG1-O 3.17Å; V309-L339 PolarHBondContact N-O 2.89Å; V309-L339 PolarHBondContact O-N 2.87Å; V330-L339 HydrophobicContact CB-CD1 4.07Å; V330-L339 HydrophobicContact CG2-CD1 4.09Å; L331-L339 HydrophobicContact CD2-CB 4.22Å; L331-L339 HydrophobicContact CD2-CD1 3.94Å; L331-L339 HydrophobicContact CD2-CG 4.32Å; L331-L339 HydrophobicContact CG-CD1 4.39Å; F334-L339 HydrophobicContact CB-CD1 4.44Å; F334-L339 HydrophobicContact CB-CD2 3.64Å; F334-L339 HydrophobicContact CB-CG 3.72Å; F334-L339 HydrophobicContact CD1-CD2 4.01Å; F334-L339 HydrophobicContact CD2-CD1 4.47Å; F334-L339 HydrophobicContact CD2-CD2 3.79Å; F334-L339 HydrophobicContact CD2-CG 4.38Å; F334-L339 HydrophobicContact CE2-CD2 4.47Å; F334-L339 HydrophobicContact CG-CD2 3.54Å; F334-L339 HydrophobicContact CG-CG 4.15Å; L339-C341 PolarHBondContact O-N 2.79Å; L339-L345 HydrophobicContact CD1-CB 4.39Å; L339-L345 HydrophobicContact CD1-CD1 4.44Å; L339-L345 HydrophobicContact CD2-CD1 4.25Å; L339-I346 HydrophobicContact CB-CD1 4.04Å; L339-I346 HydrophobicContact CD1-CD1 4.48Å; L339-I346 HydrophobicContact CD1-CG2 3.81Å
340	P	95.4	Very high	90.5	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.3	137.8	167.9	-25.3	32.2	0	0	0	110.7	S49 L51 I306 C307 R342 S343	S49-P340 WeakPolarHBondContact OG-CD 3.11Å; L51-P340 HydrophobicContact CB-CB 3.8Å; L51-P340 HydrophobicContact CB-CG 3.85Å; L51-P340 HydrophobicContact CD1-CB 4.3Å; L51-P340 HydrophobicContact CD2-CB 4.24Å; L51-P340 HydrophobicContact CG-CB 4.35Å; I306-P340 HydrophobicContact CG2-CB 4.02Å; I306-P340 HydrophobicContact CG2-CG 4.49Å; C307-P340 CarbonylContact O-C 3.57Å; C307-P340 VanDerWaalsContact O-CA 3.28Å; C307-P340 WeakPolarHBondContact O-CA 3.49Å; P340-R342 PolarHBondContact O-N 3.11Å; P340-S343 WeakPolarHBondContact O-CB 3.4Å; P340-S343 PolarHBondContact O-N 2.6Å
341	C	94.3	Very high	90.5	Very high	5 Å²	5	30.6 Å²	30.6	3%	0.034	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-26.6	-179.2	-62.4	0	0	0	0	112.3	C307 L339 I358	C307-C341 HydrophobicContact CB-CB 3.76Å; C307-C341 WeakPolarHBondContact CB-SG 3.47Å; C307-C341 PolarHBondContact O-N 3.22Å; C307-C341 PolarHBondContact O-SG 3.2Å; C307-C341 WeakPolarHBondContact SG-CB 3.23Å; C307-C341 CovalentContact SG-SG 2.05Å; C307-C341 PolarHBondContact SG-SG 3.5Å; L339-C341 PolarHBondContact O-N 2.79Å; C341-I358 HydrophobicContact CB-CG2 4.1Å
342	R	92.9	Very high	90.5	Very high	27 Å²	27	37.4 Å²	37.4	10%	0.102	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	14.7	177.5	-71.5	76	177.8	-166.7	19.9	113.1	L51 L220 E225 P340 H344 K359 R361	L51-R342 HydrophobicContact CD1-CB 4.45Å; L51-R342 HydrophobicContact CD2-CB 4.48Å; L220-R342 HydrophobicContact CD1-CB 4.05Å; E225-R342 IonicContact OE1-CZ 3.65Å; E225-R342 IonicContact OE1-NE 2.75Å; E225-R342 IonicContact OE1-NH1 3.89Å; E225-R342 PolarHBondContact OE1-NH1 3.03Å; E225-R342 WeakPolarHBondContact OE2-CB 3.46Å; E225-R342 WeakPolarHBondContact OE2-CD 3.48Å; E225-R342 WeakPolarHBondContact OE2-CG 3.33Å; E225-R342 IonicContact OE2-NE 3.32Å; P340-R342 PolarHBondContact O-N 3.11Å; R342-H344 PolarHBondContact O-N 2.65Å; R342-K359 PolarHBondContact NH2-O 3.09Å; R342-R361 PolarHBondContact NH1-O 2.84Å; R342-R361 PolarHBondContact NH2-O 3.02Å
343	S	94.3	Very high	90.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.202	C	C	.	.			trans	-55.5	136.4	176.5	172	0	0	0	0	110.8	T218 P340 L345 I346 R347	T218-S343 WeakPolarHBondContact OG1-CA 3.03Å; P340-S343 WeakPolarHBondContact O-CB 3.4Å; P340-S343 PolarHBondContact O-N 2.6Å; S343-L345 PolarHBondContact O-N 3.43Å; S343-L345 PolarHBondContact OG-N 2.66Å; S343-I346 PolarHBondContact O-N 3.23Å; S343-R347 VanDerWaalsContact O-CB 3.23Å; S343-R347 WeakPolarHBondContact O-CB 3.17Å; S343-R347 PolarHBondContact O-N 3.28Å
344	H	92.7	Very high	90.9	Very high	38 Å²	38	36.4 Å²	36.4	18%	0.176	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-23.3	178.2	69.5	-80.5	0	0	0	113.2	T200 V217 T218 R342	T200-H344 HydrophobicContact CG2-CB 3.64Å; T200-H344 VanDerWaalsContact CG2-CG 3.42Å; T200-H344 WeakPolarHBondContact CG2-ND1 3.42Å; V217-H344 PolarHBondContact O-CE1 3.16Å; T218-H344 HydrophobicContact CG2-CB 4.2Å; T218-H344 PolarHBondContact OG1-N 3.24Å; T218-H344 VanDerWaalsContact OG1-N 3.15Å; T218-H344 PolarHBondContact OG1-ND1 3.07Å; R342-H344 PolarHBondContact O-N 2.65Å
345	L	91.4	Very high	91	Very high	9 Å²	9	37 Å²	37	5%	0.047	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-25.1	179	-61.2	-179.6	0	0	0	113.9	L137 I202 S216 V330 F334 L339 S343	L137-L345 HydrophobicContact CD1-CD2 4.22Å; I202-L345 HydrophobicContact CD1-CD1 4.14Å; I202-L345 HydrophobicContact CD1-CD2 3.87Å; I202-L345 HydrophobicContact CG1-CD1 4.42Å; I202-L345 HydrophobicContact CG1-CD2 4.18Å; S216-L345 WeakPolarHBondContact OG-CD1 3.43Å; V330-L345 HydrophobicContact CB-CB 4.48Å; V330-L345 HydrophobicContact CG1-CB 4.31Å; V330-L345 HydrophobicContact CG1-CD1 4.43Å; V330-L345 HydrophobicContact CG2-CB 4.49Å; F334-L345 HydrophobicContact CD2-CD1 4.49Å; F334-L345 HydrophobicContact CE2-CD1 4.01Å; L339-L345 HydrophobicContact CD1-CB 4.39Å; L339-L345 HydrophobicContact CD1-CD1 4.44Å; L339-L345 HydrophobicContact CD2-CD1 4.25Å; S343-L345 PolarHBondContact O-N 3.43Å; S343-L345 PolarHBondContact OG-N 2.66Å
346	I	91.9	Very high	91.3	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.005	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-129.8	-15.4	-174.6	62.9	173.6	0	0	0	113.6	V309 T327 V330 L331 L339 S343 N348 S349 M350	V309-I346 HydrophobicContact CG1-CD1 3.34Å; T327-I346 HydrophobicContact CG2-CB 4.05Å; T327-I346 HydrophobicContact CG2-CG2 3.87Å; V330-I346 HydrophobicContact CG2-CG2 3.51Å; L331-I346 HydrophobicContact CD2-CD1 4.32Å; L331-I346 HydrophobicContact CD2-CG2 4.48Å; L331-I346 HydrophobicContact CG-CG2 4.25Å; L339-I346 HydrophobicContact CB-CD1 4.04Å; L339-I346 HydrophobicContact CD1-CD1 4.48Å; L339-I346 HydrophobicContact CD1-CG2 3.81Å; S343-I346 PolarHBondContact O-N 3.23Å; I346-N348 VanDerWaalsContact C-N 3.35Å; I346-N348 PolarHBondContact O-N 2.95Å; I346-S349 PolarHBondContact O-N 2.78Å; I346-M350 HydrophobicContact CB-CG 4.01Å; I346-M350 HydrophobicContact CD1-CE 4.33Å; I346-M350 HydrophobicContact CD1-CG 4.2Å; I346-M350 HydrophobicContact CG1-CG 4.18Å; I346-M350 VanDerWaalsContact O-CB 3.31Å; I346-M350 WeakPolarHBondContact O-CB 3.42Å; I346-M350 VanDerWaalsContact O-CG 3.27Å; I346-M350 WeakPolarHBondContact O-CG 3.48Å; I346-M350 PolarHBondContact O-N 2.79Å
347	R	88.7	Confident	91.7	Very high	90 Å²	90	43.9 Å²	43.9	34%	0.34	21%	0.206	S	C	.	.	H	α-helix	trans	-52.4	-49.2	-171.5	179.4	178.7	179.3	-176.5	2	112.2	S343 M350 L351	S343-R347 VanDerWaalsContact O-CB 3.23Å; S343-R347 WeakPolarHBondContact O-CB 3.17Å; S343-R347 PolarHBondContact O-N 3.28Å; R347-M350 PolarHBondContact O-N 2.98Å; R347-L351 HydrophobicContact CG-CD1 3.88Å; R347-L351 HydrophobicContact CG-CG 4.46Å; R347-L351 WeakPolarHBondContact O-CB 3.37Å; R347-L351 WeakPolarHBondContact O-CG 3.44Å; R347-L351 PolarHBondContact O-N 2.91Å
348	N	89.9	Confident	92	Very high	107 Å²	107	42.2 Å²	42.2	57%	0.572	20%	0.196	S	C	*	.	H	α-helix	trans	-65.2	-44.9	-176.8	-69.2	-16.2	0	0	0	111.9	I346 L351 K352	I346-N348 VanDerWaalsContact C-N 3.35Å; I346-N348 PolarHBondContact O-N 2.95Å; N348-L351 PolarHBondContact O-N 3.46Å; N348-K352 WeakPolarHBondContact O-CG 3.28Å; N348-K352 PolarHBondContact O-N 2.53Å
349	S	90.4	Very high	91.9	Very high	10 Å²	10	45.9 Å²	45.9	7%	0.07	21%	0.211	C	C	.	.	H	α-helix	trans	-66.9	-42.7	178.9	-45.1	0	0	0	0	111.7	E326 I346 K352 Y353 G354	E326-S349 VanDerWaalsContact CB-OG 3.28Å; E326-S349 WeakPolarHBondContact CB-OG 3.32Å; E326-S349 WeakPolarHBondContact OE2-CA 3.26Å; E326-S349 WeakPolarHBondContact OE2-CB 3.41Å; E326-S349 PolarHBondContact OE2-OG 2.9Å; I346-S349 PolarHBondContact O-N 2.78Å; S349-K352 PolarHBondContact O-N 3.04Å; S349-Y353 PolarHBondContact O-N 3.01Å; S349-G354 PolarHBondContact O-N 3.01Å
350	M	91.5	Very high	91.7	Very high	4 Å²	4	52.5 Å²	52.5	2%	0.02	25%	0.246	C	C	.	.	H	α-helix	trans	-65	-38.3	176.1	-72.1	-67.3	172.5	0	0	111.4	L268 L323 L331 I346 R347 G354 I358 K359	L268-M350 HydrophobicContact CD1-CE 4.18Å; L323-M350 HydrophobicContact CD1-CE 4.04Å; L323-M350 HydrophobicContact CD1-CG 4.44Å; L323-M350 HydrophobicContact CD1-SD 3.84Å; L323-M350 HydrophobicContact CD2-CE 4.15Å; L323-M350 HydrophobicContact CD2-SD 4.03Å; L323-M350 HydrophobicContact CG-CE 4.4Å; L323-M350 HydrophobicContact CG-SD 4.49Å; L331-M350 HydrophobicContact CD1-CE 3.8Å; I346-M350 HydrophobicContact CB-CG 4.01Å; I346-M350 HydrophobicContact CD1-CE 4.33Å; I346-M350 HydrophobicContact CD1-CG 4.2Å; I346-M350 HydrophobicContact CG1-CG 4.18Å; I346-M350 VanDerWaalsContact O-CB 3.31Å; I346-M350 WeakPolarHBondContact O-CB 3.42Å; I346-M350 VanDerWaalsContact O-CG 3.27Å; I346-M350 WeakPolarHBondContact O-CG 3.48Å; I346-M350 PolarHBondContact O-N 2.79Å; R347-M350 PolarHBondContact O-N 2.98Å; M350-G354 WeakPolarHBondContact O-CA 3.31Å; M350-G354 PolarHBondContact O-N 3.05Å; M350-I358 HydrophobicContact CE-CD1 4.31Å; M350-I358 HydrophobicContact SD-CD1 3.64Å; M350-I358 HydrophobicContact SD-CG2 4.48Å; M350-K359 WeakPolarHBondContact O-CE 2.9Å
351	L	90.1	Very high	91.5	Very high	91 Å²	91	53 Å²	53	48%	0.476	25%	0.248	S	C	.	.	H	α-helix	trans	-67	-36.2	175	-75.2	172	0	0	0	112.7	R347 N348 K359	R347-L351 HydrophobicContact CG-CD1 3.88Å; R347-L351 HydrophobicContact CG-CG 4.46Å; R347-L351 WeakPolarHBondContact O-CB 3.37Å; R347-L351 WeakPolarHBondContact O-CG 3.44Å; R347-L351 PolarHBondContact O-N 2.91Å; N348-L351 PolarHBondContact O-N 3.46Å; L351-K359 HydrophobicContact CD2-CG 4.44Å; L351-K359 VanDerWaalsContact O-CE 3.23Å; L351-K359 WeakPolarHBondContact O-CE 3.47Å; L351-K359 PolarHBondContact O-NZ 3.43Å
352	K	91.9	Very high	91.5	Very high	144 Å²	144	54.3 Å²	54.3	63%	0.626	26%	0.256	S	S	*	.	H	α-helix	trans	-80.8	-54.8	-179.9	-70.1	175.9	-177.3	-178.8	0	112.8	N348 S349	N348-K352 WeakPolarHBondContact O-CG 3.28Å; N348-K352 PolarHBondContact O-N 2.53Å; S349-K352 PolarHBondContact O-N 3.04Å
353	Y	92.4	Very high	91.5	Very high	86 Å²	86	53 Å²	53	34%	0.337	25%	0.251	S	S	.	.	H	α-helix	trans	-114	-10.6	-169.1	-51.7	-65.1	0	0	0	113.8	P320 M322 S349	P320-Y353 WeakPolarHBondContact CD-O 3.35Å; P320-Y353 WeakPolarHBondContact CG-O 3.23Å; M322-Y353 HydrophobicContact CB-CD1 3.91Å; M322-Y353 HydrophobicContact CB-CD2 4.23Å; M322-Y353 HydrophobicContact CB-CE1 4.1Å; M322-Y353 HydrophobicContact CB-CE2 4.42Å; M322-Y353 HydrophobicContact CB-CG 3.97Å; S349-Y353 PolarHBondContact O-N 3.01Å
354	G	90.9	Very high	91.5	Very high	7 Å²	7	53 Å²	53	7%	0.072	25%	0.251	C	S	.	.	S	Bend	trans	-72.5	155.6	-176.6	0	0	0	0	0	114.1	S349 M350 K359	S349-G354 PolarHBondContact O-N 3.01Å; M350-G354 WeakPolarHBondContact O-CA 3.31Å; M350-G354 PolarHBondContact O-N 3.05Å; G354-K359 WeakPolarHBondContact O-CE 3.46Å; G354-K359 PolarHBondContact O-NZ 3.05Å
355	P	92.6	Very high	91.3	Very high	14 Å²	14	51.2 Å²	51.2	9%	0.091	24%	0.243	C	C	.	.			trans	-60.1	150.6	174.9	25.5	-34.1	0	0	0	111.8	L263 L268 E357 I358	L263-P355 HydrophobicContact CD1-CB 3.81Å; L263-P355 HydrophobicContact CD1-CG 3.46Å; L263-P355 VanDerWaalsContact CD1-CG 3.46Å; L268-P355 HydrophobicContact CD1-CG 4.4Å; P355-E357 WeakPolarHBondContact CB-OE2 3.44Å; P355-E357 PolarHBondContact O-N 3.35Å; P355-I358 HydrophobicContact CG-CD1 3.55Å; P355-I358 HydrophobicContact CG-CG1 3.92Å; P355-I358 PolarHBondContact O-N 3.37Å
356	K	92.1	Very high	91.3	Very high	159 Å²	159	51.5 Å²	51.5	69%	0.691	24%	0.244	S	C	*	.	H	α-helix	trans	-64.5	-31	-175.3	-69.9	-178.3	179.4	178.1	0	111.8	I358 K359 L360	K356-I358 VanDerWaalsContact C-N 3.33Å; K356-I358 PolarHBondContact O-N 3.22Å; K356-K359 WeakPolarHBondContact O-CB 3.16Å; K356-K359 PolarHBondContact O-N 3.1Å; K356-K359 VanDerWaalsContact O-N 3.14Å; K356-L360 WeakPolarHBondContact O-CG 3.07Å; K356-L360 PolarHBondContact O-N 2.84Å
357	E	92.3	Very high	91.1	Very high	91 Å²	91	51.4 Å²	51.4	43%	0.425	24%	0.244	S	C	.	.	H	α-helix	trans	-59.5	-41	-179.3	-64.4	81.4	176.6	0	0	111.6	L263 P355 R361	L263-E357 HydrophobicContact CD1-CB 4.13Å; L263-E357 HydrophobicContact CD2-CB 4.12Å; L263-E357 HydrophobicContact CD2-CG 3.95Å; P355-E357 WeakPolarHBondContact CB-OE2 3.44Å; P355-E357 PolarHBondContact O-N 3.35Å; E357-R361 VanDerWaalsContact O-CB 3.23Å; E357-R361 WeakPolarHBondContact O-CB 3.49Å; E357-R361 PolarHBondContact O-N 2.77Å
358	I	90.8	Very high	91	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.015	23%	0.23	C	C	.	.	H	α-helix	trans	-66.6	-42.1	175.8	-64.5	172.6	0	0	0	110.8	L263 L268 L270 V309 C341 M350 P355 K356 L360	L263-I358 HydrophobicContact CD1-CG1 4.32Å; L268-I358 HydrophobicContact CD1-CD1 3.76Å; L270-I358 HydrophobicContact CD1-CD1 4.48Å; L270-I358 HydrophobicContact CD1-CG1 3.85Å; L270-I358 HydrophobicContact CD2-CB 4.14Å; L270-I358 HydrophobicContact CD2-CG1 3.51Å; L270-I358 HydrophobicContact CG-CG1 3.84Å; V309-I358 HydrophobicContact CG2-CD1 4.09Å; C341-I358 HydrophobicContact CB-CG2 4.1Å; M350-I358 HydrophobicContact CE-CD1 4.31Å; M350-I358 HydrophobicContact SD-CD1 3.64Å; M350-I358 HydrophobicContact SD-CG2 4.48Å; P355-I358 HydrophobicContact CG-CD1 3.55Å; P355-I358 HydrophobicContact CG-CG1 3.92Å; P355-I358 PolarHBondContact O-N 3.37Å; K356-I358 VanDerWaalsContact C-N 3.33Å; K356-I358 PolarHBondContact O-N 3.22Å; I358-L360 VanDerWaalsContact C-N 3.32Å; I358-L360 PolarHBondContact O-N 2.82Å
359	K	88.1	Confident	90.8	Very high	78 Å²	78	43.7 Å²	43.7	34%	0.339	21%	0.21	S	C	.	.	H	α-helix	trans	-63.5	-41.5	-178.3	-57.9	179	-167.9	179.7	0	111.1	R342 M350 L351 G354 K356	R342-K359 PolarHBondContact NH2-O 3.09Å; M350-K359 WeakPolarHBondContact O-CE 2.9Å; L351-K359 HydrophobicContact CD2-CG 4.44Å; L351-K359 VanDerWaalsContact O-CE 3.23Å; L351-K359 WeakPolarHBondContact O-CE 3.47Å; L351-K359 PolarHBondContact O-NZ 3.43Å; G354-K359 WeakPolarHBondContact O-CE 3.46Å; G354-K359 PolarHBondContact O-NZ 3.05Å; K356-K359 WeakPolarHBondContact O-CB 3.16Å; K356-K359 PolarHBondContact O-N 3.1Å; K356-K359 VanDerWaalsContact O-N 3.14Å
360	L	90.7	Very high	90.7	Very high	139 Å²	139	43.2 Å²	43.2	73%	0.728	21%	0.207	S	C	*	.	H	α-helix	trans	-88.1	-19.8	-173.1	-64.7	175.1	0	0	0	114.5	K356 I358 P362	K356-L360 WeakPolarHBondContact O-CG 3.07Å; K356-L360 PolarHBondContact O-N 2.84Å; I358-L360 VanDerWaalsContact C-N 3.32Å; I358-L360 PolarHBondContact O-N 2.82Å; L360-P362 WeakPolarHBondContact O-CD 3.39Å
361	R	92.5	Very high	90.4	Very high	9 Å²	9	43.3 Å²	43.3	3%	0.034	21%	0.208	C	C	.	.			trans	-70.8	111.2	-176.2	-179.5	174	-179.7	108.3	2.4	111.6	L258 A259 L270 T272 R342 E357	L258-R361 VanDerWaalsContact CB-NH2 3.32Å; L258-R361 HydrophobicContact CD1-CG 4.25Å; L258-R361 PolarHBondContact O-NH2 2.57Å; A259-R361 PolarHBondContact O-NH1 3.15Å; A259-R361 PolarHBondContact O-NH2 2.75Å; A259-R361 VanDerWaalsContact O-NH2 3.16Å; L270-R361 HydrophobicContact CD2-CB 4.25Å; T272-R361 PolarHBondContact OG1-NH2 3.3Å; T272-R361 VanDerWaalsContact OG1-NH2 3.08Å; R342-R361 PolarHBondContact NH1-O 2.84Å; R342-R361 PolarHBondContact NH2-O 3.02Å; E357-R361 VanDerWaalsContact O-CB 3.23Å; E357-R361 WeakPolarHBondContact O-CB 3.49Å; E357-R361 PolarHBondContact O-N 2.77Å
362	P	93.1	Very high	90.2	Very high	33 Å²	33	40.7 Å²	40.7	21%	0.214	19%	0.194	C	C	.	.			trans	-72.8	157.4	179.4	32.6	-35.3	0	0	0	111.4	P226 R228 L258 L360	P226-P362 HydrophobicContact CB-CB 4.31Å; P226-P362 CarbonylContact O-C 3.58Å; P226-P362 WeakPolarHBondContact O-CA 3.42Å; P226-P362 WeakPolarHBondContact O-CB 3.2Å; R228-P362 HydrophobicContact CB-CB 4.34Å; R228-P362 HydrophobicContact CB-CG 4.05Å; L258-P362 HydrophobicContact CD1-CG 4Å; L360-P362 WeakPolarHBondContact O-CD 3.39Å
363	S	94.3	Very high	89.7	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	163.3	158.9	-68.2	0	0	0	0	109.1	E225 P226 F227 R228 G305 C307	E225-S363 VanDerWaalsContact OE1-CB 3.29Å; E225-S363 WeakPolarHBondContact OE1-CB 3.48Å; E225-S363 PolarHBondContact OE1-OG 2.81Å; P226-S363 PolarHBondContact O-N 2.9Å; F227-S363 CarbonylContact C-O 3.58Å; F227-S363 VanDerWaalsContact CA-O 3.32Å; F227-S363 WeakPolarHBondContact CA-O 3.49Å; F227-S363 VanDerWaalsContact CE1-CB 3.48Å; R228-S363 PolarHBondContact N-O 2.69Å; G305-S363 CarbonylContact O-C 3.54Å; G305-S363 WeakPolarHBondContact O-CA 3.09Å; G305-S363 WeakPolarHBondContact O-CB 3.36Å; C307-S363 PolarHBondContact N-OG 2.85Å; C307-S363 VanDerWaalsContact N-OG 3.1Å
364	E	92.4	Very high	89.1	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	139.4	-175	-60.4	-171.8	107.5	0	0	110.3	R228 L230 L258 T272 W274 G305	R228-E364 HydrophobicContact CB-CG 4.42Å; R228-E364 IonicContact CZ-OE1 3.28Å; R228-E364 IonicContact NH1-OE1 3.85Å; R228-E364 PolarHBondContact NH1-OE1 3.28Å; R228-E364 WeakPolarHBondContact O-CA 3.29Å; L230-E364 HydrophobicContact CD1-CB 4.33Å; L258-E364 HydrophobicContact CD1-CG 4.05Å; L258-E364 HydrophobicContact CG-CG 4.35Å; L258-E364 WeakPolarHBondContact CG-OE1 3.43Å; L258-E364 PolarHBondContact N-OE1 3.48Å; L258-E364 VanDerWaalsContact N-OE1 3.13Å; L258-E364 PolarHBondContact N-OE2 3.09Å; T272-E364 PolarHBondContact OG1-OE2 3.09Å; W274-E364 HydrophobicContact CH2-CB 3.45Å; W274-E364 VanDerWaalsContact CH2-CB 3.45Å; W274-E364 HydrophobicContact CZ2-CB 3.81Å; W274-E364 HydrophobicContact CZ2-CG 4.46Å; W274-E364 WeakPolarHBondContact CZ2-OE2 3.41Å; W274-E364 HydrophobicContact CZ3-CB 4.37Å; G305-E364 WeakPolarHBondContact CA-O 3.04Å; G305-E364 PolarHBondContact N-O 3.21Å; G305-E364 PolarHBondContact O-N 3.37Å
365	L	90.5	Very high	88.3	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	108.5	175.5	-174	67.8	0	0	0	108.5	F227 R228 N229 L230 I302 I304 I367 I479	F227-L365 HydrophobicContact CB-CB 4.3Å; F227-L365 HydrophobicContact CD1-CB 4Å; F227-L365 HydrophobicContact CG-CB 4.39Å; R228-L365 PolarHBondContact O-N 2.99Å; N229-L365 WeakPolarHBondContact CA-O 3.45Å; L230-L365 PolarHBondContact N-O 3.46Å; I302-L365 HydrophobicContact CB-CD1 4.22Å; I302-L365 HydrophobicContact CD1-CD1 4.24Å; I302-L365 HydrophobicContact CG1-CD1 4.47Å; I304-L365 HydrophobicContact CG1-CD1 3.66Å; L365-I367 HydrophobicContact CD2-CD1 4.25Å; L365-I367 HydrophobicContact CD2-CG1 4.37Å; L365-I367 HydrophobicContact CG-CG1 4.19Å; L365-I479 HydrophobicContact CD2-CG2 3.89Å; L365-I479 VanDerWaalsContact CD2-O 3.27Å; L365-I479 WeakPolarHBondContact CD2-O 3.48Å
366	M	89.6	Confident	86.9	Confident	15 Å²	15	37.7 Å²	37.7	7%	0.074	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	128.9	174.1	-76	174.6	176.9	0	0	109.5	L230 W274 W277 I302 R303	L230-M366 HydrophobicContact CB-CB 4.42Å; L230-M366 HydrophobicContact CB-CG 3.72Å; L230-M366 HydrophobicContact CD1-CE 3.72Å; L230-M366 HydrophobicContact CD1-CG 3.89Å; L230-M366 HydrophobicContact CG-CG 4.45Å; L230-M366 CarbonylContact O-C 3.54Å; L230-M366 WeakPolarHBondContact O-CA 3.27Å; W274-M366 HydrophobicContact CE3-SD 4.3Å; W274-M366 HydrophobicContact CH2-CB 4.49Å; W274-M366 HydrophobicContact CH2-CE 3.53Å; W274-M366 HydrophobicContact CH2-CG 3.58Å; W274-M366 HydrophobicContact CH2-SD 3.59Å; W274-M366 VanDerWaalsContact CH2-SD 3.59Å; W274-M366 HydrophobicContact CZ2-CE 3.61Å; W274-M366 HydrophobicContact CZ2-SD 4.17Å; W274-M366 HydrophobicContact CZ3-CB 4.18Å; W274-M366 HydrophobicContact CZ3-CE 4.21Å; W274-M366 HydrophobicContact CZ3-CG 3.72Å; W274-M366 HydrophobicContact CZ3-SD 3.66Å; W277-M366 HydrophobicContact CH2-CB 3.87Å; W277-M366 HydrophobicContact CZ3-CB 4.37Å; I302-M366 CarbonylContact C-O 3.53Å; I302-M366 WeakPolarHBondContact CA-O 2.87Å; R303-M366 HydrophobicContact CB-CB 4.14Å; R303-M366 PolarHBondContact N-O 2.96Å; R303-M366 PolarHBondContact O-N 2.93Å
367	I	88.4	Confident	85.5	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	132.8	-179.4	-54.9	171.7	0	0	0	107.1	L230 F231 S232 M300 I302 L365 I470 I479	L230-I367 PolarHBondContact O-N 3.33Å; F231-I367 WeakPolarHBondContact CA-O 3.4Å; F231-I367 HydrophobicContact CD1-CB 4.11Å; F231-I367 HydrophobicContact CE1-CB 4.2Å; F231-I367 HydrophobicContact CE1-CD1 4.01Å; F231-I367 HydrophobicContact CE1-CG2 4.48Å; S232-I367 PolarHBondContact N-O 3.09Å; M300-I367 HydrophobicContact CG-CG2 3.94Å; M300-I367 HydrophobicContact SD-CG2 3.74Å; I302-I367 HydrophobicContact CG2-CB 4.45Å; I302-I367 HydrophobicContact CG2-CG1 4.01Å; I302-I367 HydrophobicContact CG2-CG2 4.31Å; L365-I367 HydrophobicContact CD2-CD1 4.25Å; L365-I367 HydrophobicContact CD2-CG1 4.37Å; L365-I367 HydrophobicContact CG-CG1 4.19Å; I367-I470 HydrophobicContact CD1-CD1 3.85Å; I367-I479 HydrophobicContact CD1-CG2 3.65Å
368	R	85.8	Confident	83.6	Confident	12 Å²	12	33.2 Å²	33.2	5%	0.045	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	151.8	170.5	72.7	179.3	179.4	-158.6	-6.2	111.8	D252 W277 M300 Q301	D252-R368 IonicContact OD1-NH1 3.76Å; D252-R368 IonicContact OD2-NH1 2.96Å; W277-R368 VanDerWaalsContact CE2-CZ 3.47Å; W277-R368 HydrophobicContact CE3-CG 4.36Å; W277-R368 HydrophobicContact CH2-CB 4.25Å; W277-R368 HydrophobicContact CH2-CG 3.78Å; W277-R368 HydrophobicContact CZ3-CB 4.41Å; W277-R368 HydrophobicContact CZ3-CG 3.69Å; M300-R368 WeakPolarHBondContact CA-O 3.12Å; Q301-R368 HydrophobicContact CB-CG 4.21Å; Q301-R368 PolarHBondContact N-O 2.9Å; Q301-R368 PolarHBondContact O-N 3.07Å
369	S	87.7	Confident	81.6	Confident	23 Å²	23	40.4 Å²	40.4	16%	0.161	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	149.6	164.7	-65.2	0	0	0	0	109.6	L234 K235 G299	L234-S369 WeakPolarHBondContact CA-O 3.38Å; L234-S369 VanDerWaalsContact CD1-CB 3.45Å; K235-S369 PolarHBondContact N-O 3.1Å; K235-S369 VanDerWaalsContact N-O 3.11Å; G299-S369 CarbonylContact O-C 3.57Å; G299-S369 WeakPolarHBondContact O-CA 3.11Å
370	C	87	Confident	79.8	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	152.3	178.9	61.3	0	0	0	0	110.8	K235 I237 C280 S298 G299 M300 Q301	K235-C370 VanDerWaalsContact O-CA 3.24Å; K235-C370 WeakPolarHBondContact O-CA 3.36Å; I237-C370 HydrophobicContact CD1-CB 4.42Å; C280-C370 WeakPolarHBondContact CA-SG 3.16Å; C280-C370 HydrophobicContact CB-CB 3.8Å; C280-C370 WeakPolarHBondContact CB-SG 3.33Å; C280-C370 VanDerWaalsContact SG-C 3.5Å; C280-C370 WeakPolarHBondContact SG-CB 3.27Å; C280-C370 CovalentContact SG-SG 2.01Å; C280-C370 PolarHBondContact SG-SG 3.26Å; S298-C370 CarbonylContact C-O 3.59Å; S298-C370 WeakPolarHBondContact CA-O 3.4Å; S298-C370 WeakPolarHBondContact CB-O 3.34Å; G299-C370 PolarHBondContact N-O 3.45Å; G299-C370 PolarHBondContact O-N 3.2Å; G299-C370 PolarHBondContact O-SG 3.36Å; M300-C370 PolarHBondContact N-SG 3.43Å; Q301-C370 HydrophobicContact CG-CB 4.01Å
371	I	85.6	Confident	77.8	Confident	6 Å²	6	37.1 Å²	37.1	3%	0.031	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	117.2	170.8	-67.5	163.9	0	0	0	106.1	L234 K235 I236 I237 T284 F289 V296	L234-I371 HydrophobicContact CD1-CD1 4.25Å; L234-I371 HydrophobicContact CD1-CG1 4.21Å; L234-I371 HydrophobicContact CD2-CD1 3.98Å; L234-I371 HydrophobicContact CG-CD1 4.48Å; K235-I371 PolarHBondContact O-N 3.47Å; I236-I371 HydrophobicContact CG1-CB 4.48Å; I236-I371 HydrophobicContact CG1-CD1 4.38Å; I237-I371 PolarHBondContact N-O 3.06Å; T284-I371 HydrophobicContact CG2-CG2 4.44Å; F289-I371 HydrophobicContact CD2-CG2 4.21Å; F289-I371 HydrophobicContact CE2-CG2 3.66Å; F289-I371 HydrophobicContact CZ-CG2 4.29Å; V296-I371 HydrophobicContact CB-CD1 4.45Å; V296-I371 HydrophobicContact CG1-CD1 3.75Å; V296-I371 HydrophobicContact CG1-CG1 4.09Å
372	N	85.1	Confident	75.6	Confident	35 Å²	35	43 Å²	43	19%	0.187	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	126.3	176	178	34.1	0	0	0	108.2	I237 C280 C283 T284 C374	I237-N372 HydrophobicContact CB-CB 4.25Å; I237-N372 HydrophobicContact CD1-CB 4.43Å; C280-N372 HydrophobicContact CB-CB 3.73Å; C283-N372 CarbonylContact C-O 3.59Å; C283-N372 WeakPolarHBondContact CA-O 3.31Å; C283-N372 WeakPolarHBondContact CB-O 3.38Å; T284-N372 PolarHBondContact N-O 3.24Å; N372-C374 PolarHBondContact O-N 3.38Å
373	E	81.2	Confident	73.4	Confident	60 Å²	60	43.1 Å²	43.1	28%	0.28	25%	0.252	S	S	.	.	B	Isolated β-bridge	trans	-67.3	128.4	-178.3	-163.7	-168.2	144.2	0	0	111.1	R239 K286 F289	R239-E373 PolarHBondContact NH2-O 2.87Å; K286-E373 WeakPolarHBondContact CE-OE1 3.29Å; K286-E373 HydrophobicContact CG-CG 3.99Å; K286-E373 WeakPolarHBondContact CG-OE1 3.29Å; K286-E373 IonicContact NZ-OE1 2.68Å; F289-E373 HydrophobicContact CD2-CB 4.41Å; F289-E373 HydrophobicContact CD2-CG 4.38Å; F289-E373 HydrophobicContact CE2-CB 4.04Å; F289-E373 HydrophobicContact CE2-CG 4.46Å
374	C	80.1	Confident	71.1	Confident	4 Å²	4	46.2 Å²	46.2	3%	0.027	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-56.8	139.8	172.9	-62.9	0	0	0	0	110.5	C283 T284 N372 S376	C283-C374 HydrophobicContact CB-CB 3.98Å; C283-C374 WeakPolarHBondContact CB-SG 3.2Å; C283-C374 WeakPolarHBondContact SG-CA 3.35Å; C283-C374 WeakPolarHBondContact SG-CB 3.26Å; C283-C374 CovalentContact SG-SG 2.03Å; C283-C374 PolarHBondContact SG-SG 2.86Å; T284-C374 PolarHBondContact O-N 3.16Å; T284-C374 PolarHBondContact O-SG 3.22Å; T284-C374 VanDerWaalsContact O-SG 3.41Å; N372-C374 PolarHBondContact O-N 3.38Å; C374-S376 PolarHBondContact O-N 2.98Å
375	P	73.8	Confident	68.8	Low	56 Å²	56	55.6 Å²	55.6	36%	0.364	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-54.1	134.7	172.9	22.6	-30.7	0	0	0	110.1	R239 F377	R239-P375 VanDerWaalsContact NH2-N 3.12Å; P375-F377 PolarHBondContact O-N 3.13Å
376	S	64.6	Low	66.7	Low	68 Å²	68	60 Å²	60	48%	0.476	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-58.6	127.3	177	-66.5	0	0	0	0	109.6	K286 C374 S378	K286-S376 WeakPolarHBondContact CE-OG 3.19Å; K286-S376 PolarHBondContact NZ-OG 2.68Å; C374-S376 PolarHBondContact O-N 2.98Å; S376-S378 PolarHBondContact O-N 2.9Å
377	F	61.4	Low	64.5	Low	82 Å²	82	60.4 Å²	60.4	36%	0.36	34%	0.344	S	S	.	.			trans	-70.4	112	175.2	-45.9	-63.7	0	0	0	107.9	P375 R455 I514	P375-F377 PolarHBondContact O-N 3.13Å; F377-R455 VanDerWaalsContact CE2-NH1 3.31Å; F377-R455 VanDerWaalsContact CZ-NH1 3.25Å; F377-I514 HydrophobicContact CB-CD1 4.32Å; F377-I514 HydrophobicContact CD1-CB 4.33Å; F377-I514 HydrophobicContact CD1-CD1 3.13Å; F377-I514 HydrophobicContact CD1-CG1 3.68Å; F377-I514 HydrophobicContact CE1-CD1 3.42Å; F377-I514 VanDerWaalsContact CE1-CD1 3.42Å; F377-I514 HydrophobicContact CE1-CG1 3.6Å; F377-I514 HydrophobicContact CG-CD1 3.76Å; F377-I514 HydrophobicContact CZ-CD1 4.26Å
378	S	53.3	Low	62.4	Low	74 Å²	74	63.6 Å²	63.6	52%	0.517	37%	0.366	S	S	.	.			trans	-65.6	155.8	157.4	56.6	0	0	0	0	108.1	S376 I380	S376-S378 PolarHBondContact O-N 2.9Å; S378-I380 PolarHBondContact O-N 2.84Å
379	N	48	Very low	60.5	Low	154 Å²	154	69.2 Å²	69.2	82%	0.824	40%	0.397	S	S	*	.			trans	-62.7	83.9	174.2	-83.8	-21	0	0	0	109.8	T381	N379-T381 PolarHBondContact O-N 2.88Å
380	I	51.6	Low	58.7	Low	32 Å²	32	76.5 Å²	76.5	16%	0.164	43%	0.426	C	S	.	.			trans	-75.6	82.6	171.1	-57.1	155	0	0	0	106.3	S378 I514 N516	S378-I380 PolarHBondContact O-N 2.84Å; I380-I514 HydrophobicContact CD1-CB 4.22Å; I380-I514 HydrophobicContact CD1-CG2 3.53Å; I380-N516 WeakPolarHBondContact CD1-OD1 3.41Å
381	T	47.6	Very low	57	Low	116 Å²	116	77.4 Å²	77.4	71%	0.712	43%	0.431	S	S	*	.			trans	-85.2	-20.7	168.4	35.2	0	0	0	0	111.8	N379	N379-T381 PolarHBondContact O-N 2.88Å
382	T	46.4	Very low	55.4	Low	133 Å²	133	81 Å²	81	82%	0.816	46%	0.456	S	S	*	.	S	Bend	trans	-105.4	-6.2	-162.1	39.7	0	0	0	0	117.2
383	S	46.6	Very low	54.4	Low	36 Å²	36	88 Å²	88	25%	0.252	48%	0.48	S	S	.	.	S	Bend	trans	-98	-1.2	-179.3	93.4	0	0	0	0	116.4	K385 S386 S387	S383-K385 VanDerWaalsContact C-N 3.31Å; S383-K385 PolarHBondContact O-N 2.86Å; S383-S386 PolarHBondContact O-N 3.47Å; S383-S386 PolarHBondContact O-OG 3.27Å; S383-S387 PolarHBondContact O-N 3.32Å; S383-S387 PolarHBondContact O-OG 2.61Å
384	L	46	Very low	54.1	Low	64 Å²	64	91.4 Å²	91.4	34%	0.335	49%	0.494	S	S	.	.	H	α-helix	trans	-60.3	-31.6	-175	-105.7	94.2	0	0	0	114.8	S387 S388	L384-S387 WeakPolarHBondContact CA-OG 3.22Å; L384-S387 PolarHBondContact O-N 3.3Å; L384-S387 PolarHBondContact O-OG 3.25Å; L384-S387 VanDerWaalsContact O-OG 3.06Å; L384-S388 PolarHBondContact O-N 3.33Å
385	K	44.4	Very low	54.1	Low	197 Å²	197	91.7 Å²	91.7	86%	0.857	50%	0.496	S	S	*	.	H	α-helix	trans	-73.1	-31.7	-175.9	-74.8	-174	178	-179.6	0	113.7	S383 S388	S383-K385 VanDerWaalsContact C-N 3.31Å; S383-K385 PolarHBondContact O-N 2.86Å; K385-S388 PolarHBondContact O-OG 3.42Å
386	S	45.5	Very low	54.6	Low	93 Å²	93	94.7 Å²	94.7	65%	0.65	50%	0.503	S	S	*	.	H	α-helix	trans	-83.6	-24.2	175.9	73.6	0	0	0	0	112.4	S383	S383-S386 PolarHBondContact O-N 3.47Å; S383-S386 PolarHBondContact O-OG 3.27Å
387	S	45.3	Very low	55.5	Low	24 Å²	24	96.8 Å²	96.8	17%	0.168	50%	0.501	C	S	.	.	H	α-helix	trans	-83.1	-29.5	-173.5	70.5	0	0	0	0	113.6	S383 L384 N389 K390 L391	S383-S387 PolarHBondContact O-N 3.32Å; S383-S387 PolarHBondContact O-OG 2.61Å; L384-S387 WeakPolarHBondContact CA-OG 3.22Å; L384-S387 PolarHBondContact O-N 3.3Å; L384-S387 PolarHBondContact O-OG 3.25Å; L384-S387 VanDerWaalsContact O-OG 3.06Å; S387-N389 VanDerWaalsContact C-N 3.26Å; S387-N389 PolarHBondContact O-N 2.8Å; S387-K390 PolarHBondContact O-N 3.34Å; S387-K390 VanDerWaalsContact O-N 3.1Å; S387-L391 WeakPolarHBondContact O-CD1 3.4Å; S387-L391 PolarHBondContact O-N 3.05Å; S387-L391 VanDerWaalsContact O-N 3.11Å
388	S	43.9	Very low	56.8	Low	66 Å²	66	95.2 Å²	95.2	46%	0.462	50%	0.495	S	S	.	.	H	α-helix	trans	-56.9	-36.2	180	60.1	0	0	0	0	113.4	L384 K385 K390 L391	L384-S388 PolarHBondContact O-N 3.33Å; K385-S388 PolarHBondContact O-OG 3.42Å; S388-K390 VanDerWaalsContact C-N 3.35Å; S388-K390 PolarHBondContact O-N 2.94Å; S388-L391 PolarHBondContact O-N 3.08Å
389	N	46.4	Very low	58.4	Low	131 Å²	131	96.1 Å²	96.1	70%	0.701	50%	0.498	S	S	*	.	H	α-helix	trans	-66.6	-32.9	179.2	-77.8	-7.7	0	0	0	112.9	S387 S392	S387-N389 VanDerWaalsContact C-N 3.26Å; S387-N389 PolarHBondContact O-N 2.8Å; N389-S392 PolarHBondContact O-OG 2.75Å
390	K	49.9	Very low	60.3	Low	175 Å²	175	90.5 Å²	90.5	76%	0.761	47%	0.467	S	S	*	.	H	α-helix	trans	-82.3	-28.1	175.1	-77.5	-174.8	-179.9	178.1	0	113.1	S387 S388 S392	S387-K390 PolarHBondContact O-N 3.34Å; S387-K390 VanDerWaalsContact O-N 3.1Å; S388-K390 VanDerWaalsContact C-N 3.35Å; S388-K390 PolarHBondContact O-N 2.94Å; K390-S392 PolarHBondContact O-N 2.95Å
391	L	50.5	Low	62	Low	20 Å²	20	95.4 Å²	95.4	11%	0.105	49%	0.49	C	S	.	.	H	α-helix	trans	-64.3	-17.6	174.1	-93.7	92.3	0	0	0	113.6	S387 S388 R393 Y442 I447 P453 Y521	S387-L391 WeakPolarHBondContact O-CD1 3.4Å; S387-L391 PolarHBondContact O-N 3.05Å; S387-L391 VanDerWaalsContact O-N 3.11Å; S388-L391 PolarHBondContact O-N 3.08Å; L391-R393 PolarHBondContact O-N 3.16Å; L391-R393 VanDerWaalsContact O-N 3.08Å; L391-Y442 VanDerWaalsContact O-CE1 3.24Å; L391-Y442 WeakPolarHBondContact O-CE1 3.39Å; L391-I447 HydrophobicContact CD2-CD1 3.79Å; L391-I447 HydrophobicContact CD2-CG1 4.27Å; L391-I447 HydrophobicContact CD2-CG2 4.32Å; L391-P453 HydrophobicContact CD2-CG 3.83Å; L391-Y521 HydrophobicContact CD1-CE2 3.78Å; L391-Y521 WeakPolarHBondContact CD1-OH 3.41Å; L391-Y521 WeakPolarHBondContact CD2-OH 3.32Å; L391-Y521 HydrophobicContact CG-CE2 4.5Å; L391-Y521 WeakPolarHBondContact CG-OH 3.26Å
392	S	51.3	Low	63.9	Low	80 Å²	80	90.2 Å²	90.2	56%	0.559	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-10	-167.2	62.3	0	0	0	0	116.7	N389 K390 F394	N389-S392 PolarHBondContact O-OG 2.75Å; K390-S392 PolarHBondContact O-N 2.95Å; S392-F394 PolarHBondContact O-N 3.13Å
393	R	64.6	Low	65.7	Low	183 Å²	183	87.5 Å²	87.5	69%	0.691	44%	0.438	S	S	*	.			trans	-91.7	101.6	-175.9	-68.6	-175.8	-178.8	168.2	0.3	111.7	L391 R415 Y442	L391-R393 PolarHBondContact O-N 3.16Å; L391-R393 VanDerWaalsContact O-N 3.08Å; R393-R415 PolarHBondContact O-NH1 2.98Å; R393-Y442 PolarHBondContact O-OH 2.81Å; R393-Y442 VanDerWaalsContact O-OH 3.12Å
394	F	74.3	Confident	67.5	Low	132 Å²	132	86.8 Å²	86.8	58%	0.579	43%	0.431	S	S	*	.	P	Polyproline II helix	trans	-48.2	143.6	166.6	-75.8	-76.6	0	0	0	111.7	S392 R415 I438 Y442	S392-F394 PolarHBondContact O-N 3.13Å; F394-R415 PolarHBondContact O-NH1 2.86Å; F394-R415 PolarHBondContact O-NH2 2.98Å; F394-I438 HydrophobicContact CD1-CG2 3.99Å; F394-I438 HydrophobicContact CE1-CG2 4.09Å; F394-Y442 HydrophobicContact CD1-CD2 4.04Å; F394-Y442 AromaticContact CD1-CE2 3.92Å; F394-Y442 HydrophobicContact CD1-CE2 3.92Å; F394-Y442 AromaticContact CE1-CD2 3.94Å; F394-Y442 HydrophobicContact CE1-CD2 3.94Å; F394-Y442 HydrophobicContact CE1-CE2 4.3Å; F394-Y442 HydrophobicContact CE1-CG 4.43Å
395	P	80.3	Confident	69.2	Low	9 Å²	9	85.4 Å²	85.4	6%	0.058	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-61.6	153	-177.4	30.2	-40.9	0	0	0	113.3	R397 R415 W524 I527	P395-R397 PolarHBondContact O-N 2.92Å; P395-R415 VanDerWaalsContact CA-NH2 3.27Å; P395-W524 HydrophobicContact CB-CD2 3.71Å; P395-W524 HydrophobicContact CB-CE3 4.36Å; P395-W524 HydrophobicContact CB-CG 3.93Å; P395-W524 HydrophobicContact CB-CZ2 4.23Å; P395-W524 HydrophobicContact CG-CD2 3.71Å; P395-W524 VanDerWaalsContact CG-CE2 3.47Å; P395-W524 HydrophobicContact CG-CE3 3.95Å; P395-W524 HydrophobicContact CG-CG 4.45Å; P395-W524 HydrophobicContact CG-CH2 3.96Å; P395-W524 HydrophobicContact CG-CZ2 3.63Å; P395-W524 HydrophobicContact CG-CZ3 4.07Å; P395-I527 HydrophobicContact CB-CD1 4.33Å; P395-I527 HydrophobicContact CB-CG1 3.99Å; P395-I527 HydrophobicContact CG-CD1 3.61Å; P395-I527 HydrophobicContact CG-CG1 3.83Å
396	K	84.1	Confident	71.2	Confident	119 Å²	119	80.1 Å²	80.1	52%	0.517	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	121.9	-177.7	-174.5	177.1	179.2	-177	0	106.6	I398 P413 S525 G526 I527	K396-I398 HydrophobicContact CD-CD1 4.44Å; K396-I398 HydrophobicContact CD-CG1 4.45Å; K396-I398 HydrophobicContact CG-CG1 4.25Å; K396-P413 HydrophobicContact CB-CB 4.26Å; K396-P413 HydrophobicContact CB-CG 4.16Å; K396-P413 HydrophobicContact CD-CB 3.95Å; K396-S525 PolarHBondContact N-O 3.09Å; K396-S525 VanDerWaalsContact N-O 3.09Å; K396-G526 CarbonylContact O-C 3.52Å; K396-G526 VanDerWaalsContact O-CA 3.28Å; K396-G526 WeakPolarHBondContact O-CA 3.32Å; K396-I527 PolarHBondContact O-N 2.87Å
397	R	83.9	Confident	73.3	Confident	113 Å²	113	80.4 Å²	80.4	43%	0.426	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	129.6	174.8	-59	-175.9	-167.1	-171.2	1.9	108.8	P395 M435 I527	P395-R397 PolarHBondContact O-N 2.92Å; R397-M435 VanDerWaalsContact CZ-SD 3.55Å; R397-M435 PolarHBondContact NH1-SD 3.44Å; R397-M435 PolarHBondContact NH2-SD 2.76Å; R397-I527 CarbonylContact C-O 3.51Å; R397-I527 WeakPolarHBondContact CA-O 2.83Å; R397-I527 HydrophobicContact CG-CB 4.4Å; R397-I527 HydrophobicContact CG-CD1 4.41Å
398	I	88.1	Confident	75.4	Confident	48 Å²	48	80.1 Å²	80.1	25%	0.246	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	124.8	176	-59.4	-177.6	0	0	0	107.2	K396 I400 P413 I527 I528 Y529	K396-I398 HydrophobicContact CD-CD1 4.44Å; K396-I398 HydrophobicContact CD-CG1 4.45Å; K396-I398 HydrophobicContact CG-CG1 4.25Å; I398-I400 HydrophobicContact CG2-CG1 3.9Å; I398-P413 HydrophobicContact CD1-CB 3.79Å; I398-P413 HydrophobicContact CD1-CG 3.77Å; I398-I527 PolarHBondContact N-O 3.07Å; I398-I528 HydrophobicContact CB-CG1 4.38Å; I398-I528 WeakPolarHBondContact O-CA 3.14Å; I398-Y529 PolarHBondContact O-N 3.06Å
399	T	88.1	Confident	77.6	Confident	93 Å²	93	80.3 Å²	80.3	57%	0.571	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104	122.9	170.1	-62	0	0	0	0	107.6	Q401 Y529	T399-Q401 HydrophobicContact CG2-CG 4.41Å; T399-Y529 CarbonylContact C-O 3.59Å; T399-Y529 WeakPolarHBondContact CA-O 3.1Å; T399-Y529 HydrophobicContact CG2-CD1 4.07Å
400	I	87.3	Confident	79.7	Confident	36 Å²	36	74.1 Å²	74.1	19%	0.185	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	120.5	176	-55.5	176.6	0	0	0	106.9	I398 L408 I528 Y529 I530 D531	I398-I400 HydrophobicContact CG2-CG1 3.9Å; I400-L408 HydrophobicContact CD1-CD1 4.48Å; I400-L408 HydrophobicContact CG2-CD1 3.6Å; I400-L408 HydrophobicContact CG2-CD2 4.49Å; I400-I528 HydrophobicContact CD1-CG2 3.88Å; I400-I528 HydrophobicContact CG1-CG2 4.37Å; I400-Y529 PolarHBondContact N-O 2.99Å; I400-I530 HydrophobicContact CB-CG1 4.35Å; I400-I530 HydrophobicContact CD1-CG1 4.44Å; I400-I530 WeakPolarHBondContact O-CA 3.46Å; I400-D531 PolarHBondContact O-N 3.26Å
401	Q	87.4	Confident	81.5	Confident	135 Å²	135	68.9 Å²	68.9	63%	0.631	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.2	129.3	171.5	-64.1	-171.9	-36	0	0	108.7	T399 D531	T399-Q401 HydrophobicContact CG2-CG 4.41Å; Q401-D531 WeakPolarHBondContact CA-O 2.96Å; Q401-D531 HydrophobicContact CG-CB 4.1Å
402	V	87.2	Confident	83.2	Confident	8 Å²	8	68.2 Å²	68.2	5%	0.048	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	143.9	-178.2	63.8	0	0	0	0	109.7	E406 L408 T490 I530 D531 V532 L533	V402-E406 HydrophobicContact CG2-CB 3.84Å; V402-L408 HydrophobicContact CG1-CD2 4.35Å; V402-L408 HydrophobicContact CG2-CB 4.5Å; V402-T490 HydrophobicContact CG1-CG2 3.83Å; V402-T490 HydrophobicContact CG2-CG2 4.15Å; V402-I530 HydrophobicContact CG1-CG2 4.16Å; V402-D531 PolarHBondContact N-O 3.16Å; V402-V532 HydrophobicContact CG1-CB 4.47Å; V402-V532 HydrophobicContact CG1-CG2 3.93Å; V402-V532 CarbonylContact O-C 3.48Å; V402-V532 WeakPolarHBondContact O-CA 2.93Å; V402-L533 PolarHBondContact O-N 3.21Å
403	N	84.8	Confident	84.6	Confident	76 Å²	76	65 Å²	65	41%	0.406	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	142.8	175.3	-57.1	-51.3	0	0	0	110	G405 E406 T490	N403-G405 PolarHBondContact O-N 2.83Å; N403-E406 HydrophobicContact CB-CG 4.14Å; N403-E406 PolarHBondContact N-OE2 2.8Å; N403-E406 PolarHBondContact ND2-OE1 2.89Å; N403-E406 PolarHBondContact ND2-OE2 2.82Å; N403-E406 WeakPolarHBondContact O-CB 3.49Å; N403-E406 PolarHBondContact O-N 2.87Å; N403-E406 VanDerWaalsContact O-N 3.09Å; N403-T490 PolarHBondContact O-OG1 3.3Å
404	E	83.7	Confident	84.8	Confident	20 Å²	20	59.3 Å²	59.3	9%	0.093	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	131.9	171.8	-173.4	-180	-168.8	0	0	111.2	K495 V532 L533 Q535	E404-K495 WeakPolarHBondContact OE1-CD 3.46Å; E404-K495 IonicContact OE1-NZ 2.75Å; E404-K495 PolarHBondContact OE1-NZ 2.65Å; E404-K495 IonicContact OE2-NZ 3.69Å; E404-K495 PolarHBondContact OE2-NZ 2.84Å; E404-V532 HydrophobicContact CB-CG1 3.97Å; E404-L533 WeakPolarHBondContact CB-O 3.25Å; E404-L533 PolarHBondContact N-O 2.96Å; E404-Q535 HydrophobicContact CB-CB 4.43Å; E404-Q535 PolarHBondContact OE2-N 3Å
405	G	82.5	Confident	84.3	Confident	35 Å²	35	56.5 Å²	56.5	36%	0.361	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.3	-14.8	-177.5	0	0	0	0	0	114.5	N403 T490	N403-G405 PolarHBondContact O-N 2.83Å; G405-T490 PolarHBondContact N-O 2.98Å
406	E	86.4	Confident	83.4	Confident	86 Å²	86	57.7 Å²	57.7	40%	0.402	31%	0.307	S	S	.	.			trans	-84	147.7	179.9	-69.4	176.6	175.9	0	0	111.8	V402 N403 T490	V402-E406 HydrophobicContact CG2-CB 3.84Å; N403-E406 HydrophobicContact CB-CG 4.14Å; N403-E406 PolarHBondContact N-OE2 2.8Å; N403-E406 PolarHBondContact ND2-OE1 2.89Å; N403-E406 PolarHBondContact ND2-OE2 2.82Å; N403-E406 WeakPolarHBondContact O-CB 3.49Å; N403-E406 PolarHBondContact O-N 2.87Å; N403-E406 VanDerWaalsContact O-N 3.09Å; E406-T490 WeakPolarHBondContact O-CG2 3.36Å; E406-T490 PolarHBondContact O-N 3.37Å; E406-T490 PolarHBondContact O-OG1 2.76Å
407	P	89.2	Confident	82.3	Confident	99 Å²	99	55.4 Å²	55.4	64%	0.643	30%	0.298	S	S	*	.			trans	-69.3	146	170.7	30.5	-34.4	0	0	0	110.4	V487	P407-V487 CarbonylContact C-O 3.57Å; P407-V487 VanDerWaalsContact CA-O 3.27Å; P407-V487 WeakPolarHBondContact CA-O 3.33Å
408	L	90.1	Very high	81.3	Confident	18 Å²	18	51.1 Å²	51.1	9%	0.094	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	136.1	178.8	172.6	64.6	0	0	0	110.9	I400 V402 I410 V487 T490 I530	I400-L408 HydrophobicContact CD1-CD1 4.48Å; I400-L408 HydrophobicContact CG2-CD1 3.6Å; I400-L408 HydrophobicContact CG2-CD2 4.49Å; V402-L408 HydrophobicContact CG1-CD2 4.35Å; V402-L408 HydrophobicContact CG2-CB 4.5Å; L408-I410 HydrophobicContact CD2-CD1 4.3Å; L408-I410 HydrophobicContact CD2-CG1 3.84Å; L408-I410 HydrophobicContact CG-CG1 3.95Å; L408-V487 HydrophobicContact CB-CB 4.11Å; L408-V487 HydrophobicContact CB-CG2 4.39Å; L408-V487 PolarHBondContact N-O 2.87Å; L408-V487 WeakPolarHBondContact O-CA 3.33Å; L408-V487 WeakPolarHBondContact O-CB 3.19Å; L408-V487 PolarHBondContact O-N 2.9Å; L408-T490 HydrophobicContact CB-CG2 3.57Å; L408-T490 HydrophobicContact CD2-CG2 4.16Å; L408-I530 HydrophobicContact CD2-CD1 4.01Å; L408-I530 HydrophobicContact CD2-CG1 4.06Å; L408-I530 HydrophobicContact CD2-CG2 3.62Å
409	I	89.5	Confident	80.1	Confident	70 Å²	70	50.7 Å²	50.7	36%	0.359	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	119.7	170.7	-61.7	160.2	0	0	0	107.7	P222 T411 N484	P222-I409 HydrophobicContact CB-CD1 4.12Å; P222-I409 HydrophobicContact CB-CG1 4.49Å; P222-I409 HydrophobicContact CB-CG2 3.6Å; P222-I409 HydrophobicContact CG-CG2 3.97Å; P222-I409 VanDerWaalsContact O-CD1 3.26Å; P222-I409 WeakPolarHBondContact O-CD1 3.28Å; I409-T411 HydrophobicContact CG2-CG2 3.86Å; I409-N484 HydrophobicContact CG2-CB 4.42Å
410	I	89.9	Confident	79.4	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	109.7	178.9	-49	163.9	0	0	0	107.8	L408 W424 N484 I485 V487 L504 I528 I530	L408-I410 HydrophobicContact CD2-CD1 4.3Å; L408-I410 HydrophobicContact CD2-CG1 3.84Å; L408-I410 HydrophobicContact CG-CG1 3.95Å; I410-W424 HydrophobicContact CG2-CH2 3.93Å; I410-W424 HydrophobicContact CG2-CZ3 4.2Å; I410-N484 WeakPolarHBondContact O-CA 3.21Å; I410-I485 HydrophobicContact CB-CB 4.11Å; I410-I485 HydrophobicContact CD1-CB 4.14Å; I410-I485 HydrophobicContact CD1-CG2 4.25Å; I410-I485 PolarHBondContact N-O 2.91Å; I410-I485 PolarHBondContact O-N 2.86Å; I410-V487 HydrophobicContact CD1-CG2 3.87Å; I410-V487 HydrophobicContact CG1-CG2 4.4Å; I410-L504 HydrophobicContact CD1-CD1 4.07Å; I410-L504 HydrophobicContact CG2-CD1 4.14Å; I410-I528 HydrophobicContact CG2-CD1 3.9Å; I410-I528 HydrophobicContact CG2-CG2 4.05Å; I410-I530 HydrophobicContact CD1-CD1 3.34Å; I410-I530 HydrophobicContact CG1-CD1 3.76Å; I410-I530 HydrophobicContact CG2-CD1 4.43Å
411	T	88.1	Confident	79	Confident	66 Å²	66	46.3 Å²	46.3	41%	0.405	25%	0.252	S	S	.	.			trans	-105.2	139.4	176.4	62.7	0	0	0	0	109.9	I409 N484 I528	I409-T411 HydrophobicContact CG2-CG2 3.86Å; T411-N484 WeakPolarHBondContact CA-OD1 3.49Å; T411-N484 WeakPolarHBondContact CB-OD1 3.48Å; T411-N484 HydrophobicContact CG2-CB 4.31Å; T411-N484 WeakPolarHBondContact CG2-OD1 3.23Å; T411-I528 WeakPolarHBondContact O-CD1 3.38Å
412	C	86.4	Confident	78.9	Confident	5 Å²	5	40.5 Å²	40.5	3%	0.034	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-76	132.3	172.9	-175.8	0	0	0	0	109.4	I414 I422 W424 C506 H508	C412-I414 PolarHBondContact O-N 2.82Å; C412-I422 HydrophobicContact CB-CD1 3.87Å; C412-I422 HydrophobicContact CB-CG2 4.3Å; C412-W424 HydrophobicContact CB-CH2 3.98Å; C412-W424 HydrophobicContact CB-CZ2 4Å; C412-C506 VanDerWaalsContact CA-SG 3.6Å; C412-C506 HydrophobicContact CB-CB 3.66Å; C412-C506 WeakPolarHBondContact CB-SG 3.16Å; C412-C506 WeakPolarHBondContact SG-CB 3.35Å; C412-C506 CovalentContact SG-SG 2.03Å; C412-C506 PolarHBondContact SG-SG 2.99Å; C412-H508 VanDerWaalsContact SG-CD2 3.58Å; C412-H508 PolarHBondContact SG-NE2 2.68Å
413	P	80.7	Confident	79	Confident	14 Å²	14	40.2 Å²	40.2	9%	0.091	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-60.4	138.2	171.7	22	-30.3	0	0	0	110.7	K396 I398 H508 S525 G526	K396-P413 HydrophobicContact CB-CB 4.26Å; K396-P413 HydrophobicContact CB-CG 4.16Å; K396-P413 HydrophobicContact CD-CB 3.95Å; I398-P413 HydrophobicContact CD1-CB 3.79Å; I398-P413 HydrophobicContact CD1-CG 3.77Å; P413-H508 PolarHBondContact O-NE2 2.98Å; P413-S525 WeakPolarHBondContact O-CB 3.46Å; P413-G526 VanDerWaalsContact CG-CA 3.45Å
414	I	69.8	Low	79.3	Confident	62 Å²	62	36.7 Å²	36.7	32%	0.318	21%	0.205	S	C	.	.	P	Polyproline II helix	trans	-102.1	129.8	179.2	-62.4	144.3	0	0	0	108.6	C194 C412 G416 I418	C194-I414 HydrophobicContact CB-CD1 3.73Å; C194-I414 WeakPolarHBondContact SG-CD1 3.49Å; C412-I414 PolarHBondContact O-N 2.82Å; I414-G416 WeakPolarHBondContact CG2-O 3.49Å; I414-I418 HydrophobicContact CD1-CD1 3.55Å; I414-I418 HydrophobicContact CD1-CG1 4.36Å; I414-I418 HydrophobicContact CG1-CD1 3.71Å; I414-I418 HydrophobicContact CG1-CG1 4.03Å; I414-I418 HydrophobicContact CG2-CD1 4.35Å; I414-I418 HydrophobicContact CG2-CG1 3.98Å
415	R	62.9	Low	79.7	Confident	74 Å²	74	35.8 Å²	35.8	28%	0.279	20%	0.2	S	C	.	.	S	Bend	trans	-112	-13.4	177.8	-69.1	175.7	175.2	-134.9	-38.1	113.5	R393 F394 P395 D523 S525	R393-R415 PolarHBondContact O-NH1 2.98Å; F394-R415 PolarHBondContact O-NH1 2.86Å; F394-R415 PolarHBondContact O-NH2 2.98Å; P395-R415 VanDerWaalsContact CA-NH2 3.27Å; R415-D523 WeakPolarHBondContact CB-OD2 3.46Å; R415-D523 WeakPolarHBondContact CD-OD2 3.25Å; R415-S525 PolarHBondContact NE-O 3.04Å
416	G	61	Low	80.1	Confident	33 Å²	33	36.4 Å²	36.4	34%	0.34	19%	0.192	S	C	.	.	S	Bend	trans	-150.7	-152	-174.3	0	0	0	0	0	111.8	I414	I414-G416 WeakPolarHBondContact CG2-O 3.49Å
417	F	61.2	Low	80.3	Confident	72 Å²	72	32.7 Å²	32.7	32%	0.316	18%	0.177	S	C	.	.			trans	-82.6	133.9	174.4	-60.5	-95	0	0	0	109.4	H184 K193 E419	H184-F417 HydrophobicContact CB-CE1 3.77Å; H184-F417 HydrophobicContact CB-CZ 4.19Å; K193-F417 HydrophobicContact CB-CD1 4.14Å; K193-F417 HydrophobicContact CD-CD1 3.43Å; K193-F417 VanDerWaalsContact CD-CD1 3.43Å; K193-F417 HydrophobicContact CD-CE1 3.32Å; K193-F417 HydrophobicContact CD-CE2 4.41Å; K193-F417 HydrophobicContact CD-CG 4.06Å; K193-F417 HydrophobicContact CD-CZ 3.85Å; K193-F417 HydrophobicContact CG-CD1 3.4Å; K193-F417 HydrophobicContact CG-CE1 3.52Å; K193-F417 HydrophobicContact CG-CG 4.33Å; K193-F417 VanDerWaalsContact NZ-CZ 3.26Å; F417-E419 HydrophobicContact CB-CG 3.91Å; F417-E419 PolarHBondContact O-N 2.86Å; F417-E419 VanDerWaalsContact O-N 3.13Å
418	I	62.2	Low	80.2	Confident	22 Å²	22	28.9 Å²	28.9	11%	0.113	15%	0.152	C	C	.	.			trans	-81.2	95.8	172.2	-53.5	170.4	0	0	0	106.8	G55 K193 I414	G55-I418 WeakPolarHBondContact O-CD1 3.34Å; K193-I418 WeakPolarHBondContact O-CD1 2.97Å; K193-I418 WeakPolarHBondContact O-CG1 3.39Å; I414-I418 HydrophobicContact CD1-CD1 3.55Å; I414-I418 HydrophobicContact CD1-CG1 4.36Å; I414-I418 HydrophobicContact CG1-CD1 3.71Å; I414-I418 HydrophobicContact CG1-CG1 4.03Å; I414-I418 HydrophobicContact CG2-CD1 4.35Å; I414-I418 HydrophobicContact CG2-CG1 3.98Å
419	E	62.7	Low	79.8	Confident	40 Å²	40	34 Å²	34	19%	0.187	18%	0.179	C	C	.	.			trans	-113.1	-2.3	-178.3	-74.4	175.5	149.9	0	0	112.5	A26 R191 F417 I520	A26-E419 WeakPolarHBondContact CB-O 3.47Å; R191-E419 IonicContact NH1-OE1 3.73Å; F417-E419 HydrophobicContact CB-CG 3.91Å; F417-E419 PolarHBondContact O-N 2.86Å; F417-E419 VanDerWaalsContact O-N 3.13Å; E419-I520 HydrophobicContact CB-CD1 4.41Å; E419-I520 WeakPolarHBondContact OE2-CD1 3.28Å; E419-I520 WeakPolarHBondContact OE2-CG1 3.37Å; E419-I520 WeakPolarHBondContact OE2-CG2 3.44Å
420	K	73.9	Confident	79.6	Confident	30 Å²	30	34.8 Å²	34.8	13%	0.13	18%	0.184	C	C	.	.	S	Bend	trans	-150.5	148.9	-178.1	-68.7	-173.9	169.3	175.6	0	111.3	A26 M281	A26-K420 VanDerWaalsContact CB-CA 3.49Å; M281-K420 HydrophobicContact CE-CB 3.74Å; M281-K420 HydrophobicContact CE-CD 3.56Å; M281-K420 HydrophobicContact CE-CG 3.72Å; M281-K420 HydrophobicContact SD-CB 3.91Å; M281-K420 HydrophobicContact SD-CD 4.49Å
421	P	80.2	Confident	79.5	Confident	6 Å²	6	40.5 Å²	40.5	4%	0.039	21%	0.209	C	C	.	.			trans	-44.3	150.9	172.6	-34.1	35.7	0	0	0	115.2	M281 Y483 G509	M281-P421 HydrophobicContact CB-CB 4.22Å; M281-P421 HydrophobicContact CG-CB 4.39Å; M281-P421 HydrophobicContact CG-CG 4.36Å; M281-P421 HydrophobicContact SD-CB 3.87Å; M281-P421 VanDerWaalsContact SD-CD 3.51Å; M281-P421 HydrophobicContact SD-CG 3.89Å; P421-Y483 HydrophobicContact CB-CE1 3.92Å; P421-Y483 HydrophobicContact CB-CE2 3.99Å; P421-Y483 WeakPolarHBondContact CB-OH 3.07Å; P421-Y483 HydrophobicContact CG-CE2 4.31Å; P421-Y483 WeakPolarHBondContact CG-OH 3.48Å; P421-G509 WeakPolarHBondContact O-CA 3.47Å; P421-G509 PolarHBondContact O-N 3.38Å
422	I	85.5	Confident	79.5	Confident	13 Å²	13	42.9 Å²	42.9	7%	0.067	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	126.5	177.2	-58.6	171.9	0	0	0	109.7	C412 W424 Y483 C506 I507	C412-I422 HydrophobicContact CB-CD1 3.87Å; C412-I422 HydrophobicContact CB-CG2 4.3Å; I422-W424 HydrophobicContact CG2-CD2 4.3Å; I422-W424 HydrophobicContact CG2-CG 4.4Å; I422-W424 HydrophobicContact CG2-CZ2 4.29Å; I422-Y483 HydrophobicContact CB-CG 4.45Å; I422-C506 HydrophobicContact CG2-CB 3.92Å; I422-I507 WeakPolarHBondContact CA-O 3.33Å
423	T	88.7	Confident	79.7	Confident	3 Å²	3	48 Å²	48	2%	0.018	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	122.8	169.7	-55.4	0	0	0	0	109.8	P282 L425 I458 Q463 I507 P511	P282-T423 HydrophobicContact CG-CG2 4.48Å; T423-L425 HydrophobicContact CG2-CD2 4.12Å; T423-I458 HydrophobicContact CG2-CD1 4.33Å; T423-Q463 HydrophobicContact CG2-CG 4.21Å; T423-I507 PolarHBondContact N-O 2.98Å; T423-I507 PolarHBondContact O-N 3.05Å; T423-P511 HydrophobicContact CG2-CG 4.27Å
424	W	91.2	Very high	80	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.008	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	129.2	179.2	-70.2	97.5	0	0	0	111.1	I410 C412 I422 Q463 V464 F466 Y483 I485 L504 C506 I528	I410-W424 HydrophobicContact CG2-CH2 3.93Å; I410-W424 HydrophobicContact CG2-CZ3 4.2Å; C412-W424 HydrophobicContact CB-CH2 3.98Å; C412-W424 HydrophobicContact CB-CZ2 4Å; I422-W424 HydrophobicContact CG2-CD2 4.3Å; I422-W424 HydrophobicContact CG2-CG 4.4Å; I422-W424 HydrophobicContact CG2-CZ2 4.29Å; W424-Q463 WeakPolarHBondContact O-CG 3.5Å; W424-V464 HydrophobicContact CB-CB 3.91Å; W424-V464 HydrophobicContact CB-CG2 3.89Å; W424-V464 PolarHBondContact O-N 3.33Å; W424-F466 HydrophobicContact CB-CE2 4.25Å; W424-F466 HydrophobicContact CB-CZ 4.18Å; W424-F466 AromaticContact CD1-CE2 3.65Å; W424-F466 AromaticContact CD1-CZ 3.48Å; W424-F466 VanDerWaalsContact CD1-CZ 3.48Å; W424-F466 HydrophobicContact CG-CE2 4.22Å; W424-F466 AromaticContact CG-CZ 3.91Å; W424-F466 HydrophobicContact CG-CZ 3.91Å; W424-Y483 PolarHBondContact NE1-O 2.84Å; W424-I485 HydrophobicContact CD2-CD1 3.8Å; W424-I485 HydrophobicContact CD2-CG1 4.36Å; W424-I485 HydrophobicContact CE3-CD1 4.05Å; W424-I485 HydrophobicContact CG-CD1 4.13Å; W424-I485 HydrophobicContact CZ2-CD1 4.37Å; W424-I485 HydrophobicContact CZ2-CG1 4.2Å; W424-I485 HydrophobicContact CZ3-CD1 4.41Å; W424-L504 HydrophobicContact CE3-CB 4.02Å; W424-L504 HydrophobicContact CE3-CD1 3.95Å; W424-L504 HydrophobicContact CE3-CG 4.46Å; W424-L504 HydrophobicContact CZ3-CB 4Å; W424-L504 HydrophobicContact CZ3-CD1 3.86Å; W424-C506 HydrophobicContact CD2-CB 4.14Å; W424-C506 HydrophobicContact CE3-CB 3.74Å; W424-C506 HydrophobicContact CH2-CB 3.94Å; W424-C506 HydrophobicContact CZ2-CB 4.31Å; W424-C506 HydrophobicContact CZ3-CB 3.65Å; W424-I528 HydrophobicContact CH2-CD1 3.81Å; W424-I528 HydrophobicContact CZ3-CD1 3.79Å
425	L	91.5	Very high	80.9	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	146.6	178.5	-52.3	179	0	0	0	110.1	T423 A427 L457 I458 L461 K462 Q463 L504 I505 I507	T423-L425 HydrophobicContact CG2-CD2 4.12Å; L425-A427 PolarHBondContact O-N 2.96Å; L425-L457 HydrophobicContact CD1-CB 4Å; L425-I458 HydrophobicContact CD2-CD1 3.49Å; L425-I458 VanDerWaalsContact CD2-CD1 3.49Å; L425-L461 HydrophobicContact CB-CB 4.26Å; L425-L461 HydrophobicContact CB-CD1 4.2Å; L425-L461 HydrophobicContact CD1-CB 4.34Å; L425-L461 HydrophobicContact CD1-CD1 4.17Å; L425-K462 WeakPolarHBondContact CA-O 3.32Å; L425-Q463 HydrophobicContact CD2-CB 3.99Å; L425-Q463 HydrophobicContact CD2-CG 4.28Å; L425-L504 WeakPolarHBondContact O-CA 3.37Å; L425-I505 HydrophobicContact CB-CB 4.22Å; L425-I505 HydrophobicContact CD1-CG2 4.37Å; L425-I505 PolarHBondContact N-O 2.98Å; L425-I505 PolarHBondContact O-N 3.28Å; L425-I507 HydrophobicContact CD1-CD1 3.75Å
426	Y	90.8	Very high	82.2	Confident	48 Å²	48	51 Å²	51	19%	0.188	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	126.2	168	-66.2	-82.9	0	0	0	109.3	K462 V464 L501	Y426-K462 HydrophobicContact CD2-CB 4.11Å; Y426-K462 HydrophobicContact CD2-CD 4.43Å; Y426-K462 HydrophobicContact CD2-CG 4.18Å; Y426-K462 WeakPolarHBondContact CD2-O 3.43Å; Y426-K462 HydrophobicContact CE2-CD 4.5Å; Y426-K462 PolarHBondContact N-O 2.67Å; Y426-V464 HydrophobicContact CD1-CG2 4.5Å; Y426-V464 HydrophobicContact CD2-CG2 4.02Å; Y426-V464 HydrophobicContact CE1-CG2 4.29Å; Y426-V464 HydrophobicContact CE2-CB 4.26Å; Y426-V464 HydrophobicContact CE2-CG2 3.76Å; Y426-V464 HydrophobicContact CG-CG2 4.38Å; Y426-L501 HydrophobicContact CD1-CD2 4.29Å; Y426-L501 HydrophobicContact CE1-CD2 3.5Å; Y426-L501 VanDerWaalsContact CE1-CD2 3.5Å
427	A	89.9	Confident	83.6	Confident	9 Å²	9	50 Å²	50	7%	0.074	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-88.2	152.9	171	0	0	0	0	0	110.1	L425 L434 N503 I505	L425-A427 PolarHBondContact O-N 2.96Å; A427-L434 HydrophobicContact CB-CD1 4.22Å; A427-N503 HydrophobicContact CB-CB 3.91Å; A427-N503 PolarHBondContact N-O 3.35Å; A427-N503 WeakPolarHBondContact O-CB 3.45Å; A427-I505 HydrophobicContact CB-CD1 3.74Å; A427-I505 HydrophobicContact CB-CG1 3.78Å
428	P	87.6	Confident	84.9	Confident	18 Å²	18	46.7 Å²	46.7	12%	0.117	23%	0.229	C	C	.	.	P	Polyproline II helix	trans	-59.3	142.6	171.8	-22.2	33	0	0	0	112.1	E433 L437 L461	P428-E433 HydrophobicContact CB-CB 4.06Å; P428-E433 HydrophobicContact CB-CG 3.85Å; P428-E433 HydrophobicContact CG-CG 4.12Å; P428-L437 HydrophobicContact CG-CD2 4.47Å; P428-L461 HydrophobicContact CG-CD2 4.34Å
429	D	82.9	Confident	86.1	Confident	127 Å²	127	52.6 Å²	52.6	68%	0.679	25%	0.253	S	S	*	.	S	Bend	trans	-74.6	-30.1	179.7	-64.3	-34.3	0	0	0	113	N503	D429-N503 WeakPolarHBondContact CA-ND2 3.38Å; D429-N503 PolarHBondContact OD1-ND2 2.74Å
430	N	85.4	Confident	87.4	Confident	86 Å²	86	52.8 Å²	52.8	46%	0.46	26%	0.257	S	S	.	.	S	Bend	trans	-79.4	124.1	177.7	-174.8	-6.9	0	0	0	110.5	D432 E433 L434	N430-D432 VanDerWaalsContact C-N 3.27Å; N430-D432 PolarHBondContact O-N 3.23Å; N430-D432 PolarHBondContact OD1-N 2.79Å; N430-E433 HydrophobicContact CB-CB 3.98Å; N430-E433 PolarHBondContact O-N 3.16Å; N430-L434 WeakPolarHBondContact O-CB 3.47Å; N430-L434 PolarHBondContact O-N 3.11Å
431	F	86.1	Confident	88.1	Confident	121 Å²	121	51.3 Å²	51.3	53%	0.531	25%	0.251	S	S	.	.	H	α-helix	trans	-56.6	-38.7	176.4	-177.4	-99	0	0	0	112.8	L434 M435	F431-L434 PolarHBondContact O-N 3.24Å; F431-M435 HydrophobicContact CD1-CG 3.95Å; F431-M435 HydrophobicContact CE1-CG 3.54Å; F431-M435 HydrophobicContact CE1-SD 4.31Å; F431-M435 HydrophobicContact CE2-CG 4.23Å; F431-M435 HydrophobicContact CE2-SD 4.33Å; F431-M435 HydrophobicContact CG-CG 4.46Å; F431-M435 HydrophobicContact CZ-CG 3.7Å; F431-M435 HydrophobicContact CZ-SD 3.89Å; F431-M435 WeakPolarHBondContact O-CB 3.32Å; F431-M435 VanDerWaalsContact O-CG 3.29Å; F431-M435 WeakPolarHBondContact O-CG 3.4Å; F431-M435 PolarHBondContact O-N 3.42Å
432	D	89.4	Confident	88.3	Confident	116 Å²	116	53.4 Å²	53.4	62%	0.62	26%	0.258	S	S	*	.	H	α-helix	trans	-67.6	-39.8	179.7	-68.8	-32.8	0	0	0	111.8	N430 M435 K436	N430-D432 VanDerWaalsContact C-N 3.27Å; N430-D432 PolarHBondContact O-N 3.23Å; N430-D432 PolarHBondContact OD1-N 2.79Å; D432-M435 PolarHBondContact O-N 2.79Å; D432-K436 WeakPolarHBondContact O-CB 3.32Å; D432-K436 PolarHBondContact O-N 2.98Å
433	E	89.9	Confident	88.3	Confident	112 Å²	112	56.4 Å²	56.4	52%	0.523	27%	0.274	S	S	.	.	H	α-helix	trans	-66.2	-43.5	175.6	-171.2	178.4	-177.8	0	0	110.9	P428 N430 M435 K436 L437	P428-E433 HydrophobicContact CB-CB 4.06Å; P428-E433 HydrophobicContact CB-CG 3.85Å; P428-E433 HydrophobicContact CG-CG 4.12Å; N430-E433 HydrophobicContact CB-CB 3.98Å; N430-E433 PolarHBondContact O-N 3.16Å; E433-M435 PolarHBondContact O-N 3.22Å; E433-K436 PolarHBondContact O-N 3Å; E433-L437 WeakPolarHBondContact O-CB 3.46Å; E433-L437 PolarHBondContact O-N 3.24Å
434	L	88.2	Confident	88	Confident	16 Å²	16	63.6 Å²	63.6	8%	0.084	30%	0.302	C	S	.	.	H	α-helix	trans	-60.1	-44.6	173.7	177.7	65.9	0	0	0	111.5	A427 N430 F431 K436 L437 I438 I505 I527	A427-L434 HydrophobicContact CB-CD1 4.22Å; N430-L434 WeakPolarHBondContact O-CB 3.47Å; N430-L434 PolarHBondContact O-N 3.11Å; F431-L434 PolarHBondContact O-N 3.24Å; L434-K436 PolarHBondContact O-N 3.24Å; L434-L437 HydrophobicContact CD1-CD2 4.46Å; L434-L437 WeakPolarHBondContact O-CB 3.29Å; L434-L437 PolarHBondContact O-N 2.81Å; L434-I438 HydrophobicContact CD1-CD1 4.35Å; L434-I438 HydrophobicContact CG-CD1 4.05Å; L434-I438 WeakPolarHBondContact O-CD1 3.37Å; L434-I438 WeakPolarHBondContact O-CG1 3.47Å; L434-I438 PolarHBondContact O-N 3.1Å; L434-I505 HydrophobicContact CD1-CD1 4.43Å; L434-I527 HydrophobicContact CD1-CD1 4.34Å; L434-I527 HydrophobicContact CD1-CG2 4.24Å; L434-I527 HydrophobicContact CD2-CG2 4.06Å
435	M	87.9	Confident	87.9	Confident	45 Å²	45	67 Å²	67	22%	0.222	32%	0.324	C	S	.	.	H	α-helix	trans	-64.2	-40.1	176.8	-76.3	-55.1	-55	0	0	112.1	R397 F431 D432 E433 I438 K439	R397-M435 VanDerWaalsContact CZ-SD 3.55Å; R397-M435 PolarHBondContact NH1-SD 3.44Å; R397-M435 PolarHBondContact NH2-SD 2.76Å; F431-M435 HydrophobicContact CD1-CG 3.95Å; F431-M435 HydrophobicContact CE1-CG 3.54Å; F431-M435 HydrophobicContact CE1-SD 4.31Å; F431-M435 HydrophobicContact CE2-CG 4.23Å; F431-M435 HydrophobicContact CE2-SD 4.33Å; F431-M435 HydrophobicContact CG-CG 4.46Å; F431-M435 HydrophobicContact CZ-CG 3.7Å; F431-M435 HydrophobicContact CZ-SD 3.89Å; F431-M435 WeakPolarHBondContact O-CB 3.32Å; F431-M435 VanDerWaalsContact O-CG 3.29Å; F431-M435 WeakPolarHBondContact O-CG 3.4Å; F431-M435 PolarHBondContact O-N 3.42Å; D432-M435 PolarHBondContact O-N 2.79Å; E433-M435 PolarHBondContact O-N 3.22Å; M435-I438 PolarHBondContact O-N 2.78Å; M435-I438 HydrophobicContact SD-CD1 4.11Å; M435-K439 WeakPolarHBondContact O-CB 3.35Å; M435-K439 WeakPolarHBondContact O-CG 3.43Å; M435-K439 PolarHBondContact O-N 3.16Å
436	K	90.7	Very high	87.6	Confident	152 Å²	152	67.5 Å²	67.5	66%	0.661	33%	0.326	S	S	*	.	H	α-helix	trans	-63.8	-43	174.3	-174.8	-179.8	178.9	-177.8	0	111.3	D432 E433 L434 K439 T440	D432-K436 WeakPolarHBondContact O-CB 3.32Å; D432-K436 PolarHBondContact O-N 2.98Å; E433-K436 PolarHBondContact O-N 3Å; L434-K436 PolarHBondContact O-N 3.24Å; K436-K439 PolarHBondContact O-N 3.08Å; K436-T440 WeakPolarHBondContact O-CB 3.49Å; K436-T440 PolarHBondContact O-N 2.91Å; K436-T440 PolarHBondContact O-OG1 3.39Å
437	L	90.5	Very high	87.1	Confident	13 Å²	13	66.4 Å²	66.4	7%	0.068	32%	0.324	C	S	.	.	H	α-helix	trans	-59.4	-49.5	175.1	-176.1	93.3	0	0	0	110.9	P428 E433 L434 K439 T440 A441 Y456 L457 T460 L461 I505	P428-L437 HydrophobicContact CG-CD2 4.47Å; E433-L437 WeakPolarHBondContact O-CB 3.46Å; E433-L437 PolarHBondContact O-N 3.24Å; L434-L437 HydrophobicContact CD1-CD2 4.46Å; L434-L437 WeakPolarHBondContact O-CB 3.29Å; L434-L437 PolarHBondContact O-N 2.81Å; L437-K439 PolarHBondContact O-N 2.92Å; L437-T440 PolarHBondContact O-N 3.21Å; L437-A441 WeakPolarHBondContact O-CB 3.34Å; L437-A441 PolarHBondContact O-N 2.91Å; L437-Y456 HydrophobicContact CD1-CE1 4.06Å; L437-Y456 HydrophobicContact CG-CE1 4.42Å; L437-L457 HydrophobicContact CD1-CD2 4.4Å; L437-L457 HydrophobicContact CD2-CD2 3.62Å; L437-L457 HydrophobicContact CG-CD2 3.95Å; L437-T460 HydrophobicContact CD1-CG2 4.08Å; L437-L461 HydrophobicContact CD1-CD2 4.16Å; L437-L461 HydrophobicContact CD2-CD1 4.02Å; L437-L461 HydrophobicContact CD2-CD2 4.26Å; L437-L461 HydrophobicContact CD2-CG 4.48Å; L437-I505 HydrophobicContact CD2-CD1 4.07Å
438	I	88.1	Confident	86.7	Confident	2 Å²	2	69.5 Å²	69.5	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-58.7	-50	177.7	-64.6	159.4	0	0	0	110.6	F394 L434 M435 T440 A441 Y442 W524 I527	F394-I438 HydrophobicContact CD1-CG2 3.99Å; F394-I438 HydrophobicContact CE1-CG2 4.09Å; L434-I438 HydrophobicContact CD1-CD1 4.35Å; L434-I438 HydrophobicContact CG-CD1 4.05Å; L434-I438 WeakPolarHBondContact O-CD1 3.37Å; L434-I438 WeakPolarHBondContact O-CG1 3.47Å; L434-I438 PolarHBondContact O-N 3.1Å; M435-I438 PolarHBondContact O-N 2.78Å; M435-I438 HydrophobicContact SD-CD1 4.11Å; I438-T440 VanDerWaalsContact C-N 3.3Å; I438-T440 PolarHBondContact O-N 3.08Å; I438-A441 PolarHBondContact O-N 3.33Å; I438-Y442 HydrophobicContact CG2-CD2 4.11Å; I438-Y442 HydrophobicContact CG2-CE2 4.34Å; I438-Y442 WeakPolarHBondContact O-CD2 3.32Å; I438-Y442 PolarHBondContact O-N 2.88Å; I438-W524 HydrophobicContact CB-CH2 4.11Å; I438-W524 HydrophobicContact CG1-CH2 3.51Å; I438-W524 HydrophobicContact CG1-CZ2 4.1Å; I438-W524 HydrophobicContact CG1-CZ3 4.43Å; I438-W524 HydrophobicContact CG2-CH2 4.25Å; I438-W524 HydrophobicContact CG2-CZ3 4.41Å; I438-I527 HydrophobicContact CD1-CD1 3.48Å; I438-I527 VanDerWaalsContact CD1-CD1 3.48Å; I438-I527 HydrophobicContact CG1-CD1 3.9Å
439	K	88.1	Confident	86.4	Confident	146 Å²	146	75.3 Å²	75.3	64%	0.635	36%	0.364	S	S	*	.	H	α-helix	trans	-61	-39.5	179.6	-74.6	177.7	178.9	-179.3	0	111.9	M435 K436 L437 N443	M435-K439 WeakPolarHBondContact O-CB 3.35Å; M435-K439 WeakPolarHBondContact O-CG 3.43Å; M435-K439 PolarHBondContact O-N 3.16Å; K436-K439 PolarHBondContact O-N 3.08Å; L437-K439 PolarHBondContact O-N 2.92Å; K439-N443 PolarHBondContact O-N 2.84Å
440	T	89.9	Confident	86.3	Confident	43 Å²	43	71.4 Å²	71.4	26%	0.264	34%	0.341	S	S	.	.	H	α-helix	trans	-68.7	-44.2	178.2	-53.2	0	0	0	0	111	K436 L437 I438 Y442 N443 T446 Y456	K436-T440 WeakPolarHBondContact O-CB 3.49Å; K436-T440 PolarHBondContact O-N 2.91Å; K436-T440 PolarHBondContact O-OG1 3.39Å; L437-T440 PolarHBondContact O-N 3.21Å; I438-T440 VanDerWaalsContact C-N 3.3Å; I438-T440 PolarHBondContact O-N 3.08Å; T440-Y442 VanDerWaalsContact C-N 3.25Å; T440-Y442 PolarHBondContact O-N 3.12Å; T440-N443 VanDerWaalsContact O-CB 3.23Å; T440-N443 WeakPolarHBondContact O-CB 3.36Å; T440-N443 PolarHBondContact O-N 3.04Å; T440-T446 WeakPolarHBondContact O-CB 3.27Å; T440-T446 WeakPolarHBondContact O-CG2 3.44Å; T440-T446 PolarHBondContact O-OG1 2.84Å; T440-T446 VanDerWaalsContact O-OG1 3.06Å; T440-Y456 HydrophobicContact CG2-CE1 4.3Å; T440-Y456 HydrophobicContact CG2-CE2 4.16Å; T440-Y456 WeakPolarHBondContact CG2-OH 3.36Å
441	A	87	Confident	86	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-59.3	-36.1	179.8	0	0	0	0	0	113	L437 I438 P453 Y456 L457 W524	L437-A441 WeakPolarHBondContact O-CB 3.34Å; L437-A441 PolarHBondContact O-N 2.91Å; I438-A441 PolarHBondContact O-N 3.33Å; A441-P453 HydrophobicContact CB-CB 4.16Å; A441-P453 WeakPolarHBondContact O-CB 3.27Å; A441-Y456 HydrophobicContact CB-CD1 3.54Å; A441-Y456 HydrophobicContact CB-CE1 3.93Å; A441-L457 HydrophobicContact CB-CD2 4.45Å; A441-W524 HydrophobicContact CB-CZ3 4.2Å
442	Y	85.6	Confident	85.7	Confident	49 Å²	49	66 Å²	66	19%	0.192	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	2.4	176.6	-75.3	-74.2	0	0	0	114.2	L391 R393 F394 I438 T440 P453 W524	L391-Y442 VanDerWaalsContact O-CE1 3.24Å; L391-Y442 WeakPolarHBondContact O-CE1 3.39Å; R393-Y442 PolarHBondContact O-OH 2.81Å; R393-Y442 VanDerWaalsContact O-OH 3.12Å; F394-Y442 HydrophobicContact CD1-CD2 4.04Å; F394-Y442 AromaticContact CD1-CE2 3.92Å; F394-Y442 HydrophobicContact CD1-CE2 3.92Å; F394-Y442 AromaticContact CE1-CD2 3.94Å; F394-Y442 HydrophobicContact CE1-CD2 3.94Å; F394-Y442 HydrophobicContact CE1-CE2 4.3Å; F394-Y442 HydrophobicContact CE1-CG 4.43Å; I438-Y442 HydrophobicContact CG2-CD2 4.11Å; I438-Y442 HydrophobicContact CG2-CE2 4.34Å; I438-Y442 WeakPolarHBondContact O-CD2 3.32Å; I438-Y442 PolarHBondContact O-N 2.88Å; T440-Y442 VanDerWaalsContact C-N 3.25Å; T440-Y442 PolarHBondContact O-N 3.12Å; Y442-P453 HydrophobicContact CD1-CG 4.11Å; Y442-P453 HydrophobicContact CE1-CG 4.07Å; Y442-W524 HydrophobicContact CD2-CZ3 4.11Å; Y442-W524 AromaticContact CE2-CE3 3.64Å; Y442-W524 HydrophobicContact CE2-CE3 3.64Å; Y442-W524 AromaticContact CE2-CZ3 3.46Å; Y442-W524 HydrophobicContact CE2-CZ3 3.46Å; Y442-W524 VanDerWaalsContact CE2-CZ3 3.46Å; Y442-W524 AromaticContact CZ-CE3 3.97Å
443	N	85.8	Confident	85.5	Confident	76 Å²	76	60.7 Å²	60.7	41%	0.406	29%	0.285	S	S	.	.			trans	-69.5	137.4	175.7	-169.1	-4.3	0	0	0	110.1	K439 T440 T445 T446 I447	K439-N443 PolarHBondContact O-N 2.84Å; T440-N443 VanDerWaalsContact O-CB 3.23Å; T440-N443 WeakPolarHBondContact O-CB 3.36Å; T440-N443 PolarHBondContact O-N 3.04Å; N443-T445 VanDerWaalsContact C-N 3.26Å; N443-T445 PolarHBondContact ND2-OG1 2.82Å; N443-T445 VanDerWaalsContact ND2-OG1 3.14Å; N443-T445 PolarHBondContact O-N 3.15Å; N443-T445 PolarHBondContact OD1-N 2.96Å; N443-T446 PolarHBondContact O-N 2.86Å; N443-T446 VanDerWaalsContact O-N 3.15Å; N443-I447 WeakPolarHBondContact O-CG1 3.3Å; N443-I447 PolarHBondContact O-N 2.97Å
444	Y	82.2	Confident	85.3	Confident	154 Å²	154	55.4 Å²	55.4	60%	0.604	26%	0.261	S	S	*	.	H	α-helix	trans	-56.2	-39.3	179.1	-177.1	-109.1	0	0	0	112.5	I447 I448	Y444-I447 PolarHBondContact O-N 3.43Å; Y444-I448 HydrophobicContact CD1-CD1 3.63Å; Y444-I448 HydrophobicContact CD1-CG1 4.49Å; Y444-I448 HydrophobicContact CE1-CD1 3.17Å; Y444-I448 HydrophobicContact CE1-CG1 4.17Å; Y444-I448 HydrophobicContact CE2-CD1 4.26Å; Y444-I448 HydrophobicContact CE2-CG1 4.45Å; Y444-I448 HydrophobicContact CG-CD1 4.35Å; Y444-I448 WeakPolarHBondContact O-CG1 3.24Å; Y444-I448 PolarHBondContact O-N 3.15Å
445	T	87.6	Confident	85.1	Confident	75 Å²	75	56.7 Å²	56.7	46%	0.46	27%	0.265	S	S	.	.	H	α-helix	trans	-63.9	-44.3	177.7	55.3	0	0	0	0	112	N443 I448 Q449	N443-T445 VanDerWaalsContact C-N 3.26Å; N443-T445 PolarHBondContact ND2-OG1 2.82Å; N443-T445 VanDerWaalsContact ND2-OG1 3.14Å; N443-T445 PolarHBondContact O-N 3.15Å; N443-T445 PolarHBondContact OD1-N 2.96Å; T445-I448 PolarHBondContact O-N 3.44Å; T445-Q449 WeakPolarHBondContact O-CG 3.48Å; T445-Q449 PolarHBondContact O-N 2.92Å; T445-Q449 VanDerWaalsContact O-N 3.08Å
446	T	85.1	Confident	85.1	Confident	9 Å²	9	56.1 Å²	56.1	6%	0.055	26%	0.26	C	S	.	.	H	α-helix	trans	-65.8	-39.7	176.6	-56.7	0	0	0	0	111.3	T440 N443 I448 Q449 H450 Y456	T440-T446 WeakPolarHBondContact O-CB 3.27Å; T440-T446 WeakPolarHBondContact O-CG2 3.44Å; T440-T446 PolarHBondContact O-OG1 2.84Å; T440-T446 VanDerWaalsContact O-OG1 3.06Å; N443-T446 PolarHBondContact O-N 2.86Å; N443-T446 VanDerWaalsContact O-N 3.15Å; T446-I448 VanDerWaalsContact C-N 3.35Å; T446-I448 PolarHBondContact O-N 2.03Å; T446-Q449 PolarHBondContact O-N 2.83Å; T446-H450 WeakPolarHBondContact O-CB 3.39Å; T446-H450 PolarHBondContact O-N 2.86Å; T446-Y456 HydrophobicContact CG2-CD1 4.28Å; T446-Y456 HydrophobicContact CG2-CD2 3.47Å; T446-Y456 VanDerWaalsContact CG2-CD2 3.47Å; T446-Y456 HydrophobicContact CG2-CE2 4.04Å; T446-Y456 HydrophobicContact CG2-CG 3.6Å
447	I	81.7	Confident	85	Confident	26 Å²	26	48.9 Å²	48.9	13%	0.133	23%	0.229	C	C	.	.	H	α-helix	trans	-64.8	-37.9	174.7	-66.7	164.7	0	0	0	110.9	L391 N443 Y444 Q449 K451 P453	L391-I447 HydrophobicContact CD2-CD1 3.79Å; L391-I447 HydrophobicContact CD2-CG1 4.27Å; L391-I447 HydrophobicContact CD2-CG2 4.32Å; N443-I447 WeakPolarHBondContact O-CG1 3.3Å; N443-I447 PolarHBondContact O-N 2.97Å; Y444-I447 PolarHBondContact O-N 3.43Å; I447-Q449 PolarHBondContact O-N 2.94Å; I447-K451 CarbonylContact O-C 3.55Å; I447-K451 WeakPolarHBondContact O-CA 2.84Å; I447-K451 PolarHBondContact O-N 3.29Å; I447-P453 HydrophobicContact CG1-CG 4.31Å
448	I	80.1	Confident	84.9	Confident	73 Å²	73	48.4 Å²	48.4	37%	0.374	23%	0.226	S	C	.	.	H	α-helix	trans	-62.9	-43.9	174.7	-74.7	167.6	0	0	0	111.5	Y444 T445 T446 K451	Y444-I448 HydrophobicContact CD1-CD1 3.63Å; Y444-I448 HydrophobicContact CD1-CG1 4.49Å; Y444-I448 HydrophobicContact CE1-CD1 3.17Å; Y444-I448 HydrophobicContact CE1-CG1 4.17Å; Y444-I448 HydrophobicContact CE2-CD1 4.26Å; Y444-I448 HydrophobicContact CE2-CG1 4.45Å; Y444-I448 HydrophobicContact CG-CD1 4.35Å; Y444-I448 WeakPolarHBondContact O-CG1 3.24Å; Y444-I448 PolarHBondContact O-N 3.15Å; T445-I448 PolarHBondContact O-N 3.44Å; T446-I448 VanDerWaalsContact C-N 3.35Å; T446-I448 PolarHBondContact O-N 2.03Å; I448-K451 PolarHBondContact O-NZ 2.85Å; I448-K451 VanDerWaalsContact O-NZ 3.09Å
449	Q	82.7	Confident	84.7	Confident	141 Å²	141	51 Å²	51	66%	0.659	24%	0.242	S	C	*	.	H	α-helix	trans	-70.6	-53.9	-177.4	-72.5	174.5	-18.8	0	0	111.9	T445 T446 I447	T445-Q449 WeakPolarHBondContact O-CG 3.48Å; T445-Q449 PolarHBondContact O-N 2.92Å; T445-Q449 VanDerWaalsContact O-N 3.08Å; T446-Q449 PolarHBondContact O-N 2.83Å; I447-Q449 PolarHBondContact O-N 2.94Å
450	H	80.8	Confident	84.7	Confident	45 Å²	45	47.7 Å²	47.7	21%	0.208	23%	0.234	C	C	.	.	H	α-helix	trans	-92.6	-6.1	-175	-68.1	-92.4	0	0	0	113.8	T446 T452 R455 Y456 T459	T446-H450 WeakPolarHBondContact O-CB 3.39Å; T446-H450 PolarHBondContact O-N 2.86Å; H450-T452 PolarHBondContact O-N 3.32Å; H450-R455 HydrophobicContact CB-CB 4.46Å; H450-R455 HydrophobicContact CB-CG 4.39Å; H450-R455 WeakPolarHBondContact O-CB 3.15Å; H450-R455 VanDerWaalsContact O-CD 3.22Å; H450-R455 WeakPolarHBondContact O-CD 3.44Å; H450-R455 WeakPolarHBondContact O-CG 3.19Å; H450-Y456 AromaticContact CD2-CD2 3.87Å; H450-Y456 AromaticContact NE2-CD2 3.74Å; H450-T459 PolarHBondContact CE1-OG1 3.13Å
451	K	77.9	Confident	84.7	Confident	93 Å²	93	46.8 Å²	46.8	40%	0.404	23%	0.228	S	C	.	.	S	Bend	trans	68.6	-32.8	-176.9	-50.2	-60.4	-176.9	-164.8	0	115.2	I447 I448 I514	I447-K451 CarbonylContact O-C 3.55Å; I447-K451 WeakPolarHBondContact O-CA 2.84Å; I447-K451 PolarHBondContact O-N 3.29Å; I448-K451 PolarHBondContact O-NZ 2.85Å; I448-K451 VanDerWaalsContact O-NZ 3.09Å; K451-I514 HydrophobicContact CB-CD1 3.8Å; K451-I514 HydrophobicContact CB-CG1 4.25Å; K451-I514 HydrophobicContact CB-CG2 4.35Å; K451-I514 HydrophobicContact CG-CD1 3.82Å
452	T	80.8	Confident	84.7	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.254	C	S	.	.	S	Bend	trans	-142.1	151.8	175.5	68.2	0	0	0	0	111.9	H450 S454 R455 Y456 Y521	H450-T452 PolarHBondContact O-N 3.32Å; T452-S454 VanDerWaalsContact C-N 3.3Å; T452-S454 PolarHBondContact O-N 3.04Å; T452-R455 PolarHBondContact O-N 3.23Å; T452-R455 VanDerWaalsContact OG1-CB 3.23Å; T452-R455 WeakPolarHBondContact OG1-CB 3.45Å; T452-R455 PolarHBondContact OG1-N 2.78Å; T452-Y456 PolarHBondContact O-N 2.79Å; T452-Y521 HydrophobicContact CG2-CE2 4.17Å
453	P	84.6	Confident	84.8	Confident	4 Å²	4	52.4 Å²	52.4	3%	0.026	25%	0.254	C	S	.	.	H	α-helix	trans	-58.9	-40.1	171	-24.8	34.3	0	0	0	112.4	L391 A441 Y442 I447 R455 Y456 L457 Y521	L391-P453 HydrophobicContact CD2-CG 3.83Å; A441-P453 HydrophobicContact CB-CB 4.16Å; A441-P453 WeakPolarHBondContact O-CB 3.27Å; Y442-P453 HydrophobicContact CD1-CG 4.11Å; Y442-P453 HydrophobicContact CE1-CG 4.07Å; I447-P453 HydrophobicContact CG1-CG 4.31Å; P453-R455 VanDerWaalsContact C-N 3.31Å; P453-R455 PolarHBondContact O-N 2.88Å; P453-Y456 WeakPolarHBondContact O-CB 3.41Å; P453-Y456 PolarHBondContact O-N 2.83Å; P453-L457 WeakPolarHBondContact O-CG 3.49Å; P453-L457 PolarHBondContact O-N 3.44Å; P453-Y521 WeakPolarHBondContact CD-OH 3.39Å
454	S	87	Confident	84.9	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.014	24%	0.235	C	C	.	.	H	α-helix	trans	-60	-39.3	178.2	-51.8	0	0	0	0	112.2	T452 L457 I458 P511 P522	T452-S454 VanDerWaalsContact C-N 3.3Å; T452-S454 PolarHBondContact O-N 3.04Å; S454-L457 PolarHBondContact O-N 3.38Å; S454-I458 PolarHBondContact O-N 2.83Å; S454-I458 VanDerWaalsContact O-N 3.12Å; S454-P511 CarbonylContact C-O 3.52Å; S454-P522 PolarHBondContact OG-O 2.89Å
455	R	84.2	Confident	85.1	Confident	43 Å²	43	44.2 Å²	44.2	16%	0.162	22%	0.22	C	C	.	.	H	α-helix	trans	-68.3	-38.6	176.1	-179.3	159.6	171	-168.9	3.3	112.2	F377 H450 T452 P453 I458 T459 P511 Y512	F377-R455 VanDerWaalsContact CE2-NH1 3.31Å; F377-R455 VanDerWaalsContact CZ-NH1 3.25Å; H450-R455 HydrophobicContact CB-CB 4.46Å; H450-R455 HydrophobicContact CB-CG 4.39Å; H450-R455 WeakPolarHBondContact O-CB 3.15Å; H450-R455 VanDerWaalsContact O-CD 3.22Å; H450-R455 WeakPolarHBondContact O-CD 3.44Å; H450-R455 WeakPolarHBondContact O-CG 3.19Å; T452-R455 PolarHBondContact O-N 3.23Å; T452-R455 VanDerWaalsContact OG1-CB 3.23Å; T452-R455 WeakPolarHBondContact OG1-CB 3.45Å; T452-R455 PolarHBondContact OG1-N 2.78Å; P453-R455 VanDerWaalsContact C-N 3.31Å; P453-R455 PolarHBondContact O-N 2.88Å; R455-I458 VanDerWaalsContact O-CG2 3.26Å; R455-I458 WeakPolarHBondContact O-CG2 3.48Å; R455-T459 WeakPolarHBondContact O-CG2 2.98Å; R455-T459 PolarHBondContact O-N 3.49Å; R455-T459 PolarHBondContact O-OG1 2.81Å; R455-P511 VanDerWaalsContact CA-O 3.25Å; R455-P511 WeakPolarHBondContact CA-O 3.26Å; R455-P511 WeakPolarHBondContact CB-O 3.32Å; R455-P511 PolarHBondContact N-O 3.22Å; R455-Y512 HydrophobicContact CG-CD1 4.15Å
456	Y	87.1	Confident	84.9	Confident	33 Å²	33	41 Å²	41	13%	0.129	20%	0.2	C	C	.	.	H	α-helix	trans	-58.9	-48.3	171.4	168.9	-102.4	0	0	0	110.9	L437 T440 A441 T446 H450 T452 P453 I458 T459 T460	L437-Y456 HydrophobicContact CD1-CE1 4.06Å; L437-Y456 HydrophobicContact CG-CE1 4.42Å; T440-Y456 HydrophobicContact CG2-CE1 4.3Å; T440-Y456 HydrophobicContact CG2-CE2 4.16Å; T440-Y456 WeakPolarHBondContact CG2-OH 3.36Å; A441-Y456 HydrophobicContact CB-CD1 3.54Å; A441-Y456 HydrophobicContact CB-CE1 3.93Å; T446-Y456 HydrophobicContact CG2-CD1 4.28Å; T446-Y456 HydrophobicContact CG2-CD2 3.47Å; T446-Y456 VanDerWaalsContact CG2-CD2 3.47Å; T446-Y456 HydrophobicContact CG2-CE2 4.04Å; T446-Y456 HydrophobicContact CG2-CG 3.6Å; H450-Y456 AromaticContact CD2-CD2 3.87Å; H450-Y456 AromaticContact NE2-CD2 3.74Å; T452-Y456 PolarHBondContact O-N 2.79Å; P453-Y456 WeakPolarHBondContact O-CB 3.41Å; P453-Y456 PolarHBondContact O-N 2.83Å; Y456-I458 PolarHBondContact O-N 3.23Å; Y456-T459 WeakPolarHBondContact CA-OG1 3.42Å; Y456-T459 PolarHBondContact O-N 3.5Å; Y456-T459 VanDerWaalsContact O-N 3.13Å; Y456-T459 PolarHBondContact O-OG1 3.24Å; Y456-T460 WeakPolarHBondContact CE2-OG1 3.27Å; Y456-T460 PolarHBondContact O-N 3.44Å; Y456-T460 PolarHBondContact O-OG1 3.43Å; Y456-T460 VanDerWaalsContact O-OG1 3.13Å
457	L	89.1	Confident	84.7	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.2	-46.4	-178.8	-66.8	172.6	0	0	0	113.3	L425 L437 A441 P453 S454 T459 T460 L461 I505 I507 W524	L425-L457 HydrophobicContact CD1-CB 4Å; L437-L457 HydrophobicContact CD1-CD2 4.4Å; L437-L457 HydrophobicContact CD2-CD2 3.62Å; L437-L457 HydrophobicContact CG-CD2 3.95Å; A441-L457 HydrophobicContact CB-CD2 4.45Å; P453-L457 WeakPolarHBondContact O-CG 3.49Å; P453-L457 PolarHBondContact O-N 3.44Å; S454-L457 PolarHBondContact O-N 3.38Å; L457-T459 VanDerWaalsContact C-N 3.26Å; L457-T459 PolarHBondContact O-N 3.44Å; L457-T460 PolarHBondContact O-N 3.02Å; L457-L461 HydrophobicContact CB-CD1 4.44Å; L457-L461 HydrophobicContact CD2-CD1 4.08Å; L457-L461 VanDerWaalsContact O-CB 3.26Å; L457-L461 WeakPolarHBondContact O-CB 3.49Å; L457-L461 WeakPolarHBondContact O-CG 3.44Å; L457-L461 PolarHBondContact O-N 2.71Å; L457-I505 HydrophobicContact CD1-CG2 4.37Å; L457-I507 HydrophobicContact CB-CD1 4.32Å; L457-I507 HydrophobicContact CD1-CD1 4.28Å; L457-W524 HydrophobicContact CD1-CD2 3.61Å; L457-W524 HydrophobicContact CD1-CE3 3.76Å; L457-W524 HydrophobicContact CD1-CG 3.99Å; L457-W524 HydrophobicContact CD1-CH2 4.07Å; L457-W524 HydrophobicContact CD1-CZ2 4.02Å; L457-W524 HydrophobicContact CD1-CZ3 3.99Å; L457-W524 HydrophobicContact CD2-CH2 4.29Å
458	I	87.1	Confident	84.8	Confident	3 Å²	3	43.2 Å²	43.2	2%	0.015	22%	0.215	C	C	.	.	H	α-helix	trans	-69.2	-23.8	178.9	-170.4	67.6	0	0	0	113	P282 K297 T423 L425 S454 R455 Y456 Q463 P511 Y512	P282-I458 HydrophobicContact CG-CD1 4.21Å; K297-I458 PolarHBondContact NZ-O 3.15Å; T423-I458 HydrophobicContact CG2-CD1 4.33Å; L425-I458 HydrophobicContact CD2-CD1 3.49Å; L425-I458 VanDerWaalsContact CD2-CD1 3.49Å; S454-I458 PolarHBondContact O-N 2.83Å; S454-I458 VanDerWaalsContact O-N 3.12Å; R455-I458 VanDerWaalsContact O-CG2 3.26Å; R455-I458 WeakPolarHBondContact O-CG2 3.48Å; Y456-I458 PolarHBondContact O-N 3.23Å; I458-Q463 HydrophobicContact CD1-CB 4.43Å; I458-P511 HydrophobicContact CB-CB 3.82Å; I458-P511 HydrophobicContact CB-CG 3.83Å; I458-P511 HydrophobicContact CD1-CG 4.04Å; I458-P511 HydrophobicContact CG1-CB 4.34Å; I458-P511 HydrophobicContact CG1-CG 3.77Å; I458-P511 HydrophobicContact CG2-CB 3.83Å; I458-P511 HydrophobicContact CG2-CG 4.07Å; I458-Y512 HydrophobicContact CG1-CD2 4.42Å; I458-Y512 HydrophobicContact CG1-CE1 4.47Å; I458-Y512 HydrophobicContact CG1-CE2 3.68Å; I458-Y512 HydrophobicContact CG2-CD1 3.87Å; I458-Y512 HydrophobicContact CG2-CD2 4.34Å; I458-Y512 HydrophobicContact CG2-CE1 3.53Å; I458-Y512 HydrophobicContact CG2-CE2 4.05Å; I458-Y512 HydrophobicContact CG2-CG 4.26Å
459	T	85.3	Confident	85	Confident	57 Å²	57	40 Å²	40	35%	0.35	20%	0.198	S	C	.	.	H	α-helix	trans	-77	-36	173.9	54.5	0	0	0	0	112.4	H450 R455 Y456 L457 Y512	H450-T459 PolarHBondContact CE1-OG1 3.13Å; R455-T459 WeakPolarHBondContact O-CG2 2.98Å; R455-T459 PolarHBondContact O-N 3.49Å; R455-T459 PolarHBondContact O-OG1 2.81Å; Y456-T459 WeakPolarHBondContact CA-OG1 3.42Å; Y456-T459 PolarHBondContact O-N 3.5Å; Y456-T459 VanDerWaalsContact O-N 3.13Å; Y456-T459 PolarHBondContact O-OG1 3.24Å; L457-T459 VanDerWaalsContact C-N 3.26Å; L457-T459 PolarHBondContact O-N 3.44Å; T459-Y512 HydrophobicContact CG2-CE1 4.13Å
460	T	87	Confident	85	Confident	76 Å²	76	33.7 Å²	33.7	47%	0.466	17%	0.169	S	C	.	.	H	α-helix	trans	-90.2	-36.3	-175.8	-52.9	0	0	0	0	113.2	L437 Y456 L457	L437-T460 HydrophobicContact CD1-CG2 4.08Å; Y456-T460 WeakPolarHBondContact CE2-OG1 3.27Å; Y456-T460 PolarHBondContact O-N 3.44Å; Y456-T460 PolarHBondContact O-OG1 3.43Å; Y456-T460 VanDerWaalsContact O-OG1 3.13Å; L457-T460 PolarHBondContact O-N 3.02Å
461	L	89	Confident	85.1	Confident	23 Å²	23	40.4 Å²	40.4	12%	0.12	19%	0.193	C	C	.	.	S	Bend	trans	-99.2	155.9	-174	-58.8	177.4	0	0	0	112.4	L425 P428 L437 L457 I505	L425-L461 HydrophobicContact CB-CB 4.26Å; L425-L461 HydrophobicContact CB-CD1 4.2Å; L425-L461 HydrophobicContact CD1-CB 4.34Å; L425-L461 HydrophobicContact CD1-CD1 4.17Å; P428-L461 HydrophobicContact CG-CD2 4.34Å; L437-L461 HydrophobicContact CD1-CD2 4.16Å; L437-L461 HydrophobicContact CD2-CD1 4.02Å; L437-L461 HydrophobicContact CD2-CD2 4.26Å; L437-L461 HydrophobicContact CD2-CG 4.48Å; L457-L461 HydrophobicContact CB-CD1 4.44Å; L457-L461 HydrophobicContact CD2-CD1 4.08Å; L457-L461 VanDerWaalsContact O-CB 3.26Å; L457-L461 WeakPolarHBondContact O-CB 3.49Å; L457-L461 WeakPolarHBondContact O-CG 3.44Å; L457-L461 PolarHBondContact O-N 2.71Å; L461-I505 HydrophobicContact CD1-CD1 3.56Å
462	K	87.5	Confident	85.4	Confident	126 Å²	126	42.6 Å²	42.6	55%	0.548	21%	0.205	S	C	.	.	P	Polyproline II helix	trans	-81	134	172.8	-173.1	176.5	-178.7	179.7	0	110.6	L425 Y426	L425-K462 WeakPolarHBondContact CA-O 3.32Å; Y426-K462 HydrophobicContact CD2-CB 4.11Å; Y426-K462 HydrophobicContact CD2-CD 4.43Å; Y426-K462 HydrophobicContact CD2-CG 4.18Å; Y426-K462 WeakPolarHBondContact CD2-O 3.43Å; Y426-K462 HydrophobicContact CE2-CD 4.5Å; Y426-K462 PolarHBondContact N-O 2.67Å
463	Q	88.4	Confident	85.5	Confident	41 Å²	41	43.9 Å²	43.9	19%	0.192	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-75.7	143.1	170.9	-173	-175.2	-15.5	0	0	112.1	P282 T423 W424 L425 I458 N465	P282-Q463 VanDerWaalsContact CD-OE1 3.27Å; P282-Q463 VanDerWaalsContact CG-OE1 3.23Å; T423-Q463 HydrophobicContact CG2-CG 4.21Å; W424-Q463 WeakPolarHBondContact O-CG 3.5Å; L425-Q463 HydrophobicContact CD2-CB 3.99Å; L425-Q463 HydrophobicContact CD2-CG 4.28Å; I458-Q463 HydrophobicContact CD1-CB 4.43Å; Q463-N465 PolarHBondContact O-N 3.12Å
464	V	88.1	Confident	85.4	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.006	25%	0.254	C	S	.	.			trans	-71.6	112.3	169	-177	0	0	0	0	108.9	W424 Y426 F466 L469 L501 L504	W424-V464 HydrophobicContact CB-CB 3.91Å; W424-V464 HydrophobicContact CB-CG2 3.89Å; W424-V464 PolarHBondContact O-N 3.33Å; Y426-V464 HydrophobicContact CD1-CG2 4.5Å; Y426-V464 HydrophobicContact CD2-CG2 4.02Å; Y426-V464 HydrophobicContact CE1-CG2 4.29Å; Y426-V464 HydrophobicContact CE2-CB 4.26Å; Y426-V464 HydrophobicContact CE2-CG2 3.76Å; Y426-V464 HydrophobicContact CG-CG2 4.38Å; V464-F466 HydrophobicContact CG1-CD1 4.43Å; V464-F466 HydrophobicContact CG1-CE1 4.13Å; V464-F466 HydrophobicContact CG1-CE2 4.32Å; V464-F466 HydrophobicContact CG1-CZ 4.08Å; V464-L469 HydrophobicContact CG1-CD2 4.05Å; V464-L501 HydrophobicContact CG1-CD2 3.98Å; V464-L501 HydrophobicContact CG2-CD2 3.93Å; V464-L504 HydrophobicContact CG2-CD2 4.02Å
465	N	85.5	Confident	85.1	Confident	57 Å²	57	55.7 Å²	55.7	31%	0.305	26%	0.26	S	S	.	.			trans	-89.8	105.7	172.4	-179.9	-21.3	0	0	0	109.2	Q463 T467 T468 L469	Q463-N465 PolarHBondContact O-N 3.12Å; N465-T467 VanDerWaalsContact C-N 3.35Å; N465-T467 PolarHBondContact O-N 3.46Å; N465-T467 WeakPolarHBondContact OD1-CB 3.46Å; N465-T467 PolarHBondContact OD1-N 3.31Å; N465-T468 VanDerWaalsContact CB-OG1 3.29Å; N465-T468 WeakPolarHBondContact CB-OG1 2.85Å; N465-T468 VanDerWaalsContact CG-OG1 3.3Å; N465-T468 PolarHBondContact O-N 3.37Å; N465-T468 PolarHBondContact O-OG1 3.14Å; N465-T468 PolarHBondContact OD1-N 3.37Å; N465-T468 VanDerWaalsContact OD1-N 3.14Å; N465-L469 VanDerWaalsContact O-CB 3.22Å; N465-L469 WeakPolarHBondContact O-CB 3.36Å; N465-L469 PolarHBondContact O-N 3.48Å
466	F	84	Confident	85.1	Confident	7 Å²	7	57.5 Å²	57.5	3%	0.031	27%	0.267	C	S	.	.	H	α-helix	trans	-67.5	-33.3	-178.9	-71.3	-76.5	0	0	0	113	M300 W424 V464 T468 L469 I470 I479 I485	M300-F466 HydrophobicContact CE-CD2 3.67Å; M300-F466 HydrophobicContact CE-CE2 4.22Å; M300-F466 HydrophobicContact CE-CG 4.48Å; M300-F466 HydrophobicContact SD-CB 3.88Å; M300-F466 HydrophobicContact SD-CD2 3.75Å; M300-F466 HydrophobicContact SD-CG 4.22Å; W424-F466 HydrophobicContact CB-CE2 4.25Å; W424-F466 HydrophobicContact CB-CZ 4.18Å; W424-F466 AromaticContact CD1-CE2 3.65Å; W424-F466 AromaticContact CD1-CZ 3.48Å; W424-F466 VanDerWaalsContact CD1-CZ 3.48Å; W424-F466 HydrophobicContact CG-CE2 4.22Å; W424-F466 AromaticContact CG-CZ 3.91Å; W424-F466 HydrophobicContact CG-CZ 3.91Å; V464-F466 HydrophobicContact CG1-CD1 4.43Å; V464-F466 HydrophobicContact CG1-CE1 4.13Å; V464-F466 HydrophobicContact CG1-CE2 4.32Å; V464-F466 HydrophobicContact CG1-CZ 4.08Å; F466-T468 PolarHBondContact O-N 3.21Å; F466-L469 HydrophobicContact CD1-CD2 4.29Å; F466-L469 HydrophobicContact CE1-CD2 4.5Å; F466-L469 PolarHBondContact O-N 3.45Å; F466-I470 HydrophobicContact CB-CD1 4.29Å; F466-I470 WeakPolarHBondContact O-CB 3.44Å; F466-I470 WeakPolarHBondContact O-CD1 3.31Å; F466-I470 WeakPolarHBondContact O-CG1 3.45Å; F466-I470 PolarHBondContact O-N 3.29Å; F466-I479 HydrophobicContact CD1-CB 4.22Å; F466-I479 HydrophobicContact CD1-CD1 4.27Å; F466-I479 HydrophobicContact CD2-CD1 3.95Å; F466-I479 HydrophobicContact CE1-CB 4.42Å; F466-I479 HydrophobicContact CE1-CD1 4.18Å; F466-I479 HydrophobicContact CE2-CD1 3.85Å; F466-I479 HydrophobicContact CG-CD1 4.16Å; F466-I479 HydrophobicContact CZ-CD1 3.96Å; F466-I485 HydrophobicContact CE1-CD1 3.85Å; F466-I485 HydrophobicContact CE1-CG1 3.78Å; F466-I485 HydrophobicContact CE1-CG2 4.47Å; F466-I485 HydrophobicContact CZ-CD1 3.79Å; F466-I485 HydrophobicContact CZ-CG1 3.87Å
467	T	81.7	Confident	85.2	Confident	24 Å²	24	56.5 Å²	56.5	15%	0.147	26%	0.263	C	S	.	.	H	α-helix	trans	-60.4	-46.6	177	-53.5	0	0	0	0	111.1	F231 N465 R471	F231-T467 HydrophobicContact CD1-CG2 3.91Å; F231-T467 HydrophobicContact CE1-CG2 4.4Å; N465-T467 VanDerWaalsContact C-N 3.35Å; N465-T467 PolarHBondContact O-N 3.46Å; N465-T467 WeakPolarHBondContact OD1-CB 3.46Å; N465-T467 PolarHBondContact OD1-N 3.31Å; T467-R471 WeakPolarHBondContact O-CB 3.48Å; T467-R471 PolarHBondContact O-N 3.08Å
468	T	82.2	Confident	85.2	Confident	58 Å²	58	62.3 Å²	62.3	36%	0.356	29%	0.285	S	S	.	.	H	α-helix	trans	-71.3	-44.1	176.3	55.3	0	0	0	0	111.3	N465 F466 I470 R471 E472	N465-T468 VanDerWaalsContact CB-OG1 3.29Å; N465-T468 WeakPolarHBondContact CB-OG1 2.85Å; N465-T468 VanDerWaalsContact CG-OG1 3.3Å; N465-T468 PolarHBondContact O-N 3.37Å; N465-T468 PolarHBondContact O-OG1 3.14Å; N465-T468 PolarHBondContact OD1-N 3.37Å; N465-T468 VanDerWaalsContact OD1-N 3.14Å; F466-T468 PolarHBondContact O-N 3.21Å; T468-I470 PolarHBondContact O-N 3.11Å; T468-R471 PolarHBondContact O-N 3.01Å; T468-E472 WeakPolarHBondContact O-CB 3.42Å; T468-E472 WeakPolarHBondContact O-CG 3.29Å; T468-E472 PolarHBondContact O-N 2.95Å
469	L	84.4	Confident	85.2	Confident	5 Å²	5	62.3 Å²	62.3	3%	0.026	29%	0.285	C	S	.	.	H	α-helix	trans	-59.7	-47	-177.7	-177.9	68.7	0	0	0	111.9	V464 N465 F466 R471 T473 Y477 L501	V464-L469 HydrophobicContact CG1-CD2 4.05Å; N465-L469 VanDerWaalsContact O-CB 3.22Å; N465-L469 WeakPolarHBondContact O-CB 3.36Å; N465-L469 PolarHBondContact O-N 3.48Å; F466-L469 HydrophobicContact CD1-CD2 4.29Å; F466-L469 HydrophobicContact CE1-CD2 4.5Å; F466-L469 PolarHBondContact O-N 3.45Å; L469-R471 VanDerWaalsContact C-N 3.33Å; L469-R471 PolarHBondContact O-N 2.8Å; L469-T473 HydrophobicContact CD1-CG2 4.05Å; L469-T473 WeakPolarHBondContact O-CB 3.17Å; L469-T473 VanDerWaalsContact O-CG2 3.26Å; L469-T473 WeakPolarHBondContact O-CG2 3.43Å; L469-T473 PolarHBondContact O-N 3.34Å; L469-T473 VanDerWaalsContact O-N 3.08Å; L469-T473 PolarHBondContact O-OG1 3.06Å; L469-Y477 HydrophobicContact CD1-CD2 4.15Å; L469-Y477 HydrophobicContact CD1-CG 4.3Å; L469-Y477 HydrophobicContact CD2-CD1 4.33Å; L469-Y477 HydrophobicContact CD2-CG 4.02Å; L469-Y477 HydrophobicContact CG-CD2 4.36Å; L469-Y477 HydrophobicContact CG-CG 4.13Å; L469-L501 HydrophobicContact CD2-CD1 3.79Å; L469-L501 HydrophobicContact CD2-CD2 4.43Å; L469-L501 HydrophobicContact CD2-CG 4.34Å
470	I	84.3	Confident	85.3	Confident	10 Å²	10	59.7 Å²	59.7	5%	0.051	27%	0.269	C	S	.	.	H	α-helix	trans	-65.4	-39.2	-179.8	-62.7	163.2	0	0	0	110.5	F231 I367 F466 T468 R474 G475 Y477	F231-I470 HydrophobicContact CE1-CB 4.42Å; F231-I470 HydrophobicContact CE1-CD1 3.94Å; F231-I470 HydrophobicContact CE2-CG2 4.15Å; F231-I470 HydrophobicContact CZ-CB 3.77Å; F231-I470 HydrophobicContact CZ-CD1 3.78Å; F231-I470 HydrophobicContact CZ-CG1 4.37Å; F231-I470 HydrophobicContact CZ-CG2 3.57Å; I367-I470 HydrophobicContact CD1-CD1 3.85Å; F466-I470 HydrophobicContact CB-CD1 4.29Å; F466-I470 WeakPolarHBondContact O-CB 3.44Å; F466-I470 WeakPolarHBondContact O-CD1 3.31Å; F466-I470 WeakPolarHBondContact O-CG1 3.45Å; F466-I470 PolarHBondContact O-N 3.29Å; T468-I470 PolarHBondContact O-N 3.11Å; I470-R474 PolarHBondContact O-N 2.65Å; I470-G475 PolarHBondContact O-N 2.76Å; I470-Y477 WeakPolarHBondContact CG1-O 3.46Å
471	R	81.4	Confident	85.2	Confident	185 Å²	185	56.1 Å²	56.1	70%	0.698	25%	0.247	S	C	*	.	H	α-helix	trans	-68.3	-49.9	179.5	-173.3	-177.1	-71.5	178.7	-2.8	112.1	T467 T468 L469 T473 R474	T467-R471 WeakPolarHBondContact O-CB 3.48Å; T467-R471 PolarHBondContact O-N 3.08Å; T468-R471 PolarHBondContact O-N 3.01Å; L469-R471 VanDerWaalsContact C-N 3.33Å; L469-R471 PolarHBondContact O-N 2.8Å; R471-T473 VanDerWaalsContact C-N 3.3Å; R471-T473 PolarHBondContact O-N 3.21Å; R471-R474 PolarHBondContact O-N 2.86Å
472	E	84.2	Confident	85	Confident	140 Å²	140	55.4 Å²	55.4	65%	0.654	24%	0.244	S	C	*	.	H	α-helix	trans	-64.8	-35.2	-178.5	-72.8	175	-174.1	0	0	112	T468	T468-E472 WeakPolarHBondContact O-CB 3.42Å; T468-E472 WeakPolarHBondContact O-CG 3.29Å; T468-E472 PolarHBondContact O-N 2.95Å
473	T	83.3	Confident	84.9	Confident	27 Å²	27	49.8 Å²	49.8	17%	0.166	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.6	9.2	-177.1	68.6	0	0	0	0	113.5	L469 R471 G475 R476 Y477	L469-T473 HydrophobicContact CD1-CG2 4.05Å; L469-T473 WeakPolarHBondContact O-CB 3.17Å; L469-T473 VanDerWaalsContact O-CG2 3.26Å; L469-T473 WeakPolarHBondContact O-CG2 3.43Å; L469-T473 PolarHBondContact O-N 3.34Å; L469-T473 VanDerWaalsContact O-N 3.08Å; L469-T473 PolarHBondContact O-OG1 3.06Å; R471-T473 VanDerWaalsContact C-N 3.3Å; R471-T473 PolarHBondContact O-N 3.21Å; T473-G475 PolarHBondContact O-N 2.85Å; T473-G475 VanDerWaalsContact O-N 3.16Å; T473-R476 VanDerWaalsContact O-CB 3.31Å; T473-R476 WeakPolarHBondContact O-CB 3.02Å; T473-R476 PolarHBondContact O-N 2.92Å; T473-Y477 HydrophobicContact CG2-CD2 3.59Å; T473-Y477 HydrophobicContact CG2-CE2 3.91Å; T473-Y477 PolarHBondContact OG1-N 3.32Å
474	R	82	Confident	84.9	Confident	240 Å²	240	48.1 Å²	48.1	91%	0.906	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.6	37.1	-178.8	-59	-178.4	178.1	178.8	-1.2	113.1	I470 R471	I470-R474 PolarHBondContact O-N 2.65Å; R471-R474 PolarHBondContact O-N 2.86Å
475	G	81.9	Confident	85	Confident	13 Å²	13	48 Å²	48	13%	0.134	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.2	15.5	179.7	0	0	0	0	0	115.9	I470 T473 Y477 R478	I470-G475 PolarHBondContact O-N 2.76Å; T473-G475 PolarHBondContact O-N 2.85Å; T473-G475 VanDerWaalsContact O-N 3.16Å; G475-Y477 VanDerWaalsContact C-N 3.32Å; G475-R478 WeakPolarHBondContact O-CG 3.42Å; G475-R478 PolarHBondContact O-NE 3.39Å
476	R	84.7	Confident	85.2	Confident	82 Å²	82	47 Å²	47	31%	0.309	21%	0.205	S	C	.	.	S	Bend	trans	-62.5	-41.4	167.9	-179.1	-175	-70.3	157.9	-3.3	111.2	T473 A488 I491	T473-R476 VanDerWaalsContact O-CB 3.31Å; T473-R476 WeakPolarHBondContact O-CB 3.02Å; T473-R476 PolarHBondContact O-N 2.92Å; R476-A488 HydrophobicContact CG-CB 4.37Å; R476-A488 WeakPolarHBondContact O-CB 3.11Å; R476-A488 PolarHBondContact O-N 2.98Å; R476-I491 VanDerWaalsContact CZ-CD1 3.44Å
477	Y	88	Confident	85.5	Confident	12 Å²	12	46.8 Å²	46.8	5%	0.047	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	136.3	169	-64.7	-92.3	0	0	0	108.9	L469 I470 T473 G475 I485 I486 V487 L501	L469-Y477 HydrophobicContact CD1-CD2 4.15Å; L469-Y477 HydrophobicContact CD1-CG 4.3Å; L469-Y477 HydrophobicContact CD2-CD1 4.33Å; L469-Y477 HydrophobicContact CD2-CG 4.02Å; L469-Y477 HydrophobicContact CG-CD2 4.36Å; L469-Y477 HydrophobicContact CG-CG 4.13Å; I470-Y477 WeakPolarHBondContact CG1-O 3.46Å; T473-Y477 HydrophobicContact CG2-CD2 3.59Å; T473-Y477 HydrophobicContact CG2-CE2 3.91Å; T473-Y477 PolarHBondContact OG1-N 3.32Å; G475-Y477 VanDerWaalsContact C-N 3.32Å; Y477-I485 HydrophobicContact CD1-CG2 4.18Å; Y477-I486 CarbonylContact C-O 3.47Å; Y477-I486 WeakPolarHBondContact CA-O 3.33Å; Y477-V487 HydrophobicContact CD1-CB 4.43Å; Y477-V487 HydrophobicContact CD1-CG1 4.25Å; Y477-V487 HydrophobicContact CD1-CG2 3.77Å; Y477-V487 HydrophobicContact CE1-CB 4.34Å; Y477-V487 HydrophobicContact CE1-CG1 3.84Å; Y477-V487 HydrophobicContact CE1-CG2 3.67Å; Y477-L501 HydrophobicContact CD1-CD1 3.65Å; Y477-L501 HydrophobicContact CD1-CG 4.34Å; Y477-L501 HydrophobicContact CE1-CB 4.19Å; Y477-L501 HydrophobicContact CE1-CD1 3.75Å; Y477-L501 HydrophobicContact CE1-CG 4.01Å
478	R	88.5	Confident	85.7	Confident	121 Å²	121	48.3 Å²	48.3	46%	0.457	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	164	175.6	-58.3	-179	-173.5	178.7	-1	109.1	G475 I485 I486	G475-R478 WeakPolarHBondContact O-CG 3.42Å; G475-R478 PolarHBondContact O-NE 3.39Å; R478-I485 WeakPolarHBondContact O-CA 3.16Å; R478-I486 HydrophobicContact CB-CB 4.34Å; R478-I486 PolarHBondContact N-O 3.47Å; R478-I486 PolarHBondContact O-N 3.48Å
479	I	88.5	Confident	85.7	Confident	3 Å²	3	49.6 Å²	49.6	2%	0.015	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	144.3	172.3	-165.6	173.1	0	0	0	108.3	M300 L365 I367 F466 Y483 N484	M300-I479 HydrophobicContact CE-CD1 3.75Å; L365-I479 HydrophobicContact CD2-CG2 3.89Å; L365-I479 VanDerWaalsContact CD2-O 3.27Å; L365-I479 WeakPolarHBondContact CD2-O 3.48Å; I367-I479 HydrophobicContact CD1-CG2 3.65Å; F466-I479 HydrophobicContact CD1-CB 4.22Å; F466-I479 HydrophobicContact CD1-CD1 4.27Å; F466-I479 HydrophobicContact CD2-CD1 3.95Å; F466-I479 HydrophobicContact CE1-CB 4.42Å; F466-I479 HydrophobicContact CE1-CD1 4.18Å; F466-I479 HydrophobicContact CE2-CD1 3.85Å; F466-I479 HydrophobicContact CG-CD1 4.16Å; F466-I479 HydrophobicContact CZ-CD1 3.96Å; I479-Y483 HydrophobicContact CD1-CD1 3.72Å; I479-Y483 HydrophobicContact CD1-CG 4.19Å; I479-N484 WeakPolarHBondContact CA-O 3.39Å
480	D	86.9	Confident	85.7	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.011	22%	0.223	C	C	.	.			trans	-100.6	175.4	173.5	80.9	-9.4	0	0	0	111.3	A482 Y483 N484 I486	D480-A482 PolarHBondContact O-N 2.97Å; D480-A482 WeakPolarHBondContact OD1-CA 3.2Å; D480-A482 PolarHBondContact OD1-N 2.78Å; D480-Y483 PolarHBondContact O-N 3.48Å; D480-Y483 PolarHBondContact OD1-N 3.38Å; D480-N484 PolarHBondContact N-O 2.96Å; D480-N484 VanDerWaalsContact N-O 3.16Å; D480-N484 WeakPolarHBondContact OD1-CA 3.41Å; D480-N484 VanDerWaalsContact OD1-CB 3.32Å; D480-N484 WeakPolarHBondContact OD1-CB 3.28Å; D480-N484 PolarHBondContact OD1-N 2.91Å; D480-N484 PolarHBondContact OD1-ND2 3.31Å; D480-N484 PolarHBondContact OD2-ND2 3.5Å; D480-I486 HydrophobicContact CB-CD1 3.95Å
481	P	85.2	Confident	85.5	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.013	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-34.5	175.7	-31.9	39.3	0	0	0	115.2	F227 I304 Y483	F227-P481 HydrophobicContact CD2-CG 4.45Å; F227-P481 HydrophobicContact CE1-CG 3.89Å; F227-P481 VanDerWaalsContact CE2-CD 3.4Å; F227-P481 HydrophobicContact CE2-CG 3.56Å; F227-P481 HydrophobicContact CZ-CG 3.24Å; I304-P481 HydrophobicContact CD1-CB 3.63Å; I304-P481 HydrophobicContact CD1-CG 4.35Å; I304-P481 HydrophobicContact CG1-CB 4.05Å; I304-P481 HydrophobicContact CG1-CG 4.28Å; I304-P481 HydrophobicContact CG2-CG 4.24Å; P481-Y483 WeakPolarHBondContact O-CD2 2.9Å; P481-Y483 PolarHBondContact O-N 2.83Å
482	A	84.1	Confident	85.1	Confident	7 Å²	7	41.8 Å²	41.8	6%	0.058	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	6.4	-179.8	0	0	0	0	0	113	D56 D480 N484	D56-A482 WeakPolarHBondContact OD1-CA 3.48Å; D56-A482 VanDerWaalsContact OD1-CB 3.28Å; D56-A482 WeakPolarHBondContact OD1-CB 3.18Å; D56-A482 PolarHBondContact OD1-N 2.85Å; D480-A482 PolarHBondContact O-N 2.97Å; D480-A482 WeakPolarHBondContact OD1-CA 3.2Å; D480-A482 PolarHBondContact OD1-N 2.78Å; A482-N484 WeakPolarHBondContact CB-ND2 3.44Å; A482-N484 PolarHBondContact O-N 3.45Å
483	Y	86.9	Confident	84.2	Confident	9 Å²	9	39.7 Å²	39.7	4%	0.035	19%	0.191	C	C	.	.			trans	62.7	20.8	-175.2	-64	-106.1	0	0	0	114.5	I27 S278 M300 I302 P421 I422 W424 I479 D480 P481	I27-Y483 HydrophobicContact CD1-CE2 3.55Å; I27-Y483 HydrophobicContact CG1-CE2 4.22Å; S278-Y483 WeakPolarHBondContact CB-OH 3.49Å; S278-Y483 PolarHBondContact OG-OH 3.35Å; M300-Y483 HydrophobicContact CE-CD1 3.84Å; M300-Y483 HydrophobicContact CE-CE1 3.54Å; I302-Y483 HydrophobicContact CD1-CD1 4.45Å; I302-Y483 HydrophobicContact CD1-CD2 4.03Å; I302-Y483 HydrophobicContact CD1-CE1 3.96Å; I302-Y483 HydrophobicContact CD1-CE2 3.49Å; I302-Y483 VanDerWaalsContact CD1-CE2 3.49Å; I302-Y483 HydrophobicContact CD1-CG 4.47Å; I302-Y483 VanDerWaalsContact CD1-CZ 3.43Å; I302-Y483 HydrophobicContact CG1-CE1 4.44Å; I302-Y483 HydrophobicContact CG1-CE2 4.14Å; I302-Y483 WeakPolarHBondContact CG1-OH 3.46Å; P421-Y483 HydrophobicContact CB-CE1 3.92Å; P421-Y483 HydrophobicContact CB-CE2 3.99Å; P421-Y483 WeakPolarHBondContact CB-OH 3.07Å; P421-Y483 HydrophobicContact CG-CE2 4.31Å; P421-Y483 WeakPolarHBondContact CG-OH 3.48Å; I422-Y483 HydrophobicContact CB-CG 4.45Å; W424-Y483 PolarHBondContact NE1-O 2.84Å; I479-Y483 HydrophobicContact CD1-CD1 3.72Å; I479-Y483 HydrophobicContact CD1-CG 4.19Å; D480-Y483 PolarHBondContact O-N 3.48Å; D480-Y483 PolarHBondContact OD1-N 3.38Å; P481-Y483 WeakPolarHBondContact O-CD2 2.9Å; P481-Y483 PolarHBondContact O-N 2.83Å
484	N	88.4	Confident	83.2	Confident	5 Å²	5	48 Å²	48	3%	0.027	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-71.2	143.1	168.4	-55.6	-51.3	0	0	0	109.6	E54 I409 I410 T411 I479 D480 A482	E54-N484 PolarHBondContact O-ND2 2.81Å; I409-N484 HydrophobicContact CG2-CB 4.42Å; I410-N484 WeakPolarHBondContact O-CA 3.21Å; T411-N484 WeakPolarHBondContact CA-OD1 3.49Å; T411-N484 WeakPolarHBondContact CB-OD1 3.48Å; T411-N484 HydrophobicContact CG2-CB 4.31Å; T411-N484 WeakPolarHBondContact CG2-OD1 3.23Å; I479-N484 WeakPolarHBondContact CA-O 3.39Å; D480-N484 PolarHBondContact N-O 2.96Å; D480-N484 VanDerWaalsContact N-O 3.16Å; D480-N484 WeakPolarHBondContact OD1-CA 3.41Å; D480-N484 VanDerWaalsContact OD1-CB 3.32Å; D480-N484 WeakPolarHBondContact OD1-CB 3.28Å; D480-N484 PolarHBondContact OD1-N 2.91Å; D480-N484 PolarHBondContact OD1-ND2 3.31Å; D480-N484 PolarHBondContact OD2-ND2 3.5Å; A482-N484 WeakPolarHBondContact CB-ND2 3.44Å; A482-N484 PolarHBondContact O-N 3.45Å
485	I	90.1	Very high	81.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	118.9	176.9	-49.2	-179.2	0	0	0	108.4	I410 W424 F466 Y477 R478 V487 L501 L504	I410-I485 HydrophobicContact CB-CB 4.11Å; I410-I485 HydrophobicContact CD1-CB 4.14Å; I410-I485 HydrophobicContact CD1-CG2 4.25Å; I410-I485 PolarHBondContact N-O 2.91Å; I410-I485 PolarHBondContact O-N 2.86Å; W424-I485 HydrophobicContact CD2-CD1 3.8Å; W424-I485 HydrophobicContact CD2-CG1 4.36Å; W424-I485 HydrophobicContact CE3-CD1 4.05Å; W424-I485 HydrophobicContact CG-CD1 4.13Å; W424-I485 HydrophobicContact CZ2-CD1 4.37Å; W424-I485 HydrophobicContact CZ2-CG1 4.2Å; W424-I485 HydrophobicContact CZ3-CD1 4.41Å; F466-I485 HydrophobicContact CE1-CD1 3.85Å; F466-I485 HydrophobicContact CE1-CG1 3.78Å; F466-I485 HydrophobicContact CE1-CG2 4.47Å; F466-I485 HydrophobicContact CZ-CD1 3.79Å; F466-I485 HydrophobicContact CZ-CG1 3.87Å; Y477-I485 HydrophobicContact CD1-CG2 4.18Å; R478-I485 WeakPolarHBondContact O-CA 3.16Å; I485-V487 HydrophobicContact CG2-CG2 4.41Å; I485-L501 HydrophobicContact CD1-CD1 3.81Å; I485-L501 HydrophobicContact CG2-CD1 3.76Å; I485-L504 HydrophobicContact CD1-CD1 3.91Å
486	I	88.7	Confident	80.5	Confident	34 Å²	34	43.7 Å²	43.7	17%	0.174	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	117.5	176.6	-57.4	167.9	0	0	0	108	Y477 R478 D480	Y477-I486 CarbonylContact C-O 3.47Å; Y477-I486 WeakPolarHBondContact CA-O 3.33Å; R478-I486 HydrophobicContact CB-CB 4.34Å; R478-I486 PolarHBondContact N-O 3.47Å; R478-I486 PolarHBondContact O-N 3.48Å; D480-I486 HydrophobicContact CB-CD1 3.95Å
487	V	89.5	Confident	78.9	Confident	3 Å²	3	50 Å²	50	2%	0.018	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	116.7	176	-169.8	0	0	0	0	108	P407 L408 I410 Y477 I485 E489 T490	P407-V487 CarbonylContact C-O 3.57Å; P407-V487 VanDerWaalsContact CA-O 3.27Å; P407-V487 WeakPolarHBondContact CA-O 3.33Å; L408-V487 HydrophobicContact CB-CB 4.11Å; L408-V487 HydrophobicContact CB-CG2 4.39Å; L408-V487 PolarHBondContact N-O 2.87Å; L408-V487 WeakPolarHBondContact O-CA 3.33Å; L408-V487 WeakPolarHBondContact O-CB 3.19Å; L408-V487 PolarHBondContact O-N 2.9Å; I410-V487 HydrophobicContact CD1-CG2 3.87Å; I410-V487 HydrophobicContact CG1-CG2 4.4Å; Y477-V487 HydrophobicContact CD1-CB 4.43Å; Y477-V487 HydrophobicContact CD1-CG1 4.25Å; Y477-V487 HydrophobicContact CD1-CG2 3.77Å; Y477-V487 HydrophobicContact CE1-CB 4.34Å; Y477-V487 HydrophobicContact CE1-CG1 3.84Å; Y477-V487 HydrophobicContact CE1-CG2 3.67Å; I485-V487 HydrophobicContact CG2-CG2 4.41Å; V487-E489 WeakPolarHBondContact CG1-O 3.46Å; V487-T490 HydrophobicContact CG1-CG2 4.05Å
488	A	86.5	Confident	77.1	Confident	56 Å²	56	55.8 Å²	55.8	46%	0.463	27%	0.27	S	S	.	.	S	Bend	trans	-69.4	-36.3	-179.3	0	0	0	0	0	112.9	R476	R476-A488 HydrophobicContact CG-CB 4.37Å; R476-A488 WeakPolarHBondContact O-CB 3.11Å; R476-A488 PolarHBondContact O-N 2.98Å
489	E	83.1	Confident	75.6	Confident	86 Å²	86	56.5 Å²	56.5	40%	0.402	28%	0.276	S	S	.	.	S	Bend	trans	-149.3	124.5	179.1	-170.6	-173.4	-174.3	0	0	109	V487	V487-E489 WeakPolarHBondContact CG1-O 3.46Å
490	T	83.2	Confident	74.5	Confident	6 Å²	6	57.3 Å²	57.3	4%	0.037	28%	0.28	C	S	.	.			trans	-85	140.7	176.3	54.2	0	0	0	0	111.3	V402 N403 G405 E406 L408 V487	V402-T490 HydrophobicContact CG1-CG2 3.83Å; V402-T490 HydrophobicContact CG2-CG2 4.15Å; N403-T490 PolarHBondContact O-OG1 3.3Å; G405-T490 PolarHBondContact N-O 2.98Å; E406-T490 WeakPolarHBondContact O-CG2 3.36Å; E406-T490 PolarHBondContact O-N 3.37Å; E406-T490 PolarHBondContact O-OG1 2.76Å; L408-T490 HydrophobicContact CB-CG2 3.57Å; L408-T490 HydrophobicContact CD2-CG2 4.16Å; V487-T490 HydrophobicContact CG1-CG2 4.05Å
491	I	79.8	Confident	73.9	Confident	22 Å²	22	57.4 Å²	57.4	11%	0.113	28%	0.281	C	S	.	.			trans	-126.2	144.9	-178.7	-61.6	172	0	0	0	108.7	R476 K495 T496	R476-I491 VanDerWaalsContact CZ-CD1 3.44Å; I491-K495 HydrophobicContact CG2-CB 4.41Å; I491-T496 HydrophobicContact CG2-CG2 3.67Å
492	S	73.3	Confident	73.7	Confident	7 Å²	7	58.3 Å²	58.3	5%	0.049	29%	0.285	C	S	.	.			trans	-76.9	137.9	178.7	71.1	0	0	0	0	111.3	K494 K495	S492-K494 PolarHBondContact O-N 3.39Å; S492-K495 PolarHBondContact O-N 3.14Å
493	V	66.4	Low	73.9	Confident	96 Å²	96	58.6 Å²	58.6	58%	0.582	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-42.9	-40.5	176.9	-175	0	0	0	0	113.2	K495 H502	V493-K495 PolarHBondContact O-N 3.08Å; V493-H502 VanDerWaalsContact CG2-NE2 3.34Å; V493-H502 WeakPolarHBondContact CG2-NE2 3.21Å
494	K	60.9	Low	74.2	Confident	203 Å²	203	58.1 Å²	58.1	88%	0.883	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-62.7	-13	-174.1	-67.5	-174.3	-179.9	180	0	114.2	S492	S492-K494 PolarHBondContact O-N 3.39Å
495	K	54.3	Low	74.3	Confident	115 Å²	115	57.9 Å²	57.9	50%	0.5	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-107	-12.3	-170.9	-69.9	-179.5	-173.3	162.5	0	115.1	E404 I491 S492 V493	E404-K495 WeakPolarHBondContact OE1-CD 3.46Å; E404-K495 IonicContact OE1-NZ 2.75Å; E404-K495 PolarHBondContact OE1-NZ 2.65Å; E404-K495 IonicContact OE2-NZ 3.69Å; E404-K495 PolarHBondContact OE2-NZ 2.84Å; I491-K495 HydrophobicContact CG2-CB 4.41Å; S492-K495 PolarHBondContact O-N 3.14Å; V493-K495 PolarHBondContact O-N 3.08Å
496	T	52.6	Low	74.4	Confident	46 Å²	46	57.9 Å²	57.9	28%	0.282	28%	0.282	S	S	.	.			trans	-125.9	140.3	-166.1	58.8	0	0	0	0	114.3	I491 H498 E500	I491-T496 HydrophobicContact CG2-CG2 3.67Å; T496-H498 PolarHBondContact O-N 3.46Å; T496-E500 WeakPolarHBondContact CB-OE1 3.41Å; T496-E500 VanDerWaalsContact CG2-OE1 3.23Å; T496-E500 WeakPolarHBondContact CG2-OE1 3.43Å; T496-E500 PolarHBondContact OG1-OE1 3.16Å
497	K	51.6	Low	74.3	Confident	215 Å²	215	56.3 Å²	56.3	94%	0.935	27%	0.274	S	S	*	.	S	Bend	trans	-80	6.4	165.6	-69.1	-175.7	176.8	-178.7	0	112.3
498	H	51.3	Low	74	Confident	133 Å²	133	57 Å²	57	62%	0.616	28%	0.277	S	S	*	.	S	Bend	trans	-103.7	147	-165.2	-65.9	32.1	0	0	0	110.3	T496 E500	T496-H498 PolarHBondContact O-N 3.46Å; H498-E500 PolarHBondContact O-N 2.91Å
499	K	56.1	Low	73.7	Confident	136 Å²	136	54.4 Å²	54.4	59%	0.591	26%	0.256	S	S	*	.			trans	-69.6	95.1	176.5	-71.4	175.7	-175.8	164.4	0	108.9
500	E	64.7	Low	73.7	Confident	21 Å²	21	51 Å²	51	10%	0.098	24%	0.24	C	C	.	.			trans	-92.2	151.4	176	-73.3	-173.5	-157.4	0	0	111.4	T496 H498 H502	T496-E500 WeakPolarHBondContact CB-OE1 3.41Å; T496-E500 VanDerWaalsContact CG2-OE1 3.23Å; T496-E500 WeakPolarHBondContact CG2-OE1 3.43Å; T496-E500 PolarHBondContact OG1-OE1 3.16Å; H498-E500 PolarHBondContact O-N 2.91Å; E500-H502 VanDerWaalsContact C-N 3.33Å; E500-H502 WeakPolarHBondContact CB-NE2 3.42Å; E500-H502 PolarHBondContact O-N 3.23Å; E500-H502 VanDerWaalsContact O-N 3.14Å; E500-H502 IonicContact OE2-CE1 3.53Å; E500-H502 PolarHBondContact OE2-CE1 3.23Å; E500-H502 IonicContact OE2-NE2 3.99Å; E500-H502 PolarHBondContact OE2-NE2 3.43Å
501	L	75.2	Confident	73.7	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.021	24%	0.238	C	C	.	.			trans	-86.2	73.2	-179.5	-61.1	176.8	0	0	0	109.4	Y426 V464 L469 Y477 I485 L504 I530	Y426-L501 HydrophobicContact CD1-CD2 4.29Å; Y426-L501 HydrophobicContact CE1-CD2 3.5Å; Y426-L501 VanDerWaalsContact CE1-CD2 3.5Å; V464-L501 HydrophobicContact CG1-CD2 3.98Å; V464-L501 HydrophobicContact CG2-CD2 3.93Å; L469-L501 HydrophobicContact CD2-CD1 3.79Å; L469-L501 HydrophobicContact CD2-CD2 4.43Å; L469-L501 HydrophobicContact CD2-CG 4.34Å; Y477-L501 HydrophobicContact CD1-CD1 3.65Å; Y477-L501 HydrophobicContact CD1-CG 4.34Å; Y477-L501 HydrophobicContact CE1-CB 4.19Å; Y477-L501 HydrophobicContact CE1-CD1 3.75Å; Y477-L501 HydrophobicContact CE1-CG 4.01Å; I485-L501 HydrophobicContact CD1-CD1 3.81Å; I485-L501 HydrophobicContact CG2-CD1 3.76Å; L501-L504 HydrophobicContact CB-CD1 4.07Å; L501-L504 HydrophobicContact CB-CD2 4.12Å; L501-L504 HydrophobicContact CB-CG 4.3Å; L501-L504 HydrophobicContact CD1-CD1 4.49Å; L501-L504 HydrophobicContact CD2-CD2 3.6Å; L501-L504 HydrophobicContact CG-CD2 4.34Å; L501-I530 WeakPolarHBondContact O-CD1 2.98Å
502	H	80.8	Confident	73.8	Confident	21 Å²	21	49.9 Å²	49.9	10%	0.097	23%	0.234	C	C	.	.	S	Bend	trans	-88.2	-37.8	174.7	-63.1	-66.2	0	0	0	112.2	V493 E500 Y529 I530	V493-H502 VanDerWaalsContact CG2-NE2 3.34Å; V493-H502 WeakPolarHBondContact CG2-NE2 3.21Å; E500-H502 VanDerWaalsContact C-N 3.33Å; E500-H502 WeakPolarHBondContact CB-NE2 3.42Å; E500-H502 PolarHBondContact O-N 3.23Å; E500-H502 VanDerWaalsContact O-N 3.14Å; E500-H502 IonicContact OE2-CE1 3.53Å; E500-H502 PolarHBondContact OE2-CE1 3.23Å; E500-H502 IonicContact OE2-NE2 3.99Å; E500-H502 PolarHBondContact OE2-NE2 3.43Å; H502-Y529 CarbonylContact O-C 3.56Å; H502-I530 PolarHBondContact O-N 3.18Å
503	N	88.6	Confident	73.8	Confident	12 Å²	12	50.1 Å²	50.1	6%	0.064	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	115.1	-175	-69.3	-48.2	0	0	0	109.9	A427 D429 Y529	A427-N503 HydrophobicContact CB-CB 3.91Å; A427-N503 PolarHBondContact N-O 3.35Å; A427-N503 WeakPolarHBondContact O-CB 3.45Å; D429-N503 WeakPolarHBondContact CA-ND2 3.38Å; D429-N503 PolarHBondContact OD1-ND2 2.74Å; N503-Y529 WeakPolarHBondContact OD1-CD2 3.41Å; N503-Y529 WeakPolarHBondContact OD1-CE2 3.13Å
504	L	92.3	Very high	73.8	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	143.2	-174.9	-63	175.5	0	0	0	111.7	I410 W424 L425 V464 I485 L501 I527 I528	I410-L504 HydrophobicContact CD1-CD1 4.07Å; I410-L504 HydrophobicContact CG2-CD1 4.14Å; W424-L504 HydrophobicContact CE3-CB 4.02Å; W424-L504 HydrophobicContact CE3-CD1 3.95Å; W424-L504 HydrophobicContact CE3-CG 4.46Å; W424-L504 HydrophobicContact CZ3-CB 4Å; W424-L504 HydrophobicContact CZ3-CD1 3.86Å; L425-L504 WeakPolarHBondContact O-CA 3.37Å; V464-L504 HydrophobicContact CG2-CD2 4.02Å; I485-L504 HydrophobicContact CD1-CD1 3.91Å; L501-L504 HydrophobicContact CB-CD1 4.07Å; L501-L504 HydrophobicContact CB-CD2 4.12Å; L501-L504 HydrophobicContact CB-CG 4.3Å; L501-L504 HydrophobicContact CD1-CD1 4.49Å; L501-L504 HydrophobicContact CD2-CD2 3.6Å; L501-L504 HydrophobicContact CG-CD2 4.34Å; L504-I527 CarbonylContact O-C 3.52Å; L504-I527 WeakPolarHBondContact O-CA 3.44Å; L504-I528 HydrophobicContact CB-CB 4.42Å; L504-I528 PolarHBondContact N-O 3.15Å; L504-I528 PolarHBondContact O-N 3.1Å
505	I	91.8	Very high	73.6	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	132.6	165.2	-74.9	163.1	0	0	0	107.3	L425 A427 L434 L437 L457 L461 I507 W524 I527	L425-I505 HydrophobicContact CB-CB 4.22Å; L425-I505 HydrophobicContact CD1-CG2 4.37Å; L425-I505 PolarHBondContact N-O 2.98Å; L425-I505 PolarHBondContact O-N 3.28Å; A427-I505 HydrophobicContact CB-CD1 3.74Å; A427-I505 HydrophobicContact CB-CG1 3.78Å; L434-I505 HydrophobicContact CD1-CD1 4.43Å; L437-I505 HydrophobicContact CD2-CD1 4.07Å; L457-I505 HydrophobicContact CD1-CG2 4.37Å; L461-I505 HydrophobicContact CD1-CD1 3.56Å; I505-I507 HydrophobicContact CG2-CG1 4.22Å; I505-W524 HydrophobicContact CD1-CZ2 4.18Å; I505-W524 HydrophobicContact CG1-CZ2 4.43Å; I505-I527 HydrophobicContact CG1-CG1 4.25Å; I505-I527 HydrophobicContact CG1-CG2 4.34Å
506	C	90.7	Very high	73.5	Confident	0 Å²	0	36 Å²	36	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	132.8	174.6	63.8	0	0	0	0	110.9	C412 I422 W424 S525 G526	C412-C506 VanDerWaalsContact CA-SG 3.6Å; C412-C506 HydrophobicContact CB-CB 3.66Å; C412-C506 WeakPolarHBondContact CB-SG 3.16Å; C412-C506 WeakPolarHBondContact SG-CB 3.35Å; C412-C506 CovalentContact SG-SG 2.03Å; C412-C506 PolarHBondContact SG-SG 2.99Å; I422-C506 HydrophobicContact CG2-CB 3.92Å; W424-C506 HydrophobicContact CD2-CB 4.14Å; W424-C506 HydrophobicContact CE3-CB 3.74Å; W424-C506 HydrophobicContact CH2-CB 3.94Å; W424-C506 HydrophobicContact CZ2-CB 4.31Å; W424-C506 HydrophobicContact CZ3-CB 3.65Å; C506-S525 PolarHBondContact O-N 2.95Å; C506-S525 VanDerWaalsContact O-N 3.15Å; C506-G526 PolarHBondContact N-O 3.28Å; C506-G526 VanDerWaalsContact N-O 3.15Å; C506-G526 PolarHBondContact O-N 2.99Å
507	I	87.9	Confident	73.3	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	123.7	178.5	-58.3	173.8	0	0	0	107.2	I422 T423 L425 L457 I505 P511 P522 D523	I422-I507 WeakPolarHBondContact CA-O 3.33Å; T423-I507 PolarHBondContact N-O 2.98Å; T423-I507 PolarHBondContact O-N 3.05Å; L425-I507 HydrophobicContact CD1-CD1 3.75Å; L457-I507 HydrophobicContact CB-CD1 4.32Å; L457-I507 HydrophobicContact CD1-CD1 4.28Å; I505-I507 HydrophobicContact CG2-CG1 4.22Å; I507-P511 HydrophobicContact CD1-CB 3.98Å; I507-P511 HydrophobicContact CG2-CB 4.32Å; I507-P522 HydrophobicContact CG2-CB 4.12Å; I507-D523 WeakPolarHBondContact CA-O 3.36Å
508	H	83.2	Confident	72.9	Confident	17 Å²	17	33.3 Å²	33.3	8%	0.079	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	123.5	172.2	-77.6	-104.1	0	0	0	108.8	C412 P413 P522 D523 S525	C412-H508 VanDerWaalsContact SG-CD2 3.58Å; C412-H508 PolarHBondContact SG-NE2 2.68Å; P413-H508 PolarHBondContact O-NE2 2.98Å; H508-P522 CarbonylContact O-C 3.56Å; H508-P522 VanDerWaalsContact O-CA 3.27Å; H508-P522 WeakPolarHBondContact O-CA 3.29Å; H508-D523 PolarHBondContact N-O 2.96Å; H508-D523 PolarHBondContact O-N 3.17Å; H508-D523 VanDerWaalsContact O-N 3.08Å; H508-S525 VanDerWaalsContact CD2-CB 3.45Å; H508-S525 WeakPolarHBondContact CD2-CB 3.23Å; H508-S525 PolarHBondContact CD2-OG 3.47Å
509	G	79.7	Confident	72.6	Confident	2 Å²	2	30.2 Å²	30.2	2%	0.021	19%	0.187	C	C	.	.	S	Bend	trans	83	-171.5	-176.9	0	0	0	0	0	115.7	P421 P511	P421-G509 WeakPolarHBondContact O-CA 3.47Å; P421-G509 PolarHBondContact O-N 3.38Å; G509-P511 VanDerWaalsContact O-CD 3.23Å; G509-P511 WeakPolarHBondContact O-CD 3.38Å
510	D	82.3	Confident	72.5	Confident	14 Å²	14	27.4 Å²	27.4	8%	0.075	18%	0.177	C	C	.	.			trans	-79.2	111.7	-172	-169.7	-23.1	0	0	0	110.6	M281 C283 Y512 S513 P522	M281-D510 HydrophobicContact CE-CB 4.28Å; M281-D510 HydrophobicContact CG-CB 4.38Å; M281-D510 HydrophobicContact SD-CB 4.17Å; C283-D510 WeakPolarHBondContact CB-OD2 3.48Å; C283-D510 PolarHBondContact N-OD1 3.5Å; C283-D510 PolarHBondContact N-OD2 3.42Å; C283-D510 PolarHBondContact SG-OD2 3.14Å; D510-Y512 PolarHBondContact O-N 3.16Å; D510-Y512 VanDerWaalsContact O-N 3.11Å; D510-Y512 PolarHBondContact OD1-N 2.96Å; D510-S513 WeakPolarHBondContact O-CB 3.18Å; D510-S513 PolarHBondContact O-N 3.03Å; D510-S513 PolarHBondContact O-OG 2.93Å; D510-P522 WeakPolarHBondContact O-CB 3.19Å; D510-P522 WeakPolarHBondContact O-CG 3.37Å
511	P	83.3	Confident	72.3	Confident	0 Å²	0	29 Å²	29	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-21	-179.1	27.8	-37.6	0	0	0	113.9	P282 T423 S454 R455 I458 I507 G509	P282-P511 HydrophobicContact CB-CG 3.77Å; T423-P511 HydrophobicContact CG2-CG 4.27Å; S454-P511 CarbonylContact C-O 3.52Å; R455-P511 VanDerWaalsContact CA-O 3.25Å; R455-P511 WeakPolarHBondContact CA-O 3.26Å; R455-P511 WeakPolarHBondContact CB-O 3.32Å; R455-P511 PolarHBondContact N-O 3.22Å; I458-P511 HydrophobicContact CB-CB 3.82Å; I458-P511 HydrophobicContact CB-CG 3.83Å; I458-P511 HydrophobicContact CD1-CG 4.04Å; I458-P511 HydrophobicContact CG1-CB 4.34Å; I458-P511 HydrophobicContact CG1-CG 3.77Å; I458-P511 HydrophobicContact CG2-CB 3.83Å; I458-P511 HydrophobicContact CG2-CG 4.07Å; I507-P511 HydrophobicContact CD1-CB 3.98Å; I507-P511 HydrophobicContact CG2-CB 4.32Å; G509-P511 VanDerWaalsContact O-CD 3.23Å; G509-P511 WeakPolarHBondContact O-CD 3.38Å
512	Y	82.3	Confident	72	Confident	5 Å²	5	29 Å²	29	2%	0.02	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-12.3	175	-69.2	-69.6	0	0	0	113.8	P282 C283 P285 K297 R455 I458 T459 D510	P282-Y512 HydrophobicContact CB-CD2 3.89Å; P282-Y512 HydrophobicContact CB-CE2 4.02Å; P282-Y512 HydrophobicContact CG-CE2 4.48Å; C283-Y512 WeakPolarHBondContact O-CD2 3.41Å; C283-Y512 VanDerWaalsContact O-CE2 3.25Å; C283-Y512 WeakPolarHBondContact O-CE2 3.5Å; C283-Y512 VanDerWaalsContact SG-CB 3.59Å; P285-Y512 HydrophobicContact CG-CD1 3.92Å; P285-Y512 HydrophobicContact CG-CD2 4.42Å; P285-Y512 HydrophobicContact CG-CE1 3.55Å; P285-Y512 HydrophobicContact CG-CE2 4.08Å; P285-Y512 HydrophobicContact CG-CG 4.35Å; K297-Y512 WeakPolarHBondContact CD-OH 3.34Å; K297-Y512 PolarHBondContact NZ-OH 2.66Å; R455-Y512 HydrophobicContact CG-CD1 4.15Å; I458-Y512 HydrophobicContact CG1-CD2 4.42Å; I458-Y512 HydrophobicContact CG1-CE1 4.47Å; I458-Y512 HydrophobicContact CG1-CE2 3.68Å; I458-Y512 HydrophobicContact CG2-CD1 3.87Å; I458-Y512 HydrophobicContact CG2-CD2 4.34Å; I458-Y512 HydrophobicContact CG2-CE1 3.53Å; I458-Y512 HydrophobicContact CG2-CE2 4.05Å; I458-Y512 HydrophobicContact CG2-CG 4.26Å; T459-Y512 HydrophobicContact CG2-CE1 4.13Å; D510-Y512 PolarHBondContact O-N 3.16Å; D510-Y512 VanDerWaalsContact O-N 3.11Å; D510-Y512 PolarHBondContact OD1-N 2.96Å
513	S	73.5	Confident	71.6	Confident	12 Å²	12	30.3 Å²	30.3	8%	0.084	19%	0.19	C	C	.	.			trans	-64.9	140.7	179.4	65	0	0	0	0	111.6	D510 P522	D510-S513 WeakPolarHBondContact O-CB 3.18Å; D510-S513 PolarHBondContact O-N 3.03Å; D510-S513 PolarHBondContact O-OG 2.93Å; S513-P522 WeakPolarHBondContact OG-CD 3.37Å; S513-P522 WeakPolarHBondContact OG-CG 3.23Å
514	I	65.9	Low	71.2	Confident	21 Å²	21	30 Å²	30	11%	0.108	19%	0.188	C	C	.	.			trans	-115.6	140.2	175.2	-54.4	-177.5	0	0	0	107	F377 I380 K451 N516	F377-I514 HydrophobicContact CB-CD1 4.32Å; F377-I514 HydrophobicContact CD1-CB 4.33Å; F377-I514 HydrophobicContact CD1-CD1 3.13Å; F377-I514 HydrophobicContact CD1-CG1 3.68Å; F377-I514 HydrophobicContact CE1-CD1 3.42Å; F377-I514 VanDerWaalsContact CE1-CD1 3.42Å; F377-I514 HydrophobicContact CE1-CG1 3.6Å; F377-I514 HydrophobicContact CG-CD1 3.76Å; F377-I514 HydrophobicContact CZ-CD1 4.26Å; I380-I514 HydrophobicContact CD1-CB 4.22Å; I380-I514 HydrophobicContact CD1-CG2 3.53Å; K451-I514 HydrophobicContact CB-CD1 3.8Å; K451-I514 HydrophobicContact CB-CG1 4.25Å; K451-I514 HydrophobicContact CB-CG2 4.35Å; K451-I514 HydrophobicContact CG-CD1 3.82Å; I514-N516 PolarHBondContact O-N 2.96Å
515	P	57.5	Low	70.7	Confident	27 Å²	27	30 Å²	30	18%	0.175	19%	0.188	C	C	.	.			trans	-59.1	110.4	178.6	23.3	-36	0	0	0	112.3	Y521	P515-Y521 HydrophobicContact CG-CD2 4.35Å; P515-Y521 HydrophobicContact CG-CE2 4.36Å
516	N	52.4	Low	70.4	Confident	70 Å²	70	30 Å²	30	37%	0.374	19%	0.188	S	C	.	.			trans	-101.7	95.5	160.4	-86.6	-14.7	0	0	0	108.6	I380 I514 S518 D519	I380-N516 WeakPolarHBondContact CD1-OD1 3.41Å; I514-N516 PolarHBondContact O-N 2.96Å; N516-S518 VanDerWaalsContact C-N 3.29Å; N516-S518 PolarHBondContact O-N 3.02Å; N516-D519 PolarHBondContact O-N 3.23Å; N516-D519 VanDerWaalsContact O-N 3.08Å
517	G	47.4	Very low	70.3	Confident	96 Å²	96	30.3 Å²	30.3	99%	0.99	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.1	-74	168.7	0	0	0	0	0	116.2
518	S	44.2	Very low	70.4	Confident	108 Å²	108	30.3 Å²	30.3	76%	0.755	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-106.2	-11.1	-179.3	57.7	0	0	0	0	114.6	N516 I520	N516-S518 VanDerWaalsContact C-N 3.29Å; N516-S518 PolarHBondContact O-N 3.02Å; S518-I520 PolarHBondContact O-N 3.44Å
519	D	45.6	Very low	70.7	Confident	69 Å²	69	34.6 Å²	34.6	37%	0.369	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-64.9	122.7	-178.9	-83	-30.4	0	0	0	111.2	N516 Y521	N516-D519 PolarHBondContact O-N 3.23Å; N516-D519 VanDerWaalsContact O-N 3.08Å; D519-Y521 PolarHBondContact O-N 3.3Å
520	I	53.5	Low	71.1	Confident	76 Å²	76	34.8 Å²	34.8	39%	0.39	21%	0.207	S	C	.	.	P	Polyproline II helix	trans	-63.2	123.8	178.2	-59	116.8	0	0	0	108.9	E419 S518	E419-I520 HydrophobicContact CB-CD1 4.41Å; E419-I520 WeakPolarHBondContact OE2-CD1 3.28Å; E419-I520 WeakPolarHBondContact OE2-CG1 3.37Å; E419-I520 WeakPolarHBondContact OE2-CG2 3.44Å; S518-I520 PolarHBondContact O-N 3.44Å
521	Y	60.6	Low	71.2	Confident	56 Å²	56	36.5 Å²	36.5	22%	0.22	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-54.3	137.1	-179.2	-158.2	-93.9	0	0	0	110.9	L391 T452 P453 P515 D519 D523	L391-Y521 HydrophobicContact CD1-CE2 3.78Å; L391-Y521 WeakPolarHBondContact CD1-OH 3.41Å; L391-Y521 WeakPolarHBondContact CD2-OH 3.32Å; L391-Y521 HydrophobicContact CG-CE2 4.5Å; L391-Y521 WeakPolarHBondContact CG-OH 3.26Å; T452-Y521 HydrophobicContact CG2-CE2 4.17Å; P453-Y521 WeakPolarHBondContact CD-OH 3.39Å; P515-Y521 HydrophobicContact CG-CD2 4.35Å; P515-Y521 HydrophobicContact CG-CE2 4.36Å; D519-Y521 PolarHBondContact O-N 3.3Å; Y521-D523 PolarHBondContact O-N 3.07Å; Y521-D523 VanDerWaalsContact O-N 3.16Å
522	P	67.9	Low	71.3	Confident	2 Å²	2	37.1 Å²	37.1	1%	0.013	22%	0.22	C	C	.	.			trans	-69.1	112.4	168.6	27.6	-31.1	0	0	0	109.4	S454 I507 H508 D510 S513	S454-P522 PolarHBondContact OG-O 2.89Å; I507-P522 HydrophobicContact CG2-CB 4.12Å; H508-P522 CarbonylContact O-C 3.56Å; H508-P522 VanDerWaalsContact O-CA 3.27Å; H508-P522 WeakPolarHBondContact O-CA 3.29Å; D510-P522 WeakPolarHBondContact O-CB 3.19Å; D510-P522 WeakPolarHBondContact O-CG 3.37Å; S513-P522 WeakPolarHBondContact OG-CD 3.37Å; S513-P522 WeakPolarHBondContact OG-CG 3.23Å
523	D	72.2	Confident	71.3	Confident	49 Å²	49	40.4 Å²	40.4	26%	0.262	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	113	-173.7	-169.3	2.1	0	0	0	110.8	R415 I507 H508 Y521 S525	R415-D523 WeakPolarHBondContact CB-OD2 3.46Å; R415-D523 WeakPolarHBondContact CD-OD2 3.25Å; I507-D523 WeakPolarHBondContact CA-O 3.36Å; H508-D523 PolarHBondContact N-O 2.96Å; H508-D523 PolarHBondContact O-N 3.17Å; H508-D523 VanDerWaalsContact O-N 3.08Å; Y521-D523 PolarHBondContact O-N 3.07Å; Y521-D523 VanDerWaalsContact O-N 3.16Å; D523-S525 VanDerWaalsContact C-N 3.27Å; D523-S525 PolarHBondContact O-N 3.11Å; D523-S525 PolarHBondContact O-OG 2.98Å
524	W	80.5	Confident	71.5	Confident	5 Å²	5	43.6 Å²	43.6	2%	0.019	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	93.3	164.3	178.6	17.4	0	0	0	109.3	P395 I438 A441 Y442 L457 I505 G526 I527	P395-W524 HydrophobicContact CB-CD2 3.71Å; P395-W524 HydrophobicContact CB-CE3 4.36Å; P395-W524 HydrophobicContact CB-CG 3.93Å; P395-W524 HydrophobicContact CB-CZ2 4.23Å; P395-W524 HydrophobicContact CG-CD2 3.71Å; P395-W524 VanDerWaalsContact CG-CE2 3.47Å; P395-W524 HydrophobicContact CG-CE3 3.95Å; P395-W524 HydrophobicContact CG-CG 4.45Å; P395-W524 HydrophobicContact CG-CH2 3.96Å; P395-W524 HydrophobicContact CG-CZ2 3.63Å; P395-W524 HydrophobicContact CG-CZ3 4.07Å; I438-W524 HydrophobicContact CB-CH2 4.11Å; I438-W524 HydrophobicContact CG1-CH2 3.51Å; I438-W524 HydrophobicContact CG1-CZ2 4.1Å; I438-W524 HydrophobicContact CG1-CZ3 4.43Å; I438-W524 HydrophobicContact CG2-CH2 4.25Å; I438-W524 HydrophobicContact CG2-CZ3 4.41Å; A441-W524 HydrophobicContact CB-CZ3 4.2Å; Y442-W524 HydrophobicContact CD2-CZ3 4.11Å; Y442-W524 AromaticContact CE2-CE3 3.64Å; Y442-W524 HydrophobicContact CE2-CE3 3.64Å; Y442-W524 AromaticContact CE2-CZ3 3.46Å; Y442-W524 HydrophobicContact CE2-CZ3 3.46Å; Y442-W524 VanDerWaalsContact CE2-CZ3 3.46Å; Y442-W524 AromaticContact CZ-CE3 3.97Å; L457-W524 HydrophobicContact CD1-CD2 3.61Å; L457-W524 HydrophobicContact CD1-CE3 3.76Å; L457-W524 HydrophobicContact CD1-CG 3.99Å; L457-W524 HydrophobicContact CD1-CH2 4.07Å; L457-W524 HydrophobicContact CD1-CZ2 4.02Å; L457-W524 HydrophobicContact CD1-CZ3 3.99Å; L457-W524 HydrophobicContact CD2-CH2 4.29Å; I505-W524 HydrophobicContact CD1-CZ2 4.18Å; I505-W524 HydrophobicContact CG1-CZ2 4.43Å; W524-G526 PolarHBondContact NE1-O 2.01Å; W524-I527 HydrophobicContact CH2-CD1 4.36Å; W524-I527 HydrophobicContact CZ2-CD1 3.61Å; W524-I527 HydrophobicContact CZ2-CG1 3.73Å
525	S	81.5	Confident	71.7	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	-37.3	-163.2	-60.4	0	0	0	0	112.7	K396 P413 R415 C506 H508 D523	K396-S525 PolarHBondContact N-O 3.09Å; K396-S525 VanDerWaalsContact N-O 3.09Å; P413-S525 WeakPolarHBondContact O-CB 3.46Å; R415-S525 PolarHBondContact NE-O 3.04Å; C506-S525 PolarHBondContact O-N 2.95Å; C506-S525 VanDerWaalsContact O-N 3.15Å; H508-S525 VanDerWaalsContact CD2-CB 3.45Å; H508-S525 WeakPolarHBondContact CD2-CB 3.23Å; H508-S525 PolarHBondContact CD2-OG 3.47Å; D523-S525 VanDerWaalsContact C-N 3.27Å; D523-S525 PolarHBondContact O-N 3.11Å; D523-S525 PolarHBondContact O-OG 2.98Å
526	G	86.1	Confident	72.3	Confident	0 Å²	0	48 Å²	48	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	149.7	-173.1	0	0	0	0	0	115.3	K396 P413 C506 W524	K396-G526 CarbonylContact O-C 3.52Å; K396-G526 VanDerWaalsContact O-CA 3.28Å; K396-G526 WeakPolarHBondContact O-CA 3.32Å; P413-G526 VanDerWaalsContact CG-CA 3.45Å; C506-G526 PolarHBondContact N-O 3.28Å; C506-G526 VanDerWaalsContact N-O 3.15Å; C506-G526 PolarHBondContact O-N 2.99Å; W524-G526 PolarHBondContact NE1-O 2.01Å
527	I	89.2	Confident	73	Confident	8 Å²	8	49.1 Å²	49.1	4%	0.041	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	122.3	158.5	-50.7	175.2	0	0	0	106	P395 K396 R397 I398 L434 I438 L504 I505 W524	P395-I527 HydrophobicContact CB-CD1 4.33Å; P395-I527 HydrophobicContact CB-CG1 3.99Å; P395-I527 HydrophobicContact CG-CD1 3.61Å; P395-I527 HydrophobicContact CG-CG1 3.83Å; K396-I527 PolarHBondContact O-N 2.87Å; R397-I527 CarbonylContact C-O 3.51Å; R397-I527 WeakPolarHBondContact CA-O 2.83Å; R397-I527 HydrophobicContact CG-CB 4.4Å; R397-I527 HydrophobicContact CG-CD1 4.41Å; I398-I527 PolarHBondContact N-O 3.07Å; L434-I527 HydrophobicContact CD1-CD1 4.34Å; L434-I527 HydrophobicContact CD1-CG2 4.24Å; L434-I527 HydrophobicContact CD2-CG2 4.06Å; I438-I527 HydrophobicContact CD1-CD1 3.48Å; I438-I527 VanDerWaalsContact CD1-CD1 3.48Å; I438-I527 HydrophobicContact CG1-CD1 3.9Å; L504-I527 CarbonylContact O-C 3.52Å; L504-I527 WeakPolarHBondContact O-CA 3.44Å; I505-I527 HydrophobicContact CG1-CG1 4.25Å; I505-I527 HydrophobicContact CG1-CG2 4.34Å; W524-I527 HydrophobicContact CH2-CD1 4.36Å; W524-I527 HydrophobicContact CZ2-CD1 3.61Å; W524-I527 HydrophobicContact CZ2-CG1 3.73Å
528	I	90.8	Very high	73.7	Confident	0 Å²	0	50 Å²	50	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	122.2	-174.9	-60.7	166.1	0	0	0	108.1	I398 I400 I410 T411 W424 L504 I530	I398-I528 HydrophobicContact CB-CG1 4.38Å; I398-I528 WeakPolarHBondContact O-CA 3.14Å; I400-I528 HydrophobicContact CD1-CG2 3.88Å; I400-I528 HydrophobicContact CG1-CG2 4.37Å; I410-I528 HydrophobicContact CG2-CD1 3.9Å; I410-I528 HydrophobicContact CG2-CG2 4.05Å; T411-I528 WeakPolarHBondContact O-CD1 3.38Å; W424-I528 HydrophobicContact CH2-CD1 3.81Å; W424-I528 HydrophobicContact CZ3-CD1 3.79Å; L504-I528 HydrophobicContact CB-CB 4.42Å; L504-I528 PolarHBondContact N-O 3.15Å; L504-I528 PolarHBondContact O-N 3.1Å; I528-I530 HydrophobicContact CG2-CD1 4.35Å; I528-I530 HydrophobicContact CG2-CG1 4.09Å
529	Y	89.3	Confident	74.6	Confident	106 Å²	106	46.6 Å²	46.6	42%	0.416	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	126.6	173.6	-176.8	-85.8	0	0	0	108.4	I398 T399 I400 H502 N503 D531	I398-Y529 PolarHBondContact O-N 3.06Å; T399-Y529 CarbonylContact C-O 3.59Å; T399-Y529 WeakPolarHBondContact CA-O 3.1Å; T399-Y529 HydrophobicContact CG2-CD1 4.07Å; I400-Y529 PolarHBondContact N-O 2.99Å; H502-Y529 CarbonylContact O-C 3.56Å; N503-Y529 WeakPolarHBondContact OD1-CD2 3.41Å; N503-Y529 WeakPolarHBondContact OD1-CE2 3.13Å; Y529-D531 HydrophobicContact CD1-CB 4.22Å; Y529-D531 HydrophobicContact CE1-CB 3.76Å
530	I	87.7	Confident	75.3	Confident	6 Å²	6	49.2 Å²	49.2	3%	0.031	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	107.4	180	-63.8	155	0	0	0	108.1	I400 V402 L408 I410 L501 H502 I528 V532	I400-I530 HydrophobicContact CB-CG1 4.35Å; I400-I530 HydrophobicContact CD1-CG1 4.44Å; I400-I530 WeakPolarHBondContact O-CA 3.46Å; V402-I530 HydrophobicContact CG1-CG2 4.16Å; L408-I530 HydrophobicContact CD2-CD1 4.01Å; L408-I530 HydrophobicContact CD2-CG1 4.06Å; L408-I530 HydrophobicContact CD2-CG2 3.62Å; I410-I530 HydrophobicContact CD1-CD1 3.34Å; I410-I530 HydrophobicContact CG1-CD1 3.76Å; I410-I530 HydrophobicContact CG2-CD1 4.43Å; L501-I530 WeakPolarHBondContact O-CD1 2.98Å; H502-I530 PolarHBondContact O-N 3.18Å; I528-I530 HydrophobicContact CG2-CD1 4.35Å; I528-I530 HydrophobicContact CG2-CG1 4.09Å; I530-V532 HydrophobicContact CG2-CG2 4.03Å
531	D	84.6	Confident	76	Confident	51 Å²	51	50.8 Å²	50.8	27%	0.273	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	111.2	174.5	-164.9	9.8	0	0	0	109	I400 Q401 V402 Y529	I400-D531 PolarHBondContact O-N 3.26Å; Q401-D531 WeakPolarHBondContact CA-O 2.96Å; Q401-D531 HydrophobicContact CG-CB 4.1Å; V402-D531 PolarHBondContact N-O 3.16Å; Y529-D531 HydrophobicContact CD1-CB 4.22Å; Y529-D531 HydrophobicContact CE1-CB 3.76Å
532	V	84.4	Confident	76.2	Confident	13 Å²	13	52.4 Å²	52.4	8%	0.079	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	107.6	176.8	-175.1	0	0	0	0	108.2	V402 E404 I530 P534	V402-V532 HydrophobicContact CG1-CB 4.47Å; V402-V532 HydrophobicContact CG1-CG2 3.93Å; V402-V532 CarbonylContact O-C 3.48Å; V402-V532 WeakPolarHBondContact O-CA 2.93Å; E404-V532 HydrophobicContact CB-CG1 3.97Å; I530-V532 HydrophobicContact CG2-CG2 4.03Å; V532-P534 WeakPolarHBondContact O-CD 3.34Å
533	L	81.8	Confident	76.4	Confident	73 Å²	73	55.5 Å²	55.5	38%	0.382	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	115.7	175.8	-63	176	0	0	0	108.4	V402 E404 Q535	V402-L533 PolarHBondContact O-N 3.21Å; E404-L533 WeakPolarHBondContact CB-O 3.25Å; E404-L533 PolarHBondContact N-O 2.96Å; L533-Q535 PolarHBondContact O-N 3.18Å
534	P	78	Confident	76.3	Confident	79 Å²	79	60 Å²	60	51%	0.513	32%	0.32	S	S	.	.	P	Polyproline II helix	trans	-64.1	133	179.3	27.1	-33.2	0	0	0	109.1	V532 S536	V532-P534 WeakPolarHBondContact O-CD 3.34Å; P534-S536 PolarHBondContact O-N 3.06Å
535	Q	70.3	Confident	76.1	Confident	75 Å²	75	63.8 Å²	63.8	35%	0.35	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-65.6	124.9	174.2	-166.6	-179.5	33.5	0	0	108.3	E404 L533 A539	E404-Q535 HydrophobicContact CB-CB 4.43Å; E404-Q535 PolarHBondContact OE2-N 3Å; L533-Q535 PolarHBondContact O-N 3.18Å; Q535-A539 HydrophobicContact CG-CB 4.03Å
536	S	71.1	Confident	76	Confident	65 Å²	65	67 Å²	67	46%	0.455	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-60.1	142.9	174.1	72.5	0	0	0	0	109.5	P534 L538 A539 R540	P534-S536 PolarHBondContact O-N 3.06Å; S536-L538 PolarHBondContact O-N 3.38Å; S536-L538 VanDerWaalsContact O-N 3.16Å; S536-A539 PolarHBondContact O-N 3.12Å; S536-A539 VanDerWaalsContact OG-CB 3.26Å; S536-A539 WeakPolarHBondContact OG-CB 3.29Å; S536-A539 PolarHBondContact OG-N 3.32Å; S536-A539 VanDerWaalsContact OG-N 3.07Å; S536-R540 PolarHBondContact O-N 3.49Å; S536-R540 VanDerWaalsContact O-N 3.1Å
537	S	67	Low	75.6	Confident	95 Å²	95	69.9 Å²	69.9	66%	0.664	38%	0.378	S	S	*	.	H	α-helix	trans	-53.7	-36.8	176.4	52.4	0	0	0	0	111.5	R540 I541	S537-R540 PolarHBondContact O-N 3.46Å; S537-I541 VanDerWaalsContact O-CG1 3.32Å; S537-I541 WeakPolarHBondContact O-CG1 3.39Å; S537-I541 PolarHBondContact O-N 2.8Å
538	L	60.5	Low	75.3	Confident	113 Å²	113	72.9 Å²	72.9	59%	0.592	40%	0.397	S	S	*	.	H	α-helix	trans	-65.2	-43.8	177	-169.7	140.4	0	0	0	112.4	S536 R540 I541 L542	S536-L538 PolarHBondContact O-N 3.38Å; S536-L538 VanDerWaalsContact O-N 3.16Å; L538-R540 VanDerWaalsContact C-N 3.31Å; L538-R540 PolarHBondContact O-N 2.87Å; L538-I541 PolarHBondContact O-N 3.11Å; L538-L542 HydrophobicContact CD2-CD1 3.29Å; L538-L542 HydrophobicContact CG-CD1 4.03Å; L538-L542 WeakPolarHBondContact O-CB 3.23Å; L538-L542 PolarHBondContact O-N 3.33Å
539	A	63.1	Low	74.8	Confident	38 Å²	38	76.8 Å²	76.8	31%	0.314	42%	0.417	S	S	.	.	H	α-helix	trans	-63.3	-37.3	175.1	0	0	0	0	0	112.1	Q535 S536 L542 S543	Q535-A539 HydrophobicContact CG-CB 4.03Å; S536-A539 PolarHBondContact O-N 3.12Å; S536-A539 VanDerWaalsContact OG-CB 3.26Å; S536-A539 WeakPolarHBondContact OG-CB 3.29Å; S536-A539 PolarHBondContact OG-N 3.32Å; S536-A539 VanDerWaalsContact OG-N 3.07Å; A539-L542 PolarHBondContact O-N 2.83Å; A539-S543 WeakPolarHBondContact O-CB 3.47Å; A539-S543 PolarHBondContact O-N 2.89Å
540	R	61.5	Low	74.4	Confident	123 Å²	123	78.4 Å²	78.4	46%	0.464	43%	0.428	S	S	.	.	H	α-helix	trans	-67.2	-38.4	174.5	-176.3	179	-93.8	-169.4	-9.3	112.2	S536 S537 L538 K544	S536-R540 PolarHBondContact O-N 3.49Å; S536-R540 VanDerWaalsContact O-N 3.1Å; S537-R540 PolarHBondContact O-N 3.46Å; L538-R540 VanDerWaalsContact C-N 3.31Å; L538-R540 PolarHBondContact O-N 2.87Å; R540-K544 WeakPolarHBondContact O-CG 3.4Å; R540-K544 PolarHBondContact O-N 3.06Å
541	I	67.6	Low	74.3	Confident	109 Å²	109	84.2 Å²	84.2	56%	0.559	46%	0.458	S	S	*	.	H	α-helix	trans	-64.9	-50.4	174.1	-68.2	164.4	0	0	0	109.4	S537 L538 S543 K544 L545	S537-I541 VanDerWaalsContact O-CG1 3.32Å; S537-I541 WeakPolarHBondContact O-CG1 3.39Å; S537-I541 PolarHBondContact O-N 2.8Å; L538-I541 PolarHBondContact O-N 3.11Å; I541-S543 PolarHBondContact O-N 3.31Å; I541-K544 CarbonylContact O-C 3.56Å; I541-K544 PolarHBondContact O-N 2.86Å; I541-K544 VanDerWaalsContact O-N 3.16Å; I541-L545 VanDerWaalsContact O-CB 3.28Å; I541-L545 WeakPolarHBondContact O-CB 3.36Å; I541-L545 PolarHBondContact O-N 2.89Å
542	L	66	Low	74.4	Confident	90 Å²	90	85.6 Å²	85.6	47%	0.471	47%	0.465	S	S	.	.	H	α-helix	trans	-58.7	-42.4	177.9	-91.6	140.1	0	0	0	113	L538 A539 K544 L545 T546	L538-L542 HydrophobicContact CD2-CD1 3.29Å; L538-L542 HydrophobicContact CG-CD1 4.03Å; L538-L542 WeakPolarHBondContact O-CB 3.23Å; L538-L542 PolarHBondContact O-N 3.33Å; A539-L542 PolarHBondContact O-N 2.83Å; L542-K544 VanDerWaalsContact C-N 3.28Å; L542-K544 PolarHBondContact O-N 3.28Å; L542-L545 PolarHBondContact O-N 3.49Å; L542-T546 WeakPolarHBondContact O-CB 3.26Å; L542-T546 PolarHBondContact O-N 2.97Å; L542-T546 PolarHBondContact O-OG1 2.83Å
543	S	70.2	Confident	74.5	Confident	68 Å²	68	90.4 Å²	90.4	48%	0.476	49%	0.488	S	S	.	.	H	α-helix	trans	-65.3	-32.7	178.6	98.1	0	0	0	0	112.2	A539 I541 P547	A539-S543 WeakPolarHBondContact O-CB 3.47Å; A539-S543 PolarHBondContact O-N 2.89Å; I541-S543 PolarHBondContact O-N 3.31Å; S543-P547 WeakPolarHBondContact O-CD 3.16Å
544	K	72.1	Confident	74.7	Confident	144 Å²	144	90.6 Å²	90.6	63%	0.626	49%	0.493	S	S	*	.	H	α-helix	trans	-78.9	-33.1	173.3	-71.3	-175.2	176.8	-170.1	0	112.8	R540 I541 L542 P547 V548	R540-K544 WeakPolarHBondContact O-CG 3.4Å; R540-K544 PolarHBondContact O-N 3.06Å; I541-K544 CarbonylContact O-C 3.56Å; I541-K544 PolarHBondContact O-N 2.86Å; I541-K544 VanDerWaalsContact O-N 3.16Å; L542-K544 VanDerWaalsContact C-N 3.28Å; L542-K544 PolarHBondContact O-N 3.28Å; K544-P547 WeakPolarHBondContact O-CD 3.49Å; K544-P547 WeakPolarHBondContact O-CG 3.37Å; K544-V548 WeakPolarHBondContact O-CG2 3.26Å
545	L	75.2	Confident	75.3	Confident	84 Å²	84	93.4 Å²	93.4	44%	0.44	50%	0.498	S	S	.	.	H	α-helix	trans	-75.5	-34.2	-178.2	-150.5	86.2	0	0	0	111.8	I541 L542 V548 I549	I541-L545 VanDerWaalsContact O-CB 3.28Å; I541-L545 WeakPolarHBondContact O-CB 3.36Å; I541-L545 PolarHBondContact O-N 2.89Å; L542-L545 PolarHBondContact O-N 3.49Å; L545-V548 CarbonylContact O-C 3.6Å; L545-V548 WeakPolarHBondContact O-CB 3.26Å; L545-V548 PolarHBondContact O-N 3.42Å; L545-V548 VanDerWaalsContact O-N 3.11Å; L545-I549 HydrophobicContact CB-CD1 4.38Å; L545-I549 HydrophobicContact CD2-CD1 3.44Å; L545-I549 VanDerWaalsContact CD2-CD1 3.44Å; L545-I549 HydrophobicContact CD2-CG1 4.27Å; L545-I549 HydrophobicContact CG-CD1 3.77Å; L545-I549 HydrophobicContact CG-CG1 4.15Å; L545-I549 WeakPolarHBondContact O-CG1 3.29Å; L545-I549 PolarHBondContact O-N 3.28Å
546	T	79.5	Confident	76.1	Confident	66 Å²	66	94.9 Å²	94.9	41%	0.405	51%	0.507	S	S	.	.	H	α-helix	trans	-54.2	-52.1	-178.2	-57.7	0	0	0	0	113.3	L542 V548 I549 Q550	L542-T546 WeakPolarHBondContact O-CB 3.26Å; L542-T546 PolarHBondContact O-N 2.97Å; L542-T546 PolarHBondContact O-OG1 2.83Å; T546-V548 VanDerWaalsContact C-N 3.31Å; T546-V548 PolarHBondContact O-N 3.41Å; T546-I549 PolarHBondContact O-N 2.81Å; T546-Q550 WeakPolarHBondContact O-CB 3.44Å; T546-Q550 WeakPolarHBondContact O-CG 3.35Å; T546-Q550 PolarHBondContact O-N 3.3Å
547	P	78	Confident	77	Confident	61 Å²	61	96.6 Å²	96.6	40%	0.396	51%	0.511	S	S	.	.	H	α-helix	trans	-65.6	-34.2	176.6	23.2	-32.2	0	0	0	112.4	S543 K544 Q550 I551	S543-P547 WeakPolarHBondContact O-CD 3.16Å; K544-P547 WeakPolarHBondContact O-CD 3.49Å; K544-P547 WeakPolarHBondContact O-CG 3.37Å; P547-Q550 PolarHBondContact O-N 2.9Å; P547-I551 WeakPolarHBondContact O-CD1 3.45Å; P547-I551 VanDerWaalsContact O-CG1 3.25Å; P547-I551 WeakPolarHBondContact O-CG1 3.38Å; P547-I551 PolarHBondContact O-N 2.95Å; P547-I551 VanDerWaalsContact O-N 3.09Å
548	V	81.9	Confident	78.1	Confident	72 Å²	72	94.8 Å²	94.8	44%	0.436	50%	0.501	S	S	.	.	H	α-helix	trans	-64.8	-45.1	176.1	176.8	0	0	0	0	110.9	K544 L545 T546 I551 I552	K544-V548 WeakPolarHBondContact O-CG2 3.26Å; L545-V548 CarbonylContact O-C 3.6Å; L545-V548 WeakPolarHBondContact O-CB 3.26Å; L545-V548 PolarHBondContact O-N 3.42Å; L545-V548 VanDerWaalsContact O-N 3.11Å; T546-V548 VanDerWaalsContact C-N 3.31Å; T546-V548 PolarHBondContact O-N 3.41Å; V548-I551 PolarHBondContact O-N 3.3Å; V548-I552 HydrophobicContact CG1-CD1 3.63Å; V548-I552 HydrophobicContact CG1-CG1 4.45Å; V548-I552 VanDerWaalsContact O-CG1 3.3Å; V548-I552 WeakPolarHBondContact O-CG1 3.42Å; V548-I552 PolarHBondContact O-N 3.14Å
549	I	81.4	Confident	79.6	Confident	82 Å²	82	93.8 Å²	93.8	42%	0.421	50%	0.496	S	S	.	.	H	α-helix	trans	-63.8	-42.7	175.7	-69.4	167.7	0	0	0	110.6	L545 T546 I551 I552 M553	L545-I549 HydrophobicContact CB-CD1 4.38Å; L545-I549 HydrophobicContact CD2-CD1 3.44Å; L545-I549 VanDerWaalsContact CD2-CD1 3.44Å; L545-I549 HydrophobicContact CD2-CG1 4.27Å; L545-I549 HydrophobicContact CG-CD1 3.77Å; L545-I549 HydrophobicContact CG-CG1 4.15Å; L545-I549 WeakPolarHBondContact O-CG1 3.29Å; L545-I549 PolarHBondContact O-N 3.28Å; T546-I549 PolarHBondContact O-N 2.81Å; I549-I551 PolarHBondContact O-N 2.96Å; I549-I552 PolarHBondContact O-N 3.01Å; I549-I552 VanDerWaalsContact O-N 3.17Å; I549-M553 WeakPolarHBondContact O-CB 3.29Å; I549-M553 PolarHBondContact O-N 3.5Å
550	Q	80.5	Confident	80.9	Confident	139 Å²	139	93.9 Å²	93.9	65%	0.65	50%	0.5	S	S	*	.	H	α-helix	trans	-60.5	-30.4	177	-78.5	179	-23.2	0	0	112.8	T546 P547 P554	T546-Q550 WeakPolarHBondContact O-CB 3.44Å; T546-Q550 WeakPolarHBondContact O-CG 3.35Å; T546-Q550 PolarHBondContact O-N 3.3Å; P547-Q550 PolarHBondContact O-N 2.9Å; Q550-P554 WeakPolarHBondContact O-CD 3.23Å
551	I	84.8	Confident	82.3	Confident	129 Å²	129	92.9 Å²	92.9	66%	0.662	50%	0.503	S	S	*	.	H	α-helix	trans	-78.5	-40.5	174.9	-66.8	164.3	0	0	0	111.4	P547 V548 I549 P554	P547-I551 WeakPolarHBondContact O-CD1 3.45Å; P547-I551 VanDerWaalsContact O-CG1 3.25Å; P547-I551 WeakPolarHBondContact O-CG1 3.38Å; P547-I551 PolarHBondContact O-N 2.95Å; P547-I551 VanDerWaalsContact O-N 3.09Å; V548-I551 PolarHBondContact O-N 3.3Å; I549-I551 PolarHBondContact O-N 2.96Å; I551-P554 WeakPolarHBondContact O-CG 3.22Å
552	I	86.6	Confident	83.4	Confident	79 Å²	79	93.8 Å²	93.8	41%	0.405	50%	0.503	S	S	.	.	H	α-helix	trans	-81.6	-35.8	-173.5	-66.3	173.3	0	0	0	112.6	V548 I549 F555 I556	V548-I552 HydrophobicContact CG1-CD1 3.63Å; V548-I552 HydrophobicContact CG1-CG1 4.45Å; V548-I552 VanDerWaalsContact O-CG1 3.3Å; V548-I552 WeakPolarHBondContact O-CG1 3.42Å; V548-I552 PolarHBondContact O-N 3.14Å; I549-I552 PolarHBondContact O-N 3.01Å; I549-I552 VanDerWaalsContact O-N 3.17Å; I552-F555 WeakPolarHBondContact O-CA 3.36Å; I552-F555 VanDerWaalsContact O-CB 3.32Å; I552-F555 WeakPolarHBondContact O-CB 3.35Å; I552-F555 PolarHBondContact O-N 2.93Å; I552-I556 HydrophobicContact CG2-CD1 3.56Å; I552-I556 HydrophobicContact CG2-CG1 3.87Å; I552-I556 PolarHBondContact O-N 3.47Å
553	M	86.4	Confident	84.6	Confident	115 Å²	115	96.1 Å²	96.1	57%	0.567	51%	0.51	S	S	*	.	H	α-helix	trans	-56.2	-45.7	-176.5	-168.8	169.5	-171.9	0	0	114.3	I549 F555 I556 L557	I549-M553 WeakPolarHBondContact O-CB 3.29Å; I549-M553 PolarHBondContact O-N 3.5Å; M553-F555 VanDerWaalsContact C-N 3.28Å; M553-F555 PolarHBondContact O-N 3.4Å; M553-I556 PolarHBondContact O-N 3.19Å; M553-L557 HydrophobicContact CG-CD1 4.22Å; M553-L557 WeakPolarHBondContact O-CB 3.37Å; M553-L557 PolarHBondContact O-N 2.92Å
554	P	87.7	Confident	85.4	Confident	76 Å²	76	98.7 Å²	98.7	49%	0.494	52%	0.516	S	S	.	.	H	α-helix	trans	-65.2	-31.2	174.7	24	-32.9	0	0	0	112.7	Q550 I551 A558	Q550-P554 WeakPolarHBondContact O-CD 3.23Å; I551-P554 WeakPolarHBondContact O-CG 3.22Å; P554-A558 VanDerWaalsContact O-CB 3.3Å; P554-A558 WeakPolarHBondContact O-CB 3.34Å; P554-A558 PolarHBondContact O-N 2.87Å
555	F	89	Confident	86.1	Confident	139 Å²	139	95.8 Å²	95.8	61%	0.61	51%	0.506	S	S	*	.	H	α-helix	trans	-67.4	-43.5	175.6	-174.8	-98.8	0	0	0	111.8	I552 M553 A558 L559	I552-F555 WeakPolarHBondContact O-CA 3.36Å; I552-F555 VanDerWaalsContact O-CB 3.32Å; I552-F555 WeakPolarHBondContact O-CB 3.35Å; I552-F555 PolarHBondContact O-N 2.93Å; M553-F555 VanDerWaalsContact C-N 3.28Å; M553-F555 PolarHBondContact O-N 3.4Å; F555-A558 PolarHBondContact O-N 2.93Å; F555-L559 HydrophobicContact CD1-CD1 3.85Å; F555-L559 HydrophobicContact CE1-CD1 3.36Å; F555-L559 HydrophobicContact CZ-CD1 3.9Å; F555-L559 PolarHBondContact O-N 3.21Å
556	I	88.1	Confident	86.7	Confident	106 Å²	106	95.7 Å²	95.7	54%	0.544	51%	0.505	S	S	.	.	H	α-helix	trans	-64.3	-43.4	175.2	-65.7	176.4	0	0	0	110.9	I552 M553 L559 G560	I552-I556 HydrophobicContact CG2-CD1 3.56Å; I552-I556 HydrophobicContact CG2-CG1 3.87Å; I552-I556 PolarHBondContact O-N 3.47Å; M553-I556 PolarHBondContact O-N 3.19Å; I556-L559 WeakPolarHBondContact O-CB 3.43Å; I556-L559 PolarHBondContact O-N 3.33Å; I556-G560 PolarHBondContact O-N 3.42Å
557	L	90.3	Very high	87	Confident	101 Å²	101	96.9 Å²	96.9	53%	0.529	51%	0.509	S	S	.	.	H	α-helix	trans	-61.9	-42.2	175.8	-86.6	160.5	0	0	0	111.9	M553 G560 I561	M553-L557 HydrophobicContact CG-CD1 4.22Å; M553-L557 WeakPolarHBondContact O-CB 3.37Å; M553-L557 PolarHBondContact O-N 2.92Å; L557-G560 PolarHBondContact O-N 3.46Å; L557-I561 VanDerWaalsContact O-CG1 3.31Å; L557-I561 WeakPolarHBondContact O-CG1 3.01Å; L557-I561 PolarHBondContact O-N 3.2Å
558	A	89.2	Confident	87.2	Confident	56 Å²	56	97.1 Å²	97.1	46%	0.463	51%	0.509	S	S	.	.	H	α-helix	trans	-62.5	-42.1	175.7	0	0	0	0	0	112	P554 F555 I561 F562	P554-A558 VanDerWaalsContact O-CB 3.3Å; P554-A558 WeakPolarHBondContact O-CB 3.34Å; P554-A558 PolarHBondContact O-N 2.87Å; F555-A558 PolarHBondContact O-N 2.93Å; A558-I561 PolarHBondContact O-N 2.88Å; A558-F562 WeakPolarHBondContact O-CB 3.41Å; A558-F562 PolarHBondContact O-N 2.71Å
559	L	91.7	Very high	87.1	Confident	93 Å²	93	97.3 Å²	97.3	49%	0.487	51%	0.507	S	S	.	.	H	α-helix	trans	-60.9	-43.4	173.2	-106.2	151.1	0	0	0	112.1	F555 I556 F562 F563	F555-L559 HydrophobicContact CD1-CD1 3.85Å; F555-L559 HydrophobicContact CE1-CD1 3.36Å; F555-L559 HydrophobicContact CZ-CD1 3.9Å; F555-L559 PolarHBondContact O-N 3.21Å; I556-L559 WeakPolarHBondContact O-CB 3.43Å; I556-L559 PolarHBondContact O-N 3.33Å; L559-F562 PolarHBondContact O-N 3.37Å; L559-F563 PolarHBondContact O-N 3.5Å
560	G	91.7	Very high	87.1	Confident	39 Å²	39	101.4 Å²	101.4	40%	0.402	52%	0.519	S	S	.	.	H	α-helix	trans	-61.8	-44.3	176	0	0	0	0	0	112.7	I556 L557 F563 M564	I556-G560 PolarHBondContact O-N 3.42Å; L557-G560 PolarHBondContact O-N 3.46Å; G560-F563 PolarHBondContact O-N 3.25Å; G560-M564 WeakPolarHBondContact O-CG 3.39Å; G560-M564 PolarHBondContact O-N 3.3Å
561	I	90.5	Very high	87.1	Confident	103 Å²	103	98.8 Å²	98.8	53%	0.528	51%	0.512	S	S	.	.	H	α-helix	trans	-63.9	-43.5	176.2	-67.3	164.8	0	0	0	110.7	L557 A558 F563 M564 I565	L557-I561 VanDerWaalsContact O-CG1 3.31Å; L557-I561 WeakPolarHBondContact O-CG1 3.01Å; L557-I561 PolarHBondContact O-N 3.2Å; A558-I561 PolarHBondContact O-N 2.88Å; I561-F563 VanDerWaalsContact C-N 3.32Å; I561-F563 PolarHBondContact O-N 3.09Å; I561-M564 PolarHBondContact O-N 3.27Å; I561-I565 HydrophobicContact CG2-CD1 3.86Å; I561-I565 HydrophobicContact CG2-CG1 4.45Å; I561-I565 WeakPolarHBondContact O-CG1 3.22Å; I561-I565 PolarHBondContact O-N 3.08Å
562	F	90.8	Very high	86.5	Confident	128 Å²	128	98.3 Å²	98.3	56%	0.561	51%	0.507	S	S	*	.	H	α-helix	trans	-60.9	-42.4	177.6	-173.6	-103.7	0	0	0	111.8	A558 L559 M564 I565 I566	A558-F562 WeakPolarHBondContact O-CB 3.41Å; A558-F562 PolarHBondContact O-N 2.71Å; L559-F562 PolarHBondContact O-N 3.37Å; F562-M564 PolarHBondContact O-N 3.5Å; F562-I565 PolarHBondContact O-N 3.5Å; F562-I566 HydrophobicContact CD1-CD1 3.76Å; F562-I566 HydrophobicContact CE1-CD1 3.27Å; F562-I566 HydrophobicContact CE1-CG1 4.23Å; F562-I566 HydrophobicContact CZ-CD1 3.75Å; F562-I566 HydrophobicContact CZ-CG1 4.42Å; F562-I566 WeakPolarHBondContact O-CG1 3.37Å; F562-I566 PolarHBondContact O-N 3Å
563	F	91.4	Very high	85.3	Confident	139 Å²	139	101.8 Å²	101.8	61%	0.61	52%	0.515	S	S	*	.	H	α-helix	trans	-63.9	-41.2	176.6	-152.6	-88.9	0	0	0	112	L559 G560 I561 I565 I566 L567	L559-F563 PolarHBondContact O-N 3.5Å; G560-F563 PolarHBondContact O-N 3.25Å; I561-F563 VanDerWaalsContact C-N 3.32Å; I561-F563 PolarHBondContact O-N 3.09Å; F563-I565 PolarHBondContact O-N 3.27Å; F563-I566 PolarHBondContact O-N 2.92Å; F563-L567 HydrophobicContact CE1-CD1 4.16Å; F563-L567 WeakPolarHBondContact O-CB 3.08Å; F563-L567 PolarHBondContact O-N 3.36Å
564	M	86.8	Confident	84.3	Confident	121 Å²	121	100.1 Å²	100.1	60%	0.596	51%	0.506	S	S	*	.	H	α-helix	trans	-63.5	-37.5	174.5	-72.5	-64.8	-70.6	0	0	112.8	G560 I561 F562 L567 T568	G560-M564 WeakPolarHBondContact O-CG 3.39Å; G560-M564 PolarHBondContact O-N 3.3Å; I561-M564 PolarHBondContact O-N 3.27Å; F562-M564 PolarHBondContact O-N 3.5Å; M564-L567 PolarHBondContact O-N 3.3Å; M564-T568 WeakPolarHBondContact O-CG2 3.25Å; M564-T568 PolarHBondContact O-N 2.91Å; M564-T568 PolarHBondContact O-OG1 3.05Å
565	I	87.2	Confident	83.3	Confident	84 Å²	84	99.4 Å²	99.4	43%	0.431	50%	0.502	S	S	.	.	H	α-helix	trans	-66.3	-42.8	175.3	-68.6	166.6	0	0	0	110.9	I561 F562 F563 L567 T568 L569	I561-I565 HydrophobicContact CG2-CD1 3.86Å; I561-I565 HydrophobicContact CG2-CG1 4.45Å; I561-I565 WeakPolarHBondContact O-CG1 3.22Å; I561-I565 PolarHBondContact O-N 3.08Å; F562-I565 PolarHBondContact O-N 3.5Å; F563-I565 PolarHBondContact O-N 3.27Å; I565-L567 VanDerWaalsContact C-N 3.35Å; I565-T568 WeakPolarHBondContact CA-OG1 2.97Å; I565-T568 PolarHBondContact O-N 2.81Å; I565-T568 PolarHBondContact O-OG1 2.81Å; I565-L569 HydrophobicContact CG2-CD1 3.85Å; I565-L569 WeakPolarHBondContact O-CB 3.45Å; I565-L569 WeakPolarHBondContact O-CG 3.37Å; I565-L569 PolarHBondContact O-N 3Å
566	I	86.9	Confident	82.3	Confident	82 Å²	82	99.6 Å²	99.6	42%	0.421	50%	0.502	S	S	.	.	H	α-helix	trans	-62.6	-44.6	176.2	-71.5	178	0	0	0	110.7	F562 F563 T568 L569 Y570	F562-I566 HydrophobicContact CD1-CD1 3.76Å; F562-I566 HydrophobicContact CE1-CD1 3.27Å; F562-I566 HydrophobicContact CE1-CG1 4.23Å; F562-I566 HydrophobicContact CZ-CD1 3.75Å; F562-I566 HydrophobicContact CZ-CG1 4.42Å; F562-I566 WeakPolarHBondContact O-CG1 3.37Å; F562-I566 PolarHBondContact O-N 3Å; F563-I566 PolarHBondContact O-N 2.92Å; I566-T568 PolarHBondContact O-N 3.41Å; I566-L569 PolarHBondContact O-N 3.14Å; I566-Y570 WeakPolarHBondContact O-CB 3.49Å; I566-Y570 PolarHBondContact O-N 2.78Å
567	L	86.3	Confident	81.2	Confident	90 Å²	90	100.3 Å²	100.3	47%	0.471	51%	0.505	S	S	.	.	H	α-helix	trans	-63.1	-42.2	-178.7	-149.4	102.6	0	0	0	111.8	F563 M564 I565 Y570 T571	F563-L567 HydrophobicContact CE1-CD1 4.16Å; F563-L567 WeakPolarHBondContact O-CB 3.08Å; F563-L567 PolarHBondContact O-N 3.36Å; M564-L567 PolarHBondContact O-N 3.3Å; I565-L567 VanDerWaalsContact C-N 3.35Å; L567-Y570 PolarHBondContact O-N 3.39Å; L567-T571 WeakPolarHBondContact O-CB 3.24Å; L567-T571 WeakPolarHBondContact O-CG2 3.33Å; L567-T571 PolarHBondContact O-N 3.14Å; L567-T571 PolarHBondContact O-OG1 2.71Å
568	T	82.2	Confident	80.1	Confident	66 Å²	66	103.2 Å²	103.2	41%	0.405	51%	0.508	S	S	.	.	H	α-helix	trans	-68.7	-37.9	177.1	49.9	0	0	0	0	112.2	M564 I565 I566 Y570 E572	M564-T568 WeakPolarHBondContact O-CG2 3.25Å; M564-T568 PolarHBondContact O-N 2.91Å; M564-T568 PolarHBondContact O-OG1 3.05Å; I565-T568 WeakPolarHBondContact CA-OG1 2.97Å; I565-T568 PolarHBondContact O-N 2.81Å; I565-T568 PolarHBondContact O-OG1 2.81Å; I566-T568 PolarHBondContact O-N 3.41Å; T568-Y570 VanDerWaalsContact C-N 3.35Å; T568-Y570 PolarHBondContact O-N 2.03Å; T568-E572 PolarHBondContact O-N 2.76Å
569	L	80.2	Confident	79	Confident	76 Å²	76	104 Å²	104	40%	0.398	51%	0.505	S	S	.	.	I	π-helix	trans	-61.9	-41.7	173.2	-79.8	164.8	0	0	0	112.5	I565 I566 R573 Q574	I565-L569 HydrophobicContact CG2-CD1 3.85Å; I565-L569 WeakPolarHBondContact O-CB 3.45Å; I565-L569 WeakPolarHBondContact O-CG 3.37Å; I565-L569 PolarHBondContact O-N 3Å; I566-L569 PolarHBondContact O-N 3.14Å; L569-R573 HydrophobicContact CD2-CB 4.37Å; L569-R573 PolarHBondContact O-N 3.24Å; L569-Q574 PolarHBondContact O-N 3.37Å; L569-Q574 VanDerWaalsContact O-N 3.15Å
570	Y	80.9	Confident	77.9	Confident	169 Å²	169	102.9 Å²	102.9	66%	0.663	51%	0.509	S	S	*	.	I	π-helix	trans	-72.7	-42.7	-178.6	-162.4	-98	0	0	0	112.3	I566 L567 T568	I566-Y570 WeakPolarHBondContact O-CB 3.49Å; I566-Y570 PolarHBondContact O-N 2.78Å; L567-Y570 PolarHBondContact O-N 3.39Å; T568-Y570 VanDerWaalsContact C-N 3.35Å; T568-Y570 PolarHBondContact O-N 2.03Å
571	T	79.7	Confident	76.8	Confident	83 Å²	83	105.2 Å²	105.2	51%	0.509	52%	0.524	S	S	.	.	I	π-helix	trans	-80.7	-42.7	-174.8	52.8	0	0	0	0	113.4	L567 P575	L567-T571 WeakPolarHBondContact O-CB 3.24Å; L567-T571 WeakPolarHBondContact O-CG2 3.33Å; L567-T571 PolarHBondContact O-N 3.14Å; L567-T571 PolarHBondContact O-OG1 2.71Å; T571-P575 WeakPolarHBondContact O-CG 3.49Å
572	E	72.7	Confident	76.1	Confident	120 Å²	120	108.2 Å²	108.2	56%	0.561	53%	0.534	S	S	*	.	I	π-helix	trans	-99.9	-44.2	-173.6	-66.8	-164.3	151.8	0	0	113.9	T568 K576	T568-E572 PolarHBondContact O-N 2.76Å; E572-K576 WeakPolarHBondContact O-CD 3.39Å; E572-K576 WeakPolarHBondContact O-CG 3.46Å
573	R	62.5	Low	74.6	Confident	151 Å²	151	105.1 Å²	105.1	57%	0.57	54%	0.537	S	S	*	.	I	π-helix	trans	-84.2	-42	-169	-92.6	-179.3	172.9	-171.1	4.8	113	L569 K576 M577	L569-R573 HydrophobicContact CD2-CB 4.37Å; L569-R573 PolarHBondContact O-N 3.24Å; R573-K576 PolarHBondContact O-N 3.13Å; R573-M577 WeakPolarHBondContact O-CB 3.41Å; R573-M577 VanDerWaalsContact O-CG 3.23Å; R573-M577 WeakPolarHBondContact O-CG 3.49Å; R573-M577 PolarHBondContact O-N 2.93Å
574	Q	65	Low	73.2	Confident	80 Å²	80	103.5 Å²	103.5	37%	0.374	54%	0.535	S	S	.	.	H	α-helix	trans	-59.8	-46.2	-177	-131	-163.8	24.1	0	0	114.1	L569 R578	L569-Q574 PolarHBondContact O-N 3.37Å; L569-Q574 VanDerWaalsContact O-N 3.15Å; Q574-R578 WeakPolarHBondContact O-CB 3.33Å; Q574-R578 WeakPolarHBondContact O-CG 3.15Å; Q574-R578 PolarHBondContact O-N 2.7Å
575	P	65.4	Low	71.7	Confident	62 Å²	62	104.4 Å²	104.4	40%	0.403	55%	0.546	S	S	.	.	H	α-helix	trans	-68.8	-39.3	178.2	24.2	-31.1	0	0	0	112.1	T571 R578 L579	T571-P575 WeakPolarHBondContact O-CG 3.49Å; P575-R578 PolarHBondContact O-N 3.43Å; P575-L579 WeakPolarHBondContact O-CB 2.66Å; P575-L579 WeakPolarHBondContact O-CG 3.17Å; P575-L579 PolarHBondContact O-N 3.13Å
576	K	68.3	Low	70.2	Confident	142 Å²	142	106.3 Å²	106.3	62%	0.617	56%	0.557	S	S	*	*	H	α-helix	trans	-63.8	-41.6	176.4	-71.9	-179.1	-178.4	175.3	0	112.1	E572 R573 L579 A580	E572-K576 WeakPolarHBondContact O-CD 3.39Å; E572-K576 WeakPolarHBondContact O-CG 3.46Å; R573-K576 PolarHBondContact O-N 3.13Å; K576-L579 PolarHBondContact O-N 3.02Å; K576-A580 WeakPolarHBondContact O-CB 3.28Å; K576-A580 PolarHBondContact O-N 2.97Å
577	M	64.7	Low	68.4	Low	122 Å²	122	115 Å²	115	60%	0.601	59%	0.591	S	S	*	*	H	α-helix	trans	-67.7	-38.4	175.5	-70.2	-131.7	-154.3	0	0	112.3	R573 L579 A580 A581	R573-M577 WeakPolarHBondContact O-CB 3.41Å; R573-M577 VanDerWaalsContact O-CG 3.23Å; R573-M577 WeakPolarHBondContact O-CG 3.49Å; R573-M577 PolarHBondContact O-N 2.93Å; M577-L579 VanDerWaalsContact C-N 3.34Å; M577-A580 PolarHBondContact O-N 2.73Å; M577-A581 VanDerWaalsContact O-CB 3.27Å; M577-A581 WeakPolarHBondContact O-CB 3.3Å; M577-A581 PolarHBondContact O-N 3.06Å
578	R	67.7	Low	67.5	Low	161 Å²	161	116.3 Å²	116.3	61%	0.608	60%	0.597	S	S	*	*	H	α-helix	trans	-65.8	-35.8	174.7	-79	-178.7	178.5	169.8	2.1	112.4	Q574 P575 K582	Q574-R578 WeakPolarHBondContact O-CB 3.33Å; Q574-R578 WeakPolarHBondContact O-CG 3.15Å; Q574-R578 PolarHBondContact O-N 2.7Å; P575-R578 PolarHBondContact O-N 3.43Å; R578-K582 WeakPolarHBondContact O-CG 3.48Å; R578-K582 PolarHBondContact O-N 2.93Å
579	L	67.6	Low	66.7	Low	73 Å²	73	118.9 Å²	118.9	38%	0.382	61%	0.607	S	S	.	*	H	α-helix	trans	-69.6	-44.4	174.6	-77.6	161.1	0	0	0	111.5	P575 K576 M577 A581 K582 I586	P575-L579 WeakPolarHBondContact O-CB 2.66Å; P575-L579 WeakPolarHBondContact O-CG 3.17Å; P575-L579 PolarHBondContact O-N 3.13Å; K576-L579 PolarHBondContact O-N 3.02Å; M577-L579 VanDerWaalsContact C-N 3.34Å; L579-A581 PolarHBondContact O-N 3.16Å; L579-K582 PolarHBondContact O-N 3.24Å; L579-I586 HydrophobicContact CD1-CD1 4.13Å; L579-I586 HydrophobicContact CD2-CD1 4.38Å
580	A	68	Low	65.9	Low	69 Å²	69	121.3 Å²	121.3	57%	0.57	62%	0.619	S	S	*	*	H	α-helix	trans	-63.2	-40.8	175.9	0	0	0	0	0	112.7	K576 M577 K582 G583	K576-A580 WeakPolarHBondContact O-CB 3.28Å; K576-A580 PolarHBondContact O-N 2.97Å; M577-A580 PolarHBondContact O-N 2.73Å; A580-K582 VanDerWaalsContact C-N 3.25Å; A580-K582 PolarHBondContact O-N 3.4Å; A580-G583 PolarHBondContact O-N 3.29Å
581	A	69.3	Low	65.1	Low	89 Å²	89	118.5 Å²	118.5	74%	0.736	62%	0.616	S	S	*	*	H	α-helix	trans	-66.9	-25	177.7	0	0	0	0	0	113.3	M577 L579 G583	M577-A581 VanDerWaalsContact O-CB 3.27Å; M577-A581 WeakPolarHBondContact O-CB 3.3Å; M577-A581 PolarHBondContact O-N 3.06Å; L579-A581 PolarHBondContact O-N 3.16Å; A581-G583 PolarHBondContact O-N 3.18Å
582	K	74.2	Confident	64.1	Low	166 Å²	166	120.7 Å²	120.7	72%	0.722	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	6.7	172.9	-74.8	-177.4	177.2	-173.2	0	113.3	R578 L579 A580 L584	R578-K582 WeakPolarHBondContact O-CG 3.48Å; R578-K582 PolarHBondContact O-N 2.93Å; L579-K582 PolarHBondContact O-N 3.24Å; A580-K582 VanDerWaalsContact C-N 3.25Å; A580-K582 PolarHBondContact O-N 3.4Å; K582-L584 PolarHBondContact O-N 3.38Å
583	G	59.9	Low	63.6	Low	62 Å²	62	120.7 Å²	120.7	64%	0.639	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.2	6.3	177.5	0	0	0	0	0	114.4	A580 A581 V585	A580-G583 PolarHBondContact O-N 3.29Å; A581-G583 PolarHBondContact O-N 3.18Å; G583-V585 PolarHBondContact O-N 2.99Å; G583-V585 VanDerWaalsContact O-N 3.15Å
584	L	61.5	Low	63.7	Low	106 Å²	106	118.6 Å²	118.6	56%	0.555	63%	0.631	S	S	*	*			trans	-82.9	89.9	172.6	-78	154	0	0	0	107.9	K582 I586	K582-L584 PolarHBondContact O-N 3.38Å; L584-I586 VanDerWaalsContact C-N 3.26Å; L584-I586 PolarHBondContact O-N 2.81Å
585	V	55.6	Low	63.6	Low	139 Å²	139	121.5 Å²	121.5	84%	0.842	65%	0.651	S	S	*	*			trans	-69.8	95	160.7	-174.2	0	0	0	0	106.1	G583 K587	G583-V585 PolarHBondContact O-N 2.99Å; G583-V585 VanDerWaalsContact O-N 3.15Å; V585-K587 PolarHBondContact O-N 3.02Å
586	I	55.2	Low	63.4	Low	125 Å²	125	126.5 Å²	126.5	64%	0.641	67%	0.672	S	S	*	*			trans	-65.2	119.1	166.3	-55	175.1	0	0	0	105.6	L579 L584	L579-I586 HydrophobicContact CD1-CD1 4.13Å; L579-I586 HydrophobicContact CD2-CD1 4.38Å; L584-I586 VanDerWaalsContact C-N 3.26Å; L584-I586 PolarHBondContact O-N 2.81Å
587	K	48.9	Very low	63	Low	264 Å²	264	125.1 Å²	125.1	100%	1.148	68%	0.677	S	S	*	*			trans	-69	0	168.4	-132.1	-174.3	-173.4	-177.4	0	110.1	V585	V585-K587 PolarHBondContact O-N 3.02Å

Retrieved 587 of 587 residues in 226.2 ms (Link to these results)

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