A0A3Q0KUJ5_SCHMA Loading...

Glyco_hydro_5_C domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KUJ5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 221 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	33.8	Very low	40.5	Very low	227 Å²	227	100.5 Å²	100.5	100%	1.118	50%	0.498	S	S	*	.				0	103.9	0	-159	174.4	-79.6	0	0	104.4
2	T	37.4	Very low	40.7	Very low	114 Å²	114	102.6 Å²	102.6	70%	0.699	50%	0.502	S	S	*	.			trans	-97.1	103.6	-173.9	-37.2	0	0	0	0	106.2	F4	T2-F4 PolarHBondContact O-N 3.42Å
3	D	38.1	Very low	41.3	Very low	122 Å²	122	94.8 Å²	94.8	65%	0.652	47%	0.465	S	S	*	.			trans	-69.2	121.7	178.7	-67.1	-31.9	0	0	0	108.8	G56	D3-G56 WeakPolarHBondContact O-CA 3.32Å
4	F	39.1	Very low	41.7	Very low	162 Å²	162	88.4 Å²	88.4	71%	0.711	43%	0.434	S	S	*	.			trans	-86.7	119.7	173.2	-80.7	-92.4	0	0	0	108.8	T2 I6	T2-F4 PolarHBondContact O-N 3.42Å; F4-I6 PolarHBondContact O-N 3.08Å
5	V	40.3	Very low	41.8	Very low	39 Å²	39	87.2 Å²	87.2	24%	0.236	43%	0.427	C	S	.	.			trans	-80.1	99.2	164.4	177.7	0	0	0	0	106.9	C7 I50 V51 T54 G55	V5-C7 PolarHBondContact O-N 2.81Å; V5-I50 HydrophobicContact CG1-CG2 4.47Å; V5-V51 HydrophobicContact CB-CG2 4.15Å; V5-V51 HydrophobicContact CG1-CG2 4.36Å; V5-T54 WeakPolarHBondContact CG2-OG1 3.37Å; V5-G55 WeakPolarHBondContact CG2-O 3.22Å
6	I	45.2	Very low	41.8	Very low	129 Å²	129	89.1 Å²	89.1	66%	0.662	44%	0.438	S	S	*	.			trans	-72.4	101.2	170.8	-60.3	175.6	0	0	0	106.6	F4 R8 T61	F4-I6 PolarHBondContact O-N 3.08Å; I6-R8 PolarHBondContact O-N 3.13Å; I6-T61 HydrophobicContact CG2-CG2 4.03Å
7	C	38.9	Very low	41.9	Very low	21 Å²	21	90.8 Å²	90.8	14%	0.142	45%	0.449	C	S	.	.			trans	-87.2	97.5	172.1	-137.9	0	0	0	0	108.4	V5 I9 V47	V5-C7 PolarHBondContact O-N 2.81Å; C7-I9 PolarHBondContact O-N 3.38Å; C7-V47 HydrophobicContact CB-CG1 3.74Å; C7-V47 HydrophobicContact CB-CG2 4.22Å; C7-V47 WeakPolarHBondContact SG-CG2 3.06Å
8	R	39.4	Very low	42.2	Very low	164 Å²	164	86.3 Å²	86.3	62%	0.619	43%	0.428	S	S	*	.			trans	-77.2	82.3	170.3	-158.4	176.4	-167.3	-169.6	1.5	108.1	I6 I10 E62	I6-R8 PolarHBondContact O-N 3.13Å; R8-I10 HydrophobicContact CG-CG1 4.35Å; R8-E62 IonicContact CZ-OE1 3.21Å; R8-E62 IonicContact NE-OE1 2.84Å; R8-E62 PolarHBondContact NE-OE1 2.92Å; R8-E62 IonicContact NE-OE2 3.99Å; R8-E62 IonicContact NH2-OE1 2.72Å; R8-E62 PolarHBondContact NH2-OE1 2.84Å; R8-E62 IonicContact NH2-OE2 3.9Å
9	I	44.5	Very low	42.4	Very low	25 Å²	25	87.8 Å²	87.8	13%	0.128	44%	0.438	C	S	.	.			trans	-83.6	111.4	162.1	-60	162.4	0	0	0	105	C7 F11 T43 V47 L60	C7-I9 PolarHBondContact O-N 3.38Å; I9-F11 HydrophobicContact CG2-CB 4.42Å; I9-F11 HydrophobicContact CG2-CD2 4.02Å; I9-F11 PolarHBondContact O-N 3.25Å; I9-T43 HydrophobicContact CD1-CG2 3.39Å; I9-T43 HydrophobicContact CG1-CG2 4.09Å; I9-T43 HydrophobicContact CG2-CG2 3.76Å; I9-V47 HydrophobicContact CD1-CG2 3.31Å; I9-V47 HydrophobicContact CG1-CG2 3.97Å; I9-L60 HydrophobicContact CB-CD1 3.76Å; I9-L60 HydrophobicContact CD1-CD1 4.39Å; I9-L60 HydrophobicContact CG2-CD1 4.2Å; I9-L60 WeakPolarHBondContact O-CD1 3.47Å
10	I	42.2	Very low	42.3	Very low	82 Å²	82	91.6 Å²	91.6	42%	0.421	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	98.1	162.4	-55.7	178.6	0	0	0	104.7	R8 F12	R8-I10 HydrophobicContact CG-CG1 4.35Å; I10-F12 HydrophobicContact CB-CD2 4.44Å; I10-F12 HydrophobicContact CB-CE2 4.25Å; I10-F12 HydrophobicContact CG2-CD2 3.63Å; I10-F12 HydrophobicContact CG2-CE2 3.35Å; I10-F12 HydrophobicContact CG2-CG 4.45Å; I10-F12 HydrophobicContact CG2-CZ 3.96Å; I10-F12 PolarHBondContact O-N 3.35Å; I10-F12 VanDerWaalsContact O-N 3.16Å
11	F	47	Very low	42.1	Very low	21 Å²	21	90.2 Å²	90.2	9%	0.092	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	104.8	169.4	-141.5	-80.9	0	0	0	106.5	I9 P13 L35 L39 L40 T43 E62 F63 V83	I9-F11 HydrophobicContact CG2-CB 4.42Å; I9-F11 HydrophobicContact CG2-CD2 4.02Å; I9-F11 PolarHBondContact O-N 3.25Å; F11-P13 HydrophobicContact CD1-CB 3.88Å; F11-P13 HydrophobicContact CE1-CB 4.26Å; F11-P13 WeakPolarHBondContact O-CD 3.46Å; F11-L35 HydrophobicContact CE1-CD1 3.52Å; F11-L35 HydrophobicContact CZ-CD1 3.77Å; F11-L39 HydrophobicContact CZ-CB 4.4Å; F11-L40 HydrophobicContact CD2-CD2 4.12Å; F11-L40 HydrophobicContact CE1-CD2 3.98Å; F11-L40 HydrophobicContact CE2-CD2 3.44Å; F11-L40 VanDerWaalsContact CE2-CD2 3.44Å; F11-L40 HydrophobicContact CE2-CG 4.34Å; F11-L40 HydrophobicContact CZ-CD2 3.35Å; F11-L40 HydrophobicContact CZ-CG 3.91Å; F11-T43 HydrophobicContact CD2-CG2 4.32Å; F11-T43 HydrophobicContact CE2-CG2 4.19Å; F11-E62 PolarHBondContact N-O 3.38Å; F11-F63 HydrophobicContact CB-CB 4Å; F11-V83 HydrophobicContact CD1-CG2 4.48Å
12	F	43.2	Very low	42.5	Very low	125 Å²	125	86.3 Å²	86.3	55%	0.548	44%	0.44	S	S	.	.			trans	-83.5	95.2	159.9	-78.8	-84	0	0	0	105.2	I10 L16 L65	I10-F12 HydrophobicContact CB-CD2 4.44Å; I10-F12 HydrophobicContact CB-CE2 4.25Å; I10-F12 HydrophobicContact CG2-CD2 3.63Å; I10-F12 HydrophobicContact CG2-CE2 3.35Å; I10-F12 HydrophobicContact CG2-CG 4.45Å; I10-F12 HydrophobicContact CG2-CZ 3.96Å; I10-F12 PolarHBondContact O-N 3.35Å; I10-F12 VanDerWaalsContact O-N 3.16Å; F12-L16 HydrophobicContact CD1-CD1 4.27Å; F12-L65 HydrophobicContact CD1-CD1 3.71Å; F12-L65 HydrophobicContact CE1-CD1 4.28Å
13	P	47.5	Very low	42.9	Very low	2 Å²	2	87.3 Å²	87.3	1%	0.013	44%	0.437	C	S	.	.			trans	-71.3	161.6	-179.1	45.7	-45.5	0	0	0	107.3	F11 Q15 G64 L65 E79	F11-P13 HydrophobicContact CD1-CB 3.88Å; F11-P13 HydrophobicContact CE1-CB 4.26Å; F11-P13 WeakPolarHBondContact O-CD 3.46Å; P13-Q15 PolarHBondContact O-N 2.89Å; P13-G64 WeakPolarHBondContact CD-O 3.4Å; P13-G64 WeakPolarHBondContact CG-O 3.27Å; P13-L65 HydrophobicContact CG-CB 4.08Å; P13-E79 VanDerWaalsContact C-OE1 3.23Å; P13-E79 HydrophobicContact CB-CG 3.68Å; P13-E79 WeakPolarHBondContact CB-OE1 3.42Å; P13-E79 HydrophobicContact CG-CG 4.25Å
14	S	47.1	Very low	43.6	Very low	5 Å²	5	88.4 Å²	88.4	4%	0.035	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	2.9	-157.4	76.3	0	0	0	0	117.9	L16 L17 C18 E79	S14-L16 PolarHBondContact O-N 3.32Å; S14-L17 CarbonylContact O-C 3.51Å; S14-L17 WeakPolarHBondContact O-CA 3.29Å; S14-L17 PolarHBondContact O-N 3.28Å; S14-C18 WeakPolarHBondContact CB-SG 3.48Å; S14-C18 WeakPolarHBondContact O-CB 3.33Å; S14-C18 PolarHBondContact O-N 3.18Å; S14-C18 PolarHBondContact O-SG 3.05Å; S14-C18 VanDerWaalsContact O-SG 3.35Å; S14-C18 PolarHBondContact OG-SG 3.37Å; S14-C18 VanDerWaalsContact OG-SG 3.35Å; S14-E79 WeakPolarHBondContact CA-OE1 3.45Å; S14-E79 WeakPolarHBondContact CB-OE1 3.16Å; S14-E79 PolarHBondContact N-OE1 2.64Å; S14-E79 PolarHBondContact OG-OE1 2.72Å
15	Q	44	Very low	44.2	Very low	70 Å²	70	88 Å²	88	33%	0.327	44%	0.436	S	S	.	.	H	α-helix	trans	-54.2	-30.6	173.3	-74.2	-155.6	-2.3	0	0	113.2	P13 N19 L65 N76	P13-Q15 PolarHBondContact O-N 2.89Å; Q15-N19 VanDerWaalsContact O-CB 3.32Å; Q15-N19 WeakPolarHBondContact O-CB 3Å; Q15-N19 PolarHBondContact O-ND2 3.29Å; Q15-L65 PolarHBondContact NE2-O 2.82Å; Q15-N76 PolarHBondContact NE2-OD1 2.67Å
16	L	41.9	Very low	44.8	Very low	117 Å²	117	91.5 Å²	91.5	61%	0.613	45%	0.453	S	S	*	.	H	α-helix	trans	-77	-27.4	172.4	-88.3	152.4	0	0	0	113.9	F12 S14	F12-L16 HydrophobicContact CD1-CD1 4.27Å; S14-L16 PolarHBondContact O-N 3.32Å
17	L	42.7	Very low	45.1	Very low	118 Å²	118	86.7 Å²	86.7	62%	0.618	43%	0.429	S	S	*	.	H	α-helix	trans	-94.1	-28.6	-176.2	-76.3	160.5	0	0	0	113	S14 L39	S14-L17 CarbonylContact O-C 3.51Å; S14-L17 WeakPolarHBondContact O-CA 3.29Å; S14-L17 PolarHBondContact O-N 3.28Å; L17-L39 HydrophobicContact CD1-CD1 4.43Å
18	C	47.9	Very low	45.8	Very low	10 Å²	10	88.5 Å²	88.5	7%	0.068	44%	0.436	C	S	.	.	H	α-helix	trans	-100.9	-22.1	-172.1	-56.3	0	0	0	0	114	S14 Q20 C31	S14-C18 WeakPolarHBondContact CB-SG 3.48Å; S14-C18 WeakPolarHBondContact O-CB 3.33Å; S14-C18 PolarHBondContact O-N 3.18Å; S14-C18 PolarHBondContact O-SG 3.05Å; S14-C18 VanDerWaalsContact O-SG 3.35Å; S14-C18 PolarHBondContact OG-SG 3.37Å; S14-C18 VanDerWaalsContact OG-SG 3.35Å; C18-Q20 PolarHBondContact O-N 3.11Å; C18-C31 WeakPolarHBondContact CA-SG 3.41Å; C18-C31 HydrophobicContact CB-CB 3.76Å; C18-C31 WeakPolarHBondContact CB-SG 3.48Å; C18-C31 WeakPolarHBondContact SG-CB 3.29Å; C18-C31 CovalentContact SG-SG 2.01Å; C18-C31 PolarHBondContact SG-SG 3.22Å
19	N	45.5	Very low	46.6	Very low	115 Å²	115	88.3 Å²	88.3	62%	0.615	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	4.6	175.6	-78.3	-23.5	0	0	0	113.9	Q15	Q15-N19 VanDerWaalsContact O-CB 3.32Å; Q15-N19 WeakPolarHBondContact O-CB 3Å; Q15-N19 PolarHBondContact O-ND2 3.29Å
20	Q	40.4	Very low	47.1	Very low	164 Å²	164	92.1 Å²	92.1	77%	0.766	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	3	-179	-68.6	-160.6	-5.8	0	0	115	C18	C18-Q20 PolarHBondContact O-N 3.11Å
21	T	38	Very low	48	Very low	62 Å²	62	88.9 Å²	88.9	38%	0.38	44%	0.444	S	S	.	.			trans	-133.6	121.9	-172	44.9	0	0	0	0	112.2	E23 T27	T21-E23 PolarHBondContact O-N 3.09Å; T21-T27 HydrophobicContact CG2-CG2 3.92Å; T21-T27 VanDerWaalsContact OG1-CB 3.29Å; T21-T27 WeakPolarHBondContact OG1-CB 3.5Å; T21-T27 WeakPolarHBondContact OG1-CG2 3.42Å
22	T	42.9	Very low	48.8	Very low	146 Å²	146	89.2 Å²	89.2	90%	0.896	45%	0.446	S	S	*	.	S	Bend	trans	-73	4.4	-178.5	45.6	0	0	0	0	114.9
23	E	45.8	Very low	49.6	Very low	134 Å²	134	85.7 Å²	85.7	63%	0.626	44%	0.437	S	S	*	.			trans	-98.5	90.5	171.9	-74.3	-174.4	172.6	0	0	109.3	T21 E25 T27	T21-E23 PolarHBondContact O-N 3.09Å; E23-E25 PolarHBondContact O-N 2.66Å; E23-T27 VanDerWaalsContact O-CB 3.28Å; E23-T27 WeakPolarHBondContact O-CB 3.36Å; E23-T27 PolarHBondContact O-N 3.1Å; E23-T27 PolarHBondContact O-OG1 3.14Å
24	F	52.7	Low	50.4	Low	146 Å²	146	87.8 Å²	87.8	64%	0.64	45%	0.452	S	S	*	.	H	α-helix	trans	-66.2	-35.1	-158.4	-123	-100.3	0	0	0	115.1	Q28	F24-Q28 VanDerWaalsContact CD1-NE2 3.27Å; F24-Q28 VanDerWaalsContact O-CB 3.31Å; F24-Q28 WeakPolarHBondContact O-CB 2.95Å; F24-Q28 WeakPolarHBondContact O-CG 3.28Å; F24-Q28 PolarHBondContact O-NE2 2.93Å; F24-Q28 PolarHBondContact O-OE1 3.41Å
25	E	52.3	Low	51.4	Low	152 Å²	152	87.6 Å²	87.6	71%	0.71	45%	0.451	S	S	*	.	H	α-helix	trans	-92.6	-52.8	-174.2	-69.7	179.3	169.4	0	0	113.2	E23 T27 Q28 F29	E23-E25 PolarHBondContact O-N 2.66Å; E25-T27 VanDerWaalsContact C-N 3.3Å; E25-T27 PolarHBondContact O-N 2.88Å; E25-Q28 PolarHBondContact O-N 2.82Å; E25-F29 WeakPolarHBondContact O-CD2 3.36Å; E25-F29 PolarHBondContact O-N 3.43Å
26	I	52.5	Low	52.5	Low	114 Å²	114	86.6 Å²	86.6	59%	0.585	45%	0.448	S	S	*	.	H	α-helix	trans	-62.5	-42	-177.5	-64.3	174.7	0	0	0	110.4	F29 L30	I26-F29 PolarHBondContact O-N 3.03Å; I26-L30 HydrophobicContact CG2-CD1 3.87Å; I26-L30 HydrophobicContact CG2-CG 4.38Å; I26-L30 WeakPolarHBondContact O-CB 3.06Å; I26-L30 WeakPolarHBondContact O-CG 3.16Å; I26-L30 PolarHBondContact O-N 2.78Å
27	T	51	Low	53.7	Low	28 Å²	28	87.2 Å²	87.2	17%	0.172	45%	0.447	C	S	.	.	H	α-helix	trans	-71.1	-34.8	-177.8	-34.9	0	0	0	0	111.8	T21 E23 E25 L30 C31	T21-T27 HydrophobicContact CG2-CG2 3.92Å; T21-T27 VanDerWaalsContact OG1-CB 3.29Å; T21-T27 WeakPolarHBondContact OG1-CB 3.5Å; T21-T27 WeakPolarHBondContact OG1-CG2 3.42Å; E23-T27 VanDerWaalsContact O-CB 3.28Å; E23-T27 WeakPolarHBondContact O-CB 3.36Å; E23-T27 PolarHBondContact O-N 3.1Å; E23-T27 PolarHBondContact O-OG1 3.14Å; E25-T27 VanDerWaalsContact C-N 3.3Å; E25-T27 PolarHBondContact O-N 2.88Å; T27-L30 PolarHBondContact O-N 2.95Å; T27-C31 WeakPolarHBondContact O-CB 2.96Å; T27-C31 PolarHBondContact O-N 3.27Å
28	Q	54.5	Low	55.3	Low	59 Å²	59	87.3 Å²	87.3	28%	0.276	45%	0.448	S	S	.	.	H	α-helix	trans	-63.2	-45.5	173.5	-79.1	176.4	3.2	0	0	112	F24 E25 C31 L32 I75	F24-Q28 VanDerWaalsContact CD1-NE2 3.27Å; F24-Q28 VanDerWaalsContact O-CB 3.31Å; F24-Q28 WeakPolarHBondContact O-CB 2.95Å; F24-Q28 WeakPolarHBondContact O-CG 3.28Å; F24-Q28 PolarHBondContact O-NE2 2.93Å; F24-Q28 PolarHBondContact O-OE1 3.41Å; E25-Q28 PolarHBondContact O-N 2.82Å; Q28-C31 WeakPolarHBondContact O-CB 3.4Å; Q28-C31 PolarHBondContact O-N 2.85Å; Q28-L32 WeakPolarHBondContact O-CB 3.43Å; Q28-L32 WeakPolarHBondContact O-CG 3.2Å; Q28-L32 PolarHBondContact O-N 3.29Å; Q28-I75 HydrophobicContact CG-CD1 4.46Å
29	F	54.6	Low	56.9	Low	159 Å²	159	90.4 Å²	90.4	70%	0.697	46%	0.463	S	S	*	.	H	α-helix	trans	-61.7	-44.1	175.7	-89.8	-76.4	0	0	0	112.6	E25 I26 C31 S33	E25-F29 WeakPolarHBondContact O-CD2 3.36Å; E25-F29 PolarHBondContact O-N 3.43Å; I26-F29 PolarHBondContact O-N 3.03Å; F29-C31 VanDerWaalsContact C-N 3.29Å; F29-C31 PolarHBondContact O-N 2.83Å; F29-S33 VanDerWaalsContact O-CB 3.31Å; F29-S33 WeakPolarHBondContact O-CB 3.37Å; F29-S33 PolarHBondContact O-N 2Å; F29-S33 PolarHBondContact O-OG 2.86Å
30	L	56.3	Low	58.7	Low	106 Å²	106	84.9 Å²	84.9	56%	0.555	43%	0.434	S	S	*	.	H	α-helix	trans	-63.4	-38.5	175.3	-72.6	172.4	0	0	0	111.5	I26 T27 S33 S34	I26-L30 HydrophobicContact CG2-CD1 3.87Å; I26-L30 HydrophobicContact CG2-CG 4.38Å; I26-L30 WeakPolarHBondContact O-CB 3.06Å; I26-L30 WeakPolarHBondContact O-CG 3.16Å; I26-L30 PolarHBondContact O-N 2.78Å; T27-L30 PolarHBondContact O-N 2.95Å; L30-S33 WeakPolarHBondContact CA-OG 3.48Å; L30-S33 PolarHBondContact O-OG 3.15Å; L30-S34 WeakPolarHBondContact O-CB 3.4Å; L30-S34 PolarHBondContact O-N 2.87Å; L30-S34 PolarHBondContact O-OG 3.26Å; L30-S34 VanDerWaalsContact O-OG 3.1Å
31	C	61.5	Low	60.8	Low	13 Å²	13	80.4 Å²	80.4	9%	0.088	42%	0.415	C	S	.	.	H	α-helix	trans	-63.9	-53.8	176.7	-115.7	0	0	0	0	112.4	C18 T27 Q28 F29 S33 S34 L35	C18-C31 WeakPolarHBondContact CA-SG 3.41Å; C18-C31 HydrophobicContact CB-CB 3.76Å; C18-C31 WeakPolarHBondContact CB-SG 3.48Å; C18-C31 WeakPolarHBondContact SG-CB 3.29Å; C18-C31 CovalentContact SG-SG 2.01Å; C18-C31 PolarHBondContact SG-SG 3.22Å; T27-C31 WeakPolarHBondContact O-CB 2.96Å; T27-C31 PolarHBondContact O-N 3.27Å; Q28-C31 WeakPolarHBondContact O-CB 3.4Å; Q28-C31 PolarHBondContact O-N 2.85Å; F29-C31 VanDerWaalsContact C-N 3.29Å; F29-C31 PolarHBondContact O-N 2.83Å; C31-S33 VanDerWaalsContact C-N 3.33Å; C31-S33 PolarHBondContact O-N 2.89Å; C31-S34 PolarHBondContact O-N 2.98Å; C31-S34 PolarHBondContact O-OG 2.82Å; C31-L35 VanDerWaalsContact O-CB 3.31Å; C31-L35 WeakPolarHBondContact O-CB 3.46Å; C31-L35 PolarHBondContact O-N 2.84Å
32	L	63.4	Low	63.1	Low	28 Å²	28	84.7 Å²	84.7	15%	0.147	43%	0.425	C	S	.	.	H	α-helix	trans	-59.7	-44.2	178.7	-73	171.1	0	0	0	111.2	Q28 S34 L35 D36 I75 V78	Q28-L32 WeakPolarHBondContact O-CB 3.43Å; Q28-L32 WeakPolarHBondContact O-CG 3.2Å; Q28-L32 PolarHBondContact O-N 3.29Å; L32-S34 PolarHBondContact O-N 2.85Å; L32-L35 WeakPolarHBondContact O-CB 3.3Å; L32-L35 PolarHBondContact O-N 2.86Å; L32-D36 WeakPolarHBondContact O-CB 3.43Å; L32-D36 PolarHBondContact O-N 2.82Å; L32-I75 HydrophobicContact CD1-CD1 4.04Å; L32-I75 HydrophobicContact CD2-CD1 3.68Å; L32-I75 HydrophobicContact CG-CD1 3.78Å; L32-V78 HydrophobicContact CD1-CB 4.43Å; L32-V78 HydrophobicContact CD1-CG1 3.94Å; L32-V78 HydrophobicContact CD2-CB 4.12Å; L32-V78 HydrophobicContact CD2-CG1 3.61Å; L32-V78 HydrophobicContact CG-CG1 4.29Å
33	S	59.7	Low	65.2	Low	51 Å²	51	79.1 Å²	79.1	36%	0.357	39%	0.391	S	S	.	.	H	α-helix	trans	-65.4	-39.2	176.3	59.2	0	0	0	0	112.8	F29 L30 C31 H37	F29-S33 VanDerWaalsContact O-CB 3.31Å; F29-S33 WeakPolarHBondContact O-CB 3.37Å; F29-S33 PolarHBondContact O-N 2Å; F29-S33 PolarHBondContact O-OG 2.86Å; L30-S33 WeakPolarHBondContact CA-OG 3.48Å; L30-S33 PolarHBondContact O-OG 3.15Å; C31-S33 VanDerWaalsContact C-N 3.33Å; C31-S33 PolarHBondContact O-N 2.89Å; S33-H37 VanDerWaalsContact O-CB 3.27Å; S33-H37 WeakPolarHBondContact O-CB 3.31Å; S33-H37 PolarHBondContact O-CD2 3.05Å; S33-H37 PolarHBondContact O-N 2.77Å
34	S	63.6	Low	67.2	Low	47 Å²	47	72.9 Å²	72.9	33%	0.329	36%	0.362	S	S	.	.	H	α-helix	trans	-69.1	-36.7	176.1	71.1	0	0	0	0	112.6	L30 C31 L32 L38 L39	L30-S34 WeakPolarHBondContact O-CB 3.4Å; L30-S34 PolarHBondContact O-N 2.87Å; L30-S34 PolarHBondContact O-OG 3.26Å; L30-S34 VanDerWaalsContact O-OG 3.1Å; C31-S34 PolarHBondContact O-N 2.98Å; C31-S34 PolarHBondContact O-OG 2.82Å; L32-S34 PolarHBondContact O-N 2.85Å; S34-L38 VanDerWaalsContact O-CB 3.32Å; S34-L38 WeakPolarHBondContact O-CB 3.33Å; S34-L38 PolarHBondContact O-N 2.72Å; S34-L38 VanDerWaalsContact O-N 3.08Å; S34-L39 PolarHBondContact O-N 2.82Å; S34-L39 VanDerWaalsContact O-N 3.1Å
35	L	69.3	Low	69	Low	1 Å²	1	73.3 Å²	73.3	1%	0.005	36%	0.363	C	S	.	.	I	π-helix	trans	-61	-54.9	173.8	176.3	64.5	0	0	0	110.4	F11 C31 L32 L39 L40 E79	F11-L35 HydrophobicContact CE1-CD1 3.52Å; F11-L35 HydrophobicContact CZ-CD1 3.77Å; C31-L35 VanDerWaalsContact O-CB 3.31Å; C31-L35 WeakPolarHBondContact O-CB 3.46Å; C31-L35 PolarHBondContact O-N 2.84Å; L32-L35 WeakPolarHBondContact O-CB 3.3Å; L32-L35 PolarHBondContact O-N 2.86Å; L35-L39 HydrophobicContact CD1-CB 4.47Å; L35-L39 HydrophobicContact CD1-CD1 4.45Å; L35-L39 PolarHBondContact O-N 2.83Å; L35-L40 HydrophobicContact CD1-CD1 4.48Å; L35-L40 HydrophobicContact CD1-CG 4.24Å; L35-L40 HydrophobicContact CG-CD1 4.19Å; L35-L40 HydrophobicContact CG-CG 4.42Å; L35-L40 WeakPolarHBondContact O-CB 3.4Å; L35-L40 WeakPolarHBondContact O-CG 3.49Å; L35-L40 PolarHBondContact O-N 3.42Å; L35-E79 HydrophobicContact CD2-CB 4.43Å; L35-E79 HydrophobicContact CD2-CG 3.96Å
36	D	66.4	Low	70.7	Confident	49 Å²	49	69.5 Å²	69.5	26%	0.262	35%	0.348	S	S	.	.	I	π-helix	trans	-65.4	-52.4	-176.5	-77.2	5.8	0	0	0	112.5	L32 N41 A82	L32-D36 WeakPolarHBondContact O-CB 3.43Å; L32-D36 PolarHBondContact O-N 2.82Å; D36-N41 PolarHBondContact O-ND2 3.31Å; D36-A82 WeakPolarHBondContact OD1-CB 3.32Å
37	H	67.2	Low	72.4	Confident	130 Å²	130	64.3 Å²	64.3	60%	0.602	32%	0.322	S	S	*	.	I	π-helix	trans	-83.1	-33.2	-169.3	-73	-71.6	0	0	0	113.4	S33 N41	S33-H37 VanDerWaalsContact O-CB 3.27Å; S33-H37 WeakPolarHBondContact O-CB 3.31Å; S33-H37 PolarHBondContact O-CD2 3.05Å; S33-H37 PolarHBondContact O-N 2.77Å; H37-N41 WeakPolarHBondContact O-CB 3.24Å; H37-N41 PolarHBondContact O-ND2 2.8Å
38	L	75.7	Confident	74.2	Confident	120 Å²	120	69.3 Å²	69.3	63%	0.628	34%	0.337	S	S	*	.	I	π-helix	trans	-107.3	-61.1	-172.5	-59.6	172.4	0	0	0	111.2	S34 Y42	S34-L38 VanDerWaalsContact O-CB 3.32Å; S34-L38 WeakPolarHBondContact O-CB 3.33Å; S34-L38 PolarHBondContact O-N 2.72Å; S34-L38 VanDerWaalsContact O-N 3.08Å; L38-Y42 WeakPolarHBondContact O-CB 3.28Å; L38-Y42 PolarHBondContact O-N 3.07Å
39	L	81.2	Confident	75.9	Confident	74 Å²	74	69.5 Å²	69.5	39%	0.387	35%	0.345	S	S	.	.	I	π-helix	trans	-68.2	-50.9	-170.5	-66.8	175.2	0	0	0	112.1	F11 L17 S34 L35 Y42 T43	F11-L39 HydrophobicContact CZ-CB 4.4Å; L17-L39 HydrophobicContact CD1-CD1 4.43Å; S34-L39 PolarHBondContact O-N 2.82Å; S34-L39 VanDerWaalsContact O-N 3.1Å; L35-L39 HydrophobicContact CD1-CB 4.47Å; L35-L39 HydrophobicContact CD1-CD1 4.45Å; L35-L39 PolarHBondContact O-N 2.83Å; L39-Y42 PolarHBondContact O-N 2.85Å; L39-T43 VanDerWaalsContact O-CB 3.25Å; L39-T43 WeakPolarHBondContact O-CB 3.46Å; L39-T43 PolarHBondContact O-N 2.89Å; L39-T43 PolarHBondContact O-OG1 2.91Å
40	L	84.2	Confident	77.5	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	33%	0.329	C	S	.	.	I	π-helix	trans	-64.1	-49.6	-179.9	-72.9	173.1	0	0	0	111.2	F11 L35 Y42 T43 F44 A82 V83 A86	F11-L40 HydrophobicContact CD2-CD2 4.12Å; F11-L40 HydrophobicContact CE1-CD2 3.98Å; F11-L40 HydrophobicContact CE2-CD2 3.44Å; F11-L40 VanDerWaalsContact CE2-CD2 3.44Å; F11-L40 HydrophobicContact CE2-CG 4.34Å; F11-L40 HydrophobicContact CZ-CD2 3.35Å; F11-L40 HydrophobicContact CZ-CG 3.91Å; L35-L40 HydrophobicContact CD1-CD1 4.48Å; L35-L40 HydrophobicContact CD1-CG 4.24Å; L35-L40 HydrophobicContact CG-CD1 4.19Å; L35-L40 HydrophobicContact CG-CG 4.42Å; L35-L40 WeakPolarHBondContact O-CB 3.4Å; L35-L40 WeakPolarHBondContact O-CG 3.49Å; L35-L40 PolarHBondContact O-N 3.42Å; L40-Y42 VanDerWaalsContact C-N 3.34Å; L40-Y42 PolarHBondContact O-N 2.77Å; L40-T43 PolarHBondContact O-N 2.94Å; L40-F44 HydrophobicContact CD2-CE2 4.2Å; L40-F44 VanDerWaalsContact O-CD2 3.27Å; L40-F44 WeakPolarHBondContact O-CD2 3.42Å; L40-F44 PolarHBondContact O-N 3.31Å; L40-A82 HydrophobicContact CD1-CB 3.93Å; L40-V83 HydrophobicContact CD1-CG2 4.48Å; L40-V83 HydrophobicContact CD2-CG2 4.03Å; L40-A86 HydrophobicContact CB-CB 4.37Å; L40-A86 HydrophobicContact CD1-CB 4.38Å
41	N	85	Confident	79	Confident	70 Å²	70	61.1 Å²	61.1	37%	0.374	31%	0.308	S	S	.	.	H	α-helix	trans	-60	-43	178	-75.5	-28.4	0	0	0	112.5	D36 H37 K45	D36-N41 PolarHBondContact O-ND2 3.31Å; H37-N41 WeakPolarHBondContact O-CB 3.24Å; H37-N41 PolarHBondContact O-ND2 2.8Å; N41-K45 WeakPolarHBondContact O-CB 3.48Å; N41-K45 PolarHBondContact O-N 2.84Å
42	Y	85.5	Confident	80.4	Confident	152 Å²	152	67.1 Å²	67.1	60%	0.596	34%	0.335	S	S	*	.	H	α-helix	trans	-60.9	-48.3	175.8	179.8	-98.1	0	0	0	110.7	L38 L39 L40 K45 N46	L38-Y42 WeakPolarHBondContact O-CB 3.28Å; L38-Y42 PolarHBondContact O-N 3.07Å; L39-Y42 PolarHBondContact O-N 2.85Å; L40-Y42 VanDerWaalsContact C-N 3.34Å; L40-Y42 PolarHBondContact O-N 2.77Å; Y42-K45 PolarHBondContact O-N 2.88Å; Y42-N46 VanDerWaalsContact O-CB 3.31Å; Y42-N46 WeakPolarHBondContact O-CB 3.31Å; Y42-N46 PolarHBondContact O-N 3.24Å
43	T	86.2	Confident	81.6	Confident	28 Å²	28	70.4 Å²	70.4	17%	0.172	36%	0.361	C	S	.	.	H	α-helix	trans	-58.6	-56.1	-177.9	-61.3	0	0	0	0	111.7	I9 F11 L39 L40 K45 N46 V47	I9-T43 HydrophobicContact CD1-CG2 3.39Å; I9-T43 HydrophobicContact CG1-CG2 4.09Å; I9-T43 HydrophobicContact CG2-CG2 3.76Å; F11-T43 HydrophobicContact CD2-CG2 4.32Å; F11-T43 HydrophobicContact CE2-CG2 4.19Å; L39-T43 VanDerWaalsContact O-CB 3.25Å; L39-T43 WeakPolarHBondContact O-CB 3.46Å; L39-T43 PolarHBondContact O-N 2.89Å; L39-T43 PolarHBondContact O-OG1 2.91Å; L40-T43 PolarHBondContact O-N 2.94Å; T43-K45 VanDerWaalsContact C-N 3.32Å; T43-K45 PolarHBondContact O-N 2.87Å; T43-N46 PolarHBondContact O-N 3.41Å; T43-N46 VanDerWaalsContact O-N 3.16Å; T43-V47 PolarHBondContact O-N 2.98Å; T43-V47 VanDerWaalsContact O-N 3.09Å
44	F	89	Confident	83.1	Confident	4 Å²	4	72.2 Å²	72.2	2%	0.018	37%	0.369	C	S	.	.	H	α-helix	trans	-63.1	-37.3	178.9	-78	-74.2	0	0	0	112.4	L40 R48 L60 A86 A87 N90 E92	L40-F44 HydrophobicContact CD2-CE2 4.2Å; L40-F44 VanDerWaalsContact O-CD2 3.27Å; L40-F44 WeakPolarHBondContact O-CD2 3.42Å; L40-F44 PolarHBondContact O-N 3.31Å; F44-R48 WeakPolarHBondContact O-CB 3.48Å; F44-R48 PolarHBondContact O-N 2.81Å; F44-L60 HydrophobicContact CZ-CD2 4.45Å; F44-A86 HydrophobicContact CD2-CB 3.84Å; F44-A86 HydrophobicContact CE2-CB 3.4Å; F44-A86 VanDerWaalsContact CE2-CB 3.4Å; F44-A86 HydrophobicContact CZ-CB 4.2Å; F44-A87 HydrophobicContact CE1-CB 4.36Å; F44-A87 HydrophobicContact CZ-CB 4.02Å; F44-N90 HydrophobicContact CB-CB 4.37Å; F44-N90 WeakPolarHBondContact CB-ND2 3.27Å; F44-N90 HydrophobicContact CD1-CB 3.76Å; F44-N90 HydrophobicContact CE1-CB 4.36Å; F44-N90 HydrophobicContact CG-CB 4.2Å; F44-N90 WeakPolarHBondContact CG-ND2 3.48Å; F44-E92 HydrophobicContact CD1-CB 4.28Å; F44-E92 VanDerWaalsContact CD1-OE2 3.32Å; F44-E92 WeakPolarHBondContact CD1-OE2 3.2Å; F44-E92 HydrophobicContact CE1-CB 3.84Å; F44-E92 HydrophobicContact CE1-CG 4.06Å
45	K	89.6	Confident	84.2	Confident	154 Å²	154	71.6 Å²	71.6	67%	0.67	37%	0.371	S	S	*	.	H	α-helix	trans	-64.9	-39.8	175	-175.7	179.7	179.7	-177.3	0	111.9	N41 Y42 T43 R48 S49	N41-K45 WeakPolarHBondContact O-CB 3.48Å; N41-K45 PolarHBondContact O-N 2.84Å; Y42-K45 PolarHBondContact O-N 2.88Å; T43-K45 VanDerWaalsContact C-N 3.32Å; T43-K45 PolarHBondContact O-N 2.87Å; K45-R48 PolarHBondContact O-N 2.92Å; K45-S49 WeakPolarHBondContact O-CB 3.49Å; K45-S49 PolarHBondContact O-N 2.89Å
46	N	88.7	Confident	85	Confident	73 Å²	73	73.2 Å²	73.2	39%	0.39	39%	0.387	S	S	.	.	H	α-helix	trans	-66.3	-46	-179	-142.4	10.8	0	0	0	110.6	Y42 T43 R48 S49 I50	Y42-N46 VanDerWaalsContact O-CB 3.31Å; Y42-N46 WeakPolarHBondContact O-CB 3.31Å; Y42-N46 PolarHBondContact O-N 3.24Å; T43-N46 PolarHBondContact O-N 3.41Å; T43-N46 VanDerWaalsContact O-N 3.16Å; N46-R48 PolarHBondContact O-N 3.36Å; N46-S49 WeakPolarHBondContact O-CB 3.14Å; N46-S49 PolarHBondContact O-N 2.97Å; N46-S49 VanDerWaalsContact O-N 3.14Å; N46-I50 WeakPolarHBondContact O-CG1 3.45Å; N46-I50 PolarHBondContact O-N 3.08Å
47	V	86.9	Confident	85.8	Confident	5 Å²	5	72 Å²	72	3%	0.03	39%	0.387	C	S	.	.	H	α-helix	trans	-63.1	-42.6	175.4	-179	0	0	0	0	111.7	C7 I9 T43 S49 I50 V51 R58	C7-V47 HydrophobicContact CB-CG1 3.74Å; C7-V47 HydrophobicContact CB-CG2 4.22Å; C7-V47 WeakPolarHBondContact SG-CG2 3.06Å; I9-V47 HydrophobicContact CD1-CG2 3.31Å; I9-V47 HydrophobicContact CG1-CG2 3.97Å; T43-V47 PolarHBondContact O-N 2.98Å; T43-V47 VanDerWaalsContact O-N 3.09Å; V47-S49 VanDerWaalsContact C-N 3.28Å; V47-S49 PolarHBondContact O-N 3.46Å; V47-I50 PolarHBondContact O-N 2.82Å; V47-V51 PolarHBondContact O-N 3.39Å; V47-R58 HydrophobicContact CG1-CB 4.29Å; V47-R58 HydrophobicContact CG1-CG 3.73Å
48	R	89.3	Confident	86.8	Confident	132 Å²	132	68.7 Å²	68.7	50%	0.498	37%	0.369	S	S	.	.	H	α-helix	trans	-57.1	-43.2	173.2	-175.8	178.6	178.6	170.7	2.6	111.6	F44 K45 N46 V51 Q52	F44-R48 WeakPolarHBondContact O-CB 3.48Å; F44-R48 PolarHBondContact O-N 2.81Å; K45-R48 PolarHBondContact O-N 2.92Å; N46-R48 PolarHBondContact O-N 3.36Å; R48-V51 PolarHBondContact O-N 3.46Å; R48-Q52 WeakPolarHBondContact O-CB 3.27Å; R48-Q52 WeakPolarHBondContact O-CG 3.23Å; R48-Q52 PolarHBondContact O-N 2.86Å
49	S	90.4	Very high	87.5	Confident	64 Å²	64	66.9 Å²	66.9	45%	0.448	36%	0.356	S	S	.	.	H	α-helix	trans	-65.7	-38.9	178.3	-171.1	0	0	0	0	112.6	K45 N46 V47 S53	K45-S49 WeakPolarHBondContact O-CB 3.49Å; K45-S49 PolarHBondContact O-N 2.89Å; N46-S49 WeakPolarHBondContact O-CB 3.14Å; N46-S49 PolarHBondContact O-N 2.97Å; N46-S49 VanDerWaalsContact O-N 3.14Å; V47-S49 VanDerWaalsContact C-N 3.28Å; V47-S49 PolarHBondContact O-N 3.46Å; S49-S53 PolarHBondContact O-N 2.88Å
50	I	88.1	Confident	87.8	Confident	68 Å²	68	63.5 Å²	63.5	35%	0.349	34%	0.339	S	S	.	.	H	α-helix	trans	-64.5	-51.2	175.9	-67.6	165.5	0	0	0	109.4	V5 N46 V47 Q52 S53 T54	V5-I50 HydrophobicContact CG1-CG2 4.47Å; N46-I50 WeakPolarHBondContact O-CG1 3.45Å; N46-I50 PolarHBondContact O-N 3.08Å; V47-I50 PolarHBondContact O-N 2.82Å; I50-Q52 VanDerWaalsContact C-N 3.27Å; I50-Q52 PolarHBondContact O-N 3Å; I50-S53 PolarHBondContact O-N 3.47Å; I50-S53 PolarHBondContact O-OG 2.99Å; I50-T54 HydrophobicContact CG2-CG2 4.24Å; I50-T54 PolarHBondContact O-N 3.14Å; I50-T54 PolarHBondContact O-OG1 3.32Å
51	V	88.3	Confident	87.9	Confident	21 Å²	21	65.1 Å²	65.1	13%	0.127	35%	0.348	C	S	.	.	H	α-helix	trans	-64.5	-30.8	179.9	168.9	0	0	0	0	112.8	V5 V47 R48 S53 G55 G56 R58	V5-V51 HydrophobicContact CB-CG2 4.15Å; V5-V51 HydrophobicContact CG1-CG2 4.36Å; V47-V51 PolarHBondContact O-N 3.39Å; R48-V51 PolarHBondContact O-N 3.46Å; V51-S53 VanDerWaalsContact C-N 3.27Å; V51-S53 PolarHBondContact O-N 3.42Å; V51-G55 CarbonylContact O-C 3.51Å; V51-G55 WeakPolarHBondContact O-CA 3.38Å; V51-G55 PolarHBondContact O-N 3.16Å; V51-G56 WeakPolarHBondContact CG1-O 3.42Å; V51-R58 HydrophobicContact CB-CG 4.01Å; V51-R58 HydrophobicContact CG1-CG 4.23Å; V51-R58 HydrophobicContact CG2-CG 3.44Å; V51-R58 VanDerWaalsContact CG2-CG 3.44Å
52	Q	89.5	Confident	87.7	Confident	138 Å²	138	62.7 Å²	62.7	65%	0.645	34%	0.335	S	S	*	.	H	α-helix	trans	-63.7	-31.4	171.8	-79.8	173.1	-20.3	0	0	113	R48 I50	R48-Q52 WeakPolarHBondContact O-CB 3.27Å; R48-Q52 WeakPolarHBondContact O-CG 3.23Å; R48-Q52 PolarHBondContact O-N 2.86Å; I50-Q52 VanDerWaalsContact C-N 3.27Å; I50-Q52 PolarHBondContact O-N 3Å
53	S	90.3	Very high	87.7	Confident	98 Å²	98	55.6 Å²	55.6	69%	0.685	31%	0.307	S	S	*	.	H	α-helix	trans	-92.2	-32.9	-179.5	67.4	0	0	0	0	113.4	S49 I50 V51	S49-S53 PolarHBondContact O-N 2.88Å; I50-S53 PolarHBondContact O-N 3.47Å; I50-S53 PolarHBondContact O-OG 2.99Å; V51-S53 VanDerWaalsContact C-N 3.27Å; V51-S53 PolarHBondContact O-N 3.42Å
54	T	90.4	Very high	87.4	Confident	88 Å²	88	54.5 Å²	54.5	54%	0.54	30%	0.301	S	S	.	.	H	α-helix	trans	-99	-17.4	-176.8	59.9	0	0	0	0	113.7	V5 I50	V5-T54 WeakPolarHBondContact CG2-OG1 3.37Å; I50-T54 HydrophobicContact CG2-CG2 4.24Å; I50-T54 PolarHBondContact O-N 3.14Å; I50-T54 PolarHBondContact O-OG1 3.32Å
55	G	87.6	Confident	86.8	Confident	35 Å²	35	58 Å²	58	36%	0.361	32%	0.32	S	S	.	.			trans	76.1	-178.4	-163.7	0	0	0	0	0	112.5	V5 V51	V5-G55 WeakPolarHBondContact CG2-O 3.22Å; V51-G55 CarbonylContact O-C 3.51Å; V51-G55 WeakPolarHBondContact O-CA 3.38Å; V51-G55 PolarHBondContact O-N 3.16Å
56	G	85.7	Confident	86.3	Confident	34 Å²	34	50.7 Å²	50.7	35%	0.351	29%	0.288	S	S	.	.			trans	101.6	-178	173.6	0	0	0	0	0	116.4	D3 V51	D3-G56 WeakPolarHBondContact O-CA 3.32Å; V51-G56 WeakPolarHBondContact CG1-O 3.42Å
57	G	83.6	Confident	86	Confident	25 Å²	25	49.6 Å²	49.6	26%	0.258	28%	0.282	S	S	.	.			trans	-87.4	170.5	174.4	0	0	0	0	0	112.6
58	R	88	Confident	85.8	Confident	60 Å²	60	49.4 Å²	49.4	23%	0.226	28%	0.28	C	S	.	.			trans	-126.2	138.1	171.4	-64.3	-177.9	-68.6	140.6	1.3	109.2	V47 V51 N90 E92	V47-R58 HydrophobicContact CG1-CB 4.29Å; V47-R58 HydrophobicContact CG1-CG 3.73Å; V51-R58 HydrophobicContact CB-CG 4.01Å; V51-R58 HydrophobicContact CG1-CG 4.23Å; V51-R58 HydrophobicContact CG2-CG 3.44Å; V51-R58 VanDerWaalsContact CG2-CG 3.44Å; R58-N90 PolarHBondContact NH2-O 3.38Å; R58-E92 HydrophobicContact CB-CG 4.06Å; R58-E92 IonicContact CZ-OE2 3.66Å; R58-E92 IonicContact NE-OE2 4Å; R58-E92 IonicContact NH1-OE2 2.93Å; R58-E92 PolarHBondContact NH1-OE2 2.91Å
59	F	89.1	Confident	85.3	Confident	82 Å²	82	47 Å²	47	36%	0.36	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	117.9	-178.6	-165.4	-80	0	0	0	109	T61 S93 T95	F59-T61 HydrophobicContact CD1-CG2 3.77Å; F59-T61 HydrophobicContact CE1-CG2 4.42Å; F59-T61 PolarHBondContact O-N 3.48Å; F59-S93 CarbonylContact C-O 3.46Å; F59-S93 WeakPolarHBondContact CA-O 3.46Å; F59-S93 VanDerWaalsContact CD2-CB 3.45Å; F59-T95 HydrophobicContact CE1-CG2 3.84Å; F59-T95 HydrophobicContact CZ-CG2 3.86Å
60	L	88.1	Confident	84.6	Confident	3 Å²	3	45.1 Å²	45.1	2%	0.016	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	89.7	176	177.2	62.8	0	0	0	109.2	I9 F44 E62 F63 V83 S93 W94 T95	I9-L60 HydrophobicContact CB-CD1 3.76Å; I9-L60 HydrophobicContact CD1-CD1 4.39Å; I9-L60 HydrophobicContact CG2-CD1 4.2Å; I9-L60 WeakPolarHBondContact O-CD1 3.47Å; F44-L60 HydrophobicContact CZ-CD2 4.45Å; L60-E62 PolarHBondContact O-N 2.93Å; L60-F63 HydrophobicContact CD2-CB 4.17Å; L60-F63 HydrophobicContact CD2-CD1 3.93Å; L60-F63 HydrophobicContact CD2-CG 4.24Å; L60-F63 HydrophobicContact CG-CD1 4.35Å; L60-V83 HydrophobicContact CD2-CG1 4Å; L60-S93 PolarHBondContact N-O 2.85Å; L60-W94 HydrophobicContact CB-CB 3.96Å; L60-W94 HydrophobicContact CD2-CB 4.17Å; L60-W94 HydrophobicContact CG-CB 4.31Å; L60-W94 CarbonylContact O-C 3.52Å; L60-W94 WeakPolarHBondContact O-CA 3.37Å; L60-T95 PolarHBondContact O-N 2.93Å
61	T	86.3	Confident	84.4	Confident	33 Å²	33	45.4 Å²	45.4	20%	0.202	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	-23.1	-173.9	56.6	0	0	0	0	113.6	I6 F59 T95	I6-T61 HydrophobicContact CG2-CG2 4.03Å; F59-T61 HydrophobicContact CD1-CG2 3.77Å; F59-T61 HydrophobicContact CE1-CG2 4.42Å; F59-T61 PolarHBondContact O-N 3.48Å; T61-T95 CarbonylContact C-O 3.55Å; T61-T95 WeakPolarHBondContact CA-OG1 3.35Å; T61-T95 PolarHBondContact O-OG1 3.34Å
62	E	81.7	Confident	84.1	Confident	20 Å²	20	47.8 Å²	47.8	9%	0.093	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	122.7	-175.3	-63.7	172.8	-148.2	0	0	111.3	R8 F11 L60 W97	R8-E62 IonicContact CZ-OE1 3.21Å; R8-E62 IonicContact NE-OE1 2.84Å; R8-E62 PolarHBondContact NE-OE1 2.92Å; R8-E62 IonicContact NE-OE2 3.99Å; R8-E62 IonicContact NH2-OE1 2.72Å; R8-E62 PolarHBondContact NH2-OE1 2.84Å; R8-E62 IonicContact NH2-OE2 3.9Å; F11-E62 PolarHBondContact N-O 3.38Å; L60-E62 PolarHBondContact O-N 2.93Å; E62-W97 HydrophobicContact CB-CB 4.36Å; E62-W97 HydrophobicContact CG-CE3 4.02Å
63	F	84.4	Confident	83.8	Confident	3 Å²	3	49.1 Å²	49.1	1%	0.013	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	145.1	157.9	73	-73.3	0	0	0	107.3	F11 L60 V83 L84 W94 T95 Y96 W97 F116	F11-F63 HydrophobicContact CB-CB 4Å; L60-F63 HydrophobicContact CD2-CB 4.17Å; L60-F63 HydrophobicContact CD2-CD1 3.93Å; L60-F63 HydrophobicContact CD2-CG 4.24Å; L60-F63 HydrophobicContact CG-CD1 4.35Å; F63-V83 HydrophobicContact CB-CG1 4.1Å; F63-V83 HydrophobicContact CD2-CB 4.13Å; F63-V83 HydrophobicContact CD2-CG1 3.63Å; F63-V83 HydrophobicContact CE2-CB 4.5Å; F63-V83 HydrophobicContact CE2-CG1 4.18Å; F63-V83 HydrophobicContact CG-CG1 3.82Å; F63-L84 HydrophobicContact CE1-CD2 4.42Å; F63-L84 HydrophobicContact CE2-CD2 4.1Å; F63-L84 HydrophobicContact CE2-CG 4.24Å; F63-L84 HydrophobicContact CZ-CD2 3.56Å; F63-L84 HydrophobicContact CZ-CG 4.2Å; F63-W94 HydrophobicContact CD1-CB 4.29Å; F63-W94 HydrophobicContact CE1-CB 3.9Å; F63-W94 AromaticContact CE1-CD2 3.82Å; F63-W94 HydrophobicContact CE1-CD2 3.82Å; F63-W94 AromaticContact CE1-CE3 3.5Å; F63-W94 HydrophobicContact CE1-CE3 3.5Å; F63-W94 VanDerWaalsContact CE1-CE3 3.5Å; F63-W94 HydrophobicContact CE1-CG 4.01Å; F63-W94 HydrophobicContact CE1-CZ3 4.28Å; F63-W94 HydrophobicContact CZ-CD2 4.16Å; F63-W94 AromaticContact CZ-CE3 3.85Å; F63-W94 HydrophobicContact CZ-CE3 3.85Å; F63-W94 HydrophobicContact CZ-CZ3 4.24Å; F63-T95 WeakPolarHBondContact CD1-O 3.35Å; F63-T95 PolarHBondContact N-O 3.28Å; F63-Y96 HydrophobicContact CD2-CD2 4.01Å; F63-Y96 HydrophobicContact CE1-CD2 4.29Å; F63-Y96 AromaticContact CE2-CD2 3.64Å; F63-Y96 HydrophobicContact CE2-CD2 3.64Å; F63-Y96 HydrophobicContact CE2-CE2 4.32Å; F63-Y96 AromaticContact CZ-CD2 3.78Å; F63-Y96 HydrophobicContact CZ-CD2 3.78Å; F63-Y96 HydrophobicContact CZ-CG 4.43Å; F63-Y96 CarbonylContact O-C 3.57Å; F63-Y96 WeakPolarHBondContact O-CA 3.44Å; F63-Y96 WeakPolarHBondContact O-CD2 2.96Å; F63-W97 PolarHBondContact O-N 3.37Å; F63-F116 HydrophobicContact CE2-CE1 4.02Å; F63-F116 HydrophobicContact CZ-CD1 4.44Å; F63-F116 AromaticContact CZ-CE1 3.84Å; F63-F116 HydrophobicContact CZ-CE1 3.84Å
64	G	79.4	Confident	83.4	Confident	4 Å²	4	45.1 Å²	45.1	4%	0.041	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	-170.1	-168.3	0	0	0	0	0	112.3	P13 C66 W97	P13-G64 WeakPolarHBondContact CD-O 3.4Å; P13-G64 WeakPolarHBondContact CG-O 3.27Å; G64-C66 PolarHBondContact O-N 2.92Å; G64-C66 VanDerWaalsContact O-N 3.07Å; G64-W97 WeakPolarHBondContact CA-O 3.31Å
65	L	76.5	Confident	82.9	Confident	79 Å²	79	43 Å²	43	41%	0.414	25%	0.25	S	C	.	.	S	Bend	trans	67.2	-2.9	177.2	-48.8	178.5	0	0	0	116.4	F12 P13 Q15	F12-L65 HydrophobicContact CD1-CD1 3.71Å; F12-L65 HydrophobicContact CE1-CD1 4.28Å; P13-L65 HydrophobicContact CG-CB 4.08Å; Q15-L65 PolarHBondContact NE2-O 2.82Å
66	C	80.5	Confident	82.6	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.241	C	C	.	.			trans	-103.8	128.2	162.9	62.8	0	0	0	0	108.3	G64 E79 C80 Y96	G64-C66 PolarHBondContact O-N 2.92Å; G64-C66 VanDerWaalsContact O-N 3.07Å; C66-E79 HydrophobicContact CB-CB 4.13Å; C66-E79 HydrophobicContact CB-CG 3.82Å; C66-C80 HydrophobicContact CB-CB 3.81Å; C66-C80 WeakPolarHBondContact CB-SG 3.07Å; C66-C80 PolarHBondContact O-SG 2.86Å; C66-C80 WeakPolarHBondContact SG-CA 3.43Å; C66-C80 WeakPolarHBondContact SG-CB 3.32Å; C66-C80 CovalentContact SG-SG 2.04Å; C66-C80 PolarHBondContact SG-SG 2.85Å; C66-Y96 WeakPolarHBondContact O-CE2 3.5Å; C66-Y96 PolarHBondContact O-OH 2.93Å
67	L	81	Confident	82.6	Confident	49 Å²	49	41.7 Å²	41.7	26%	0.257	23%	0.227	S	C	.	.			trans	-127.9	100.5	179.1	-75	162.9	0	0	0	108.2	D69 N76 Y96 E101 L102	L67-D69 PolarHBondContact O-N 2.76Å; L67-D69 VanDerWaalsContact O-N 3.13Å; L67-N76 WeakPolarHBondContact O-CB 3.22Å; L67-Y96 WeakPolarHBondContact CD2-OH 3.32Å; L67-E101 WeakPolarHBondContact CD1-OE2 3.15Å; L67-E101 HydrophobicContact CD2-CB 4.48Å; L67-L102 HydrophobicContact CD2-CD2 3.75Å; L67-L102 HydrophobicContact CD2-CG 4.04Å
68	P	82.9	Confident	82.7	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.006	23%	0.226	C	C	.	.			trans	-56.3	123.2	-179.9	-21.2	31.7	0	0	0	109.4	T77 C80 S112 S115 F116	P68-T77 WeakPolarHBondContact CA-OG1 3.2Å; P68-T77 HydrophobicContact CB-CG2 4.32Å; P68-C80 HydrophobicContact CG-CB 3.78Å; P68-S112 WeakPolarHBondContact O-CA 3.48Å; P68-S112 WeakPolarHBondContact O-CB 3.47Å; P68-S112 PolarHBondContact O-OG 2.75Å; P68-S115 WeakPolarHBondContact CB-OG 3.4Å; P68-S115 WeakPolarHBondContact CG-OG 3.48Å; P68-F116 HydrophobicContact CG-CE2 4.02Å
69	D	78.9	Confident	82.5	Confident	81 Å²	81	39.6 Å²	39.6	43%	0.433	22%	0.216	S	C	.	.			trans	-100.7	2.7	-175	58.5	7.1	0	0	0	112.2	L67 N71 S74 T77	L67-D69 PolarHBondContact O-N 2.76Å; L67-D69 VanDerWaalsContact O-N 3.13Å; D69-N71 VanDerWaalsContact C-N 3.3Å; D69-N71 WeakPolarHBondContact OD1-CB 3.49Å; D69-N71 PolarHBondContact OD1-N 3.44Å; D69-S74 VanDerWaalsContact OD1-CB 3.29Å; D69-S74 WeakPolarHBondContact OD1-CB 3.1Å; D69-S74 PolarHBondContact OD1-OG 3.13Å; D69-S74 WeakPolarHBondContact OD2-CB 3.3Å; D69-S74 PolarHBondContact OD2-OG 2.98Å; D69-S74 VanDerWaalsContact OD2-OG 3.13Å; D69-T77 PolarHBondContact N-OG1 2.85Å; D69-T77 PolarHBondContact OD1-OG1 3.38Å
70	G	77.3	Confident	82.4	Confident	26 Å²	26	35.7 Å²	35.7	27%	0.268	20%	0.198	S	C	.	.	S	Bend	trans	86.5	-5.6	-179.1	0	0	0	0	0	115.7	P72 I111	G70-P72 WeakPolarHBondContact O-CD 3.11Å; G70-I111 VanDerWaalsContact CA-CD1 3.4Å; G70-I111 VanDerWaalsContact CA-CG1 3.42Å
71	N	82.4	Confident	82.5	Confident	74 Å²	74	36.2 Å²	36.2	40%	0.396	20%	0.202	S	C	.	.			trans	-83.9	114.8	162.5	178.1	4.4	0	0	0	108.4	D69 E73 S74 T77	D69-N71 VanDerWaalsContact C-N 3.3Å; D69-N71 WeakPolarHBondContact OD1-CB 3.49Å; D69-N71 PolarHBondContact OD1-N 3.44Å; N71-E73 PolarHBondContact O-N 3.15Å; N71-E73 VanDerWaalsContact O-N 3.15Å; N71-E73 PolarHBondContact OD1-N 3.47Å; N71-S74 PolarHBondContact O-N 3.06Å; N71-S74 VanDerWaalsContact O-N 3.13Å; N71-S74 PolarHBondContact O-OG 3.05Å; N71-S74 VanDerWaalsContact O-OG 3.1Å; N71-T77 WeakPolarHBondContact O-CB 3.47Å; N71-T77 PolarHBondContact O-OG1 3.06Å
72	P	82.4	Confident	82.6	Confident	71 Å²	71	35 Å²	35	46%	0.461	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-20.4	179.8	26.2	-34.4	0	0	0	113.2	G70 V78	G70-P72 WeakPolarHBondContact O-CD 3.11Å; P72-V78 WeakPolarHBondContact O-CG2 3.39Å
73	E	82.8	Confident	83	Confident	166 Å²	166	34.1 Å²	34.1	78%	0.776	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.5	-5.8	-179.6	-58.1	-176.6	169	0	0	113.1	N71	N71-E73 PolarHBondContact O-N 3.15Å; N71-E73 VanDerWaalsContact O-N 3.15Å; N71-E73 PolarHBondContact OD1-N 3.47Å
74	S	83.2	Confident	83.4	Confident	14 Å²	14	34 Å²	34	10%	0.098	19%	0.19	C	C	.	.	S	Bend	trans	-68.2	143.8	178.2	73.7	0	0	0	0	110.9	D69 N71 N76 T77 V78	D69-S74 VanDerWaalsContact OD1-CB 3.29Å; D69-S74 WeakPolarHBondContact OD1-CB 3.1Å; D69-S74 PolarHBondContact OD1-OG 3.13Å; D69-S74 WeakPolarHBondContact OD2-CB 3.3Å; D69-S74 PolarHBondContact OD2-OG 2.98Å; D69-S74 VanDerWaalsContact OD2-OG 3.13Å; N71-S74 PolarHBondContact O-N 3.06Å; N71-S74 VanDerWaalsContact O-N 3.13Å; N71-S74 PolarHBondContact O-OG 3.05Å; N71-S74 VanDerWaalsContact O-OG 3.1Å; S74-N76 PolarHBondContact O-N 3.12Å; S74-N76 VanDerWaalsContact O-N 3.11Å; S74-T77 PolarHBondContact O-N 3.36Å; S74-T77 WeakPolarHBondContact OG-CB 3.2Å; S74-T77 PolarHBondContact OG-N 2.85Å; S74-T77 PolarHBondContact OG-OG1 3.32Å; S74-V78 WeakPolarHBondContact O-CG2 3.44Å; S74-V78 PolarHBondContact O-N 3.14Å
75	I	79.9	Confident	84	Confident	42 Å²	42	36.1 Å²	36.1	22%	0.215	20%	0.2	C	C	.	.	H	α-helix	trans	-50.6	-40.3	176.8	-169.1	79.3	0	0	0	111.3	Q28 L32 E79	Q28-I75 HydrophobicContact CG-CD1 4.46Å; L32-I75 HydrophobicContact CD1-CD1 4.04Å; L32-I75 HydrophobicContact CD2-CD1 3.68Å; L32-I75 HydrophobicContact CG-CD1 3.78Å; I75-E79 WeakPolarHBondContact O-CB 3.36Å; I75-E79 PolarHBondContact O-N 3.24Å
76	N	81.3	Confident	84.7	Confident	35 Å²	35	32.3 Å²	32.3	19%	0.187	18%	0.181	C	C	.	.	H	α-helix	trans	-66.6	-44.4	-179.3	-65.3	-33.8	0	0	0	112.4	Q15 L67 S74 C80	Q15-N76 PolarHBondContact NE2-OD1 2.67Å; L67-N76 WeakPolarHBondContact O-CB 3.22Å; S74-N76 PolarHBondContact O-N 3.12Å; S74-N76 VanDerWaalsContact O-N 3.11Å; N76-C80 WeakPolarHBondContact O-CB 3.32Å; N76-C80 PolarHBondContact O-N 2.88Å; N76-C80 VanDerWaalsContact O-N 3.13Å
77	T	84.4	Confident	85.3	Confident	7 Å²	7	32.3 Å²	32.3	4%	0.043	18%	0.181	C	C	.	.	H	α-helix	trans	-69.1	-45.5	178.8	-61.4	0	0	0	0	111	P68 D69 N71 S74 E79 N81	P68-T77 WeakPolarHBondContact CA-OG1 3.2Å; P68-T77 HydrophobicContact CB-CG2 4.32Å; D69-T77 PolarHBondContact N-OG1 2.85Å; D69-T77 PolarHBondContact OD1-OG1 3.38Å; N71-T77 WeakPolarHBondContact O-CB 3.47Å; N71-T77 PolarHBondContact O-OG1 3.06Å; S74-T77 PolarHBondContact O-N 3.36Å; S74-T77 WeakPolarHBondContact OG-CB 3.2Å; S74-T77 PolarHBondContact OG-N 2.85Å; S74-T77 PolarHBondContact OG-OG1 3.32Å; T77-E79 PolarHBondContact O-N 3.38Å; T77-N81 WeakPolarHBondContact CG2-ND2 3.34Å; T77-N81 VanDerWaalsContact O-CB 3.3Å; T77-N81 WeakPolarHBondContact O-CB 3.34Å; T77-N81 VanDerWaalsContact O-CG 3.31Å; T77-N81 PolarHBondContact O-N 2.89Å; T77-N81 PolarHBondContact O-ND2 3.04Å
78	V	86	Confident	86	Confident	41 Å²	41	30.6 Å²	30.6	25%	0.248	17%	0.172	C	C	.	.	H	α-helix	trans	-60.5	-48.2	179.5	178.3	0	0	0	0	110.5	L32 P72 S74 N81 A82	L32-V78 HydrophobicContact CD1-CB 4.43Å; L32-V78 HydrophobicContact CD1-CG1 3.94Å; L32-V78 HydrophobicContact CD2-CB 4.12Å; L32-V78 HydrophobicContact CD2-CG1 3.61Å; L32-V78 HydrophobicContact CG-CG1 4.29Å; P72-V78 WeakPolarHBondContact O-CG2 3.39Å; S74-V78 WeakPolarHBondContact O-CG2 3.44Å; S74-V78 PolarHBondContact O-N 3.14Å; V78-N81 PolarHBondContact O-N 3.37Å; V78-A82 WeakPolarHBondContact O-CB 3.31Å; V78-A82 PolarHBondContact O-N 3.19Å
79	E	83.5	Confident	86.5	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.7	-46.3	-179.2	174.5	160.9	-115.8	0	0	113.1	P13 S14 L35 C66 I75 T77 A82 V83	P13-E79 VanDerWaalsContact C-OE1 3.23Å; P13-E79 HydrophobicContact CB-CG 3.68Å; P13-E79 WeakPolarHBondContact CB-OE1 3.42Å; P13-E79 HydrophobicContact CG-CG 4.25Å; S14-E79 WeakPolarHBondContact CA-OE1 3.45Å; S14-E79 WeakPolarHBondContact CB-OE1 3.16Å; S14-E79 PolarHBondContact N-OE1 2.64Å; S14-E79 PolarHBondContact OG-OE1 2.72Å; L35-E79 HydrophobicContact CD2-CB 4.43Å; L35-E79 HydrophobicContact CD2-CG 3.96Å; C66-E79 HydrophobicContact CB-CB 4.13Å; C66-E79 HydrophobicContact CB-CG 3.82Å; I75-E79 WeakPolarHBondContact O-CB 3.36Å; I75-E79 PolarHBondContact O-N 3.24Å; T77-E79 PolarHBondContact O-N 3.38Å; E79-A82 WeakPolarHBondContact O-CB 3.04Å; E79-A82 PolarHBondContact O-N 3Å; E79-V83 WeakPolarHBondContact O-CG2 3.39Å; E79-V83 PolarHBondContact O-N 3.44Å; E79-V83 VanDerWaalsContact O-N 3.13Å
80	C	87.2	Confident	87.2	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.3	-44.7	176.7	-103	0	0	0	0	111.9	C66 P68 N76 A82 V83 L84	C66-C80 HydrophobicContact CB-CB 3.81Å; C66-C80 WeakPolarHBondContact CB-SG 3.07Å; C66-C80 PolarHBondContact O-SG 2.86Å; C66-C80 WeakPolarHBondContact SG-CA 3.43Å; C66-C80 WeakPolarHBondContact SG-CB 3.32Å; C66-C80 CovalentContact SG-SG 2.04Å; C66-C80 PolarHBondContact SG-SG 2.85Å; P68-C80 HydrophobicContact CG-CB 3.78Å; N76-C80 WeakPolarHBondContact O-CB 3.32Å; N76-C80 PolarHBondContact O-N 2.88Å; N76-C80 VanDerWaalsContact O-N 3.13Å; C80-A82 VanDerWaalsContact C-N 3.28Å; C80-A82 PolarHBondContact O-N 2.98Å; C80-V83 PolarHBondContact O-N 3.4Å; C80-L84 WeakPolarHBondContact O-CB 3.19Å; C80-L84 VanDerWaalsContact O-CG 3.23Å; C80-L84 WeakPolarHBondContact O-CG 3.26Å; C80-L84 PolarHBondContact O-N 3.42Å
81	N	90.2	Very high	87.9	Confident	15 Å²	15	36.2 Å²	36.2	8%	0.08	18%	0.183	C	C	.	.	H	α-helix	trans	-65	-34.3	177.3	-74.4	-29.1	0	0	0	111.7	T77 V78 L84 N85 S115	T77-N81 WeakPolarHBondContact CG2-ND2 3.34Å; T77-N81 VanDerWaalsContact O-CB 3.3Å; T77-N81 WeakPolarHBondContact O-CB 3.34Å; T77-N81 VanDerWaalsContact O-CG 3.31Å; T77-N81 PolarHBondContact O-N 2.89Å; T77-N81 PolarHBondContact O-ND2 3.04Å; V78-N81 PolarHBondContact O-N 3.37Å; N81-L84 PolarHBondContact O-N 2.82Å; N81-N85 WeakPolarHBondContact O-CB 3.49Å; N81-N85 PolarHBondContact O-N 2.8Å; N81-N85 PolarHBondContact O-ND2 2.9Å; N81-S115 WeakPolarHBondContact OD1-CB 3.3Å; N81-S115 PolarHBondContact OD1-OG 2.96Å
82	A	89.3	Confident	88.4	Confident	7 Å²	7	33 Å²	33	6%	0.058	17%	0.165	C	C	.	.	H	α-helix	trans	-60	-49.4	174.3	0	0	0	0	0	112.6	D36 L40 V78 E79 C80 A86	D36-A82 WeakPolarHBondContact OD1-CB 3.32Å; L40-A82 HydrophobicContact CD1-CB 3.93Å; V78-A82 WeakPolarHBondContact O-CB 3.31Å; V78-A82 PolarHBondContact O-N 3.19Å; E79-A82 WeakPolarHBondContact O-CB 3.04Å; E79-A82 PolarHBondContact O-N 3Å; C80-A82 VanDerWaalsContact C-N 3.28Å; C80-A82 PolarHBondContact O-N 2.98Å; A82-A86 VanDerWaalsContact O-CB 3.28Å; A82-A86 WeakPolarHBondContact O-CB 3.31Å; A82-A86 PolarHBondContact O-N 3.47Å
83	V	89.8	Confident	88.8	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.006	17%	0.166	C	C	.	.	H	α-helix	trans	-61.4	-49.6	177.2	178.7	0	0	0	0	110.6	F11 L40 L60 F63 E79 C80 N85 A86 A87	F11-V83 HydrophobicContact CD1-CG2 4.48Å; L40-V83 HydrophobicContact CD1-CG2 4.48Å; L40-V83 HydrophobicContact CD2-CG2 4.03Å; L60-V83 HydrophobicContact CD2-CG1 4Å; F63-V83 HydrophobicContact CB-CG1 4.1Å; F63-V83 HydrophobicContact CD2-CB 4.13Å; F63-V83 HydrophobicContact CD2-CG1 3.63Å; F63-V83 HydrophobicContact CE2-CB 4.5Å; F63-V83 HydrophobicContact CE2-CG1 4.18Å; F63-V83 HydrophobicContact CG-CG1 3.82Å; E79-V83 WeakPolarHBondContact O-CG2 3.39Å; E79-V83 PolarHBondContact O-N 3.44Å; E79-V83 VanDerWaalsContact O-N 3.13Å; C80-V83 PolarHBondContact O-N 3.4Å; V83-N85 PolarHBondContact O-N 3.19Å; V83-A86 PolarHBondContact O-N 3.23Å; V83-A87 WeakPolarHBondContact O-CB 3.31Å; V83-A87 PolarHBondContact O-N 2.87Å
84	L	92.2	Very high	89.3	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.4	-43.9	-179.1	-69.7	171.6	0	0	0	112.2	F63 C80 N81 A86 A87 D88 W94 S115 F116	F63-L84 HydrophobicContact CE1-CD2 4.42Å; F63-L84 HydrophobicContact CE2-CD2 4.1Å; F63-L84 HydrophobicContact CE2-CG 4.24Å; F63-L84 HydrophobicContact CZ-CD2 3.56Å; F63-L84 HydrophobicContact CZ-CG 4.2Å; C80-L84 WeakPolarHBondContact O-CB 3.19Å; C80-L84 VanDerWaalsContact O-CG 3.23Å; C80-L84 WeakPolarHBondContact O-CG 3.26Å; C80-L84 PolarHBondContact O-N 3.42Å; N81-L84 PolarHBondContact O-N 2.82Å; L84-A86 VanDerWaalsContact C-N 3.31Å; L84-A86 PolarHBondContact O-N 2.83Å; L84-A87 WeakPolarHBondContact O-CB 3.21Å; L84-A87 PolarHBondContact O-N 3.36Å; L84-D88 PolarHBondContact O-N 3.49Å; L84-W94 HydrophobicContact CD2-CD2 3.83Å; L84-W94 HydrophobicContact CD2-CE3 4.33Å; L84-W94 HydrophobicContact CD2-CG 4.4Å; L84-W94 HydrophobicContact CD2-CH2 3.93Å; L84-W94 HydrophobicContact CD2-CZ2 3.39Å; L84-W94 HydrophobicContact CD2-CZ3 4.37Å; L84-S115 WeakPolarHBondContact CD1-O 3.35Å; L84-F116 HydrophobicContact CD1-CD1 4.14Å; L84-F116 HydrophobicContact CD1-CE1 4.31Å
85	N	93.1	Very high	89.6	Confident	49 Å²	49	30.6 Å²	30.6	26%	0.262	16%	0.156	S	C	.	.	H	α-helix	trans	-65	-36.4	175.9	-70.6	-25	0	0	0	111.5	N81 V83 R89 R118	N81-N85 WeakPolarHBondContact O-CB 3.49Å; N81-N85 PolarHBondContact O-N 2.8Å; N81-N85 PolarHBondContact O-ND2 2.9Å; V83-N85 PolarHBondContact O-N 3.19Å; N85-R89 VanDerWaalsContact O-CG 3.3Å; N85-R89 WeakPolarHBondContact O-CG 3.42Å; N85-R89 PolarHBondContact O-N 2.9Å; N85-R118 PolarHBondContact OD1-NH2 2.79Å
86	A	91.6	Very high	89.8	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-68.7	-38.5	175.7	0	0	0	0	0	112	L40 F44 A82 V83 L84 R89 N90	L40-A86 HydrophobicContact CB-CB 4.37Å; L40-A86 HydrophobicContact CD1-CB 4.38Å; F44-A86 HydrophobicContact CD2-CB 3.84Å; F44-A86 HydrophobicContact CE2-CB 3.4Å; F44-A86 VanDerWaalsContact CE2-CB 3.4Å; F44-A86 HydrophobicContact CZ-CB 4.2Å; A82-A86 VanDerWaalsContact O-CB 3.28Å; A82-A86 WeakPolarHBondContact O-CB 3.31Å; A82-A86 PolarHBondContact O-N 3.47Å; V83-A86 PolarHBondContact O-N 3.23Å; L84-A86 VanDerWaalsContact C-N 3.31Å; L84-A86 PolarHBondContact O-N 2.83Å; A86-R89 PolarHBondContact O-N 2.69Å; A86-N90 WeakPolarHBondContact O-CB 3.45Å; A86-N90 PolarHBondContact O-N 3.1Å; A86-N90 VanDerWaalsContact O-N 3.15Å; A86-N90 PolarHBondContact O-ND2 3.09Å
87	A	93	Very high	89.8	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-61.7	-46.8	174.1	0	0	0	0	0	111.3	F44 V83 L84 R89 N90 F91 E92	F44-A87 HydrophobicContact CE1-CB 4.36Å; F44-A87 HydrophobicContact CZ-CB 4.02Å; V83-A87 WeakPolarHBondContact O-CB 3.31Å; V83-A87 PolarHBondContact O-N 2.87Å; L84-A87 WeakPolarHBondContact O-CB 3.21Å; L84-A87 PolarHBondContact O-N 3.36Å; A87-R89 PolarHBondContact O-N 2.91Å; A87-N90 CarbonylContact O-C 3.58Å; A87-N90 PolarHBondContact O-N 3.4Å; A87-N90 VanDerWaalsContact O-N 3.14Å; A87-F91 PolarHBondContact O-N 3.05Å; A87-E92 WeakPolarHBondContact CB-O 3.25Å; A87-E92 PolarHBondContact O-N 3.1Å
88	D	94.7	Very high	89	Confident	12 Å²	12	38.5 Å²	38.5	6%	0.064	19%	0.185	C	C	.	.	H	α-helix	trans	-58.1	-49.3	175.2	-73.4	-14.4	0	0	0	111.7	L84 N90 F91 R118 L131	L84-D88 PolarHBondContact O-N 3.49Å; D88-N90 PolarHBondContact O-N 2.97Å; D88-N90 VanDerWaalsContact O-N 3.13Å; D88-F91 PolarHBondContact O-N 2.94Å; D88-F91 VanDerWaalsContact O-N 3.12Å; D88-R118 IonicContact OD1-NE 3.97Å; D88-R118 IonicContact OD2-CZ 3.28Å; D88-R118 VanDerWaalsContact OD2-CZ 3.28Å; D88-R118 IonicContact OD2-NE 2.94Å; D88-R118 PolarHBondContact OD2-NE 2.91Å; D88-R118 IonicContact OD2-NH2 2.73Å; D88-R118 PolarHBondContact OD2-NH2 2.87Å; D88-L131 HydrophobicContact CB-CD2 3.97Å; D88-L131 HydrophobicContact CB-CG 4.15Å
89	R	93.8	Very high	87.9	Confident	132 Å²	132	37.2 Å²	37.2	50%	0.498	18%	0.18	S	C	.	.	H	α-helix	trans	-58.7	-27.5	178.4	-76	-171.3	-57.8	-96.9	6.9	113.2	N85 A86 A87	N85-R89 VanDerWaalsContact O-CG 3.3Å; N85-R89 WeakPolarHBondContact O-CG 3.42Å; N85-R89 PolarHBondContact O-N 2.9Å; A86-R89 PolarHBondContact O-N 2.69Å; A87-R89 PolarHBondContact O-N 2.91Å
90	N	92.4	Very high	86.9	Confident	28 Å²	28	46.1 Å²	46.1	15%	0.15	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	2.2	-177.4	-76	-79.1	0	0	0	113.7	F44 R58 A86 A87 D88 E92	F44-N90 HydrophobicContact CB-CB 4.37Å; F44-N90 WeakPolarHBondContact CB-ND2 3.27Å; F44-N90 HydrophobicContact CD1-CB 3.76Å; F44-N90 HydrophobicContact CE1-CB 4.36Å; F44-N90 HydrophobicContact CG-CB 4.2Å; F44-N90 WeakPolarHBondContact CG-ND2 3.48Å; R58-N90 PolarHBondContact NH2-O 3.38Å; A86-N90 WeakPolarHBondContact O-CB 3.45Å; A86-N90 PolarHBondContact O-N 3.1Å; A86-N90 VanDerWaalsContact O-N 3.15Å; A86-N90 PolarHBondContact O-ND2 3.09Å; A87-N90 CarbonylContact O-C 3.58Å; A87-N90 PolarHBondContact O-N 3.4Å; A87-N90 VanDerWaalsContact O-N 3.14Å; D88-N90 PolarHBondContact O-N 2.97Å; D88-N90 VanDerWaalsContact O-N 3.13Å; N90-E92 HydrophobicContact CB-CB 4.41Å; N90-E92 PolarHBondContact O-N 3.2Å
91	F	93.2	Very high	85.6	Confident	67 Å²	67	52.4 Å²	52.4	29%	0.294	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	43.5	-172.3	-66.2	-75.6	0	0	0	112.5	A87 D88 P128 V129 Q130 L131 Y142	A87-F91 PolarHBondContact O-N 3.05Å; D88-F91 PolarHBondContact O-N 2.94Å; D88-F91 VanDerWaalsContact O-N 3.12Å; F91-P128 HydrophobicContact CD1-CB 3.61Å; F91-P128 HydrophobicContact CD1-CG 4.4Å; F91-P128 HydrophobicContact CD2-CB 4.23Å; F91-P128 HydrophobicContact CE1-CB 3.32Å; F91-P128 HydrophobicContact CE1-CG 4.42Å; F91-P128 HydrophobicContact CE2-CB 3.97Å; F91-P128 HydrophobicContact CG-CB 4.04Å; F91-P128 HydrophobicContact CZ-CB 3.48Å; F91-P128 VanDerWaalsContact CZ-CB 3.48Å; F91-V129 VanDerWaalsContact CE2-C 3.48Å; F91-V129 WeakPolarHBondContact CE2-O 3.06Å; F91-Q130 VanDerWaalsContact CZ-N 3.33Å; F91-L131 HydrophobicContact CD1-CB 4.19Å; F91-L131 HydrophobicContact CD1-CD2 4.33Å; F91-L131 HydrophobicContact CE1-CB 3.44Å; F91-L131 VanDerWaalsContact CE1-CB 3.44Å; F91-L131 HydrophobicContact CE1-CD2 4.25Å; F91-L131 HydrophobicContact CE1-CG 4.43Å; F91-L131 HydrophobicContact CZ-CB 3.78Å; F91-Y142 HydrophobicContact CE1-CD2 4.33Å; F91-Y142 AromaticContact CE1-CE2 3.78Å; F91-Y142 HydrophobicContact CE1-CE2 3.78Å; F91-Y142 HydrophobicContact CZ-CE2 4.28Å
92	E	91.5	Very high	84.2	Confident	5 Å²	5	52 Å²	52	2%	0.023	24%	0.242	C	C	.	.			trans	-110.7	115.9	-178.6	-166.2	150.2	169.1	0	0	108.9	F44 R58 A87 N90	F44-E92 HydrophobicContact CD1-CB 4.28Å; F44-E92 VanDerWaalsContact CD1-OE2 3.32Å; F44-E92 WeakPolarHBondContact CD1-OE2 3.2Å; F44-E92 HydrophobicContact CE1-CB 3.84Å; F44-E92 HydrophobicContact CE1-CG 4.06Å; R58-E92 HydrophobicContact CB-CG 4.06Å; R58-E92 IonicContact CZ-OE2 3.66Å; R58-E92 IonicContact NE-OE2 4Å; R58-E92 IonicContact NH1-OE2 2.93Å; R58-E92 PolarHBondContact NH1-OE2 2.91Å; A87-E92 WeakPolarHBondContact CB-O 3.25Å; A87-E92 PolarHBondContact O-N 3.1Å; N90-E92 HydrophobicContact CB-CB 4.41Å; N90-E92 PolarHBondContact O-N 3.2Å
93	S	92.4	Very high	82.8	Confident	70 Å²	70	57.1 Å²	57.1	49%	0.49	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	158.3	173.6	-58.4	0	0	0	0	110.4	F59 L60	F59-S93 CarbonylContact C-O 3.46Å; F59-S93 WeakPolarHBondContact CA-O 3.46Å; F59-S93 VanDerWaalsContact CD2-CB 3.45Å; L60-S93 PolarHBondContact N-O 2.85Å
94	W	92.1	Very high	81.3	Confident	67 Å²	67	61.1 Å²	61.1	25%	0.254	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	159.3	-172.6	52.1	-98.7	0	0	0	113	L60 F63 L84 F116	L60-W94 HydrophobicContact CB-CB 3.96Å; L60-W94 HydrophobicContact CD2-CB 4.17Å; L60-W94 HydrophobicContact CG-CB 4.31Å; L60-W94 CarbonylContact O-C 3.52Å; L60-W94 WeakPolarHBondContact O-CA 3.37Å; F63-W94 HydrophobicContact CD1-CB 4.29Å; F63-W94 HydrophobicContact CE1-CB 3.9Å; F63-W94 AromaticContact CE1-CD2 3.82Å; F63-W94 HydrophobicContact CE1-CD2 3.82Å; F63-W94 AromaticContact CE1-CE3 3.5Å; F63-W94 HydrophobicContact CE1-CE3 3.5Å; F63-W94 VanDerWaalsContact CE1-CE3 3.5Å; F63-W94 HydrophobicContact CE1-CG 4.01Å; F63-W94 HydrophobicContact CE1-CZ3 4.28Å; F63-W94 HydrophobicContact CZ-CD2 4.16Å; F63-W94 AromaticContact CZ-CE3 3.85Å; F63-W94 HydrophobicContact CZ-CE3 3.85Å; F63-W94 HydrophobicContact CZ-CZ3 4.24Å; L84-W94 HydrophobicContact CD2-CD2 3.83Å; L84-W94 HydrophobicContact CD2-CE3 4.33Å; L84-W94 HydrophobicContact CD2-CG 4.4Å; L84-W94 HydrophobicContact CD2-CH2 3.93Å; L84-W94 HydrophobicContact CD2-CZ2 3.39Å; L84-W94 HydrophobicContact CD2-CZ3 4.37Å; W94-F116 HydrophobicContact CH2-CB 4.39Å; W94-F116 AromaticContact CH2-CD1 3.94Å; W94-F116 HydrophobicContact CH2-CD1 3.94Å; W94-F116 HydrophobicContact CZ3-CD1 4.07Å
95	T	89.2	Confident	79.5	Confident	65 Å²	65	67 Å²	67	40%	0.399	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	135.6	163.3	39.1	0	0	0	0	109.9	F59 L60 T61 F63	F59-T95 HydrophobicContact CE1-CG2 3.84Å; F59-T95 HydrophobicContact CZ-CG2 3.86Å; L60-T95 PolarHBondContact O-N 2.93Å; T61-T95 CarbonylContact C-O 3.55Å; T61-T95 WeakPolarHBondContact CA-OG1 3.35Å; T61-T95 PolarHBondContact O-OG1 3.34Å; F63-T95 WeakPolarHBondContact CD1-O 3.35Å; F63-T95 PolarHBondContact N-O 3.28Å
96	Y	85.5	Confident	77.9	Confident	39 Å²	39	70.6 Å²	70.6	15%	0.153	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	143.3	180	-179.8	-93.6	0	0	0	111.5	F63 C66 L67 L102 F116	F63-Y96 HydrophobicContact CD2-CD2 4.01Å; F63-Y96 HydrophobicContact CE1-CD2 4.29Å; F63-Y96 AromaticContact CE2-CD2 3.64Å; F63-Y96 HydrophobicContact CE2-CD2 3.64Å; F63-Y96 HydrophobicContact CE2-CE2 4.32Å; F63-Y96 AromaticContact CZ-CD2 3.78Å; F63-Y96 HydrophobicContact CZ-CD2 3.78Å; F63-Y96 HydrophobicContact CZ-CG 4.43Å; F63-Y96 CarbonylContact O-C 3.57Å; F63-Y96 WeakPolarHBondContact O-CA 3.44Å; F63-Y96 WeakPolarHBondContact O-CD2 2.96Å; C66-Y96 WeakPolarHBondContact O-CE2 3.5Å; C66-Y96 PolarHBondContact O-OH 2.93Å; L67-Y96 WeakPolarHBondContact CD2-OH 3.32Å; Y96-L102 HydrophobicContact CD1-CD1 3.21Å; Y96-L102 HydrophobicContact CD1-CG 4.26Å; Y96-L102 HydrophobicContact CE1-CD1 3.32Å; Y96-L102 HydrophobicContact CE1-CG 3.91Å; Y96-L102 HydrophobicContact CG-CD1 3.9Å; Y96-F116 AromaticContact CD2-CE1 3.45Å; Y96-F116 HydrophobicContact CD2-CE1 3.45Å; Y96-F116 VanDerWaalsContact CD2-CE1 3.45Å; Y96-F116 AromaticContact CD2-CZ 3.58Å; Y96-F116 HydrophobicContact CD2-CZ 3.58Å; Y96-F116 HydrophobicContact CE2-CE1 4.02Å; Y96-F116 AromaticContact CE2-CZ 3.65Å; Y96-F116 HydrophobicContact CE2-CZ 3.65Å; Y96-F116 AromaticContact CG-CE1 3.84Å; Y96-F116 HydrophobicContact CG-CE1 3.84Å; Y96-F116 HydrophobicContact CG-CZ 4.09Å
97	W	80	Confident	76.6	Confident	139 Å²	139	74.2 Å²	74.2	53%	0.527	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	127.8	177.2	-177.3	-84.4	0	0	0	111.1	E62 F63 G64	E62-W97 HydrophobicContact CB-CB 4.36Å; E62-W97 HydrophobicContact CG-CE3 4.02Å; F63-W97 PolarHBondContact O-N 3.37Å; G64-W97 WeakPolarHBondContact CA-O 3.31Å
98	D	68.5	Low	75.2	Confident	72 Å²	72	78.1 Å²	78.1	39%	0.385	38%	0.384	S	S	.	.			cis	-112.5	145	-19.6	-168	-9.5	0	0	0	107.2	Y100	D98-Y100 HydrophobicContact CB-CD2 4.16Å; D98-Y100 PolarHBondContact O-N 2.83Å; D98-Y100 WeakPolarHBondContact OD2-CD2 2.95Å; D98-Y100 WeakPolarHBondContact OD2-CE2 3.33Å
99	G	62.7	Low	73.7	Confident	13 Å²	13	85.4 Å²	85.4	13%	0.134	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-8	-171.3	0	0	0	0	0	114.9	E101 L102 F103	G99-E101 PolarHBondContact O-N 3.45Å; G99-E101 VanDerWaalsContact O-N 3.17Å; G99-L102 PolarHBondContact O-N 3.19Å; G99-F103 WeakPolarHBondContact O-CD2 3.34Å; G99-F103 PolarHBondContact O-N 2.94Å; G99-F103 VanDerWaalsContact O-N 3.11Å
100	Y	62.5	Low	72.6	Confident	187 Å²	187	81.1 Å²	81.1	73%	0.733	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	-40.7	-176.7	-79.3	-74.5	0	0	0	113.5	D98	D98-Y100 HydrophobicContact CB-CD2 4.16Å; D98-Y100 PolarHBondContact O-N 2.83Å; D98-Y100 WeakPolarHBondContact OD2-CD2 2.95Å; D98-Y100 WeakPolarHBondContact OD2-CE2 3.33Å
101	E	60	Low	71.5	Confident	133 Å²	133	83.8 Å²	83.8	62%	0.621	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-37.8	-179	-63.9	-170.2	-174.7	0	0	112.6	L67 G99 F103 S104	L67-E101 WeakPolarHBondContact CD1-OE2 3.15Å; L67-E101 HydrophobicContact CD2-CB 4.48Å; G99-E101 PolarHBondContact O-N 3.45Å; G99-E101 VanDerWaalsContact O-N 3.17Å; E101-F103 VanDerWaalsContact C-N 3.33Å; E101-F103 PolarHBondContact O-N 2.81Å; E101-S104 PolarHBondContact O-OG 3.49Å
102	L	60.9	Low	70.6	Confident	6 Å²	6	81.5 Å²	81.5	3%	0.031	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-33.6	-178	-74.3	175.2	0	0	0	113.5	L67 Y96 G99 F116	L67-L102 HydrophobicContact CD2-CD2 3.75Å; L67-L102 HydrophobicContact CD2-CG 4.04Å; Y96-L102 HydrophobicContact CD1-CD1 3.21Å; Y96-L102 HydrophobicContact CD1-CG 4.26Å; Y96-L102 HydrophobicContact CE1-CD1 3.32Å; Y96-L102 HydrophobicContact CE1-CG 3.91Å; Y96-L102 HydrophobicContact CG-CD1 3.9Å; G99-L102 PolarHBondContact O-N 3.19Å; L102-F116 HydrophobicContact CD1-CD2 4.18Å; L102-F116 HydrophobicContact CD1-CE1 4.46Å; L102-F116 HydrophobicContact CD1-CE2 3.79Å; L102-F116 HydrophobicContact CD1-CZ 3.94Å; L102-F116 HydrophobicContact CD2-CD2 4.08Å; L102-F116 HydrophobicContact CD2-CE2 3.57Å; L102-F116 HydrophobicContact CD2-CZ 4.35Å; L102-F116 HydrophobicContact CG-CE2 4.36Å
103	F	60.7	Low	70.2	Confident	114 Å²	114	82.1 Å²	82.1	50%	0.5	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	0.8	-168.3	-55.5	-55.3	0	0	0	114.7	G99 E101 N105 L106	G99-F103 WeakPolarHBondContact O-CD2 3.34Å; G99-F103 PolarHBondContact O-N 2.94Å; G99-F103 VanDerWaalsContact O-N 3.11Å; E101-F103 VanDerWaalsContact C-N 3.33Å; E101-F103 PolarHBondContact O-N 2.81Å; F103-N105 PolarHBondContact O-N 3.5Å; F103-N105 VanDerWaalsContact O-N 3.11Å; F103-L106 HydrophobicContact CB-CG 4.4Å; F103-L106 HydrophobicContact CD1-CD1 4.45Å; F103-L106 HydrophobicContact CD1-CD2 3.58Å; F103-L106 HydrophobicContact CD1-CG 4.08Å; F103-L106 HydrophobicContact CE1-CD2 4.19Å
104	S	56.8	Low	70	Confident	85 Å²	85	82.1 Å²	82.1	59%	0.594	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-32.2	-179.1	58.4	0	0	0	0	112.4	E101	E101-S104 PolarHBondContact O-OG 3.49Å
105	N	55	Low	69.9	Low	125 Å²	125	79.2 Å²	79.2	67%	0.668	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.6	89.8	169.3	-64.2	-57.1	0	0	0	109.9	F103 N107	F103-N105 PolarHBondContact O-N 3.5Å; F103-N105 VanDerWaalsContact O-N 3.11Å; N105-N107 PolarHBondContact O-N 3.01Å
106	L	60.1	Low	69.9	Low	124 Å²	124	77.4 Å²	77.4	65%	0.649	38%	0.382	S	S	*	.			trans	-65.3	74.7	170.6	-81.4	169.9	0	0	0	110.6	F103 L113	F103-L106 HydrophobicContact CB-CG 4.4Å; F103-L106 HydrophobicContact CD1-CD1 4.45Å; F103-L106 HydrophobicContact CD1-CD2 3.58Å; F103-L106 HydrophobicContact CD1-CG 4.08Å; F103-L106 HydrophobicContact CE1-CD2 4.19Å; L106-L113 HydrophobicContact CD2-CD1 4.15Å; L106-L113 HydrophobicContact CD2-CD2 4.14Å
107	N	63.8	Low	70.2	Confident	76 Å²	76	76.8 Å²	76.8	41%	0.406	38%	0.383	S	S	.	.			trans	-92	133.1	165	-174.2	-4.1	0	0	0	107.9	N105 E109 N110 L113	N105-N107 PolarHBondContact O-N 3.01Å; N107-E109 PolarHBondContact ND2-OE2 3.41Å; N107-E109 PolarHBondContact O-N 3.35Å; N107-E109 PolarHBondContact OD1-N 3.13Å; N107-N110 HydrophobicContact CB-CB 4.43Å; N107-N110 WeakPolarHBondContact O-CA 3.33Å; N107-N110 WeakPolarHBondContact O-CB 3.39Å; N107-N110 PolarHBondContact O-N 3.28Å; N107-L113 VanDerWaalsContact O-CD1 3.24Å; N107-L113 WeakPolarHBondContact O-CD1 3.05Å
108	V	62.9	Low	71	Confident	82 Å²	82	70.4 Å²	70.4	50%	0.497	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-26	174.2	-175.5	0	0	0	0	111.1	N110 I169	V108-N110 PolarHBondContact O-N 3.05Å; V108-I169 HydrophobicContact CG1-CG1 4Å
109	E	63.8	Low	72.4	Confident	165 Å²	165	67 Å²	67	77%	0.771	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-6.1	172.6	-53.9	173.9	155.2	0	0	113.1	N107 I111	N107-E109 PolarHBondContact ND2-OE2 3.41Å; N107-E109 PolarHBondContact O-N 3.35Å; N107-E109 PolarHBondContact OD1-N 3.13Å; E109-I111 PolarHBondContact O-N 2.98Å
110	N	69.7	Low	74	Confident	42 Å²	42	70.7 Å²	70.7	23%	0.225	35%	0.351	C	S	.	.			trans	-66.8	102.3	174.6	-173.3	-12.8	0	0	0	108.4	N107 V108 S112 L113	N107-N110 HydrophobicContact CB-CB 4.43Å; N107-N110 WeakPolarHBondContact O-CA 3.33Å; N107-N110 WeakPolarHBondContact O-CB 3.39Å; N107-N110 PolarHBondContact O-N 3.28Å; V108-N110 PolarHBondContact O-N 3.05Å; N110-S112 PolarHBondContact O-N 3.29Å; N110-S112 VanDerWaalsContact O-N 3.09Å; N110-S112 WeakPolarHBondContact OD1-CB 3.41Å; N110-S112 PolarHBondContact OD1-N 3.24Å; N110-S112 PolarHBondContact OD1-OG 3.12Å; N110-S112 VanDerWaalsContact OD1-OG 3.07Å; N110-L113 HydrophobicContact CB-CD1 4.15Å; N110-L113 HydrophobicContact CB-CG 4.09Å; N110-L113 VanDerWaalsContact O-CB 3.28Å; N110-L113 WeakPolarHBondContact O-CB 3.28Å; N110-L113 PolarHBondContact O-N 2.73Å
111	I	71.3	Confident	75.7	Confident	83 Å²	83	62.9 Å²	62.9	43%	0.426	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-22.5	-177	-161.4	158.5	0	0	0	112.7	G70 E109 L113 K114	G70-I111 VanDerWaalsContact CA-CD1 3.4Å; G70-I111 VanDerWaalsContact CA-CG1 3.42Å; E109-I111 PolarHBondContact O-N 2.98Å; I111-L113 PolarHBondContact O-N 2.89Å; I111-K114 VanDerWaalsContact O-CB 3.23Å; I111-K114 WeakPolarHBondContact O-CB 3.49Å; I111-K114 PolarHBondContact O-N 3.17Å; I111-K114 VanDerWaalsContact O-N 3.13Å
112	S	73.1	Confident	77.4	Confident	20 Å²	20	61 Å²	61	14%	0.14	32%	0.315	C	S	.	.	H	α-helix	trans	-60.3	-33.2	171	-50.6	0	0	0	0	112.5	P68 N110 K114 F116	P68-S112 WeakPolarHBondContact O-CA 3.48Å; P68-S112 WeakPolarHBondContact O-CB 3.47Å; P68-S112 PolarHBondContact O-OG 2.75Å; N110-S112 PolarHBondContact O-N 3.29Å; N110-S112 VanDerWaalsContact O-N 3.09Å; N110-S112 WeakPolarHBondContact OD1-CB 3.41Å; N110-S112 PolarHBondContact OD1-N 3.24Å; N110-S112 PolarHBondContact OD1-OG 3.12Å; N110-S112 VanDerWaalsContact OD1-OG 3.07Å; S112-K114 PolarHBondContact O-N 3.47Å; S112-F116 WeakPolarHBondContact O-CD2 3.16Å
113	L	82.6	Confident	79.1	Confident	17 Å²	17	62.9 Å²	62.9	9%	0.089	33%	0.328	C	S	.	.	H	α-helix	trans	-68.4	-21.8	178.8	-63.2	178.9	0	0	0	112.5	L106 N107 N110 I111 S115 F116 S117 I169	L106-L113 HydrophobicContact CD2-CD1 4.15Å; L106-L113 HydrophobicContact CD2-CD2 4.14Å; N107-L113 VanDerWaalsContact O-CD1 3.24Å; N107-L113 WeakPolarHBondContact O-CD1 3.05Å; N110-L113 HydrophobicContact CB-CD1 4.15Å; N110-L113 HydrophobicContact CB-CG 4.09Å; N110-L113 VanDerWaalsContact O-CB 3.28Å; N110-L113 WeakPolarHBondContact O-CB 3.28Å; N110-L113 PolarHBondContact O-N 2.73Å; I111-L113 PolarHBondContact O-N 2.89Å; L113-S115 VanDerWaalsContact C-N 3.32Å; L113-S115 PolarHBondContact O-N 3.13Å; L113-F116 PolarHBondContact O-N 2.78Å; L113-S117 WeakPolarHBondContact O-CB 3.3Å; L113-S117 PolarHBondContact O-N 3.49Å; L113-S117 PolarHBondContact O-OG 2.94Å; L113-I169 HydrophobicContact CB-CD1 4.38Å
114	K	88.6	Confident	80.8	Confident	71 Å²	71	59.3 Å²	59.3	31%	0.309	32%	0.316	S	S	.	.	H	α-helix	trans	-59.2	-43.9	-178.9	-168.4	178.3	176.6	-169.9	0	111.3	I111 S112 V135 D136 I169 H170	I111-K114 VanDerWaalsContact O-CB 3.23Å; I111-K114 WeakPolarHBondContact O-CB 3.49Å; I111-K114 PolarHBondContact O-N 3.17Å; I111-K114 VanDerWaalsContact O-N 3.13Å; S112-K114 PolarHBondContact O-N 3.47Å; K114-V135 WeakPolarHBondContact CE-O 3.29Å; K114-V135 HydrophobicContact CG-CG2 4.12Å; K114-D136 PolarHBondContact NZ-O 3.18Å; K114-I169 HydrophobicContact CB-CG2 4.4Å; K114-I169 HydrophobicContact CG-CG2 4.35Å; K114-H170 WeakPolarHBondContact CG-CE1 3.43Å; K114-H170 PolarHBondContact O-CE1 2.85Å; K114-H170 PolarHBondContact O-NE2 3.38Å
115	S	89.7	Confident	82.6	Confident	5 Å²	5	56.7 Å²	56.7	4%	0.035	30%	0.299	C	S	.	.	H	α-helix	trans	-66	-41.6	-179.7	-55.4	0	0	0	0	113.3	P68 N81 L84 L113 R118	P68-S115 WeakPolarHBondContact CB-OG 3.4Å; P68-S115 WeakPolarHBondContact CG-OG 3.48Å; N81-S115 WeakPolarHBondContact OD1-CB 3.3Å; N81-S115 PolarHBondContact OD1-OG 2.96Å; L84-S115 WeakPolarHBondContact CD1-O 3.35Å; L113-S115 VanDerWaalsContact C-N 3.32Å; L113-S115 PolarHBondContact O-N 3.13Å; S115-R118 WeakPolarHBondContact O-CG 3.48Å; S115-R118 PolarHBondContact O-NH1 2.94Å
116	F	90.3	Very high	84.5	Confident	28 Å²	28	51.5 Å²	51.5	12%	0.123	28%	0.275	C	S	.	.	H	α-helix	trans	-84.3	-28.1	-177.2	-64.6	-76.1	0	0	0	113.6	F63 P68 L84 W94 Y96 L102 S112 L113 R118	F63-F116 HydrophobicContact CE2-CE1 4.02Å; F63-F116 HydrophobicContact CZ-CD1 4.44Å; F63-F116 AromaticContact CZ-CE1 3.84Å; F63-F116 HydrophobicContact CZ-CE1 3.84Å; P68-F116 HydrophobicContact CG-CE2 4.02Å; L84-F116 HydrophobicContact CD1-CD1 4.14Å; L84-F116 HydrophobicContact CD1-CE1 4.31Å; W94-F116 HydrophobicContact CH2-CB 4.39Å; W94-F116 AromaticContact CH2-CD1 3.94Å; W94-F116 HydrophobicContact CH2-CD1 3.94Å; W94-F116 HydrophobicContact CZ3-CD1 4.07Å; Y96-F116 AromaticContact CD2-CE1 3.45Å; Y96-F116 HydrophobicContact CD2-CE1 3.45Å; Y96-F116 VanDerWaalsContact CD2-CE1 3.45Å; Y96-F116 AromaticContact CD2-CZ 3.58Å; Y96-F116 HydrophobicContact CD2-CZ 3.58Å; Y96-F116 HydrophobicContact CE2-CE1 4.02Å; Y96-F116 AromaticContact CE2-CZ 3.65Å; Y96-F116 HydrophobicContact CE2-CZ 3.65Å; Y96-F116 AromaticContact CG-CE1 3.84Å; Y96-F116 HydrophobicContact CG-CE1 3.84Å; Y96-F116 HydrophobicContact CG-CZ 4.09Å; L102-F116 HydrophobicContact CD1-CD2 4.18Å; L102-F116 HydrophobicContact CD1-CE1 4.46Å; L102-F116 HydrophobicContact CD1-CE2 3.79Å; L102-F116 HydrophobicContact CD1-CZ 3.94Å; L102-F116 HydrophobicContact CD2-CD2 4.08Å; L102-F116 HydrophobicContact CD2-CE2 3.57Å; L102-F116 HydrophobicContact CD2-CZ 4.35Å; L102-F116 HydrophobicContact CG-CE2 4.36Å; S112-F116 WeakPolarHBondContact O-CD2 3.16Å; L113-F116 PolarHBondContact O-N 2.78Å; F116-R118 VanDerWaalsContact C-N 3.29Å; F116-R118 PolarHBondContact O-N 3.27Å
117	S	91.8	Very high	86.2	Confident	25 Å²	25	51.6 Å²	51.6	18%	0.175	27%	0.272	C	S	.	.	S	Bend	trans	-82.6	77	178.7	-55.3	0	0	0	0	109.3	L113 P166 I169 H170	L113-S117 WeakPolarHBondContact O-CB 3.3Å; L113-S117 PolarHBondContact O-N 3.49Å; L113-S117 PolarHBondContact O-OG 2.94Å; S117-P166 WeakPolarHBondContact O-CG 3.38Å; S117-I169 VanDerWaalsContact CB-CD1 3.43Å; S117-I169 WeakPolarHBondContact OG-CD1 3.34Å; S117-H170 PolarHBondContact O-CD2 2.91Å; S117-H170 PolarHBondContact O-NE2 3.48Å
118	R	95.6	Very high	87.7	Confident	5 Å²	5	49.9 Å²	49.9	2%	0.019	27%	0.265	C	S	.	.			trans	-94.5	153	-175.5	-54.8	178.4	74.3	78	-2.9	110.8	N85 D88 S115 F116 Y120 F133 F164	N85-R118 PolarHBondContact OD1-NH2 2.79Å; D88-R118 IonicContact OD1-NE 3.97Å; D88-R118 IonicContact OD2-CZ 3.28Å; D88-R118 VanDerWaalsContact OD2-CZ 3.28Å; D88-R118 IonicContact OD2-NE 2.94Å; D88-R118 PolarHBondContact OD2-NE 2.91Å; D88-R118 IonicContact OD2-NH2 2.73Å; D88-R118 PolarHBondContact OD2-NH2 2.87Å; S115-R118 WeakPolarHBondContact O-CG 3.48Å; S115-R118 PolarHBondContact O-NH1 2.94Å; F116-R118 VanDerWaalsContact C-N 3.29Å; F116-R118 PolarHBondContact O-N 3.27Å; R118-Y120 WeakPolarHBondContact O-CD1 3.48Å; R118-F133 HydrophobicContact CB-CD1 3.61Å; R118-F133 HydrophobicContact CB-CE1 3.92Å; R118-F133 HydrophobicContact CB-CG 4.29Å; R118-F133 HydrophobicContact CG-CD1 3.81Å; R118-F133 HydrophobicContact CG-CE1 4.05Å; R118-F133 PolarHBondContact NH2-O 3.2Å; R118-F133 VanDerWaalsContact NH2-O 3.12Å; R118-F164 WeakPolarHBondContact O-CD1 3.37Å
119	T	97.8	Very high	89.4	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.264	C	S	.	.			trans	-78.7	126.4	164.9	-59.8	0	0	0	0	108.9	F140 I163 F164 V165 Y171 I216	T119-F140 HydrophobicContact CG2-CB 3.74Å; T119-F140 HydrophobicContact CG2-CD1 3.89Å; T119-F140 HydrophobicContact CG2-CD2 3.45Å; T119-F140 VanDerWaalsContact CG2-CD2 3.45Å; T119-F140 HydrophobicContact CG2-CE1 4.3Å; T119-F140 HydrophobicContact CG2-CE2 3.88Å; T119-F140 HydrophobicContact CG2-CG 3.41Å; T119-F140 VanDerWaalsContact CG2-CG 3.41Å; T119-F140 HydrophobicContact CG2-CZ 4.27Å; T119-F140 WeakPolarHBondContact O-CD2 3.34Å; T119-F140 WeakPolarHBondContact O-CE2 3.33Å; T119-I163 HydrophobicContact CG2-CG2 3.73Å; T119-F164 VanDerWaalsContact CA-O 3.25Å; T119-F164 WeakPolarHBondContact CA-O 3.39Å; T119-F164 WeakPolarHBondContact CG2-O 3.19Å; T119-V165 HydrophobicContact CG2-CG2 4.08Å; T119-Y171 WeakPolarHBondContact OG1-CE2 3.25Å; T119-Y171 PolarHBondContact OG1-OH 3.13Å; T119-I216 HydrophobicContact CG2-CD1 4.06Å
120	Y	98	Very high	91	Very high	91 Å²	91	46.4 Å²	46.4	36%	0.357	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	151.3	-178.2	71.9	-83.3	0	0	0	112.3	R118 Q122 I163 F164	R118-Y120 WeakPolarHBondContact O-CD1 3.48Å; Y120-Q122 HydrophobicContact CD2-CG 4.34Å; Y120-Q122 HydrophobicContact CE2-CB 4.5Å; Y120-Q122 HydrophobicContact CE2-CG 3.59Å; Y120-Q122 PolarHBondContact O-N 3.29Å; Y120-Q122 PolarHBondContact OH-NE2 2.83Å; Y120-I163 WeakPolarHBondContact O-CA 3.41Å; Y120-F164 HydrophobicContact CD1-CB 4.07Å; Y120-F164 AromaticContact CD1-CD1 3.94Å; Y120-F164 HydrophobicContact CD1-CD1 3.94Å; Y120-F164 HydrophobicContact CD1-CG 4.44Å; Y120-F164 HydrophobicContact CE1-CB 3.69Å; Y120-F164 AromaticContact CE1-CD1 3.45Å; Y120-F164 HydrophobicContact CE1-CD1 3.45Å; Y120-F164 VanDerWaalsContact CE1-CD1 3.45Å; Y120-F164 HydrophobicContact CE1-CE1 4.35Å; Y120-F164 AromaticContact CE1-CG 3.82Å; Y120-F164 HydrophobicContact CE1-CG 3.82Å; Y120-F164 PolarHBondContact N-O 3.08Å; Y120-F164 VanDerWaalsContact N-O 3.13Å; Y120-F164 PolarHBondContact O-N 3.02Å
121	P	97.8	Very high	92.3	Very high	24 Å²	24	45 Å²	45	16%	0.156	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	118.6	172.3	30.4	-32.3	0	0	0	110.2	L131 Y142 E162	P121-L131 HydrophobicContact CG-CD1 4.46Å; P121-Y142 HydrophobicContact CB-CD1 4.08Å; P121-Y142 HydrophobicContact CB-CE1 3.64Å; P121-Y142 HydrophobicContact CG-CD1 4.15Å; P121-Y142 HydrophobicContact CG-CD2 4.14Å; P121-Y142 HydrophobicContact CG-CE1 3.82Å; P121-Y142 HydrophobicContact CG-CE2 3.88Å; P121-Y142 HydrophobicContact CG-CG 4.29Å; P121-E162 CarbonylContact C-O 2.87Å; P121-E162 WeakPolarHBondContact CA-O 3.39Å
122	Q	96.2	Very high	93.6	Very high	94 Å²	94	47 Å²	47	44%	0.439	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-36	171	-71	-167	-33.9	0	0	111.5	Y120 E162 F164	Y120-Q122 HydrophobicContact CD2-CG 4.34Å; Y120-Q122 HydrophobicContact CE2-CB 4.5Å; Y120-Q122 HydrophobicContact CE2-CG 3.59Å; Y120-Q122 PolarHBondContact O-N 3.29Å; Y120-Q122 PolarHBondContact OH-NE2 2.83Å; Q122-E162 PolarHBondContact N-O 3.28Å; Q122-F164 HydrophobicContact CG-CB 3.98Å
123	S	96.2	Very high	94.8	Very high	45 Å²	45	46.2 Å²	46.2	32%	0.315	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	151.3	176.7	80.7	0	0	0	0	110.6	A161 E162	S123-A161 WeakPolarHBondContact O-CA 3.4Å; S123-E162 PolarHBondContact N-O 3.12Å; S123-E162 PolarHBondContact O-N 3.1Å; S123-E162 WeakPolarHBondContact OG-CB 3.44Å; S123-E162 VanDerWaalsContact OG-CD 3.23Å; S123-E162 VanDerWaalsContact OG-CG 3.3Å; S123-E162 WeakPolarHBondContact OG-CG 3.16Å; S123-E162 PolarHBondContact OG-OE1 2.99Å
124	T	96.6	Very high	95.4	Very high	38 Å²	38	47.9 Å²	47.9	23%	0.233	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	132.3	176	-59.6	0	0	0	0	110.5	G126 Y142 F144 V160	T124-G126 PolarHBondContact O-N 3.18Å; T124-G126 VanDerWaalsContact O-N 3.07Å; T124-Y142 VanDerWaalsContact CB-OH 3.31Å; T124-Y142 WeakPolarHBondContact CB-OH 3.31Å; T124-Y142 HydrophobicContact CG2-CE1 4.11Å; T124-Y142 WeakPolarHBondContact CG2-OH 3.16Å; T124-Y142 WeakPolarHBondContact OG1-CE1 2.99Å; T124-Y142 PolarHBondContact OG1-OH 3.35Å; T124-F144 HydrophobicContact CG2-CB 3.95Å; T124-F144 HydrophobicContact CG2-CD1 3.73Å; T124-F144 HydrophobicContact CG2-CD2 3.42Å; T124-F144 VanDerWaalsContact CG2-CD2 3.42Å; T124-F144 HydrophobicContact CG2-CE1 3.99Å; T124-F144 HydrophobicContact CG2-CE2 3.7Å; T124-F144 HydrophobicContact CG2-CG 3.42Å; T124-F144 VanDerWaalsContact CG2-CG 3.42Å; T124-F144 HydrophobicContact CG2-CZ 3.98Å; T124-V160 CarbonylContact C-O 3.48Å; T124-V160 WeakPolarHBondContact CA-O 3.16Å
125	A	94.4	Very high	95.6	Very high	31 Å²	31	44.9 Å²	44.9	26%	0.256	23%	0.234	S	C	.	.	S	Bend	trans	-85	58.6	174.9	0	0	0	0	0	111.1	T147 V160	A125-T147 PolarHBondContact O-N 2.61Å; A125-T147 PolarHBondContact O-OG1 3.06Å; A125-V160 PolarHBondContact N-O 3.17Å
126	G	94.5	Very high	95.6	Very high	15 Å²	15	49.4 Å²	49.4	16%	0.155	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.5	-177.5	-172.2	0	0	0	0	0	113.5	T124 P128 V145	T124-G126 PolarHBondContact O-N 3.18Å; T124-G126 VanDerWaalsContact O-N 3.07Å; G126-P128 WeakPolarHBondContact O-CD 3.37Å; G126-V145 CarbonylContact C-O 3.42Å; G126-V145 WeakPolarHBondContact CA-O 3.04Å
127	Q	94.9	Very high	95.8	Very high	126 Å²	126	50.8 Å²	50.8	59%	0.589	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96	114.9	173.4	-177.2	58.2	43.6	0	0	109.5	F144 V145	Q127-F144 CarbonylContact O-C 3.56Å; Q127-F144 VanDerWaalsContact O-CA 3.28Å; Q127-F144 WeakPolarHBondContact O-CA 3.5Å; Q127-F144 WeakPolarHBondContact O-CB 3.2Å; Q127-V145 HydrophobicContact CB-CB 4.48Å; Q127-V145 PolarHBondContact N-O 3.49Å; Q127-V145 PolarHBondContact O-N 3.22Å
128	P	96.7	Very high	95.9	Very high	41 Å²	41	49.7 Å²	49.7	27%	0.266	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	138.3	175.5	-22.5	32.5	0	0	0	112	F91 G126 Y142	F91-P128 HydrophobicContact CD1-CB 3.61Å; F91-P128 HydrophobicContact CD1-CG 4.4Å; F91-P128 HydrophobicContact CD2-CB 4.23Å; F91-P128 HydrophobicContact CE1-CB 3.32Å; F91-P128 HydrophobicContact CE1-CG 4.42Å; F91-P128 HydrophobicContact CE2-CB 3.97Å; F91-P128 HydrophobicContact CG-CB 4.04Å; F91-P128 HydrophobicContact CZ-CB 3.48Å; F91-P128 VanDerWaalsContact CZ-CB 3.48Å; G126-P128 WeakPolarHBondContact O-CD 3.37Å; P128-Y142 HydrophobicContact CB-CE2 4.13Å
129	V	97.3	Very high	96.1	Very high	77 Å²	77	51 Å²	51	47%	0.467	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	-48.5	-178	175.8	0	0	0	0	111.6	F91 A143 V145 L211	F91-V129 VanDerWaalsContact CE2-C 3.48Å; F91-V129 WeakPolarHBondContact CE2-O 3.06Å; V129-A143 PolarHBondContact N-O 2.97Å; V129-V145 HydrophobicContact CG2-CG2 3.68Å; V129-L211 HydrophobicContact CB-CD1 4.28Å; V129-L211 HydrophobicContact CG1-CD1 4.45Å; V129-L211 HydrophobicContact CG2-CD1 4.01Å
130	Q	97.7	Very high	96.1	Very high	97 Å²	97	51 Å²	51	45%	0.453	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	139.2	179.6	-173.2	176.2	11	0	0	111.5	F91 Y141 Y142 A143	F91-Q130 VanDerWaalsContact CZ-N 3.33Å; Q130-Y141 HydrophobicContact CB-CE1 4.01Å; Q130-Y141 HydrophobicContact CG-CD1 4.23Å; Q130-Y141 HydrophobicContact CG-CE1 3.81Å; Q130-Y142 CarbonylContact O-C 3.57Å; Q130-Y142 WeakPolarHBondContact O-CA 3.41Å; Q130-Y142 VanDerWaalsContact O-CD2 3.3Å; Q130-Y142 WeakPolarHBondContact O-CD2 3.17Å; Q130-A143 HydrophobicContact CB-CB 4.37Å; Q130-A143 PolarHBondContact N-O 3.33Å; Q130-A143 VanDerWaalsContact N-O 3.15Å; Q130-A143 PolarHBondContact O-N 2.93Å
131	L	98.1	Very high	96.1	Very high	13 Å²	13	48.7 Å²	48.7	7%	0.068	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	134.5	176.1	174.7	68.5	0	0	0	108.8	D88 F91 P121 F140 Y142	D88-L131 HydrophobicContact CB-CD2 3.97Å; D88-L131 HydrophobicContact CB-CG 4.15Å; F91-L131 HydrophobicContact CD1-CB 4.19Å; F91-L131 HydrophobicContact CD1-CD2 4.33Å; F91-L131 HydrophobicContact CE1-CB 3.44Å; F91-L131 VanDerWaalsContact CE1-CB 3.44Å; F91-L131 HydrophobicContact CE1-CD2 4.25Å; F91-L131 HydrophobicContact CE1-CG 4.43Å; F91-L131 HydrophobicContact CZ-CB 3.78Å; P121-L131 HydrophobicContact CG-CD1 4.46Å; L131-F140 HydrophobicContact CD1-CD2 4.3Å; L131-F140 HydrophobicContact CD1-CE2 3.41Å; L131-F140 VanDerWaalsContact CD1-CE2 3.41Å; L131-F140 HydrophobicContact CD1-CZ 3.94Å; L131-Y142 HydrophobicContact CB-CD2 4.26Å; L131-Y142 HydrophobicContact CD1-CD2 4.01Å; L131-Y142 HydrophobicContact CD1-CG 4.42Å
132	R	97.5	Very high	96.2	Very high	125 Å²	125	47.6 Å²	47.6	47%	0.472	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	127.6	172.5	-173.3	176	71.8	104.1	0.2	109.4	Y141	R132-Y141 PolarHBondContact N-O 2.9Å; R132-Y141 PolarHBondContact O-N 3.37Å
133	F	97.8	Very high	96.3	Very high	3 Å²	3	43.1 Å²	43.1	1%	0.013	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	125.1	166.6	179.4	-112.7	0	0	0	108.9	R118 V135 F140 H170	R118-F133 HydrophobicContact CB-CD1 3.61Å; R118-F133 HydrophobicContact CB-CE1 3.92Å; R118-F133 HydrophobicContact CB-CG 4.29Å; R118-F133 HydrophobicContact CG-CD1 3.81Å; R118-F133 HydrophobicContact CG-CE1 4.05Å; R118-F133 PolarHBondContact NH2-O 3.2Å; R118-F133 VanDerWaalsContact NH2-O 3.12Å; F133-V135 HydrophobicContact CE1-CB 4.36Å; F133-F140 HydrophobicContact CB-CD2 4.42Å; F133-F140 HydrophobicContact CD2-CB 4.04Å; F133-F140 HydrophobicContact CD2-CD2 4.36Å; F133-H170 AromaticContact CE1-CE1 3.93Å; F133-H170 AromaticContact CE1-NE2 3.82Å; F133-H170 AromaticContact CZ-CD2 3.73Å; F133-H170 AromaticContact CZ-CE1 3.65Å; F133-H170 AromaticContact CZ-CG 3.77Å; F133-H170 AromaticContact CZ-ND1 3.76Å; F133-H170 AromaticContact CZ-NE2 3.64Å
134	D	95.6	Very high	96.3	Very high	51 Å²	51	41 Å²	41	27%	0.273	22%	0.22	S	C	.	.			trans	-94.5	108.6	174.4	-173.4	-70.1	0	0	0	108.2	D136 S137 G138 V139	D134-D136 VanDerWaalsContact C-N 3.27Å; D134-D136 PolarHBondContact O-N 3.01Å; D134-D136 PolarHBondContact OD1-N 2.99Å; D134-S137 VanDerWaalsContact CB-OG 3.32Å; D134-S137 WeakPolarHBondContact CB-OG 3.28Å; D134-S137 WeakPolarHBondContact OD1-CB 3.17Å; D134-S137 PolarHBondContact OD1-N 3.49Å; D134-S137 PolarHBondContact OD1-OG 2.9Å; D134-G138 WeakPolarHBondContact O-CA 2.89Å; D134-G138 PolarHBondContact O-N 2.99Å; D134-V139 HydrophobicContact CB-CB 4.46Å; D134-V139 PolarHBondContact N-O 3.35Å
135	V	92.8	Very high	96.3	Very high	8 Å²	8	42 Å²	42	5%	0.048	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-33.5	-174.8	64.3	0	0	0	0	112.1	K114 F133 H170	K114-V135 WeakPolarHBondContact CE-O 3.29Å; K114-V135 HydrophobicContact CG-CG2 4.12Å; F133-V135 HydrophobicContact CE1-CB 4.36Å; V135-H170 PolarHBondContact O-CE1 2.93Å; V135-H170 PolarHBondContact O-ND1 3.04Å
136	D	90.1	Very high	96.3	Very high	101 Å²	101	41.4 Å²	41.4	54%	0.54	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-47.8	-173.4	-66.8	-41.3	0	0	0	111.4	K114 D134	K114-D136 PolarHBondContact NZ-O 3.18Å; D134-D136 VanDerWaalsContact C-N 3.27Å; D134-D136 PolarHBondContact O-N 3.01Å; D134-D136 PolarHBondContact OD1-N 2.99Å
137	S	94.1	Very high	96.1	Very high	57 Å²	57	45 Å²	45	40%	0.399	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-10.9	-179.1	66.9	0	0	0	0	114.3	D134 V139 P218	D134-S137 VanDerWaalsContact CB-OG 3.32Å; D134-S137 WeakPolarHBondContact CB-OG 3.28Å; D134-S137 WeakPolarHBondContact OD1-CB 3.17Å; D134-S137 PolarHBondContact OD1-N 3.49Å; D134-S137 PolarHBondContact OD1-OG 2.9Å; S137-V139 PolarHBondContact O-N 3.4Å; S137-V139 WeakPolarHBondContact OG-CG2 3.37Å; S137-V139 PolarHBondContact OG-N 3.39Å; S137-P218 WeakPolarHBondContact O-CD 3.3Å; S137-P218 WeakPolarHBondContact O-CG 2.99Å
138	G	95.3	Very high	95.5	Very high	1 Å²	1	43 Å²	43	1%	0.01	23%	0.229	C	C	.	.			trans	66.8	8.5	-173.7	0	0	0	0	0	114.1	D134 F140 Y171	D134-G138 WeakPolarHBondContact O-CA 2.89Å; D134-G138 PolarHBondContact O-N 2.99Å; G138-F140 PolarHBondContact O-N 3.29Å; G138-Y171 VanDerWaalsContact O-CE1 3.26Å; G138-Y171 WeakPolarHBondContact O-CE1 2.79Å; G138-Y171 VanDerWaalsContact O-CZ 3.28Å; G138-Y171 PolarHBondContact O-OH 2.72Å
139	V	97.8	Very high	94.4	Very high	34 Å²	34	49.1 Å²	49.1	21%	0.206	25%	0.252	C	S	.	.			trans	-75.1	123.1	-178.6	177.1	0	0	0	0	109.9	D134 S137 T215 I217	D134-V139 HydrophobicContact CB-CB 4.46Å; D134-V139 PolarHBondContact N-O 3.35Å; S137-V139 PolarHBondContact O-N 3.4Å; S137-V139 WeakPolarHBondContact OG-CG2 3.37Å; S137-V139 PolarHBondContact OG-N 3.39Å; V139-T215 HydrophobicContact CG1-CG2 4.43Å; V139-I217 HydrophobicContact CG2-CG2 4.35Å
140	F	98.6	Very high	93.5	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	136.1	176.7	171.9	-98	0	0	0	110.4	T119 L131 F133 G138 Y142 I163 I214 T215 I216	T119-F140 HydrophobicContact CG2-CB 3.74Å; T119-F140 HydrophobicContact CG2-CD1 3.89Å; T119-F140 HydrophobicContact CG2-CD2 3.45Å; T119-F140 VanDerWaalsContact CG2-CD2 3.45Å; T119-F140 HydrophobicContact CG2-CE1 4.3Å; T119-F140 HydrophobicContact CG2-CE2 3.88Å; T119-F140 HydrophobicContact CG2-CG 3.41Å; T119-F140 VanDerWaalsContact CG2-CG 3.41Å; T119-F140 HydrophobicContact CG2-CZ 4.27Å; T119-F140 WeakPolarHBondContact O-CD2 3.34Å; T119-F140 WeakPolarHBondContact O-CE2 3.33Å; L131-F140 HydrophobicContact CD1-CD2 4.3Å; L131-F140 HydrophobicContact CD1-CE2 3.41Å; L131-F140 VanDerWaalsContact CD1-CE2 3.41Å; L131-F140 HydrophobicContact CD1-CZ 3.94Å; F133-F140 HydrophobicContact CB-CD2 4.42Å; F133-F140 HydrophobicContact CD2-CB 4.04Å; F133-F140 HydrophobicContact CD2-CD2 4.36Å; G138-F140 PolarHBondContact O-N 3.29Å; F140-Y142 VanDerWaalsContact CE1-CB 3.45Å; F140-Y142 HydrophobicContact CE1-CG 4.46Å; F140-Y142 HydrophobicContact CZ-CD1 4.49Å; F140-Y142 HydrophobicContact CZ-CG 4.07Å; F140-I163 HydrophobicContact CE1-CD1 4.07Å; F140-I163 HydrophobicContact CE1-CG2 4.14Å; F140-I163 HydrophobicContact CZ-CG2 4.1Å; F140-I214 HydrophobicContact CE1-CG2 4.4Å; F140-T215 CarbonylContact O-C 3.54Å; F140-T215 VanDerWaalsContact O-CA 3.24Å; F140-T215 WeakPolarHBondContact O-CA 3.46Å; F140-T215 WeakPolarHBondContact O-CG2 3.42Å; F140-I216 HydrophobicContact CB-CB 4.12Å; F140-I216 HydrophobicContact CD1-CB 4.2Å; F140-I216 HydrophobicContact CD1-CD1 3.76Å; F140-I216 HydrophobicContact CD1-CG1 3.95Å; F140-I216 HydrophobicContact CE1-CD1 4.16Å; F140-I216 PolarHBondContact N-O 2.84Å; F140-I216 PolarHBondContact O-N 2.72Å
141	Y	98.6	Very high	92.7	Very high	41 Å²	41	48.6 Å²	48.6	16%	0.161	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	132.7	171.2	172.7	-90.6	0	0	0	109.9	Q130 R132 A143 E213 I214	Q130-Y141 HydrophobicContact CB-CE1 4.01Å; Q130-Y141 HydrophobicContact CG-CD1 4.23Å; Q130-Y141 HydrophobicContact CG-CE1 3.81Å; R132-Y141 PolarHBondContact N-O 2.9Å; R132-Y141 PolarHBondContact O-N 3.37Å; Y141-A143 HydrophobicContact CE1-CB 4.04Å; Y141-E213 HydrophobicContact CE2-CB 4.18Å; Y141-E213 HydrophobicContact CE2-CG 4.41Å; Y141-E213 PolarHBondContact OH-OE2 3.01Å; Y141-I214 WeakPolarHBondContact CA-O 3.17Å
142	Y	98.7	Very high	91.6	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.008	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	134	177.4	178.6	-130.9	0	0	0	111.3	F91 P121 T124 P128 Q130 L131 F140 F144 E213 I214	F91-Y142 HydrophobicContact CE1-CD2 4.33Å; F91-Y142 AromaticContact CE1-CE2 3.78Å; F91-Y142 HydrophobicContact CE1-CE2 3.78Å; F91-Y142 HydrophobicContact CZ-CE2 4.28Å; P121-Y142 HydrophobicContact CB-CD1 4.08Å; P121-Y142 HydrophobicContact CB-CE1 3.64Å; P121-Y142 HydrophobicContact CG-CD1 4.15Å; P121-Y142 HydrophobicContact CG-CD2 4.14Å; P121-Y142 HydrophobicContact CG-CE1 3.82Å; P121-Y142 HydrophobicContact CG-CE2 3.88Å; P121-Y142 HydrophobicContact CG-CG 4.29Å; T124-Y142 VanDerWaalsContact CB-OH 3.31Å; T124-Y142 WeakPolarHBondContact CB-OH 3.31Å; T124-Y142 HydrophobicContact CG2-CE1 4.11Å; T124-Y142 WeakPolarHBondContact CG2-OH 3.16Å; T124-Y142 WeakPolarHBondContact OG1-CE1 2.99Å; T124-Y142 PolarHBondContact OG1-OH 3.35Å; P128-Y142 HydrophobicContact CB-CE2 4.13Å; Q130-Y142 CarbonylContact O-C 3.57Å; Q130-Y142 WeakPolarHBondContact O-CA 3.41Å; Q130-Y142 VanDerWaalsContact O-CD2 3.3Å; Q130-Y142 WeakPolarHBondContact O-CD2 3.17Å; L131-Y142 HydrophobicContact CB-CD2 4.26Å; L131-Y142 HydrophobicContact CD1-CD2 4.01Å; L131-Y142 HydrophobicContact CD1-CG 4.42Å; F140-Y142 VanDerWaalsContact CE1-CB 3.45Å; F140-Y142 HydrophobicContact CE1-CG 4.46Å; F140-Y142 HydrophobicContact CZ-CD1 4.49Å; F140-Y142 HydrophobicContact CZ-CG 4.07Å; Y142-F144 AromaticContact CD1-CD1 3.98Å; Y142-F144 HydrophobicContact CD1-CD1 3.98Å; Y142-F144 HydrophobicContact CD1-CE1 4.41Å; Y142-F144 AromaticContact CE1-CD1 3.49Å; Y142-F144 HydrophobicContact CE1-CD1 3.49Å; Y142-F144 VanDerWaalsContact CE1-CD1 3.49Å; Y142-F144 HydrophobicContact CE1-CE1 4.04Å; Y142-F144 HydrophobicContact CE1-CG 4.32Å; Y142-F144 AromaticContact CZ-CD1 3.95Å; Y142-E213 CarbonylContact O-C 3.6Å; Y142-E213 WeakPolarHBondContact O-CA 3.23Å; Y142-I214 HydrophobicContact CD1-CD1 4.37Å; Y142-I214 PolarHBondContact N-O 2.01Å; Y142-I214 PolarHBondContact O-N 3.35Å
143	A	98.4	Very high	90.7	Very high	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	140.1	177.1	0	0	0	0	0	111.9	V129 Q130 Y141 L211 I212 E213	V129-A143 PolarHBondContact N-O 2.97Å; Q130-A143 HydrophobicContact CB-CB 4.37Å; Q130-A143 PolarHBondContact N-O 3.33Å; Q130-A143 VanDerWaalsContact N-O 3.15Å; Q130-A143 PolarHBondContact O-N 2.93Å; Y141-A143 HydrophobicContact CE1-CB 4.04Å; A143-L211 HydrophobicContact CB-CD1 4.16Å; A143-L211 HydrophobicContact CB-CD2 4.45Å; A143-L211 HydrophobicContact CB-CG 4.38Å; A143-I212 CarbonylContact C-O 3.54Å; A143-I212 WeakPolarHBondContact CA-O 3.36Å; A143-E213 HydrophobicContact CB-CG 4.1Å
144	F	97.8	Very high	89.6	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	154.9	179	67.1	-88.3	0	0	0	112.2	T124 Q127 Y142 V160 A161 I212 I214	T124-F144 HydrophobicContact CG2-CB 3.95Å; T124-F144 HydrophobicContact CG2-CD1 3.73Å; T124-F144 HydrophobicContact CG2-CD2 3.42Å; T124-F144 VanDerWaalsContact CG2-CD2 3.42Å; T124-F144 HydrophobicContact CG2-CE1 3.99Å; T124-F144 HydrophobicContact CG2-CE2 3.7Å; T124-F144 HydrophobicContact CG2-CG 3.42Å; T124-F144 VanDerWaalsContact CG2-CG 3.42Å; T124-F144 HydrophobicContact CG2-CZ 3.98Å; Q127-F144 CarbonylContact O-C 3.56Å; Q127-F144 VanDerWaalsContact O-CA 3.28Å; Q127-F144 WeakPolarHBondContact O-CA 3.5Å; Q127-F144 WeakPolarHBondContact O-CB 3.2Å; Y142-F144 AromaticContact CD1-CD1 3.98Å; Y142-F144 HydrophobicContact CD1-CD1 3.98Å; Y142-F144 HydrophobicContact CD1-CE1 4.41Å; Y142-F144 AromaticContact CE1-CD1 3.49Å; Y142-F144 HydrophobicContact CE1-CD1 3.49Å; Y142-F144 VanDerWaalsContact CE1-CD1 3.49Å; Y142-F144 HydrophobicContact CE1-CE1 4.04Å; Y142-F144 HydrophobicContact CE1-CG 4.32Å; Y142-F144 AromaticContact CZ-CD1 3.95Å; F144-V160 HydrophobicContact CE2-CB 4.34Å; F144-V160 HydrophobicContact CZ-CB 3.97Å; F144-V160 HydrophobicContact CZ-CG2 4.1Å; F144-A161 HydrophobicContact CE1-CB 4.38Å; F144-I212 HydrophobicContact CD1-CB 4.27Å; F144-I212 HydrophobicContact CD1-CG2 4.15Å; F144-I212 HydrophobicContact CD2-CB 4.45Å; F144-I212 HydrophobicContact CE1-CB 3.89Å; F144-I212 HydrophobicContact CE1-CG2 3.43Å; F144-I212 VanDerWaalsContact CE1-CG2 3.43Å; F144-I212 HydrophobicContact CE2-CB 4.1Å; F144-I212 HydrophobicContact CE2-CD1 3.72Å; F144-I212 HydrophobicContact CE2-CG1 4.43Å; F144-I212 HydrophobicContact CE2-CG2 4.37Å; F144-I212 HydrophobicContact CZ-CB 3.8Å; F144-I212 HydrophobicContact CZ-CD1 3.71Å; F144-I212 HydrophobicContact CZ-CG1 4.35Å; F144-I212 HydrophobicContact CZ-CG2 3.57Å; F144-I212 PolarHBondContact N-O 2.84Å; F144-I212 PolarHBondContact O-N 2.9Å; F144-I214 HydrophobicContact CE1-CD1 3.85Å
145	V	95.8	Very high	88.7	Confident	58 Å²	58	61.7 Å²	61.7	35%	0.352	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	118.4	172.8	-178.1	0	0	0	0	108.5	G126 Q127 V129 T147 E210 L211	G126-V145 CarbonylContact C-O 3.42Å; G126-V145 WeakPolarHBondContact CA-O 3.04Å; Q127-V145 HydrophobicContact CB-CB 4.48Å; Q127-V145 PolarHBondContact N-O 3.49Å; Q127-V145 PolarHBondContact O-N 3.22Å; V129-V145 HydrophobicContact CG2-CG2 3.68Å; V145-T147 PolarHBondContact O-N 2.53Å; V145-E210 WeakPolarHBondContact CG2-O 3.35Å; V145-L211 HydrophobicContact CG2-CD1 4.49Å
146	P	93.9	Very high	88.4	Confident	19 Å²	19	63 Å²	63	12%	0.123	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	131.7	178.3	26.3	-32.7	0	0	0	110.9	I209 I212	P146-I209 HydrophobicContact CG-CB 4.35Å; P146-I209 HydrophobicContact CG-CG2 4.22Å; P146-I212 HydrophobicContact CB-CD1 3.97Å; P146-I212 HydrophobicContact CG-CD1 4.03Å; P146-I212 HydrophobicContact CG-CG1 4.33Å
147	T	90.8	Very high	88.4	Confident	91 Å²	91	61.8 Å²	61.8	56%	0.558	35%	0.346	S	S	*	.			trans	-93.8	-22.5	177.8	49.5	0	0	0	0	112.4	A125 V145 K149	A125-T147 PolarHBondContact O-N 2.61Å; A125-T147 PolarHBondContact O-OG1 3.06Å; V145-T147 PolarHBondContact O-N 2.53Å; T147-K149 PolarHBondContact O-N 3.06Å
148	Q	81.9	Confident	88.3	Confident	85 Å²	85	60.9 Å²	60.9	40%	0.397	34%	0.336	S	S	.	.			trans	-72.7	115.2	178.7	-171.4	67.8	19.2	0	0	111	N150 L158	Q148-N150 WeakPolarHBondContact CG-O 3.39Å; Q148-N150 PolarHBondContact NE2-O 3.19Å; Q148-L158 HydrophobicContact CB-CD2 3.91Å; Q148-L158 HydrophobicContact CG-CD1 3.94Å; Q148-L158 HydrophobicContact CG-CD2 3.65Å; Q148-L158 HydrophobicContact CG-CG 4.46Å
149	K	74.5	Confident	88.2	Confident	169 Å²	169	63.8 Å²	63.8	74%	0.735	35%	0.351	S	S	*	.			trans	-104.9	-6.1	179.4	-62.2	-167.7	179	-172.4	0	114.8	T147 I205	T147-K149 PolarHBondContact O-N 3.06Å; K149-I205 WeakPolarHBondContact O-CG2 3.48Å
150	N	77.9	Confident	88.1	Confident	121 Å²	121	62.3 Å²	62.3	65%	0.647	34%	0.342	S	S	*	.			trans	-125.6	142.1	-174.8	-69.1	-10.2	0	0	0	111	Q148	Q148-N150 WeakPolarHBondContact CG-O 3.39Å; Q148-N150 PolarHBondContact NE2-O 3.19Å
151	C	80.3	Confident	88	Confident	42 Å²	42	62.3 Å²	62.3	28%	0.284	34%	0.342	S	S	.	.			trans	-135.8	137.7	168.4	175.5	0	0	0	0	110.2	N153 S156 C202 I205	C151-N153 PolarHBondContact SG-O 2.93Å; C151-S156 PolarHBondContact SG-OG 3.49Å; C151-C202 HydrophobicContact CB-CB 3.49Å; C151-C202 VanDerWaalsContact CB-CB 3.49Å; C151-C202 WeakPolarHBondContact CB-SG 3.23Å; C151-C202 WeakPolarHBondContact SG-CB 3.17Å; C151-C202 CovalentContact SG-SG 2Å; C151-C202 PolarHBondContact SG-SG 3.45Å; C151-I205 HydrophobicContact CB-CD1 3.48Å; C151-I205 VanDerWaalsContact CB-CD1 3.48Å
152	T	76.5	Confident	88	Confident	151 Å²	151	63 Å²	63	93%	0.926	35%	0.347	S	S	*	.	S	Bend	trans	-75.9	-30.3	-174.2	50.8	0	0	0	0	112.6
153	N	78.3	Confident	88	Confident	86 Å²	86	62.9 Å²	62.9	46%	0.46	35%	0.347	S	S	.	.			trans	-135.3	123.3	-178.3	-174.2	-17.9	0	0	0	110.6	C151 N155 S156	C151-N153 PolarHBondContact SG-O 2.93Å; N153-N155 PolarHBondContact O-N 3.11Å; N153-N155 VanDerWaalsContact O-N 3.14Å; N153-N155 PolarHBondContact OD1-N 3.13Å; N153-S156 WeakPolarHBondContact O-CB 3.42Å; N153-S156 PolarHBondContact O-N 3.06Å; N153-S156 PolarHBondContact O-OG 2.9Å
154	V	73.6	Confident	87.9	Confident	78 Å²	78	65.3 Å²	65.3	47%	0.473	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-29	-178.3	-178.1	0	0	0	0	112.3	S156 T203	V154-S156 VanDerWaalsContact C-N 3.31Å; V154-T203 HydrophobicContact CG1-CG2 4.01Å
155	N	77.3	Confident	87.9	Confident	152 Å²	152	65.3 Å²	65.3	81%	0.813	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	2.5	178.8	-65	-17	0	0	0	113.5	N153	N153-N155 PolarHBondContact O-N 3.11Å; N153-N155 VanDerWaalsContact O-N 3.14Å; N153-N155 PolarHBondContact OD1-N 3.13Å
156	S	87	Confident	87.8	Confident	36 Å²	36	62.8 Å²	62.8	25%	0.252	34%	0.342	S	S	.	.			trans	-89.7	163.3	177.3	69.1	0	0	0	0	112	C151 N153 V154 C202	C151-S156 PolarHBondContact SG-OG 3.49Å; N153-S156 WeakPolarHBondContact O-CB 3.42Å; N153-S156 PolarHBondContact O-N 3.06Å; N153-S156 PolarHBondContact O-OG 2.9Å; V154-S156 VanDerWaalsContact C-N 3.31Å; S156-C202 WeakPolarHBondContact O-CB 3.29Å; S156-C202 PolarHBondContact O-N 2.75Å; S156-C202 VanDerWaalsContact O-N 3.09Å; S156-C202 PolarHBondContact O-SG 2.58Å; S156-C202 PolarHBondContact OG-SG 3.13Å
157	T	90.4	Very high	87.7	Confident	75 Å²	75	64.1 Å²	64.1	46%	0.46	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	147.2	172	52.6	0	0	0	0	108.2	M200	T157-M200 CarbonylContact C-O 3.5Å; T157-M200 WeakPolarHBondContact CA-O 3.33Å
158	L	91.6	Very high	87.7	Confident	38 Å²	38	63.2 Å²	63.2	20%	0.199	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	128.5	-177.7	-149.4	121.8	0	0	0	108.6	Q148 V160 Y199 M200 I205	Q148-L158 HydrophobicContact CB-CD2 3.91Å; Q148-L158 HydrophobicContact CG-CD1 3.94Å; Q148-L158 HydrophobicContact CG-CD2 3.65Å; Q148-L158 HydrophobicContact CG-CG 4.46Å; L158-V160 HydrophobicContact CD2-CG1 4.39Å; L158-V160 PolarHBondContact O-N 2.87Å; L158-Y199 CarbonylContact O-C 3.6Å; L158-Y199 VanDerWaalsContact O-CA 3.27Å; L158-Y199 WeakPolarHBondContact O-CA 3.19Å; L158-M200 PolarHBondContact N-O 2.98Å; L158-M200 PolarHBondContact O-N 2.04Å; L158-I205 HydrophobicContact CD1-CD1 4.45Å
159	L	93.8	Very high	88.1	Confident	62 Å²	62	61.2 Å²	61.2	33%	0.325	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	120.8	173.2	179.3	66.4	0	0	0	108.4	E162 F197 Y199	L159-E162 HydrophobicContact CD1-CG 4.37Å; L159-E162 HydrophobicContact CD2-CG 4.08Å; L159-F197 HydrophobicContact CD1-CB 3.91Å; L159-F197 HydrophobicContact CD1-CD1 3.97Å; L159-F197 HydrophobicContact CD1-CG 4.46Å; L159-F197 HydrophobicContact CD2-CD1 4.42Å; L159-Y199 HydrophobicContact CB-CD1 4.18Å; L159-Y199 HydrophobicContact CB-CE1 3.88Å; L159-Y199 HydrophobicContact CD1-CD1 4.39Å; L159-Y199 HydrophobicContact CD1-CE1 3.94Å; L159-Y199 HydrophobicContact CD1-CE2 4.39Å; L159-Y199 HydrophobicContact CG-CE1 4.49Å
160	V	95.1	Very high	89	Confident	3 Å²	3	53.8 Å²	53.8	2%	0.018	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	-23.1	-176.5	-66.6	0	0	0	0	113.8	T124 A125 F144 L158 V198 M200	T124-V160 CarbonylContact C-O 3.48Å; T124-V160 WeakPolarHBondContact CA-O 3.16Å; A125-V160 PolarHBondContact N-O 3.17Å; F144-V160 HydrophobicContact CE2-CB 4.34Å; F144-V160 HydrophobicContact CZ-CB 3.97Å; F144-V160 HydrophobicContact CZ-CG2 4.1Å; L158-V160 HydrophobicContact CD2-CG1 4.39Å; L158-V160 PolarHBondContact O-N 2.87Å; V160-V198 HydrophobicContact CG2-CB 4.24Å; V160-V198 HydrophobicContact CG2-CG1 3.94Å; V160-V198 VanDerWaalsContact CG2-O 3.28Å; V160-V198 WeakPolarHBondContact CG2-O 3.21Å; V160-V198 PolarHBondContact N-O 2.8Å; V160-M200 HydrophobicContact CG1-CB 3.58Å; V160-M200 HydrophobicContact CG1-CE 4.02Å; V160-M200 HydrophobicContact CG2-CB 4.3Å
161	A	97.2	Very high	89.7	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	146.5	173.6	0	0	0	0	0	111.8	S123 F144 I163 V198 I214	S123-A161 WeakPolarHBondContact O-CA 3.4Å; F144-A161 HydrophobicContact CE1-CB 4.38Å; A161-I163 HydrophobicContact CB-CG1 4.28Å; A161-V198 HydrophobicContact CB-CB 4.29Å; A161-V198 PolarHBondContact N-O 3.01Å; A161-V198 PolarHBondContact O-N 2.91Å; A161-I214 HydrophobicContact CB-CD1 4.25Å
162	E	97.7	Very high	90.3	Very high	55 Å²	55	50.2 Å²	50.2	26%	0.257	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	121.2	165.8	-63.1	170.3	-119.5	0	0	107.5	P121 Q122 S123 L159 F197	P121-E162 CarbonylContact C-O 2.87Å; P121-E162 WeakPolarHBondContact CA-O 3.39Å; Q122-E162 PolarHBondContact N-O 3.28Å; S123-E162 PolarHBondContact N-O 3.12Å; S123-E162 PolarHBondContact O-N 3.1Å; S123-E162 WeakPolarHBondContact OG-CB 3.44Å; S123-E162 VanDerWaalsContact OG-CD 3.23Å; S123-E162 VanDerWaalsContact OG-CG 3.3Å; S123-E162 WeakPolarHBondContact OG-CG 3.16Å; S123-E162 PolarHBondContact OG-OE1 2.99Å; L159-E162 HydrophobicContact CD1-CG 4.37Å; L159-E162 HydrophobicContact CD2-CG 4.08Å; E162-F197 HydrophobicContact CG-CD1 3.73Å; E162-F197 HydrophobicContact CG-CE1 3.79Å
163	I	98.2	Very high	91.1	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	122.5	-172.8	-57.5	174.6	0	0	0	108.4	T119 Y120 F140 A161 V165 L195 I196 V198 I214 I216	T119-I163 HydrophobicContact CG2-CG2 3.73Å; Y120-I163 WeakPolarHBondContact O-CA 3.41Å; F140-I163 HydrophobicContact CE1-CD1 4.07Å; F140-I163 HydrophobicContact CE1-CG2 4.14Å; F140-I163 HydrophobicContact CZ-CG2 4.1Å; A161-I163 HydrophobicContact CB-CG1 4.28Å; I163-V165 HydrophobicContact CG2-CG2 3.95Å; I163-L195 WeakPolarHBondContact O-CA 3.49Å; I163-I196 HydrophobicContact CB-CB 4.43Å; I163-I196 PolarHBondContact N-O 3.18Å; I163-I196 PolarHBondContact O-N 3.29Å; I163-V198 HydrophobicContact CD1-CG2 4.04Å; I163-I214 HydrophobicContact CD1-CD1 3.92Å; I163-I214 HydrophobicContact CD1-CG2 3.84Å; I163-I216 HydrophobicContact CD1-CD1 4.35Å; I163-I216 HydrophobicContact CG2-CD1 3.94Å
164	F	97.6	Very high	91.8	Very high	51 Å²	51	44.3 Å²	44.3	22%	0.224	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	127.4	168.7	178.9	-100.5	0	0	0	110	R118 T119 Y120 Q122 P166 N194 L195	R118-F164 WeakPolarHBondContact O-CD1 3.37Å; T119-F164 VanDerWaalsContact CA-O 3.25Å; T119-F164 WeakPolarHBondContact CA-O 3.39Å; T119-F164 WeakPolarHBondContact CG2-O 3.19Å; Y120-F164 HydrophobicContact CD1-CB 4.07Å; Y120-F164 AromaticContact CD1-CD1 3.94Å; Y120-F164 HydrophobicContact CD1-CD1 3.94Å; Y120-F164 HydrophobicContact CD1-CG 4.44Å; Y120-F164 HydrophobicContact CE1-CB 3.69Å; Y120-F164 AromaticContact CE1-CD1 3.45Å; Y120-F164 HydrophobicContact CE1-CD1 3.45Å; Y120-F164 VanDerWaalsContact CE1-CD1 3.45Å; Y120-F164 HydrophobicContact CE1-CE1 4.35Å; Y120-F164 AromaticContact CE1-CG 3.82Å; Y120-F164 HydrophobicContact CE1-CG 3.82Å; Y120-F164 PolarHBondContact N-O 3.08Å; Y120-F164 VanDerWaalsContact N-O 3.13Å; Y120-F164 PolarHBondContact O-N 3.02Å; Q122-F164 HydrophobicContact CG-CB 3.98Å; F164-P166 HydrophobicContact CE1-CB 3.86Å; F164-P166 HydrophobicContact CE1-CG 4.19Å; F164-P166 HydrophobicContact CZ-CB 4.16Å; F164-N194 CarbonylContact C-O 3.13Å; F164-N194 WeakPolarHBondContact CA-O 3.46Å; F164-N194 HydrophobicContact CD2-CB 4.18Å; F164-N194 WeakPolarHBondContact CD2-O 3.35Å; F164-N194 HydrophobicContact CE2-CB 3.76Å; F164-L195 HydrophobicContact CB-CD2 4.1Å; F164-L195 HydrophobicContact CD2-CD2 4.21Å
165	V	96.8	Very high	92.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.233	C	C	.	.			trans	-130.9	102.7	-175.9	-177.3	0	0	0	0	107.2	T119 I163 M167 Y171 V175 N194 I196 I216	T119-V165 HydrophobicContact CG2-CG2 4.08Å; I163-V165 HydrophobicContact CG2-CG2 3.95Å; V165-M167 VanDerWaalsContact C-N 3.3Å; V165-M167 HydrophobicContact CG1-CG 4.47Å; V165-M167 HydrophobicContact CG1-SD 3.72Å; V165-M167 PolarHBondContact O-N 3.18Å; V165-Y171 HydrophobicContact CG1-CD2 3.34Å; V165-Y171 HydrophobicContact CG1-CE2 3.42Å; V165-Y171 VanDerWaalsContact CG1-CE2 3.42Å; V165-Y171 HydrophobicContact CG1-CG 4.09Å; V165-V175 HydrophobicContact CG1-CG1 4.13Å; V165-N194 PolarHBondContact N-O 3.13Å; V165-N194 WeakPolarHBondContact O-CA 3.37Å; V165-N194 WeakPolarHBondContact O-CB 3.11Å; V165-N194 PolarHBondContact O-OD1 3.15Å; V165-I196 HydrophobicContact CB-CG1 4.49Å; V165-I196 HydrophobicContact CG2-CB 4.15Å; V165-I196 HydrophobicContact CG2-CD1 3.68Å; V165-I196 HydrophobicContact CG2-CG1 3.72Å; V165-I216 HydrophobicContact CG2-CD1 3.98Å
166	P	94.1	Very high	93.8	Very high	4 Å²	4	40.3 Å²	40.3	3%	0.026	22%	0.221	C	C	.	.			trans	-72.4	82.3	-178.7	28.7	-35.5	0	0	0	111.1	S117 F164 S168 I169 H170	S117-P166 WeakPolarHBondContact O-CG 3.38Å; F164-P166 HydrophobicContact CE1-CB 3.86Å; F164-P166 HydrophobicContact CE1-CG 4.19Å; F164-P166 HydrophobicContact CZ-CB 4.16Å; P166-S168 VanDerWaalsContact C-N 3.32Å; P166-S168 PolarHBondContact O-N 3.1Å; P166-I169 HydrophobicContact CB-CB 4.41Å; P166-I169 PolarHBondContact O-N 2.98Å; P166-I169 VanDerWaalsContact O-N 3.12Å; P166-H170 PolarHBondContact O-N 3.4Å; P166-H170 VanDerWaalsContact O-N 3.08Å
167	M	92.6	Very high	94.3	Very high	48 Å²	48	40.4 Å²	40.4	24%	0.236	22%	0.22	C	C	.	.	H	α-helix	trans	-57.7	-42.3	-169.4	-68.1	-66.6	-73.3	0	0	112.5	V165 I169 Y171 P172 V175 T193 N194	V165-M167 VanDerWaalsContact C-N 3.3Å; V165-M167 HydrophobicContact CG1-CG 4.47Å; V165-M167 HydrophobicContact CG1-SD 3.72Å; V165-M167 PolarHBondContact O-N 3.18Å; M167-I169 VanDerWaalsContact C-N 3.25Å; M167-I169 PolarHBondContact O-N 3.36Å; M167-Y171 CarbonylContact O-C 3.57Å; M167-Y171 WeakPolarHBondContact O-CA 3.12Å; M167-Y171 PolarHBondContact O-N 3.32Å; M167-Y171 VanDerWaalsContact O-O 3.07Å; M167-P172 VanDerWaalsContact O-N 3.11Å; M167-V175 HydrophobicContact SD-CG1 4.19Å; M167-T193 WeakPolarHBondContact CG-O 3.39Å; M167-N194 WeakPolarHBondContact CB-OD1 2.88Å; M167-N194 PolarHBondContact N-OD1 3.33Å
168	S	89.9	Confident	94.6	Very high	72 Å²	72	44 Å²	44	50%	0.503	23%	0.225	S	C	.	.	H	α-helix	trans	-72.4	-14.7	-177.1	56.8	0	0	0	0	114.6	P166	P166-S168 VanDerWaalsContact C-N 3.32Å; P166-S168 PolarHBondContact O-N 3.1Å
169	I	89.9	Confident	94.9	Very high	43 Å²	43	43 Å²	43	22%	0.221	22%	0.219	C	C	.	.	H	α-helix	trans	-108	-52.2	-172.8	-62.2	173.3	0	0	0	110.8	V108 L113 K114 S117 P166 M167	V108-I169 HydrophobicContact CG1-CG1 4Å; L113-I169 HydrophobicContact CB-CD1 4.38Å; K114-I169 HydrophobicContact CB-CG2 4.4Å; K114-I169 HydrophobicContact CG-CG2 4.35Å; S117-I169 VanDerWaalsContact CB-CD1 3.43Å; S117-I169 WeakPolarHBondContact OG-CD1 3.34Å; P166-I169 HydrophobicContact CB-CB 4.41Å; P166-I169 PolarHBondContact O-N 2.98Å; P166-I169 VanDerWaalsContact O-N 3.12Å; M167-I169 VanDerWaalsContact C-N 3.25Å; M167-I169 PolarHBondContact O-N 3.36Å
170	H	92.7	Very high	95	Very high	12 Å²	12	43 Å²	43	6%	0.056	22%	0.219	C	C	.	.	H	α-helix	trans	-105.5	-16.4	-175	-73	-77.6	0	0	0	114	K114 S117 F133 V135 P166 P172	K114-H170 WeakPolarHBondContact CG-CE1 3.43Å; K114-H170 PolarHBondContact O-CE1 2.85Å; K114-H170 PolarHBondContact O-NE2 3.38Å; S117-H170 PolarHBondContact O-CD2 2.91Å; S117-H170 PolarHBondContact O-NE2 3.48Å; F133-H170 AromaticContact CE1-CE1 3.93Å; F133-H170 AromaticContact CE1-NE2 3.82Å; F133-H170 AromaticContact CZ-CD2 3.73Å; F133-H170 AromaticContact CZ-CE1 3.65Å; F133-H170 AromaticContact CZ-CG 3.77Å; F133-H170 AromaticContact CZ-ND1 3.76Å; F133-H170 AromaticContact CZ-NE2 3.64Å; V135-H170 PolarHBondContact O-CE1 2.93Å; V135-H170 PolarHBondContact O-ND1 3.04Å; P166-H170 PolarHBondContact O-N 3.4Å; P166-H170 VanDerWaalsContact O-N 3.08Å; H170-P172 VanDerWaalsContact C-CD 3.43Å
171	Y	94.1	Very high	95	Very high	2 Å²	2	44 Å²	44	1%	0.008	23%	0.225	C	C	.	.			trans	-134	47.9	-173.5	-46.2	-80.4	0	0	0	113.3	T119 G138 V165 M167 H173 G174 V175 I216 P218	T119-Y171 WeakPolarHBondContact OG1-CE2 3.25Å; T119-Y171 PolarHBondContact OG1-OH 3.13Å; G138-Y171 VanDerWaalsContact O-CE1 3.26Å; G138-Y171 WeakPolarHBondContact O-CE1 2.79Å; G138-Y171 VanDerWaalsContact O-CZ 3.28Å; G138-Y171 PolarHBondContact O-OH 2.72Å; V165-Y171 HydrophobicContact CG1-CD2 3.34Å; V165-Y171 HydrophobicContact CG1-CE2 3.42Å; V165-Y171 VanDerWaalsContact CG1-CE2 3.42Å; V165-Y171 HydrophobicContact CG1-CG 4.09Å; M167-Y171 CarbonylContact O-C 3.57Å; M167-Y171 WeakPolarHBondContact O-CA 3.12Å; M167-Y171 PolarHBondContact O-N 3.32Å; M167-Y171 VanDerWaalsContact O-O 3.07Å; Y171-H173 PolarHBondContact O-N 2.78Å; Y171-G174 PolarHBondContact O-N 2.82Å; Y171-V175 HydrophobicContact CD1-CG1 3.5Å; Y171-V175 VanDerWaalsContact CD1-CG1 3.5Å; Y171-V175 HydrophobicContact CD2-CG1 4.33Å; Y171-V175 HydrophobicContact CE1-CG1 4.13Å; Y171-V175 HydrophobicContact CG-CG1 3.58Å; Y171-I216 HydrophobicContact CE1-CG2 3.98Å; Y171-P218 HydrophobicContact CD1-CB 3.93Å; Y171-P218 HydrophobicContact CD1-CG 3.67Å; Y171-P218 HydrophobicContact CE1-CB 4.37Å; Y171-P218 HydrophobicContact CE1-CG 3.64Å
172	P	91.6	Very high	95	Very high	86 Å²	86	52 Å²	52	56%	0.558	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-23.1	-174.3	23.8	-33.8	0	0	0	113.3	M167 H170	M167-P172 VanDerWaalsContact O-N 3.11Å; H170-P172 VanDerWaalsContact C-CD 3.43Å
173	H	93.4	Very high	94.8	Very high	96 Å²	96	54.8 Å²	54.8	44%	0.444	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	12.3	178.5	-51.6	-61.2	0	0	0	113	Y171 N219 N221	Y171-H173 PolarHBondContact O-N 2.78Å; H173-N219 HydrophobicContact CB-CB 4.17Å; H173-N219 VanDerWaalsContact O-CB 3.31Å; H173-N219 WeakPolarHBondContact O-CB 3.02Å; H173-N219 PolarHBondContact O-ND2 3.22Å; H173-N221 VanDerWaalsContact CD2-CG 3.47Å; H173-N221 PolarHBondContact CD2-ND2 2.77Å; H173-N221 PolarHBondContact CD2-OD1 3.17Å; H173-N221 PolarHBondContact CE1-OD1 3.29Å; H173-N221 PolarHBondContact ND1-OD1 3.11Å; H173-N221 VanDerWaalsContact NE2-CG 3.33Å; H173-N221 PolarHBondContact NE2-ND2 3.02Å; H173-N221 PolarHBondContact NE2-OD1 3.11Å
174	G	94	Very high	94.6	Very high	17 Å²	17	55.3 Å²	55.3	18%	0.175	28%	0.278	C	S	.	.			trans	86.7	-170.9	-176.6	0	0	0	0	0	114	Y171 N219	Y171-G174 PolarHBondContact O-N 2.82Å; G174-N219 PolarHBondContact O-N 3.38Å
175	V	96	Very high	94.5	Very high	21 Å²	21	55.3 Å²	55.3	13%	0.127	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	150	-170.7	-61.4	0	0	0	0	112.3	V165 M167 Y171 T177 I196 I216 I217	V165-V175 HydrophobicContact CG1-CG1 4.13Å; M167-V175 HydrophobicContact SD-CG1 4.19Å; Y171-V175 HydrophobicContact CD1-CG1 3.5Å; Y171-V175 VanDerWaalsContact CD1-CG1 3.5Å; Y171-V175 HydrophobicContact CD2-CG1 4.33Å; Y171-V175 HydrophobicContact CE1-CG1 4.13Å; Y171-V175 HydrophobicContact CG-CG1 3.58Å; V175-T177 HydrophobicContact CG2-CG2 4.41Å; V175-I196 HydrophobicContact CG2-CD1 4.05Å; V175-I216 HydrophobicContact CB-CG2 3.83Å; V175-I216 HydrophobicContact CG1-CG2 3.7Å; V175-I217 WeakPolarHBondContact CA-O 3.02Å
176	K	96.4	Very high	94.5	Very high	125 Å²	125	59.5 Å²	59.5	54%	0.543	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	136.7	157.9	-83.6	157.6	-172	-177.5	0	108.7	I217 N219	K176-I217 HydrophobicContact CB-CB 4.4Å; K176-I217 PolarHBondContact N-O 3Å; K176-I217 PolarHBondContact O-N 3.22Å; K176-N219 WeakPolarHBondContact CD-OD1 3.16Å; K176-N219 VanDerWaalsContact CE-OD1 3.23Å; K176-N219 WeakPolarHBondContact CE-OD1 3.09Å; K176-N219 VanDerWaalsContact CG-OD1 3.22Å; K176-N219 WeakPolarHBondContact CG-OD1 3.13Å
177	T	96.7	Very high	94.6	Very high	39 Å²	39	64.4 Å²	64.4	24%	0.239	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	143.8	176.3	59.2	0	0	0	0	110.6	V175 F179 Y186 T215 I216	V175-T177 HydrophobicContact CG2-CG2 4.41Å; T177-F179 HydrophobicContact CG2-CZ 4.16Å; T177-F179 WeakPolarHBondContact OG1-CE2 3.48Å; T177-Y186 HydrophobicContact CG2-CD1 4.21Å; T177-Y186 HydrophobicContact CG2-CE1 3.92Å; T177-Y186 HydrophobicContact CG2-CE2 4.45Å; T177-Y186 WeakPolarHBondContact OG1-CE1 3.14Å; T177-T215 CarbonylContact C-O 3.54Å; T177-T215 VanDerWaalsContact CA-O 3.31Å; T177-T215 WeakPolarHBondContact CA-O 3.24Å; T177-I216 HydrophobicContact CG2-CG1 4.28Å
178	R	97.7	Very high	94.7	Very high	149 Å²	149	65.1 Å²	65.1	56%	0.562	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.8	131.8	168.4	175.2	-177.6	132.8	-174.6	-5.2	108	T215	R178-T215 PolarHBondContact N-O 2.99Å; R178-T215 PolarHBondContact O-N 3.21Å
179	F	97.6	Very high	94.7	Very high	17 Å²	17	66.1 Å²	66.1	8%	0.075	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	143.5	-178.4	-60.8	-60.4	0	0	0	111.4	T177 P181 L184 Y186 V198 E213 I214	T177-F179 HydrophobicContact CG2-CZ 4.16Å; T177-F179 WeakPolarHBondContact OG1-CE2 3.48Å; F179-P181 WeakPolarHBondContact CB-O 3.41Å; F179-L184 HydrophobicContact CB-CB 3.79Å; F179-L184 HydrophobicContact CB-CD1 4.09Å; F179-L184 HydrophobicContact CB-CG 4.36Å; F179-L184 HydrophobicContact CD1-CB 4.24Å; F179-L184 HydrophobicContact CD1-CD1 4.32Å; F179-L184 HydrophobicContact CD2-CB 4.13Å; F179-L184 HydrophobicContact CG-CB 3.8Å; F179-L184 HydrophobicContact CG-CD1 4.41Å; F179-Y186 AromaticContact CE2-CD1 3.66Å; F179-Y186 HydrophobicContact CE2-CD1 3.66Å; F179-Y186 HydrophobicContact CE2-CE1 4.38Å; F179-Y186 HydrophobicContact CE2-CG 4.48Å; F179-Y186 AromaticContact CZ-CD1 3.72Å; F179-Y186 HydrophobicContact CZ-CD1 3.72Å; F179-Y186 HydrophobicContact CZ-CG 4.14Å; F179-V198 HydrophobicContact CE1-CG1 4.11Å; F179-V198 HydrophobicContact CE1-CG2 4.26Å; F179-E213 WeakPolarHBondContact CA-O 3.28Å; F179-I214 HydrophobicContact CD1-CB 4.31Å; F179-I214 HydrophobicContact CD1-CG1 3.89Å; F179-I214 HydrophobicContact CD1-CG2 4.18Å; F179-I214 HydrophobicContact CE1-CB 4.36Å; F179-I214 HydrophobicContact CE1-CG1 4.06Å; F179-I214 HydrophobicContact CE1-CG2 3.78Å
180	I	96.4	Very high	94.4	Very high	63 Å²	63	73.3 Å²	73.3	32%	0.323	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	120.1	162.5	-59.3	176.2	0	0	0	105.8	I212 E213	I180-I212 CarbonylContact O-C 3.59Å; I180-I212 VanDerWaalsContact O-CA 3.29Å; I180-I212 WeakPolarHBondContact O-CA 3.21Å; I180-E213 HydrophobicContact CB-CB 4.02Å; I180-E213 HydrophobicContact CB-CG 4.33Å; I180-E213 PolarHBondContact N-O 3.46Å; I180-E213 PolarHBondContact O-N 3.39Å
181	P	95.5	Very high	94	Very high	24 Å²	24	79.8 Å²	79.8	16%	0.156	39%	0.39	C	S	.	.	S	Bend	cis	-71	156	-4.4	35.8	-40.2	0	0	0	112.6	F179 Q183 L184 L204 I209	F179-P181 WeakPolarHBondContact CB-O 3.41Å; P181-Q183 PolarHBondContact O-N 3.32Å; P181-L184 HydrophobicContact CG-CG 4.24Å; P181-L184 WeakPolarHBondContact O-CG 3.39Å; P181-L184 PolarHBondContact O-N 2.74Å; P181-L204 HydrophobicContact CB-CD1 4.23Å; P181-L204 HydrophobicContact CG-CD1 3.44Å; P181-L204 VanDerWaalsContact CG-CD1 3.44Å; P181-L204 HydrophobicContact CG-CD2 4.39Å; P181-I209 HydrophobicContact CG-CD1 3.77Å; P181-I209 HydrophobicContact CG-CG1 4.49Å
182	E	95.3	Very high	93.6	Very high	169 Å²	169	82.6 Å²	82.6	79%	0.79	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-18.1	-172.3	-66.4	-177.6	170.5	0	0	114.3	L184	E182-L184 PolarHBondContact O-N 3.18Å
183	Q	93.8	Very high	93.4	Very high	113 Å²	113	82 Å²	82	53%	0.528	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-2.8	-179.9	-51.4	81	-5.7	0	0	113	P181 P201 L204	P181-Q183 PolarHBondContact O-N 3.32Å; Q183-P201 HydrophobicContact CB-CG 4.1Å; Q183-P201 VanDerWaalsContact O-CD 3.29Å; Q183-P201 WeakPolarHBondContact O-CD 3.32Å; Q183-L204 HydrophobicContact CB-CD1 3.88Å; Q183-L204 HydrophobicContact CB-CG 4.32Å
184	L	95.1	Very high	93.5	Very high	10 Å²	10	79.7 Å²	79.7	5%	0.052	39%	0.391	C	S	.	.			trans	-62.1	146	167.7	-63.5	179.1	0	0	0	109.9	F179 P181 E182 V198 Y199 M200 L204 I212	F179-L184 HydrophobicContact CB-CB 3.79Å; F179-L184 HydrophobicContact CB-CD1 4.09Å; F179-L184 HydrophobicContact CB-CG 4.36Å; F179-L184 HydrophobicContact CD1-CB 4.24Å; F179-L184 HydrophobicContact CD1-CD1 4.32Å; F179-L184 HydrophobicContact CD2-CB 4.13Å; F179-L184 HydrophobicContact CG-CB 3.8Å; F179-L184 HydrophobicContact CG-CD1 4.41Å; P181-L184 HydrophobicContact CG-CG 4.24Å; P181-L184 WeakPolarHBondContact O-CG 3.39Å; P181-L184 PolarHBondContact O-N 2.74Å; E182-L184 PolarHBondContact O-N 3.18Å; L184-V198 HydrophobicContact CB-CG1 4.48Å; L184-Y199 WeakPolarHBondContact CA-O 3.38Å; L184-M200 HydrophobicContact CD2-CB 3.57Å; L184-M200 HydrophobicContact CD2-CG 3.81Å; L184-L204 HydrophobicContact CD2-CD1 4.49Å; L184-I212 HydrophobicContact CD1-CB 4.49Å; L184-I212 HydrophobicContact CD1-CG1 4.4Å; L184-I212 HydrophobicContact CD1-CG2 3.49Å; L184-I212 VanDerWaalsContact CD1-CG2 3.49Å
185	S	95.6	Very high	93.6	Very high	51 Å²	51	79.4 Å²	79.4	36%	0.357	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	161.4	176.2	59.6	0	0	0	0	109.4	V198 Y199	S185-V198 CarbonylContact O-C 3.53Å; S185-V198 WeakPolarHBondContact O-CA 3.04Å; S185-Y199 PolarHBondContact N-O 2.8Å; S185-Y199 PolarHBondContact O-N 3.27Å
186	Y	96.6	Very high	93.7	Very high	88 Å²	88	78.6 Å²	78.6	35%	0.345	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	158	173.5	75.6	-78.5	0	0	0	111.7	T177 F179 V188 I196 F197	T177-Y186 HydrophobicContact CG2-CD1 4.21Å; T177-Y186 HydrophobicContact CG2-CE1 3.92Å; T177-Y186 HydrophobicContact CG2-CE2 4.45Å; T177-Y186 WeakPolarHBondContact OG1-CE1 3.14Å; F179-Y186 AromaticContact CE2-CD1 3.66Å; F179-Y186 HydrophobicContact CE2-CD1 3.66Å; F179-Y186 HydrophobicContact CE2-CE1 4.38Å; F179-Y186 HydrophobicContact CE2-CG 4.48Å; F179-Y186 AromaticContact CZ-CD1 3.72Å; F179-Y186 HydrophobicContact CZ-CD1 3.72Å; F179-Y186 HydrophobicContact CZ-CG 4.14Å; Y186-V188 HydrophobicContact CD2-CG2 4.19Å; Y186-V188 HydrophobicContact CE2-CG2 4.11Å; Y186-I196 HydrophobicContact CD2-CD1 4.48Å; Y186-I196 HydrophobicContact CD2-CG1 4.49Å; Y186-I196 HydrophobicContact CD2-CG2 3.83Å; Y186-I196 HydrophobicContact CG-CG2 4.09Å; Y186-F197 CarbonylContact C-O 3.54Å; Y186-F197 WeakPolarHBondContact CA-O 3.13Å; Y186-F197 WeakPolarHBondContact CB-O 3.03Å
187	K	95.7	Very high	93.7	Very high	108 Å²	108	74 Å²	74	47%	0.47	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	143.3	171.1	-63.5	-176.6	178.5	178	0	109.5	Y189 F197 Y199	K187-Y189 HydrophobicContact CB-CE2 4.45Å; K187-F197 PolarHBondContact N-O 3.31Å; K187-F197 PolarHBondContact O-N 3.37Å; K187-Y199 HydrophobicContact CB-CE2 4.09Å; K187-Y199 HydrophobicContact CD-CE2 3.99Å; K187-Y199 HydrophobicContact CG-CD2 4.34Å; K187-Y199 HydrophobicContact CG-CE2 3.99Å
188	V	94.1	Very high	93.7	Very high	63 Å²	63	72.1 Å²	72.1	38%	0.382	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	126.7	165	179.9	0	0	0	0	105.7	Y186 I196	Y186-V188 HydrophobicContact CD2-CG2 4.19Å; Y186-V188 HydrophobicContact CE2-CG2 4.11Å; V188-I196 HydrophobicContact CG2-CG1 3.83Å
189	Y	89.8	Confident	93.6	Very high	92 Å²	92	66.3 Å²	66.3	36%	0.361	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	141.5	179	-66.3	-82	0	0	0	110	K187 N191 N192 T193 F197 Y199	K187-Y189 HydrophobicContact CB-CE2 4.45Å; Y189-N191 WeakPolarHBondContact CB-OD1 3.47Å; Y189-N191 PolarHBondContact O-N 3.31Å; Y189-N192 CarbonylContact O-C 3.59Å; Y189-N192 PolarHBondContact O-N 2.82Å; Y189-T193 PolarHBondContact O-N 3.07Å; Y189-F197 AromaticContact CD2-CD2 3.4Å; Y189-F197 HydrophobicContact CD2-CD2 3.4Å; Y189-F197 AromaticContact CD2-CE2 3.41Å; Y189-F197 HydrophobicContact CD2-CE2 3.41Å; Y189-F197 VanDerWaalsContact CD2-CE2 3.41Å; Y189-F197 HydrophobicContact CD2-CG 4.14Å; Y189-F197 HydrophobicContact CD2-CZ 4.15Å; Y189-F197 HydrophobicContact CE2-CB 4.27Å; Y189-F197 HydrophobicContact CE2-CD1 4.26Å; Y189-F197 AromaticContact CE2-CD2 3.49Å; Y189-F197 HydrophobicContact CE2-CD2 3.49Å; Y189-F197 VanDerWaalsContact CE2-CD2 3.49Å; Y189-F197 AromaticContact CE2-CE2 3.83Å; Y189-F197 HydrophobicContact CE2-CE2 3.83Å; Y189-F197 AromaticContact CE2-CG 3.74Å; Y189-F197 HydrophobicContact CE2-CG 3.74Å; Y189-F197 HydrophobicContact CE2-CZ 4.34Å; Y189-Y199 PolarHBondContact OH-OH 3.22Å
190	E	84.4	Confident	93.4	Very high	195 Å²	195	65.6 Å²	65.6	91%	0.911	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-32.6	-178.1	-65.1	179.8	174.5	0	0	112.8	N192	E190-N192 VanDerWaalsContact C-N 3.28Å; E190-N192 PolarHBondContact O-N 3.16Å
191	N	85.4	Confident	93.2	Very high	147 Å²	147	63.7 Å²	63.7	79%	0.786	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	-12.7	177.9	67	-12.5	0	0	0	113.7	Y189	Y189-N191 WeakPolarHBondContact CB-OD1 3.47Å; Y189-N191 PolarHBondContact O-N 3.31Å
192	N	84.1	Confident	92.9	Very high	61 Å²	61	62.9 Å²	62.9	33%	0.326	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	72.4	-179	-159.7	-18.4	0	0	0	110.8	Y189 E190 N194 L195	Y189-N192 CarbonylContact O-C 3.59Å; Y189-N192 PolarHBondContact O-N 2.82Å; E190-N192 VanDerWaalsContact C-N 3.28Å; E190-N192 PolarHBondContact O-N 3.16Å; N192-N194 PolarHBondContact O-N 2.8Å; N192-N194 VanDerWaalsContact O-N 3.17Å; N192-L195 WeakPolarHBondContact ND2-CD1 3.13Å; N192-L195 WeakPolarHBondContact ND2-CG 2.8Å; N192-L195 PolarHBondContact O-N 3.07Å; N192-L195 VanDerWaalsContact O-N 3.1Å
193	T	89	Confident	92.5	Very high	74 Å²	74	58.7 Å²	58.7	45%	0.454	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	-19.1	-177.9	54.7	0	0	0	0	113.3	M167 Y189 L195	M167-T193 WeakPolarHBondContact CG-O 3.39Å; Y189-T193 PolarHBondContact O-N 3.07Å; T193-L195 VanDerWaalsContact C-N 3.33Å
194	N	94.4	Very high	92.2	Very high	48 Å²	48	54 Å²	54	26%	0.257	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	8.2	177.7	-64.1	-49.6	0	0	0	113.5	F164 V165 M167 N192	F164-N194 CarbonylContact C-O 3.13Å; F164-N194 WeakPolarHBondContact CA-O 3.46Å; F164-N194 HydrophobicContact CD2-CB 4.18Å; F164-N194 WeakPolarHBondContact CD2-O 3.35Å; F164-N194 HydrophobicContact CE2-CB 3.76Å; V165-N194 PolarHBondContact N-O 3.13Å; V165-N194 WeakPolarHBondContact O-CA 3.37Å; V165-N194 WeakPolarHBondContact O-CB 3.11Å; V165-N194 PolarHBondContact O-OD1 3.15Å; M167-N194 WeakPolarHBondContact CB-OD1 2.88Å; M167-N194 PolarHBondContact N-OD1 3.33Å; N192-N194 PolarHBondContact O-N 2.8Å; N192-N194 VanDerWaalsContact O-N 3.17Å
195	L	96.4	Very high	91.5	Very high	11 Å²	11	54.7 Å²	54.7	6%	0.058	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	128.7	173.2	-70.2	-172	0	0	0	111.7	I163 F164 N192 T193 F197	I163-L195 WeakPolarHBondContact O-CA 3.49Å; F164-L195 HydrophobicContact CB-CD2 4.1Å; F164-L195 HydrophobicContact CD2-CD2 4.21Å; N192-L195 WeakPolarHBondContact ND2-CD1 3.13Å; N192-L195 WeakPolarHBondContact ND2-CG 2.8Å; N192-L195 PolarHBondContact O-N 3.07Å; N192-L195 VanDerWaalsContact O-N 3.1Å; T193-L195 VanDerWaalsContact C-N 3.33Å; L195-F197 HydrophobicContact CB-CD2 4.23Å; L195-F197 HydrophobicContact CB-CE2 3.49Å; L195-F197 VanDerWaalsContact CB-CE2 3.49Å; L195-F197 HydrophobicContact CB-CZ 3.99Å; L195-F197 HydrophobicContact CD1-CE2 4.11Å; L195-F197 HydrophobicContact CD1-CZ 3.72Å; L195-F197 HydrophobicContact CG-CE2 4.47Å
196	I	96.9	Very high	90.4	Very high	3 Å²	3	60.1 Å²	60.1	2%	0.015	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	121.3	166.5	-68.8	-174.7	0	0	0	108.6	I163 V165 V175 Y186 V188 V198 I216	I163-I196 HydrophobicContact CB-CB 4.43Å; I163-I196 PolarHBondContact N-O 3.18Å; I163-I196 PolarHBondContact O-N 3.29Å; V165-I196 HydrophobicContact CB-CG1 4.49Å; V165-I196 HydrophobicContact CG2-CB 4.15Å; V165-I196 HydrophobicContact CG2-CD1 3.68Å; V165-I196 HydrophobicContact CG2-CG1 3.72Å; V175-I196 HydrophobicContact CG2-CD1 4.05Å; Y186-I196 HydrophobicContact CD2-CD1 4.48Å; Y186-I196 HydrophobicContact CD2-CG1 4.49Å; Y186-I196 HydrophobicContact CD2-CG2 3.83Å; Y186-I196 HydrophobicContact CG-CG2 4.09Å; V188-I196 HydrophobicContact CG2-CG1 3.83Å; I196-V198 HydrophobicContact CG2-CG2 3.92Å; I196-I216 HydrophobicContact CD1-CD1 4.01Å
197	F	97.4	Very high	89.7	Confident	28 Å²	28	60.2 Å²	60.2	12%	0.123	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	115.7	175.1	-64.4	-97.7	0	0	0	109	L159 E162 Y186 K187 Y189 L195 Y199	L159-F197 HydrophobicContact CD1-CB 3.91Å; L159-F197 HydrophobicContact CD1-CD1 3.97Å; L159-F197 HydrophobicContact CD1-CG 4.46Å; L159-F197 HydrophobicContact CD2-CD1 4.42Å; E162-F197 HydrophobicContact CG-CD1 3.73Å; E162-F197 HydrophobicContact CG-CE1 3.79Å; Y186-F197 CarbonylContact C-O 3.54Å; Y186-F197 WeakPolarHBondContact CA-O 3.13Å; Y186-F197 WeakPolarHBondContact CB-O 3.03Å; K187-F197 PolarHBondContact N-O 3.31Å; K187-F197 PolarHBondContact O-N 3.37Å; Y189-F197 AromaticContact CD2-CD2 3.4Å; Y189-F197 HydrophobicContact CD2-CD2 3.4Å; Y189-F197 AromaticContact CD2-CE2 3.41Å; Y189-F197 HydrophobicContact CD2-CE2 3.41Å; Y189-F197 VanDerWaalsContact CD2-CE2 3.41Å; Y189-F197 HydrophobicContact CD2-CG 4.14Å; Y189-F197 HydrophobicContact CD2-CZ 4.15Å; Y189-F197 HydrophobicContact CE2-CB 4.27Å; Y189-F197 HydrophobicContact CE2-CD1 4.26Å; Y189-F197 AromaticContact CE2-CD2 3.49Å; Y189-F197 HydrophobicContact CE2-CD2 3.49Å; Y189-F197 VanDerWaalsContact CE2-CD2 3.49Å; Y189-F197 AromaticContact CE2-CE2 3.83Å; Y189-F197 HydrophobicContact CE2-CE2 3.83Å; Y189-F197 AromaticContact CE2-CG 3.74Å; Y189-F197 HydrophobicContact CE2-CG 3.74Å; Y189-F197 HydrophobicContact CE2-CZ 4.34Å; L195-F197 HydrophobicContact CB-CD2 4.23Å; L195-F197 HydrophobicContact CB-CE2 3.49Å; L195-F197 VanDerWaalsContact CB-CE2 3.49Å; L195-F197 HydrophobicContact CB-CZ 3.99Å; L195-F197 HydrophobicContact CD1-CE2 4.11Å; L195-F197 HydrophobicContact CD1-CZ 3.72Å; L195-F197 HydrophobicContact CG-CE2 4.47Å; F197-Y199 HydrophobicContact CB-CE2 3.63Å; F197-Y199 WeakPolarHBondContact O-CD2 3.49Å; F197-Y199 WeakPolarHBondContact O-CE2 3.11Å
198	V	97	Very high	88.9	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	130.3	-177.2	-175.2	0	0	0	0	110.2	V160 A161 I163 F179 L184 S185 I196 I214	V160-V198 HydrophobicContact CG2-CB 4.24Å; V160-V198 HydrophobicContact CG2-CG1 3.94Å; V160-V198 VanDerWaalsContact CG2-O 3.28Å; V160-V198 WeakPolarHBondContact CG2-O 3.21Å; V160-V198 PolarHBondContact N-O 2.8Å; A161-V198 HydrophobicContact CB-CB 4.29Å; A161-V198 PolarHBondContact N-O 3.01Å; A161-V198 PolarHBondContact O-N 2.91Å; I163-V198 HydrophobicContact CD1-CG2 4.04Å; F179-V198 HydrophobicContact CE1-CG1 4.11Å; F179-V198 HydrophobicContact CE1-CG2 4.26Å; L184-V198 HydrophobicContact CB-CG1 4.48Å; S185-V198 CarbonylContact O-C 3.53Å; S185-V198 WeakPolarHBondContact O-CA 3.04Å; I196-V198 HydrophobicContact CG2-CG2 3.92Å; V198-I214 HydrophobicContact CB-CD1 4.3Å; V198-I214 HydrophobicContact CG1-CD1 4.07Å; V198-I214 HydrophobicContact CG2-CD1 4.04Å
199	Y	95.4	Very high	88.4	Confident	27 Å²	27	60.4 Å²	60.4	11%	0.106	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	135.8	-174.4	-66.3	-86.4	0	0	0	111.7	L158 L159 L184 S185 K187 Y189 F197	L158-Y199 CarbonylContact O-C 3.6Å; L158-Y199 VanDerWaalsContact O-CA 3.27Å; L158-Y199 WeakPolarHBondContact O-CA 3.19Å; L159-Y199 HydrophobicContact CB-CD1 4.18Å; L159-Y199 HydrophobicContact CB-CE1 3.88Å; L159-Y199 HydrophobicContact CD1-CD1 4.39Å; L159-Y199 HydrophobicContact CD1-CE1 3.94Å; L159-Y199 HydrophobicContact CD1-CE2 4.39Å; L159-Y199 HydrophobicContact CG-CE1 4.49Å; L184-Y199 WeakPolarHBondContact CA-O 3.38Å; S185-Y199 PolarHBondContact N-O 2.8Å; S185-Y199 PolarHBondContact O-N 3.27Å; K187-Y199 HydrophobicContact CB-CE2 4.09Å; K187-Y199 HydrophobicContact CD-CE2 3.99Å; K187-Y199 HydrophobicContact CG-CD2 4.34Å; K187-Y199 HydrophobicContact CG-CE2 3.99Å; Y189-Y199 PolarHBondContact OH-OH 3.22Å; F197-Y199 HydrophobicContact CB-CE2 3.63Å; F197-Y199 WeakPolarHBondContact O-CD2 3.49Å; F197-Y199 WeakPolarHBondContact O-CE2 3.11Å
200	M	93.4	Very high	88.4	Confident	2 Å²	2	63.9 Å²	63.9	1%	0.01	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	125.6	172.3	-177.1	175.5	59.5	0	0	110.5	T157 L158 V160 L184 L204 I205 I209 I212	T157-M200 CarbonylContact C-O 3.5Å; T157-M200 WeakPolarHBondContact CA-O 3.33Å; L158-M200 PolarHBondContact N-O 2.98Å; L158-M200 PolarHBondContact O-N 2.04Å; V160-M200 HydrophobicContact CG1-CB 3.58Å; V160-M200 HydrophobicContact CG1-CE 4.02Å; V160-M200 HydrophobicContact CG2-CB 4.3Å; L184-M200 HydrophobicContact CD2-CB 3.57Å; L184-M200 HydrophobicContact CD2-CG 3.81Å; M200-L204 HydrophobicContact CG-CB 3.93Å; M200-L204 HydrophobicContact CG-CD1 4.06Å; M200-L204 HydrophobicContact SD-CB 4.23Å; M200-I205 HydrophobicContact CE-CD1 4.15Å; M200-I205 HydrophobicContact CE-CG1 3.53Å; M200-I205 HydrophobicContact SD-CG1 4.49Å; M200-I209 HydrophobicContact SD-CD1 3.87Å; M200-I212 HydrophobicContact SD-CD1 4.03Å
201	P	92.2	Very high	88.9	Confident	24 Å²	24	57.4 Å²	57.4	16%	0.156	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	141.9	171.9	27.6	-36	0	0	0	111	Q183 T203 L204	Q183-P201 HydrophobicContact CB-CG 4.1Å; Q183-P201 VanDerWaalsContact O-CD 3.29Å; Q183-P201 WeakPolarHBondContact O-CD 3.32Å; P201-T203 PolarHBondContact O-N 2.87Å; P201-T203 VanDerWaalsContact O-N 3.11Å; P201-L204 HydrophobicContact CG-CB 4.36Å; P201-L204 HydrophobicContact CG-CD1 3.86Å; P201-L204 HydrophobicContact CG-CG 3.92Å; P201-L204 WeakPolarHBondContact O-CB 3.45Å; P201-L204 PolarHBondContact O-N 2.61Å
202	C	88.3	Confident	89.4	Confident	7 Å²	7	50.4 Å²	50.4	5%	0.047	26%	0.263	C	S	.	.	H	α-helix	trans	-66.2	-17.3	-176.8	-70.7	0	0	0	0	114.8	C151 S156 L204 I205	C151-C202 HydrophobicContact CB-CB 3.49Å; C151-C202 VanDerWaalsContact CB-CB 3.49Å; C151-C202 WeakPolarHBondContact CB-SG 3.23Å; C151-C202 WeakPolarHBondContact SG-CB 3.17Å; C151-C202 CovalentContact SG-SG 2Å; C151-C202 PolarHBondContact SG-SG 3.45Å; S156-C202 WeakPolarHBondContact O-CB 3.29Å; S156-C202 PolarHBondContact O-N 2.75Å; S156-C202 VanDerWaalsContact O-N 3.09Å; S156-C202 PolarHBondContact O-SG 2.58Å; S156-C202 PolarHBondContact OG-SG 3.13Å; C202-L204 PolarHBondContact O-N 3Å; C202-I205 HydrophobicContact CB-CD1 4.35Å; C202-I205 PolarHBondContact O-N 2.59Å
203	T	87.1	Confident	90.1	Very high	80 Å²	80	49.5 Å²	49.5	49%	0.491	26%	0.257	S	S	.	.	H	α-helix	trans	-60.2	-32.3	171.6	51.3	0	0	0	0	112.5	V154 P201	V154-T203 HydrophobicContact CG1-CG2 4.01Å; P201-T203 PolarHBondContact O-N 2.87Å; P201-T203 VanDerWaalsContact O-N 3.11Å
204	L	87.6	Confident	90.6	Very high	14 Å²	14	46 Å²	46	7%	0.073	24%	0.235	C	C	.	.	H	α-helix	trans	-75.4	-21.5	179.5	-84.5	-171.7	0	0	0	114	P181 Q183 L184 M200 P201 C202 K206 T207 I209	P181-L204 HydrophobicContact CB-CD1 4.23Å; P181-L204 HydrophobicContact CG-CD1 3.44Å; P181-L204 VanDerWaalsContact CG-CD1 3.44Å; P181-L204 HydrophobicContact CG-CD2 4.39Å; Q183-L204 HydrophobicContact CB-CD1 3.88Å; Q183-L204 HydrophobicContact CB-CG 4.32Å; L184-L204 HydrophobicContact CD2-CD1 4.49Å; M200-L204 HydrophobicContact CG-CB 3.93Å; M200-L204 HydrophobicContact CG-CD1 4.06Å; M200-L204 HydrophobicContact SD-CB 4.23Å; P201-L204 HydrophobicContact CG-CB 4.36Å; P201-L204 HydrophobicContact CG-CD1 3.86Å; P201-L204 HydrophobicContact CG-CG 3.92Å; P201-L204 WeakPolarHBondContact O-CB 3.45Å; P201-L204 PolarHBondContact O-N 2.61Å; C202-L204 PolarHBondContact O-N 3Å; L204-K206 PolarHBondContact O-N 3.13Å; L204-T207 PolarHBondContact O-N 3.07Å; L204-T207 VanDerWaalsContact O-N 3.13Å; L204-T207 PolarHBondContact O-OG1 3.09Å; L204-I209 HydrophobicContact CB-CD1 3.57Å; L204-I209 HydrophobicContact CD1-CD1 3.93Å; L204-I209 HydrophobicContact CD2-CD1 4.1Å; L204-I209 HydrophobicContact CG-CD1 4.06Å; L204-I209 WeakPolarHBondContact O-CD1 3.41Å
205	I	80.8	Confident	90.8	Very high	26 Å²	26	44.6 Å²	44.6	13%	0.133	23%	0.228	C	C	.	.	H	α-helix	trans	-63.4	-31.8	178.5	-68.6	169.6	0	0	0	111.1	K149 C151 L158 M200 C202 T207	K149-I205 WeakPolarHBondContact O-CG2 3.48Å; C151-I205 HydrophobicContact CB-CD1 3.48Å; C151-I205 VanDerWaalsContact CB-CD1 3.48Å; L158-I205 HydrophobicContact CD1-CD1 4.45Å; M200-I205 HydrophobicContact CE-CD1 4.15Å; M200-I205 HydrophobicContact CE-CG1 3.53Å; M200-I205 HydrophobicContact SD-CG1 4.49Å; C202-I205 HydrophobicContact CB-CD1 4.35Å; C202-I205 PolarHBondContact O-N 2.59Å; I205-T207 VanDerWaalsContact C-N 3.25Å; I205-T207 PolarHBondContact O-N 3.06Å
206	K	73	Confident	90.8	Very high	165 Å²	165	44 Å²	44	72%	0.717	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-12.6	179.9	-64.9	-175	179.3	-178.8	0	113.6	L204 N208	L204-K206 PolarHBondContact O-N 3.13Å; K206-N208 VanDerWaalsContact C-N 3.34Å
207	T	80.3	Confident	90.9	Very high	89 Å²	89	47 Å²	47	55%	0.546	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	10.9	-174	62.9	0	0	0	0	113.3	L204 I205 I209	L204-T207 PolarHBondContact O-N 3.07Å; L204-T207 VanDerWaalsContact O-N 3.13Å; L204-T207 PolarHBondContact O-OG1 3.09Å; I205-T207 VanDerWaalsContact C-N 3.25Å; I205-T207 PolarHBondContact O-N 3.06Å; T207-I209 PolarHBondContact O-N 2.86Å
208	N	79.1	Confident	90.8	Very high	142 Å²	142	46.6 Å²	46.6	76%	0.759	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.2	54.6	-178.3	-71.4	-21.2	0	0	0	112.5	K206 E210	K206-N208 VanDerWaalsContact C-N 3.34Å; N208-E210 PolarHBondContact O-N 3.33Å; N208-E210 VanDerWaalsContact O-N 3.08Å
209	I	84.4	Confident	90.8	Very high	33 Å²	33	48.8 Å²	48.8	17%	0.169	25%	0.253	C	S	.	.			trans	-61.2	116.4	175.9	-64.7	166.4	0	0	0	109.1	P146 P181 M200 L204 T207 L211 I212	P146-I209 HydrophobicContact CG-CB 4.35Å; P146-I209 HydrophobicContact CG-CG2 4.22Å; P181-I209 HydrophobicContact CG-CD1 3.77Å; P181-I209 HydrophobicContact CG-CG1 4.49Å; M200-I209 HydrophobicContact SD-CD1 3.87Å; L204-I209 HydrophobicContact CB-CD1 3.57Å; L204-I209 HydrophobicContact CD1-CD1 3.93Å; L204-I209 HydrophobicContact CD2-CD1 4.1Å; L204-I209 HydrophobicContact CG-CD1 4.06Å; L204-I209 WeakPolarHBondContact O-CD1 3.41Å; T207-I209 PolarHBondContact O-N 2.86Å; I209-L211 WeakPolarHBondContact CG2-O 3.21Å; I209-I212 HydrophobicContact CG2-CG1 4.02Å
210	E	89.9	Confident	90.3	Very high	166 Å²	166	55 Å²	55	78%	0.776	28%	0.282	S	S	*	.			trans	-81.2	-27.8	177.6	-61.4	-171.9	161.2	0	0	111.9	V145 N208	V145-E210 WeakPolarHBondContact CG2-O 3.35Å; N208-E210 PolarHBondContact O-N 3.33Å; N208-E210 VanDerWaalsContact O-N 3.08Å
211	L	95	Very high	89.4	Confident	58 Å²	58	63.6 Å²	63.6	30%	0.304	33%	0.329	S	S	.	.			trans	-149	134.8	-175.8	-164	68.9	0	0	0	111.5	V129 A143 V145 I209 E213	V129-L211 HydrophobicContact CB-CD1 4.28Å; V129-L211 HydrophobicContact CG1-CD1 4.45Å; V129-L211 HydrophobicContact CG2-CD1 4.01Å; A143-L211 HydrophobicContact CB-CD1 4.16Å; A143-L211 HydrophobicContact CB-CD2 4.45Å; A143-L211 HydrophobicContact CB-CG 4.38Å; V145-L211 HydrophobicContact CG2-CD1 4.49Å; I209-L211 WeakPolarHBondContact CG2-O 3.21Å; L211-E213 HydrophobicContact CD2-CG 3.87Å; L211-E213 HydrophobicContact CG-CG 4.14Å
212	I	96.5	Very high	89.3	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	130.6	164.5	-70.8	172.7	0	0	0	107.8	A143 F144 P146 I180 L184 M200 I209 I214	A143-I212 CarbonylContact C-O 3.54Å; A143-I212 WeakPolarHBondContact CA-O 3.36Å; F144-I212 HydrophobicContact CD1-CB 4.27Å; F144-I212 HydrophobicContact CD1-CG2 4.15Å; F144-I212 HydrophobicContact CD2-CB 4.45Å; F144-I212 HydrophobicContact CE1-CB 3.89Å; F144-I212 HydrophobicContact CE1-CG2 3.43Å; F144-I212 VanDerWaalsContact CE1-CG2 3.43Å; F144-I212 HydrophobicContact CE2-CB 4.1Å; F144-I212 HydrophobicContact CE2-CD1 3.72Å; F144-I212 HydrophobicContact CE2-CG1 4.43Å; F144-I212 HydrophobicContact CE2-CG2 4.37Å; F144-I212 HydrophobicContact CZ-CB 3.8Å; F144-I212 HydrophobicContact CZ-CD1 3.71Å; F144-I212 HydrophobicContact CZ-CG1 4.35Å; F144-I212 HydrophobicContact CZ-CG2 3.57Å; F144-I212 PolarHBondContact N-O 2.84Å; F144-I212 PolarHBondContact O-N 2.9Å; P146-I212 HydrophobicContact CB-CD1 3.97Å; P146-I212 HydrophobicContact CG-CD1 4.03Å; P146-I212 HydrophobicContact CG-CG1 4.33Å; I180-I212 CarbonylContact O-C 3.59Å; I180-I212 VanDerWaalsContact O-CA 3.29Å; I180-I212 WeakPolarHBondContact O-CA 3.21Å; L184-I212 HydrophobicContact CD1-CB 4.49Å; L184-I212 HydrophobicContact CD1-CG1 4.4Å; L184-I212 HydrophobicContact CD1-CG2 3.49Å; L184-I212 VanDerWaalsContact CD1-CG2 3.49Å; M200-I212 HydrophobicContact SD-CD1 4.03Å; I209-I212 HydrophobicContact CG2-CG1 4.02Å; I212-I214 HydrophobicContact CG2-CD1 4.35Å; I212-I214 HydrophobicContact CG2-CG1 4.15Å
213	E	98.3	Very high	89.3	Confident	42 Å²	42	68.6 Å²	68.6	20%	0.196	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	135.8	173.2	-51.4	172.7	-137.1	0	0	110.2	Y141 Y142 A143 F179 I180 L211	Y141-E213 HydrophobicContact CE2-CB 4.18Å; Y141-E213 HydrophobicContact CE2-CG 4.41Å; Y141-E213 PolarHBondContact OH-OE2 3.01Å; Y142-E213 CarbonylContact O-C 3.6Å; Y142-E213 WeakPolarHBondContact O-CA 3.23Å; A143-E213 HydrophobicContact CB-CG 4.1Å; F179-E213 WeakPolarHBondContact CA-O 3.28Å; I180-E213 HydrophobicContact CB-CB 4.02Å; I180-E213 HydrophobicContact CB-CG 4.33Å; I180-E213 PolarHBondContact N-O 3.46Å; I180-E213 PolarHBondContact O-N 3.39Å; L211-E213 HydrophobicContact CD2-CG 3.87Å; L211-E213 HydrophobicContact CG-CG 4.14Å
214	I	98.5	Very high	89.4	Confident	0 Å²	0	68 Å²	68	0%	0	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	122.7	-180	-61.9	165.4	0	0	0	107.2	F140 Y141 Y142 F144 A161 I163 F179 V198 I212 I216	F140-I214 HydrophobicContact CE1-CG2 4.4Å; Y141-I214 WeakPolarHBondContact CA-O 3.17Å; Y142-I214 HydrophobicContact CD1-CD1 4.37Å; Y142-I214 PolarHBondContact N-O 2.01Å; Y142-I214 PolarHBondContact O-N 3.35Å; F144-I214 HydrophobicContact CE1-CD1 3.85Å; A161-I214 HydrophobicContact CB-CD1 4.25Å; I163-I214 HydrophobicContact CD1-CD1 3.92Å; I163-I214 HydrophobicContact CD1-CG2 3.84Å; F179-I214 HydrophobicContact CD1-CB 4.31Å; F179-I214 HydrophobicContact CD1-CG1 3.89Å; F179-I214 HydrophobicContact CD1-CG2 4.18Å; F179-I214 HydrophobicContact CE1-CB 4.36Å; F179-I214 HydrophobicContact CE1-CG1 4.06Å; F179-I214 HydrophobicContact CE1-CG2 3.78Å; V198-I214 HydrophobicContact CB-CD1 4.3Å; V198-I214 HydrophobicContact CG1-CD1 4.07Å; V198-I214 HydrophobicContact CG2-CD1 4.04Å; I212-I214 HydrophobicContact CG2-CD1 4.35Å; I212-I214 HydrophobicContact CG2-CG1 4.15Å; I214-I216 HydrophobicContact CG2-CG1 4.25Å
215	T	98.5	Very high	89.6	Confident	19 Å²	19	71.2 Å²	71.2	12%	0.117	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	130.4	171.1	-49.8	0	0	0	0	109.3	V139 F140 T177 R178 I217	V139-T215 HydrophobicContact CG1-CG2 4.43Å; F140-T215 CarbonylContact O-C 3.54Å; F140-T215 VanDerWaalsContact O-CA 3.24Å; F140-T215 WeakPolarHBondContact O-CA 3.46Å; F140-T215 WeakPolarHBondContact O-CG2 3.42Å; T177-T215 CarbonylContact C-O 3.54Å; T177-T215 VanDerWaalsContact CA-O 3.31Å; T177-T215 WeakPolarHBondContact CA-O 3.24Å; R178-T215 PolarHBondContact N-O 2.99Å; R178-T215 PolarHBondContact O-N 3.21Å; T215-I217 HydrophobicContact CG2-CD1 4.15Å; T215-I217 HydrophobicContact CG2-CG1 3.86Å
216	I	98.2	Very high	90.1	Very high	0 Å²	0	74 Å²	74	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	127.4	173.7	-56	167.7	0	0	0	107.5	T119 F140 I163 V165 Y171 V175 T177 I196 I214	T119-I216 HydrophobicContact CG2-CD1 4.06Å; F140-I216 HydrophobicContact CB-CB 4.12Å; F140-I216 HydrophobicContact CD1-CB 4.2Å; F140-I216 HydrophobicContact CD1-CD1 3.76Å; F140-I216 HydrophobicContact CD1-CG1 3.95Å; F140-I216 HydrophobicContact CE1-CD1 4.16Å; F140-I216 PolarHBondContact N-O 2.84Å; F140-I216 PolarHBondContact O-N 2.72Å; I163-I216 HydrophobicContact CD1-CD1 4.35Å; I163-I216 HydrophobicContact CG2-CD1 3.94Å; V165-I216 HydrophobicContact CG2-CD1 3.98Å; Y171-I216 HydrophobicContact CE1-CG2 3.98Å; V175-I216 HydrophobicContact CB-CG2 3.83Å; V175-I216 HydrophobicContact CG1-CG2 3.7Å; T177-I216 HydrophobicContact CG2-CG1 4.28Å; I196-I216 HydrophobicContact CD1-CD1 4.01Å; I214-I216 HydrophobicContact CG2-CG1 4.25Å
217	I	97.7	Very high	91.3	Very high	66 Å²	66	67.9 Å²	67.9	34%	0.338	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	134.4	-174.1	-53.7	173.1	0	0	0	107.7	V139 V175 K176 T215	V139-I217 HydrophobicContact CG2-CG2 4.35Å; V175-I217 WeakPolarHBondContact CA-O 3.02Å; K176-I217 HydrophobicContact CB-CB 4.4Å; K176-I217 PolarHBondContact N-O 3Å; K176-I217 PolarHBondContact O-N 3.22Å; T215-I217 HydrophobicContact CG2-CD1 4.15Å; T215-I217 HydrophobicContact CG2-CG1 3.86Å
218	P	96.8	Very high	92	Very high	18 Å²	18	66.4 Å²	66.4	12%	0.117	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	142.2	172.8	-21.5	32.8	0	0	0	112.8	S137 Y171	S137-P218 WeakPolarHBondContact O-CD 3.3Å; S137-P218 WeakPolarHBondContact O-CG 2.99Å; Y171-P218 HydrophobicContact CD1-CB 3.93Å; Y171-P218 HydrophobicContact CD1-CG 3.67Å; Y171-P218 HydrophobicContact CE1-CB 4.37Å; Y171-P218 HydrophobicContact CE1-CG 3.64Å
219	N	95.7	Very high	93	Very high	47 Å²	47	60.6 Å²	60.6	25%	0.251	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-65.9	136.6	165.5	-77.8	-23.9	0	0	0	109.9	H173 G174 K176	H173-N219 HydrophobicContact CB-CB 4.17Å; H173-N219 VanDerWaalsContact O-CB 3.31Å; H173-N219 WeakPolarHBondContact O-CB 3.02Å; H173-N219 PolarHBondContact O-ND2 3.22Å; G174-N219 PolarHBondContact O-N 3.38Å; K176-N219 WeakPolarHBondContact CD-OD1 3.16Å; K176-N219 VanDerWaalsContact CE-OD1 3.23Å; K176-N219 WeakPolarHBondContact CE-OD1 3.09Å; K176-N219 VanDerWaalsContact CG-OD1 3.22Å; K176-N219 WeakPolarHBondContact CG-OD1 3.13Å
220	Q	85.3	Confident	93.7	Very high	156 Å²	156	62.9 Å²	62.9	73%	0.729	32%	0.317	S	S	*	.	P	Polyproline II helix	trans	-76.8	145.7	170.3	-59.1	-62	-39.7	0	0	109
221	N	74.7	Confident	94.1	Very high	183 Å²	183	53.5 Å²	53.5	98%	0.979	28%	0.276	S	S	*	.			trans	-63.6	0	168.1	-87.4	-31.9	0	0	0	112.6	H173	H173-N221 VanDerWaalsContact CD2-CG 3.47Å; H173-N221 PolarHBondContact CD2-ND2 2.77Å; H173-N221 PolarHBondContact CD2-OD1 3.17Å; H173-N221 PolarHBondContact CE1-OD1 3.29Å; H173-N221 PolarHBondContact ND1-OD1 3.11Å; H173-N221 VanDerWaalsContact NE2-CG 3.33Å; H173-N221 PolarHBondContact NE2-ND2 3.02Å; H173-N221 PolarHBondContact NE2-OD1 3.11Å

Retrieved 221 of 221 residues in 385.7 ms (Link to these results)

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