A0A077ZGE7_TRITR Loading...

Lustrin cystein domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZGE7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 312 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	38.6	Very low	46.2	Very low	225 Å²	225	124.5 Å²	124.5	100%	1.108	61%	0.613	S	S	*	*				0	117.9	0	-74.2	164	170.3	0	0	107.1	N3	M1-N3 PolarHBondContact O-N 3.25Å
2	R	37.5	Very low	46.9	Very low	238 Å²	238	118.2 Å²	118.2	90%	0.898	59%	0.587	S	S	*	*			trans	-75.1	115.7	177.7	-71.3	177.9	-176.8	166	0.5	106.9
3	N	46.7	Very low	48	Very low	44 Å²	44	117.5 Å²	117.5	24%	0.235	59%	0.586	C	S	.	*			trans	-104.7	126.9	176.5	-59.6	-46.5	0	0	0	107.1	M1 W25 R27	M1-N3 PolarHBondContact O-N 3.25Å; N3-W25 HydrophobicContact CB-CH2 3.98Å; N3-W25 HydrophobicContact CB-CZ2 3.57Å; N3-R27 PolarHBondContact ND2-NH2 2.94Å
4	V	45.6	Very low	49.1	Very low	65 Å²	65	110.4 Å²	110.4	39%	0.394	55%	0.55	S	S	.	.			trans	-95.2	121.5	-171.8	-177.6	0	0	0	0	107.8	V6 I11 L13	V4-V6 HydrophobicContact CG1-CG2 3.95Å; V4-I11 HydrophobicContact CG1-CG2 4.43Å; V4-L13 HydrophobicContact CG1-CD2 4.46Å; V4-L13 HydrophobicContact CG2-CD2 3.88Å
5	L	50.3	Low	50.3	Low	14 Å²	14	108.1 Å²	108.1	7%	0.073	54%	0.544	C	S	.	.			trans	-99.3	114.3	166.9	-110.3	160.7	0	0	0	107.3	L19 P33 P57 I59	L5-L19 HydrophobicContact CD1-CD1 3.39Å; L5-P33 HydrophobicContact CD1-CB 4.15Å; L5-P33 HydrophobicContact CD1-CG 3.28Å; L5-P33 HydrophobicContact CD2-CG 3.66Å; L5-P33 HydrophobicContact CG-CG 3.31Å; L5-P57 HydrophobicContact CD1-CG 4.07Å; L5-P57 HydrophobicContact CD2-CG 3.95Å; L5-I59 HydrophobicContact CD1-CG2 4.3Å
6	V	46.6	Very low	51.4	Low	107 Å²	107	104.1 Å²	104.1	65%	0.648	52%	0.523	S	S	*	.			trans	-92.4	111.4	174.8	-176.7	0	0	0	0	107.2	V4	V4-V6 HydrophobicContact CG1-CG2 3.95Å
7	T	47.7	Very low	52.4	Low	38 Å²	38	102.2 Å²	102.2	23%	0.233	52%	0.521	C	S	.	.	B	Isolated β-bridge	trans	-99.9	142.7	162.8	51.2	0	0	0	0	108.4	E9 Q10 P57	T7-E9 PolarHBondContact O-N 3.27Å; T7-Q10 PolarHBondContact O-N 3.33Å; T7-P57 HydrophobicContact CG2-CB 4.11Å; T7-P57 HydrophobicContact CG2-CG 3.81Å
8	D	44.4	Very low	53.3	Low	168 Å²	168	99.9 Å²	99.9	90%	0.898	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.5	126.5	179.3	-92.5	-35.5	0	0	0	111.5
9	E	49.2	Very low	54.3	Low	195 Å²	195	94.8 Å²	94.8	91%	0.911	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	-9	173.4	-57.9	-166.8	136.9	0	0	121	T7	T7-E9 PolarHBondContact O-N 3.27Å
10	Q	48	Very low	55.4	Low	144 Å²	144	90.1 Å²	90.1	67%	0.673	46%	0.461	S	S	*	.	B	Isolated β-bridge	trans	-148.2	127.1	168.8	-68.9	-174.1	-4.9	0	0	112.6	T7 V12	T7-Q10 PolarHBondContact O-N 3.33Å; Q10-V12 VanDerWaalsContact C-N 3.31Å; Q10-V12 HydrophobicContact CB-CG2 3.99Å; Q10-V12 PolarHBondContact O-N 2.97Å
11	I	53.2	Low	56	Low	131 Å²	131	89.4 Å²	89.4	67%	0.672	46%	0.462	S	S	*	.			trans	-74.9	86.9	171.6	-56.5	174.5	0	0	0	108.2	V4	V4-I11 HydrophobicContact CG1-CG2 4.43Å
12	V	55.4	Low	57.2	Low	49 Å²	49	84 Å²	84	30%	0.297	44%	0.437	S	S	.	.			trans	-96.9	112.9	172.1	-170	0	0	0	0	108.8	Q10 F14	Q10-V12 VanDerWaalsContact C-N 3.31Å; Q10-V12 HydrophobicContact CB-CG2 3.99Å; Q10-V12 PolarHBondContact O-N 2.97Å; V12-F14 HydrophobicContact CB-CD2 4.34Å; V12-F14 HydrophobicContact CB-CE2 3.6Å; V12-F14 HydrophobicContact CB-CZ 3.81Å; V12-F14 HydrophobicContact CG1-CD1 4.38Å; V12-F14 HydrophobicContact CG1-CD2 4.19Å; V12-F14 HydrophobicContact CG1-CE1 3.71Å; V12-F14 HydrophobicContact CG1-CE2 3.5Å; V12-F14 HydrophobicContact CG1-CZ 3.23Å; V12-F14 WeakPolarHBondContact O-CD2 3.24Å; V12-F14 PolarHBondContact O-N 2.98Å
13	L	60.8	Low	58.5	Low	109 Å²	109	72.8 Å²	72.8	57%	0.571	39%	0.394	S	S	*	.			trans	-79.4	101	180	-75.3	152.2	0	0	0	109.8	V4	V4-L13 HydrophobicContact CG1-CD2 4.46Å; V4-L13 HydrophobicContact CG2-CD2 3.88Å
14	F	62.8	Low	59.9	Low	19 Å²	19	73.7 Å²	73.7	8%	0.083	40%	0.399	C	S	.	.			trans	-95.2	139.8	170.1	-59.7	-74.3	0	0	0	110.9	V12 L19 P53 A56	V12-F14 HydrophobicContact CB-CD2 4.34Å; V12-F14 HydrophobicContact CB-CE2 3.6Å; V12-F14 HydrophobicContact CB-CZ 3.81Å; V12-F14 HydrophobicContact CG1-CD1 4.38Å; V12-F14 HydrophobicContact CG1-CD2 4.19Å; V12-F14 HydrophobicContact CG1-CE1 3.71Å; V12-F14 HydrophobicContact CG1-CE2 3.5Å; V12-F14 HydrophobicContact CG1-CZ 3.23Å; V12-F14 WeakPolarHBondContact O-CD2 3.24Å; V12-F14 PolarHBondContact O-N 2.98Å; F14-L19 HydrophobicContact CB-CD1 3.81Å; F14-L19 HydrophobicContact CB-CD2 3.98Å; F14-L19 HydrophobicContact CB-CG 3.8Å; F14-L19 HydrophobicContact CD1-CD2 4.24Å; F14-L19 HydrophobicContact CG-CD1 4.43Å; F14-L19 HydrophobicContact CG-CD2 4.01Å; F14-L19 HydrophobicContact CG-CG 4.37Å; F14-P53 HydrophobicContact CD1-CG 4.4Å; F14-P53 HydrophobicContact CE1-CB 4Å; F14-P53 HydrophobicContact CE1-CG 4.25Å; F14-A56 HydrophobicContact CD1-CB 4.21Å; F14-A56 HydrophobicContact CD2-CB 4.22Å; F14-A56 HydrophobicContact CE1-CB 3.78Å; F14-A56 HydrophobicContact CE2-CB 3.77Å; F14-A56 HydrophobicContact CG-CB 4.42Å; F14-A56 HydrophobicContact CZ-CB 3.52Å
15	T	68.3	Low	61.4	Low	75 Å²	75	71.2 Å²	71.2	46%	0.46	38%	0.383	S	S	.	.			trans	-88.9	159.7	170.7	72.5	0	0	0	0	110.8	S17 D18 L19	T15-S17 PolarHBondContact O-N 2.74Å; T15-D18 VanDerWaalsContact CB-OD2 3.31Å; T15-D18 WeakPolarHBondContact CB-OD2 3.48Å; T15-D18 PolarHBondContact N-OD2 2.85Å; T15-D18 WeakPolarHBondContact O-CB 3.36Å; T15-D18 PolarHBondContact O-N 3.19Å; T15-D18 PolarHBondContact OG1-N 2.98Å; T15-D18 PolarHBondContact OG1-OD2 2.84Å; T15-L19 PolarHBondContact O-N 3.33Å
16	E	67.5	Low	63	Low	45 Å²	45	71 Å²	71	21%	0.21	38%	0.382	C	S	.	.	H	α-helix	trans	-57.2	-32.1	175.4	-173.4	168.4	-170	0	0	112.2	D18 L19 C20 N24 W25	E16-D18 VanDerWaalsContact C-N 3.28Å; E16-D18 PolarHBondContact O-N 3.28Å; E16-L19 PolarHBondContact O-N 2.9Å; E16-C20 CarbonylContact O-C 3.48Å; E16-C20 WeakPolarHBondContact O-CA 3.29Å; E16-C20 PolarHBondContact O-N 3.31Å; E16-N24 WeakPolarHBondContact OE1-CA 3.46Å; E16-N24 VanDerWaalsContact OE1-CB 3.26Å; E16-N24 WeakPolarHBondContact OE1-CB 3.27Å; E16-N24 PolarHBondContact OE1-OD1 2.05Å; E16-W25 HydrophobicContact CB-CD2 4Å; E16-W25 HydrophobicContact CB-CE3 3.93Å; E16-W25 HydrophobicContact CB-CH2 3.9Å; E16-W25 HydrophobicContact CB-CZ2 3.93Å; E16-W25 HydrophobicContact CB-CZ3 3.89Å; E16-W25 HydrophobicContact CG-CD2 3.73Å; E16-W25 HydrophobicContact CG-CE3 4Å; E16-W25 HydrophobicContact CG-CG 4.04Å; E16-W25 HydrophobicContact CG-CZ2 4.41Å; E16-W25 HydrophobicContact CG-CZ3 4.48Å; E16-W25 PolarHBondContact OE1-N 3.3Å
17	S	68.4	Low	64.7	Low	71 Å²	71	69.7 Å²	69.7	50%	0.497	37%	0.365	S	S	.	.	H	α-helix	trans	-70.2	-22	174.4	-52.3	0	0	0	0	113.8	T15 P21	T15-S17 PolarHBondContact O-N 2.74Å; S17-P21 WeakPolarHBondContact O-CA 3.12Å
18	D	67.9	Low	66.3	Low	62 Å²	62	71 Å²	71	33%	0.332	37%	0.371	S	S	.	.	H	α-helix	trans	-84	-31.5	178.2	-59.5	-48.1	0	0	0	111.9	T15 E16	T15-D18 VanDerWaalsContact CB-OD2 3.31Å; T15-D18 WeakPolarHBondContact CB-OD2 3.48Å; T15-D18 PolarHBondContact N-OD2 2.85Å; T15-D18 WeakPolarHBondContact O-CB 3.36Å; T15-D18 PolarHBondContact O-N 3.19Å; T15-D18 PolarHBondContact OG1-N 2.98Å; T15-D18 PolarHBondContact OG1-OD2 2.84Å; E16-D18 VanDerWaalsContact C-N 3.28Å; E16-D18 PolarHBondContact O-N 3.28Å
19	L	73.3	Confident	68.1	Low	2 Å²	2	75.3 Å²	75.3	1%	0.01	38%	0.375	C	S	.	.	H	α-helix	trans	-101	-20.7	-178.5	-56.2	-177.5	0	0	0	113.7	L5 F14 T15 E16 W25 H49 A56 I59 C61	L5-L19 HydrophobicContact CD1-CD1 3.39Å; F14-L19 HydrophobicContact CB-CD1 3.81Å; F14-L19 HydrophobicContact CB-CD2 3.98Å; F14-L19 HydrophobicContact CB-CG 3.8Å; F14-L19 HydrophobicContact CD1-CD2 4.24Å; F14-L19 HydrophobicContact CG-CD1 4.43Å; F14-L19 HydrophobicContact CG-CD2 4.01Å; F14-L19 HydrophobicContact CG-CG 4.37Å; T15-L19 PolarHBondContact O-N 3.33Å; E16-L19 PolarHBondContact O-N 2.9Å; L19-W25 HydrophobicContact CB-CE3 4.18Å; L19-W25 HydrophobicContact CB-CZ3 4.46Å; L19-W25 HydrophobicContact CD1-CE3 4.02Å; L19-W25 HydrophobicContact CD1-CZ3 3.82Å; L19-W25 HydrophobicContact CG-CZ3 4.38Å; L19-H49 PolarHBondContact O-CD2 2.84Å; L19-A56 HydrophobicContact CD2-CB 3.61Å; L19-I59 HydrophobicContact CB-CD1 3.38Å; L19-I59 HydrophobicContact CB-CG1 3.98Å; L19-I59 HydrophobicContact CD1-CD1 3.71Å; L19-I59 HydrophobicContact CD1-CG1 4.47Å; L19-I59 HydrophobicContact CG-CD1 4.17Å; L19-C61 PolarHBondContact O-SG 3.48Å; L19-C61 VanDerWaalsContact O-SG 3.41Å
20	C	76.4	Confident	69.5	Low	1 Å²	1	70.1 Å²	70.1	1%	0.007	36%	0.36	C	S	.	.			trans	-141.5	73.3	176.6	-68.7	0	0	0	0	108.8	E16 I22 S23 W25 C61	E16-C20 CarbonylContact O-C 3.48Å; E16-C20 WeakPolarHBondContact O-CA 3.29Å; E16-C20 PolarHBondContact O-N 3.31Å; C20-I22 PolarHBondContact O-N 3.03Å; C20-S23 VanDerWaalsContact CB-OG 3.29Å; C20-S23 WeakPolarHBondContact CB-OG 3.46Å; C20-S23 PolarHBondContact O-N 3.01Å; C20-W25 VanDerWaalsContact SG-CA 3.52Å; C20-C61 HydrophobicContact CB-CB 4.11Å; C20-C61 WeakPolarHBondContact CB-SG 3.29Å; C20-C61 WeakPolarHBondContact SG-CB 3.02Å; C20-C61 CovalentContact SG-SG 2.04Å; C20-C61 PolarHBondContact SG-SG 3.23Å
21	P	66.5	Low	70.9	Confident	76 Å²	76	67.7 Å²	67.7	49%	0.494	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-20.7	-169.7	22.4	-33.3	0	0	0	114.9	S17	S17-P21 WeakPolarHBondContact O-CA 3.12Å
22	I	63.9	Low	72	Confident	112 Å²	112	65.7 Å²	65.7	57%	0.574	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.2	14	-178.1	58.2	170.7	0	0	0	112.8	C20	C20-I22 PolarHBondContact O-N 3.03Å
23	S	65	Low	73	Confident	1 Å²	1	64 Å²	64	1%	0.007	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	173.4	-168.5	28	0	0	0	0	110.1	C20 C61 R62 R64	C20-S23 VanDerWaalsContact CB-OG 3.29Å; C20-S23 WeakPolarHBondContact CB-OG 3.46Å; C20-S23 PolarHBondContact O-N 3.01Å; S23-C61 WeakPolarHBondContact OG-CB 3.35Å; S23-R62 CarbonylContact C-O 3.5Å; S23-R62 VanDerWaalsContact CA-O 3.3Å; S23-R62 WeakPolarHBondContact CA-O 3.09Å; S23-R62 WeakPolarHBondContact CB-O 3.25Å; S23-R64 PolarHBondContact O-NE 3.45Å
24	N	75.9	Confident	74.2	Confident	64 Å²	64	60.6 Å²	60.6	34%	0.342	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	144.3	161.3	-67	-34.5	0	0	0	107.8	E16 C61 R62 R64	E16-N24 WeakPolarHBondContact OE1-CA 3.46Å; E16-N24 VanDerWaalsContact OE1-CB 3.26Å; E16-N24 WeakPolarHBondContact OE1-CB 3.27Å; E16-N24 PolarHBondContact OE1-OD1 2.05Å; N24-C61 CarbonylContact O-C 3.43Å; N24-C61 WeakPolarHBondContact O-CA 3.02Å; N24-R62 PolarHBondContact N-O 3.2Å; N24-R62 PolarHBondContact O-N 2.73Å; N24-R64 VanDerWaalsContact OD1-CZ 3.27Å; N24-R64 PolarHBondContact OD1-NE 2.85Å; N24-R64 PolarHBondContact OD1-NH2 2.66Å
25	W	78.2	Confident	75.3	Confident	12 Å²	12	63.9 Å²	63.9	5%	0.045	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	154.3	170	56.1	41.9	0	0	0	110.6	N3 E16 L19 C20 P33 I59 C60	N3-W25 HydrophobicContact CB-CH2 3.98Å; N3-W25 HydrophobicContact CB-CZ2 3.57Å; E16-W25 HydrophobicContact CB-CD2 4Å; E16-W25 HydrophobicContact CB-CE3 3.93Å; E16-W25 HydrophobicContact CB-CH2 3.9Å; E16-W25 HydrophobicContact CB-CZ2 3.93Å; E16-W25 HydrophobicContact CB-CZ3 3.89Å; E16-W25 HydrophobicContact CG-CD2 3.73Å; E16-W25 HydrophobicContact CG-CE3 4Å; E16-W25 HydrophobicContact CG-CG 4.04Å; E16-W25 HydrophobicContact CG-CZ2 4.41Å; E16-W25 HydrophobicContact CG-CZ3 4.48Å; E16-W25 PolarHBondContact OE1-N 3.3Å; L19-W25 HydrophobicContact CB-CE3 4.18Å; L19-W25 HydrophobicContact CB-CZ3 4.46Å; L19-W25 HydrophobicContact CD1-CE3 4.02Å; L19-W25 HydrophobicContact CD1-CZ3 3.82Å; L19-W25 HydrophobicContact CG-CZ3 4.38Å; C20-W25 VanDerWaalsContact SG-CA 3.52Å; W25-P33 HydrophobicContact CD2-CB 4.25Å; W25-P33 HydrophobicContact CG-CB 4.22Å; W25-I59 HydrophobicContact CB-CD1 3.49Å; W25-I59 VanDerWaalsContact CB-CD1 3.49Å; W25-I59 HydrophobicContact CD2-CD1 4.13Å; W25-I59 HydrophobicContact CE3-CD1 3.58Å; W25-I59 HydrophobicContact CG-CD1 4.17Å; W25-C60 CarbonylContact C-O 3.56Å; W25-C60 WeakPolarHBondContact CA-O 3.09Å
26	V	83.1	Confident	76	Confident	9 Å²	9	60.8 Å²	60.8	6%	0.055	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-91.6	132.6	177	-169.7	0	0	0	0	107.7	P33 I34 P43 T46 C60 R62	V26-P33 WeakPolarHBondContact O-CA 3.26Å; V26-I34 HydrophobicContact CB-CD1 4.25Å; V26-I34 HydrophobicContact CG1-CD1 3.7Å; V26-I34 PolarHBondContact O-N 3.41Å; V26-P43 HydrophobicContact CG1-CG 4.09Å; V26-T46 HydrophobicContact CG2-CG2 3.44Å; V26-T46 VanDerWaalsContact CG2-CG2 3.44Å; V26-C60 HydrophobicContact CB-CB 3.95Å; V26-C60 HydrophobicContact CG2-CB 3.94Å; V26-C60 WeakPolarHBondContact CG2-O 3.23Å; V26-C60 PolarHBondContact N-O 3.44Å; V26-R62 HydrophobicContact CG2-CB 4.01Å
27	R	83	Confident	76.8	Confident	80 Å²	80	63.1 Å²	63.1	30%	0.302	34%	0.336	S	S	.	.	B	Isolated β-bridge	trans	-102.9	146.2	-178.8	-52.5	-172.7	-175.4	-132.8	-9	110.8	N3 D31 Q32	N3-R27 PolarHBondContact ND2-NH2 2.94Å; R27-D31 WeakPolarHBondContact CD-OD1 3.38Å; R27-D31 IonicContact CZ-OD1 3.59Å; R27-D31 IonicContact NE-OD1 3.6Å; R27-D31 VanDerWaalsContact NH1-CG 3.3Å; R27-D31 IonicContact NH1-OD1 2.85Å; R27-D31 PolarHBondContact NH1-OD1 3.2Å; R27-D31 IonicContact NH1-OD2 3.22Å; R27-D31 PolarHBondContact NH1-OD2 2.02Å; R27-Q32 CarbonylContact C-O 3.5Å; R27-Q32 VanDerWaalsContact CA-O 3.24Å; R27-Q32 WeakPolarHBondContact CA-O 3.37Å
28	D	81.4	Confident	77.5	Confident	67 Å²	67	65.1 Å²	65.1	36%	0.358	34%	0.34	S	S	.	.			trans	-77.6	-172.8	170.2	76	-2.9	0	0	0	111	S30 D31 Q32 I34	D28-S30 PolarHBondContact O-N 3.2Å; D28-S30 VanDerWaalsContact OD1-C 3.26Å; D28-S30 VanDerWaalsContact OD1-CA 3.24Å; D28-S30 WeakPolarHBondContact OD1-CA 3.04Å; D28-S30 WeakPolarHBondContact OD1-CB 3.31Å; D28-S30 PolarHBondContact OD1-N 2.88Å; D28-D31 PolarHBondContact O-N 3.29Å; D28-D31 PolarHBondContact OD1-N 3.04Å; D28-D31 VanDerWaalsContact OD1-N 3.11Å; D28-Q32 PolarHBondContact N-O 2.89Å; D28-Q32 PolarHBondContact OD1-N 2.96Å; D28-I34 HydrophobicContact CB-CG1 3.96Å
29	R	81.2	Confident	78	Confident	258 Å²	258	66.8 Å²	66.8	97%	0.974	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-15.3	177.3	-64.9	-175.3	-177.5	-170.7	1.1	113.7
30	S	79.8	Confident	78.5	Confident	85 Å²	85	74 Å²	74	59%	0.594	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	11.4	-178.2	-50.2	0	0	0	0	112.5	D28 Q32	D28-S30 PolarHBondContact O-N 3.2Å; D28-S30 VanDerWaalsContact OD1-C 3.26Å; D28-S30 VanDerWaalsContact OD1-CA 3.24Å; D28-S30 WeakPolarHBondContact OD1-CA 3.04Å; D28-S30 WeakPolarHBondContact OD1-CB 3.31Å; D28-S30 PolarHBondContact OD1-N 2.88Å; S30-Q32 PolarHBondContact O-N 3.44Å
31	D	77.8	Confident	78.9	Confident	93 Å²	93	78 Å²	78	50%	0.497	41%	0.409	S	S	.	.	S	Bend	trans	61.4	20.7	-174.2	-161	38.5	0	0	0	113.7	R27 D28	R27-D31 WeakPolarHBondContact CD-OD1 3.38Å; R27-D31 IonicContact CZ-OD1 3.59Å; R27-D31 IonicContact NE-OD1 3.6Å; R27-D31 VanDerWaalsContact NH1-CG 3.3Å; R27-D31 IonicContact NH1-OD1 2.85Å; R27-D31 PolarHBondContact NH1-OD1 3.2Å; R27-D31 IonicContact NH1-OD2 3.22Å; R27-D31 PolarHBondContact NH1-OD2 2.02Å; D28-D31 PolarHBondContact O-N 3.29Å; D28-D31 PolarHBondContact OD1-N 3.04Å; D28-D31 VanDerWaalsContact OD1-N 3.11Å
32	Q	75.4	Confident	79.8	Confident	90 Å²	90	75.1 Å²	75.1	42%	0.421	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-97.4	145.3	175.8	-62.3	-56.7	-48.1	0	0	110.9	R27 D28 S30 I34	R27-Q32 CarbonylContact C-O 3.5Å; R27-Q32 VanDerWaalsContact CA-O 3.24Å; R27-Q32 WeakPolarHBondContact CA-O 3.37Å; D28-Q32 PolarHBondContact N-O 2.89Å; D28-Q32 PolarHBondContact OD1-N 2.96Å; S30-Q32 PolarHBondContact O-N 3.44Å; Q32-I34 PolarHBondContact O-N 3.37Å
33	P	77.1	Confident	80.8	Confident	12 Å²	12	71.9 Å²	71.9	8%	0.078	38%	0.377	C	S	.	.	B	Isolated β-bridge	trans	-65.2	133.2	175.9	24.1	-30.1	0	0	0	111.3	L5 W25 V26 T35 I59	L5-P33 HydrophobicContact CD1-CB 4.15Å; L5-P33 HydrophobicContact CD1-CG 3.28Å; L5-P33 HydrophobicContact CD2-CG 3.66Å; L5-P33 HydrophobicContact CG-CG 3.31Å; W25-P33 HydrophobicContact CD2-CB 4.25Å; W25-P33 HydrophobicContact CG-CB 4.22Å; V26-P33 WeakPolarHBondContact O-CA 3.26Å; P33-T35 PolarHBondContact O-N 2.91Å; P33-I59 HydrophobicContact CB-CD1 4.37Å; P33-I59 HydrophobicContact CB-CG2 4.34Å
34	I	84.9	Confident	81.6	Confident	39 Å²	39	77.4 Å²	77.4	20%	0.2	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-72	120.7	178.4	-58.9	175.1	0	0	0	108.5	V26 D28 Q32 P43 I59 C60	V26-I34 HydrophobicContact CB-CD1 4.25Å; V26-I34 HydrophobicContact CG1-CD1 3.7Å; V26-I34 PolarHBondContact O-N 3.41Å; D28-I34 HydrophobicContact CB-CG1 3.96Å; Q32-I34 PolarHBondContact O-N 3.37Å; I34-P43 HydrophobicContact CD1-CG 3.76Å; I34-I59 CarbonylContact O-C 3.59Å; I34-I59 WeakPolarHBondContact O-CA 3.27Å; I34-I59 WeakPolarHBondContact O-CB 3.32Å; I34-C60 HydrophobicContact CB-CB 4.19Å; I34-C60 HydrophobicContact CG2-CB 4.4Å; I34-C60 PolarHBondContact O-N 2.79Å
35	T	85.4	Confident	81.4	Confident	87 Å²	87	82.9 Å²	82.9	53%	0.534	44%	0.436	S	S	.	.	B	Isolated β-bridge	trans	-80.5	151	172.7	55.5	0	0	0	0	110.9	P33 P57 A58 I59	P33-T35 PolarHBondContact O-N 2.91Å; T35-P57 HydrophobicContact CG2-CB 4.06Å; T35-A58 CarbonylContact C-O 3.39Å; T35-A58 VanDerWaalsContact CA-O 3.25Å; T35-A58 WeakPolarHBondContact CA-O 3.48Å; T35-I59 HydrophobicContact CG2-CG2 4.39Å
36	C	84.9	Confident	81.7	Confident	10 Å²	10	83.2 Å²	83.2	7%	0.068	44%	0.44	C	S	.	.			trans	-146	155.1	-178.8	59.2	0	0	0	0	110.7	D41 C42 C48 A58 I59	C36-D41 HydrophobicContact CB-CB 3.94Å; C36-C42 VanDerWaalsContact CB-SG 3.51Å; C36-C48 VanDerWaalsContact C-SG 3.56Å; C36-C48 HydrophobicContact CB-CB 3.77Å; C36-C48 WeakPolarHBondContact CB-SG 3.38Å; C36-C48 WeakPolarHBondContact SG-CA 3.43Å; C36-C48 WeakPolarHBondContact SG-CB 3.28Å; C36-C48 CovalentContact SG-SG 2.03Å; C36-C48 PolarHBondContact SG-SG 3.04Å; C36-A58 PolarHBondContact N-O 3.35Å; C36-A58 VanDerWaalsContact O-CB 3.23Å; C36-A58 WeakPolarHBondContact O-CB 3.48Å; C36-I59 PolarHBondContact SG-O 3.24Å
37	S	83.9	Confident	81.8	Confident	95 Å²	95	86.1 Å²	86.1	66%	0.664	45%	0.452	S	S	*	.	S	Bend	trans	-109	-30.6	167.2	-59.4	0	0	0	0	111.2	D41	S37-D41 WeakPolarHBondContact CA-OD2 3Å; S37-D41 PolarHBondContact N-OD2 3.39Å
38	L	82.6	Confident	81.8	Confident	113 Å²	113	82.7 Å²	82.7	59%	0.592	44%	0.44	S	S	*	.	S	Bend	trans	-136.8	161.7	179.7	-63.6	168.4	0	0	0	110.4	N40 D41	L38-N40 PolarHBondContact O-N 3.24Å; L38-N40 VanDerWaalsContact O-N 3.16Å; L38-D41 PolarHBondContact N-OD2 2.56Å; L38-D41 WeakPolarHBondContact O-CB 3.37Å; L38-D41 PolarHBondContact O-N 2.85Å
39	D	79.4	Confident	81.9	Confident	96 Å²	96	81 Å²	81	51%	0.513	43%	0.43	S	S	.	.	G	3₁₀ helix	trans	-58.2	-29.1	177.2	-70.1	-30.3	0	0	0	113.1	D41 C42 C48	D39-D41 PolarHBondContact O-N 2.91Å; D39-C42 WeakPolarHBondContact O-CB 3.27Å; D39-C42 PolarHBondContact O-N 2.69Å; D39-C42 VanDerWaalsContact O-N 3.16Å; D39-C48 WeakPolarHBondContact OD1-CB 3.27Å; D39-C48 PolarHBondContact OD1-N 2.87Å
40	N	83.5	Confident	81.5	Confident	154 Å²	154	72.9 Å²	72.9	82%	0.824	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-69.8	-17.7	178.7	-66	-21	0	0	0	113.6	L38 C42	L38-N40 PolarHBondContact O-N 3.24Å; L38-N40 VanDerWaalsContact O-N 3.16Å; N40-C42 PolarHBondContact O-N 2.85Å
41	D	84.1	Confident	81	Confident	85 Å²	85	76.7 Å²	76.7	46%	0.455	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-77.9	-13	175.8	-56.7	-33.6	0	0	0	111.4	C36 S37 L38 D39	C36-D41 HydrophobicContact CB-CB 3.94Å; S37-D41 WeakPolarHBondContact CA-OD2 3Å; S37-D41 PolarHBondContact N-OD2 3.39Å; L38-D41 PolarHBondContact N-OD2 2.56Å; L38-D41 WeakPolarHBondContact O-CB 3.37Å; L38-D41 PolarHBondContact O-N 2.85Å; D39-D41 PolarHBondContact O-N 2.91Å
42	C	85.6	Confident	80.5	Confident	16 Å²	16	76.5 Å²	76.5	11%	0.108	41%	0.412	C	S	.	.	S	Bend	trans	-94	149	-175.2	-66.9	0	0	0	0	112.4	C36 D39 N40 T46 C60	C36-C42 VanDerWaalsContact CB-SG 3.51Å; D39-C42 WeakPolarHBondContact O-CB 3.27Å; D39-C42 PolarHBondContact O-N 2.69Å; D39-C42 VanDerWaalsContact O-N 3.16Å; N40-C42 PolarHBondContact O-N 2.85Å; C42-T46 WeakPolarHBondContact CB-OG1 2.97Å; C42-C60 WeakPolarHBondContact CA-SG 3.49Å; C42-C60 HydrophobicContact CB-CB 3.76Å; C42-C60 WeakPolarHBondContact CB-SG 3.43Å; C42-C60 WeakPolarHBondContact SG-CA 3.2Å; C42-C60 WeakPolarHBondContact SG-CB 3.05Å; C42-C60 CovalentContact SG-SG 2.04Å; C42-C60 PolarHBondContact SG-SG 2.81Å
43	P	85.4	Confident	80.2	Confident	43 Å²	43	74.8 Å²	74.8	28%	0.279	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-55.8	157.6	173.4	-26.6	36	0	0	0	112.9	V26 I34 T46	V26-P43 HydrophobicContact CG1-CG 4.09Å; I34-P43 HydrophobicContact CD1-CG 3.76Å; P43-T46 WeakPolarHBondContact CD-OG1 3.3Å; P43-T46 WeakPolarHBondContact O-CB 3.45Å; P43-T46 PolarHBondContact O-N 3.22Å; P43-T46 PolarHBondContact O-OG1 3.14Å
44	P	80.6	Confident	79.7	Confident	118 Å²	118	79.4 Å²	79.4	77%	0.766	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	146	174.6	-24	32.5	0	0	0	112.4	T46	P44-T46 PolarHBondContact O-N 2.82Å
45	E	73.2	Confident	78.9	Confident	179 Å²	179	80.3 Å²	80.3	84%	0.836	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	22	-176.8	-54.7	-65.5	147.9	0	0	114.6
46	T	84.1	Confident	78.2	Confident	19 Å²	19	76.4 Å²	76.4	12%	0.117	44%	0.443	C	S	.	.			trans	-135	161.2	177.4	75.6	0	0	0	0	110.1	V26 C42 P43 P44 C61 R62	V26-T46 HydrophobicContact CG2-CG2 3.44Å; V26-T46 VanDerWaalsContact CG2-CG2 3.44Å; C42-T46 WeakPolarHBondContact CB-OG1 2.97Å; P43-T46 WeakPolarHBondContact CD-OG1 3.3Å; P43-T46 WeakPolarHBondContact O-CB 3.45Å; P43-T46 PolarHBondContact O-N 3.22Å; P43-T46 PolarHBondContact O-OG1 3.14Å; P44-T46 PolarHBondContact O-N 2.82Å; T46-C61 WeakPolarHBondContact CA-O 3.34Å; T46-C61 WeakPolarHBondContact CB-O 3.49Å; T46-R62 HydrophobicContact CG2-CB 4.03Å; T46-R62 HydrophobicContact CG2-CG 4.36Å
47	F	84	Confident	77.7	Confident	69 Å²	69	76.7 Å²	76.7	30%	0.303	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	153.3	-176.1	63.1	-88.8	0	0	0	110.8	H49 C60 C61	F47-H49 HydrophobicContact CE2-CB 4.47Å; F47-C60 CarbonylContact O-C 3.49Å; F47-C60 WeakPolarHBondContact O-CA 3.45Å; F47-C61 HydrophobicContact CD1-CB 4.45Å; F47-C61 VanDerWaalsContact CD1-O 3.28Å; F47-C61 WeakPolarHBondContact CD1-O 3.45Å; F47-C61 HydrophobicContact CD2-CB 4.27Å; F47-C61 HydrophobicContact CE1-CB 3.94Å; F47-C61 HydrophobicContact CE2-CB 3.74Å; F47-C61 HydrophobicContact CZ-CB 3.56Å; F47-C61 PolarHBondContact N-O 2.74Å; F47-C61 PolarHBondContact O-N 3.19Å
48	C	84.7	Confident	77.7	Confident	9 Å²	9	72.7 Å²	72.7	6%	0.061	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	118.3	179	-173	0	0	0	0	110.6	C36 D39 T50	C36-C48 VanDerWaalsContact C-SG 3.56Å; C36-C48 HydrophobicContact CB-CB 3.77Å; C36-C48 WeakPolarHBondContact CB-SG 3.38Å; C36-C48 WeakPolarHBondContact SG-CA 3.43Å; C36-C48 WeakPolarHBondContact SG-CB 3.28Å; C36-C48 CovalentContact SG-SG 2.03Å; C36-C48 PolarHBondContact SG-SG 3.04Å; D39-C48 WeakPolarHBondContact OD1-CB 3.27Å; D39-C48 PolarHBondContact OD1-N 2.87Å; C48-T50 PolarHBondContact O-N 3.09Å
49	H	81.9	Confident	77.8	Confident	30 Å²	30	67.4 Å²	67.4	14%	0.139	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	103.2	176	-168.8	56.5	0	0	0	111	L19 F47 E51 A58 I59 C61	L19-H49 PolarHBondContact O-CD2 2.84Å; F47-H49 HydrophobicContact CE2-CB 4.47Å; H49-E51 PolarHBondContact NE2-O 2.97Å; H49-A58 WeakPolarHBondContact O-CA 3.33Å; H49-A58 WeakPolarHBondContact O-CB 3.22Å; H49-I59 PolarHBondContact N-O 2.82Å; H49-C61 VanDerWaalsContact CB-SG 3.53Å
50	T	74.5	Confident	78.2	Confident	88 Å²	88	62.8 Å²	62.8	54%	0.54	37%	0.366	S	S	.	.			trans	-91.8	-20	-179	54.6	0	0	0	0	113.3	C48 K52	C48-T50 PolarHBondContact O-N 3.09Å; T50-K52 VanDerWaalsContact C-N 3.3Å; T50-K52 PolarHBondContact O-N 3.17Å
51	E	68.6	Low	78.3	Confident	165 Å²	165	55.5 Å²	55.5	77%	0.771	33%	0.327	S	S	*	.			trans	-80.7	68.4	178.5	-65.7	-171.7	171.9	0	0	112.8	H49	H49-E51 PolarHBondContact NE2-O 2.97Å
52	K	68.1	Low	78.3	Confident	89 Å²	89	57.7 Å²	57.7	39%	0.387	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-103.9	157.3	-171.9	68.6	-156.9	-179.2	158	0	113.1	T50 A56 A58	T50-K52 VanDerWaalsContact C-N 3.3Å; T50-K52 PolarHBondContact O-N 3.17Å; K52-A56 HydrophobicContact CB-CB 3.86Å; K52-A56 HydrophobicContact CD-CB 4.39Å; K52-A56 WeakPolarHBondContact CD-O 3.08Å; K52-A56 WeakPolarHBondContact CE-O 3.3Å; K52-A56 HydrophobicContact CG-CB 4.07Å; K52-A56 PolarHBondContact NZ-O 2.85Å; K52-A58 HydrophobicContact CD-CB 4.03Å; K52-A58 VanDerWaalsContact NZ-N 3.17Å
53	P	67.2	Low	77.5	Confident	55 Å²	55	64.2 Å²	64.2	36%	0.357	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-55.1	148.8	167.8	-21	31.4	0	0	0	111.5	F14 G55 A56	F14-P53 HydrophobicContact CD1-CG 4.4Å; F14-P53 HydrophobicContact CE1-CB 4Å; F14-P53 HydrophobicContact CE1-CG 4.25Å; P53-G55 PolarHBondContact O-N 2.83Å; P53-G55 VanDerWaalsContact O-N 3.17Å; P53-A56 HydrophobicContact CB-CB 4.49Å; P53-A56 WeakPolarHBondContact O-CB 3.14Å; P53-A56 PolarHBondContact O-N 3.05Å
54	A	67.3	Low	76.5	Confident	108 Å²	108	67.4 Å²	67.4	89%	0.893	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	124	176.9	0	0	0	0	0	110.7
55	G	67.6	Low	75.3	Confident	59 Å²	59	70.4 Å²	70.4	61%	0.608	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.2	-7.9	-177.7	0	0	0	0	0	116	P53	P53-G55 PolarHBondContact O-N 2.83Å; P53-G55 VanDerWaalsContact O-N 3.17Å
56	A	71.1	Confident	74.3	Confident	4 Å²	4	69 Å²	69	3%	0.033	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-75.6	150.2	173.8	0	0	0	0	0	111.7	F14 L19 K52 P53	F14-A56 HydrophobicContact CD1-CB 4.21Å; F14-A56 HydrophobicContact CD2-CB 4.22Å; F14-A56 HydrophobicContact CE1-CB 3.78Å; F14-A56 HydrophobicContact CE2-CB 3.77Å; F14-A56 HydrophobicContact CG-CB 4.42Å; F14-A56 HydrophobicContact CZ-CB 3.52Å; L19-A56 HydrophobicContact CD2-CB 3.61Å; K52-A56 HydrophobicContact CB-CB 3.86Å; K52-A56 HydrophobicContact CD-CB 4.39Å; K52-A56 WeakPolarHBondContact CD-O 3.08Å; K52-A56 WeakPolarHBondContact CE-O 3.3Å; K52-A56 HydrophobicContact CG-CB 4.07Å; K52-A56 PolarHBondContact NZ-O 2.85Å; P53-A56 HydrophobicContact CB-CB 4.49Å; P53-A56 WeakPolarHBondContact O-CB 3.14Å; P53-A56 PolarHBondContact O-N 3.05Å
57	P	75.5	Confident	72.2	Confident	17 Å²	17	71.3 Å²	71.3	11%	0.11	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-76.2	150.1	166.2	30.6	-30.5	0	0	0	110.7	L5 T7 T35 I59	L5-P57 HydrophobicContact CD1-CG 4.07Å; L5-P57 HydrophobicContact CD2-CG 3.95Å; T7-P57 HydrophobicContact CG2-CB 4.11Å; T7-P57 HydrophobicContact CG2-CG 3.81Å; T35-P57 HydrophobicContact CG2-CB 4.06Å; P57-I59 HydrophobicContact CG-CG2 4.33Å
58	A	83.2	Confident	69.9	Low	11 Å²	11	77.5 Å²	77.5	9%	0.091	42%	0.418	C	S	.	.	P	Polyproline II helix	trans	-78.6	135.3	170.8	0	0	0	0	0	107.5	T35 C36 H49 K52	T35-A58 CarbonylContact C-O 3.39Å; T35-A58 VanDerWaalsContact CA-O 3.25Å; T35-A58 WeakPolarHBondContact CA-O 3.48Å; C36-A58 PolarHBondContact N-O 3.35Å; C36-A58 VanDerWaalsContact O-CB 3.23Å; C36-A58 WeakPolarHBondContact O-CB 3.48Å; H49-A58 WeakPolarHBondContact O-CA 3.33Å; H49-A58 WeakPolarHBondContact O-CB 3.22Å; K52-A58 HydrophobicContact CD-CB 4.03Å; K52-A58 VanDerWaalsContact NZ-N 3.17Å
59	I	85	Confident	67.5	Low	1 Å²	1	84.7 Å²	84.7	1%	0.005	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	155.5	-172.8	65	167.2	0	0	0	111.9	L5 L19 W25 P33 I34 T35 C36 H49 P57	L5-I59 HydrophobicContact CD1-CG2 4.3Å; L19-I59 HydrophobicContact CB-CD1 3.38Å; L19-I59 HydrophobicContact CB-CG1 3.98Å; L19-I59 HydrophobicContact CD1-CD1 3.71Å; L19-I59 HydrophobicContact CD1-CG1 4.47Å; L19-I59 HydrophobicContact CG-CD1 4.17Å; W25-I59 HydrophobicContact CB-CD1 3.49Å; W25-I59 VanDerWaalsContact CB-CD1 3.49Å; W25-I59 HydrophobicContact CD2-CD1 4.13Å; W25-I59 HydrophobicContact CE3-CD1 3.58Å; W25-I59 HydrophobicContact CG-CD1 4.17Å; P33-I59 HydrophobicContact CB-CD1 4.37Å; P33-I59 HydrophobicContact CB-CG2 4.34Å; I34-I59 CarbonylContact O-C 3.59Å; I34-I59 WeakPolarHBondContact O-CA 3.27Å; I34-I59 WeakPolarHBondContact O-CB 3.32Å; T35-I59 HydrophobicContact CG2-CG2 4.39Å; C36-I59 PolarHBondContact SG-O 3.24Å; H49-I59 PolarHBondContact N-O 2.82Å; P57-I59 HydrophobicContact CG-CG2 4.33Å
60	C	86.5	Confident	65.2	Low	0 Å²	0	90.3 Å²	90.3	0%	0	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	127	175.2	-60.8	0	0	0	0	110.3	W25 V26 I34 C42 F47	W25-C60 CarbonylContact C-O 3.56Å; W25-C60 WeakPolarHBondContact CA-O 3.09Å; V26-C60 HydrophobicContact CB-CB 3.95Å; V26-C60 HydrophobicContact CG2-CB 3.94Å; V26-C60 WeakPolarHBondContact CG2-O 3.23Å; V26-C60 PolarHBondContact N-O 3.44Å; I34-C60 HydrophobicContact CB-CB 4.19Å; I34-C60 HydrophobicContact CG2-CB 4.4Å; I34-C60 PolarHBondContact O-N 2.79Å; C42-C60 WeakPolarHBondContact CA-SG 3.49Å; C42-C60 HydrophobicContact CB-CB 3.76Å; C42-C60 WeakPolarHBondContact CB-SG 3.43Å; C42-C60 WeakPolarHBondContact SG-CA 3.2Å; C42-C60 WeakPolarHBondContact SG-CB 3.05Å; C42-C60 CovalentContact SG-SG 2.04Å; C42-C60 PolarHBondContact SG-SG 2.81Å; F47-C60 CarbonylContact O-C 3.49Å; F47-C60 WeakPolarHBondContact O-CA 3.45Å
61	C	85.8	Confident	63	Low	0 Å²	0	94 Å²	94	0%	0	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	139.6	176.4	-65.6	0	0	0	0	110.7	L19 C20 S23 N24 T46 F47 H49	L19-C61 PolarHBondContact O-SG 3.48Å; L19-C61 VanDerWaalsContact O-SG 3.41Å; C20-C61 HydrophobicContact CB-CB 4.11Å; C20-C61 WeakPolarHBondContact CB-SG 3.29Å; C20-C61 WeakPolarHBondContact SG-CB 3.02Å; C20-C61 CovalentContact SG-SG 2.04Å; C20-C61 PolarHBondContact SG-SG 3.23Å; S23-C61 WeakPolarHBondContact OG-CB 3.35Å; N24-C61 CarbonylContact O-C 3.43Å; N24-C61 WeakPolarHBondContact O-CA 3.02Å; T46-C61 WeakPolarHBondContact CA-O 3.34Å; T46-C61 WeakPolarHBondContact CB-O 3.49Å; F47-C61 HydrophobicContact CD1-CB 4.45Å; F47-C61 VanDerWaalsContact CD1-O 3.28Å; F47-C61 WeakPolarHBondContact CD1-O 3.45Å; F47-C61 HydrophobicContact CD2-CB 4.27Å; F47-C61 HydrophobicContact CE1-CB 3.94Å; F47-C61 HydrophobicContact CE2-CB 3.74Å; F47-C61 HydrophobicContact CZ-CB 3.56Å; F47-C61 PolarHBondContact N-O 2.74Å; F47-C61 PolarHBondContact O-N 3.19Å; H49-C61 VanDerWaalsContact CB-SG 3.53Å
62	R	83.9	Confident	61.4	Low	131 Å²	131	93 Å²	93	49%	0.494	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	125.8	168.8	-176.3	175.3	-67.9	167.9	1.3	109.4	S23 N24 V26 T46 R64	S23-R62 CarbonylContact C-O 3.5Å; S23-R62 VanDerWaalsContact CA-O 3.3Å; S23-R62 WeakPolarHBondContact CA-O 3.09Å; S23-R62 WeakPolarHBondContact CB-O 3.25Å; N24-R62 PolarHBondContact N-O 3.2Å; N24-R62 PolarHBondContact O-N 2.73Å; V26-R62 HydrophobicContact CG2-CB 4.01Å; T46-R62 HydrophobicContact CG2-CB 4.03Å; T46-R62 HydrophobicContact CG2-CG 4.36Å; R62-R64 PolarHBondContact O-N 2.94Å
63	K	69.9	Low	59.6	Low	154 Å²	154	96.5 Å²	96.5	67%	0.67	52%	0.52	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-53.9	129.1	175.3	-161.9	170.5	-176.2	171.2	0	109.7	E65	K63-E65 PolarHBondContact O-N 2.78Å; K63-E65 VanDerWaalsContact O-N 3.16Å
64	R	63.2	Low	57.8	Low	109 Å²	109	101.7 Å²	101.7	41%	0.411	54%	0.544	S	S	.	.			trans	-64.8	118.2	174.7	-80.3	-179.5	-179.1	174.1	2.8	108	S23 N24 R62 N66	S23-R64 PolarHBondContact O-NE 3.45Å; N24-R64 VanDerWaalsContact OD1-CZ 3.27Å; N24-R64 PolarHBondContact OD1-NE 2.85Å; N24-R64 PolarHBondContact OD1-NH2 2.66Å; R62-R64 PolarHBondContact O-N 2.94Å; R64-N66 PolarHBondContact O-N 3.39Å
65	E	56.8	Low	56.1	Low	182 Å²	182	101.8 Å²	101.8	85%	0.85	54%	0.538	S	S	*	.			trans	-64.1	85.3	159.2	-75.9	-173	158.8	0	0	107.5	K63 G67	K63-E65 PolarHBondContact O-N 2.78Å; K63-E65 VanDerWaalsContact O-N 3.16Å; E65-G67 VanDerWaalsContact C-N 3.27Å; E65-G67 PolarHBondContact O-N 2.91Å
66	N	51	Low	54.6	Low	150 Å²	150	107.4 Å²	107.4	80%	0.802	55%	0.55	S	S	*	*			trans	-66.1	94.6	167.2	-83.1	-10.4	0	0	0	107.9	R64	R64-N66 PolarHBondContact O-N 3.39Å
67	G	40.7	Very low	53.1	Low	66 Å²	66	111.8 Å²	111.8	68%	0.68	58%	0.581	S	S	*	*			trans	87.8	93.4	159.4	0	0	0	0	0	114.9	E65	E65-G67 VanDerWaalsContact C-N 3.27Å; E65-G67 PolarHBondContact O-N 2.91Å
68	K	35.1	Very low	51.3	Low	199 Å²	199	117.1 Å²	117.1	87%	0.865	62%	0.617	S	S	*	*	S	Bend	trans	-30.1	140.8	156.6	-62.1	168.6	178.4	178.1	0	112.2
69	H	34.9	Very low	49.2	Very low	160 Å²	160	120.6 Å²	120.6	74%	0.741	65%	0.654	S	S	*	*			trans	99.7	51.7	169.5	-123.9	-141.6	0	0	0	118.3	K71	H69-K71 VanDerWaalsContact C-N 3.28Å
70	C	32.9	Very low	47.4	Very low	148 Å²	148	125.3 Å²	125.3	100%	1	68%	0.675	S	S	*	*			trans	-95.3	58.9	149.2	-98.7	0	0	0	0	109.8
71	K	29.7	Very low	45.7	Very low	166 Å²	166	131 Å²	131	72%	0.722	71%	0.705	S	S	*	*			trans	-131.4	126.3	166.3	-160.5	174.5	-174.2	178.1	0	104.2	H69	H69-K71 VanDerWaalsContact C-N 3.28Å
72	I	34	Very low	44.1	Very low	144 Å²	144	134.7 Å²	134.7	74%	0.738	72%	0.721	S	S	*	*	S	Bend	trans	78.6	82.8	-179.3	-41.1	163.9	0	0	0	112.9
73	L	31.6	Very low	42.7	Very low	162 Å²	162	133.1 Å²	133.1	85%	0.848	73%	0.726	S	S	*	*				-175.9	127	115.9	-90.3	164.8	0	0	0	107.8
74	L	29.3	Very low	42.3	Very low	165 Å²	165	130 Å²	130	86%	0.864	72%	0.717	S	S	*	*			trans	-53.1	134.7	-177.7	-66.8	130.6	0	0	0	111.7
75	S	31.4	Very low	42.6	Very low	109 Å²	109	125 Å²	125	76%	0.762	70%	0.698	S	S	*	*	S	Bend	trans	70.1	136.4	168.1	78.6	0	0	0	0	117.4
76	M	36.3	Very low	43.3	Very low	177 Å²	177	116.7 Å²	116.7	87%	0.872	66%	0.66	S	S	*	*			trans	98.1	95.7	170.2	-53.9	-172	162.2	0	0	118.3
77	S	38.6	Very low	43.7	Very low	97 Å²	97	119.1 Å²	119.1	68%	0.678	66%	0.658	S	S	*	*			trans	70.9	88.4	141.9	-9.9	0	0	0	0	119.3	G79	S77-G79 PolarHBondContact O-N 2.03Å
78	C	38.1	Very low	44.5	Very low	128 Å²	128	119.7 Å²	119.7	87%	0.865	65%	0.65	S	S	*	*			trans	-54.4	123.7	152.9	-62.1	0	0	0	0	109.7	F80	C78-F80 PolarHBondContact O-N 2.88Å
79	G	38.4	Very low	46.1	Very low	84 Å²	84	113.5 Å²	113.5	87%	0.866	62%	0.621	S	S	*	*			trans	-63.9	92.7	174.3	0	0	0	0	0	111.1	S77 N81	S77-G79 PolarHBondContact O-N 2.03Å; G79-N81 PolarHBondContact O-N 2.71Å
80	F	46.9	Very low	47.7	Very low	101 Å²	101	107.2 Å²	107.2	44%	0.443	60%	0.597	S	S	.	*			trans	-72	118.4	169.4	-140	-89.9	0	0	0	107.8	C78 F82 I85 T120	C78-F80 PolarHBondContact O-N 2.88Å; F80-F82 HydrophobicContact CB-CD1 4.28Å; F80-F82 HydrophobicContact CB-CE1 3.91Å; F80-F82 HydrophobicContact CB-CZ 4.35Å; F80-F82 HydrophobicContact CD1-CD1 4.31Å; F80-F82 HydrophobicContact CD1-CE1 4.49Å; F80-F82 PolarHBondContact O-N 3.43Å; F80-I85 HydrophobicContact CD1-CD1 4.05Å; F80-I85 HydrophobicContact CE1-CD1 4.01Å; F80-T120 HydrophobicContact CD1-CG2 4.42Å; F80-T120 HydrophobicContact CE1-CG2 3.22Å; F80-T120 HydrophobicContact CE2-CG2 4.4Å; F80-T120 HydrophobicContact CZ-CG2 3.22Å
81	N	51.3	Low	49.9	Very low	120 Å²	120	101 Å²	101	64%	0.642	55%	0.554	S	S	*	*			trans	-68.1	100.2	167.7	-98.6	-35.3	0	0	0	106.8	G79 V83	G79-N81 PolarHBondContact O-N 2.71Å; N81-V83 HydrophobicContact CB-CG2 4.27Å; N81-V83 PolarHBondContact O-N 2.88Å
82	F	52.4	Low	52.1	Low	76 Å²	76	94.8 Å²	94.8	33%	0.333	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	15.4	177.2	-60.3	-57.2	0	0	0	114.1	F80 I85 Q96 K97 P98	F80-F82 HydrophobicContact CB-CD1 4.28Å; F80-F82 HydrophobicContact CB-CE1 3.91Å; F80-F82 HydrophobicContact CB-CZ 4.35Å; F80-F82 HydrophobicContact CD1-CD1 4.31Å; F80-F82 HydrophobicContact CD1-CE1 4.49Å; F80-F82 PolarHBondContact O-N 3.43Å; F82-I85 HydrophobicContact CD1-CD1 3.95Å; F82-Q96 WeakPolarHBondContact CE2-O 3.3Å; F82-K97 HydrophobicContact CZ-CB 4.45Å; F82-K97 HydrophobicContact CZ-CG 4.24Å; F82-P98 HydrophobicContact CD1-CG 3.35Å; F82-P98 HydrophobicContact CE1-CG 3.4Å; F82-P98 HydrophobicContact CG-CG 4.23Å; F82-P98 VanDerWaalsContact CZ-CD 3.4Å; F82-P98 HydrophobicContact CZ-CG 4.3Å
83	V	54.3	Low	54.1	Low	98 Å²	98	90 Å²	90	59%	0.594	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-23	-162.8	-173.5	0	0	0	0	112.4	N81	N81-V83 HydrophobicContact CB-CG2 4.27Å; N81-V83 PolarHBondContact O-N 2.88Å
84	D	62.4	Low	56	Low	88 Å²	88	86.7 Å²	86.7	47%	0.471	49%	0.486	S	S	.	.	S	Bend	trans	-105	-11.2	-178.3	-56.1	-49.1	0	0	0	113	C86 W87	D84-C86 PolarHBondContact O-N 3.09Å; D84-W87 WeakPolarHBondContact O-CB 3.48Å; D84-W87 PolarHBondContact O-N 3.22Å
85	I	68.1	Low	57.9	Low	5 Å²	5	86 Å²	86	3%	0.026	48%	0.483	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	128.7	178.3	-59.9	174.7	0	0	0	109.4	F80 F82 W87 P91 P98 T120 Y124	F80-I85 HydrophobicContact CD1-CD1 4.05Å; F80-I85 HydrophobicContact CE1-CD1 4.01Å; F82-I85 HydrophobicContact CD1-CD1 3.95Å; I85-W87 VanDerWaalsContact C-N 3.32Å; I85-P91 HydrophobicContact CG2-CB 4.46Å; I85-P98 HydrophobicContact CD1-CG 4.09Å; I85-T120 HydrophobicContact CD1-CG2 4.15Å; I85-T120 HydrophobicContact CG1-CG2 4.29Å; I85-Y124 HydrophobicContact CD1-CE1 4.31Å; I85-Y124 HydrophobicContact CD1-CE2 3.96Å; I85-Y124 HydrophobicContact CG1-CE2 4.34Å; I85-Y124 HydrophobicContact CG2-CD1 4.23Å; I85-Y124 HydrophobicContact CG2-CD2 3.36Å; I85-Y124 HydrophobicContact CG2-CE2 3.85Å; I85-Y124 HydrophobicContact CG2-CG 3.56Å
86	C	72	Confident	59.3	Low	7 Å²	7	88.3 Å²	88.3	5%	0.047	48%	0.482	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.5	6	-177.8	-58.8	0	0	0	0	116.2	D84 W89 P91 C126	D84-C86 PolarHBondContact O-N 3.09Å; C86-W89 CarbonylContact C-O 3.54Å; C86-W89 CarbonylContact O-C 3.47Å; C86-W89 WeakPolarHBondContact O-CA 2.76Å; C86-W89 VanDerWaalsContact O-CB 3.24Å; C86-W89 WeakPolarHBondContact O-CB 3.27Å; C86-W89 PolarHBondContact O-N 3.29Å; C86-P91 HydrophobicContact CB-CB 4.35Å; C86-P91 VanDerWaalsContact SG-CA 3.56Å; C86-C126 WeakPolarHBondContact CA-SG 3.4Å; C86-C126 HydrophobicContact CB-CB 3.46Å; C86-C126 VanDerWaalsContact CB-CB 3.46Å; C86-C126 WeakPolarHBondContact CB-SG 3.02Å; C86-C126 WeakPolarHBondContact SG-CA 3.43Å; C86-C126 WeakPolarHBondContact SG-CB 3.31Å; C86-C126 CovalentContact SG-SG 2.01Å; C86-C126 PolarHBondContact SG-SG 3.08Å
87	W	59.1	Low	60.8	Low	201 Å²	201	85.9 Å²	85.9	76%	0.761	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	131.6	-177.6	-164.1	93.9	0	0	0	112.2	D84 I85	D84-W87 WeakPolarHBondContact O-CB 3.48Å; D84-W87 PolarHBondContact O-N 3.22Å; I85-W87 VanDerWaalsContact C-N 3.32Å
88	P	57.7	Low	62.6	Low	78 Å²	78	81.9 Å²	81.9	51%	0.506	44%	0.438	S	S	.	.	T	Hydrogen-bonded Turn	cis	-87.6	9	12	36	-37.7	0	0	0	115.8
89	W	68.9	Low	64.8	Low	69 Å²	69	77.1 Å²	77.1	26%	0.261	41%	0.405	S	S	.	.	S	Bend	trans	-97.1	169.6	-177.9	-46.2	114	0	0	0	112.9	C86 M127 R129	C86-W89 CarbonylContact C-O 3.54Å; C86-W89 CarbonylContact O-C 3.47Å; C86-W89 WeakPolarHBondContact O-CA 2.76Å; C86-W89 VanDerWaalsContact O-CB 3.24Å; C86-W89 WeakPolarHBondContact O-CB 3.27Å; C86-W89 PolarHBondContact O-N 3.29Å; W89-M127 WeakPolarHBondContact CB-O 2.97Å; W89-R129 HydrophobicContact CH2-CG 3.92Å; W89-R129 VanDerWaalsContact CH2-NE 3.26Å; W89-R129 HydrophobicContact CZ2-CG 4.06Å; W89-R129 HydrophobicContact CZ3-CG 4.49Å
90	A	69.3	Low	67.1	Low	29 Å²	29	79.3 Å²	79.3	24%	0.24	39%	0.391	C	S	.	.	P	Polyproline II helix	trans	-91.2	136.7	175	0	0	0	0	0	111.4	M127 L193	A90-M127 PolarHBondContact O-N 2.87Å; A90-M127 VanDerWaalsContact O-N 3.08Å; A90-L193 HydrophobicContact CB-CD1 4.3Å
91	P	78.1	Confident	69.1	Low	16 Å²	16	75.2 Å²	75.2	10%	0.104	38%	0.375	C	S	.	.	B	Isolated β-bridge	trans	-70.4	148.1	169.6	28.8	-32.8	0	0	0	111	I85 C86 L93 P98	I85-P91 HydrophobicContact CG2-CB 4.46Å; C86-P91 HydrophobicContact CB-CB 4.35Å; C86-P91 VanDerWaalsContact SG-CA 3.56Å; P91-L93 HydrophobicContact CB-CD2 4.43Å; P91-L93 HydrophobicContact CG-CD2 4.05Å; P91-L93 PolarHBondContact O-N 3.03Å; P91-P98 HydrophobicContact CB-CB 3.97Å
92	H	76.9	Confident	70.6	Confident	37 Å²	37	72.9 Å²	72.9	17%	0.171	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-69.1	122	164.8	-174.9	-144.5	0	0	0	109	P98 V99 F112 C125	H92-P98 CarbonylContact O-C 3.54Å; H92-P98 WeakPolarHBondContact O-CA 3.33Å; H92-V99 HydrophobicContact CB-CB 4.36Å; H92-V99 HydrophobicContact CB-CG2 4.36Å; H92-V99 WeakPolarHBondContact ND1-CG2 3.16Å; H92-V99 WeakPolarHBondContact O-CG2 3.42Å; H92-V99 PolarHBondContact O-N 3.09Å; H92-F112 HydrophobicContact CB-CD1 3.61Å; H92-F112 HydrophobicContact CB-CD2 4.49Å; H92-F112 HydrophobicContact CB-CE1 3.53Å; H92-F112 HydrophobicContact CB-CE2 4.43Å; H92-F112 HydrophobicContact CB-CG 4.11Å; H92-F112 HydrophobicContact CB-CZ 3.97Å; H92-F112 AromaticContact CD2-CE2 4Å; H92-F112 AromaticContact CD2-CZ 3.81Å; H92-C125 HydrophobicContact CB-CB 3.81Å; H92-C125 WeakPolarHBondContact CB-O 2.9Å; H92-C125 PolarHBondContact N-O 3.42Å
93	L	74.5	Confident	71.9	Confident	44 Å²	44	74 Å²	74	23%	0.23	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	128.1	-179	-60.2	176.3	0	0	0	110.8	P91 K97 P98 L193	P91-L93 HydrophobicContact CB-CD2 4.43Å; P91-L93 HydrophobicContact CG-CD2 4.05Å; P91-L93 PolarHBondContact O-N 3.03Å; L93-K97 WeakPolarHBondContact CA-O 3.01Å; L93-P98 HydrophobicContact CD2-CB 4.18Å; L93-L193 HydrophobicContact CD1-CD2 3.97Å; L93-L193 HydrophobicContact CD1-CG 4.18Å
94	I	72.2	Confident	73	Confident	92 Å²	92	77.5 Å²	77.5	47%	0.472	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	125.3	166.1	-66.2	175.7	0	0	0	107.2	Q96 K97 V99	I94-Q96 PolarHBondContact O-N 3.12Å; I94-K97 PolarHBondContact N-O 2.66Å; I94-K97 PolarHBondContact O-N 2.92Å; I94-V99 HydrophobicContact CB-CG2 3.91Å; I94-V99 HydrophobicContact CD1-CG2 3.45Å; I94-V99 VanDerWaalsContact CD1-CG2 3.45Å; I94-V99 HydrophobicContact CG1-CG2 3.45Å; I94-V99 VanDerWaalsContact CG1-CG2 3.45Å
95	N	69	Low	73.5	Confident	149 Å²	149	79.3 Å²	79.3	80%	0.797	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	43.6	-175.8	-58.9	-27.7	0	0	0	112.6	K97	N95-K97 PolarHBondContact O-N 2.75Å
96	Q	60.2	Low	73.5	Confident	158 Å²	158	83.2 Å²	83.2	74%	0.738	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.4	15.6	-178.6	-53.1	176.1	6.6	0	0	115.1	F82 I94	F82-Q96 WeakPolarHBondContact CE2-O 3.3Å; I94-Q96 PolarHBondContact O-N 3.12Å
97	K	68	Low	74	Confident	126 Å²	126	86.9 Å²	86.9	55%	0.548	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	137.8	176.2	-64.5	179.8	-177.8	179.5	0	110	F82 L93 I94 N95 V99	F82-K97 HydrophobicContact CZ-CB 4.45Å; F82-K97 HydrophobicContact CZ-CG 4.24Å; L93-K97 WeakPolarHBondContact CA-O 3.01Å; I94-K97 PolarHBondContact N-O 2.66Å; I94-K97 PolarHBondContact O-N 2.92Å; N95-K97 PolarHBondContact O-N 2.75Å; K97-V99 PolarHBondContact O-N 2.86Å
98	P	76.2	Confident	75.1	Confident	13 Å²	13	78.3 Å²	78.3	8%	0.084	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	132.4	177	30.8	-36.4	0	0	0	109.6	F82 I85 P91 H92 L93 K100 Y124	F82-P98 HydrophobicContact CD1-CG 3.35Å; F82-P98 HydrophobicContact CE1-CG 3.4Å; F82-P98 HydrophobicContact CG-CG 4.23Å; F82-P98 VanDerWaalsContact CZ-CD 3.4Å; F82-P98 HydrophobicContact CZ-CG 4.3Å; I85-P98 HydrophobicContact CD1-CG 4.09Å; P91-P98 HydrophobicContact CB-CB 3.97Å; H92-P98 CarbonylContact O-C 3.54Å; H92-P98 WeakPolarHBondContact O-CA 3.33Å; L93-P98 HydrophobicContact CD2-CB 4.18Å; P98-K100 PolarHBondContact O-N 2.78Å; P98-Y124 HydrophobicContact CB-CD1 3.63Å; P98-Y124 HydrophobicContact CB-CE1 3.96Å; P98-Y124 HydrophobicContact CB-CG 4.43Å; P98-Y124 HydrophobicContact CG-CD1 3.88Å; P98-Y124 HydrophobicContact CG-CE1 3.64Å
99	V	84.2	Confident	76.2	Confident	29 Å²	29	79.6 Å²	79.6	18%	0.176	40%	0.403	C	S	.	.			trans	-72.7	113.8	179.6	177.2	0	0	0	0	108.3	H92 I94 K97 Y124 C125	H92-V99 HydrophobicContact CB-CB 4.36Å; H92-V99 HydrophobicContact CB-CG2 4.36Å; H92-V99 WeakPolarHBondContact ND1-CG2 3.16Å; H92-V99 WeakPolarHBondContact O-CG2 3.42Å; H92-V99 PolarHBondContact O-N 3.09Å; I94-V99 HydrophobicContact CB-CG2 3.91Å; I94-V99 HydrophobicContact CD1-CG2 3.45Å; I94-V99 VanDerWaalsContact CD1-CG2 3.45Å; I94-V99 HydrophobicContact CG1-CG2 3.45Å; I94-V99 VanDerWaalsContact CG1-CG2 3.45Å; K97-V99 PolarHBondContact O-N 2.86Å; V99-Y124 CarbonylContact O-C 3.58Å; V99-Y124 VanDerWaalsContact O-CA 3.31Å; V99-Y124 WeakPolarHBondContact O-CA 3.37Å; V99-C125 HydrophobicContact CB-CB 4.32Å; V99-C125 HydrophobicContact CG1-CB 4.47Å; V99-C125 PolarHBondContact O-N 2.88Å
100	K	87.2	Confident	76.3	Confident	129 Å²	129	86.1 Å²	86.1	56%	0.561	43%	0.433	S	S	*	.	B	Isolated β-bridge	trans	-68.6	148.1	169.5	-68.6	-168.1	178	-155.9	0	110	P98 S122 S123 Y124	P98-K100 PolarHBondContact O-N 2.78Å; K100-S122 PolarHBondContact NZ-OG 2.76Å; K100-S123 CarbonylContact C-O 3.55Å; K100-S123 VanDerWaalsContact CA-O 3.23Å; K100-S123 WeakPolarHBondContact CA-O 2.97Å; K100-Y124 HydrophobicContact CD-CE1 4.41Å; K100-Y124 HydrophobicContact CG-CD1 3.89Å; K100-Y124 HydrophobicContact CG-CE1 3.56Å
101	C	88.8	Confident	76.2	Confident	16 Å²	16	86.2 Å²	86.2	11%	0.108	44%	0.437	C	S	.	.			trans	-134.5	159.6	177.2	59.2	0	0	0	0	110.9	C108 C114 S123 Y124	C101-C108 VanDerWaalsContact CB-SG 3.52Å; C101-C114 HydrophobicContact CB-CB 3.77Å; C101-C114 WeakPolarHBondContact CB-SG 3.44Å; C101-C114 WeakPolarHBondContact SG-CA 2.99Å; C101-C114 WeakPolarHBondContact SG-CB 3.38Å; C101-C114 CovalentContact SG-SG 2.02Å; C101-C114 PolarHBondContact SG-SG 3.47Å; C101-S123 PolarHBondContact N-O 3.01Å; C101-S123 WeakPolarHBondContact O-CB 3.36Å; C101-Y124 PolarHBondContact SG-N 3.27Å; C101-Y124 VanDerWaalsContact SG-N 3.4Å; C101-Y124 PolarHBondContact SG-O 2.87Å; C101-Y124 VanDerWaalsContact SG-O 3.36Å
102	D	83.8	Confident	76	Confident	70 Å²	70	87.6 Å²	87.6	37%	0.374	44%	0.441	S	S	.	.			trans	-95.3	125.8	168.2	-169.8	-36.2	0	0	0	108.7	H104 L105 N106 C114	D102-H104 PolarHBondContact O-N 2.98Å; D102-H104 WeakPolarHBondContact OD1-CB 3.33Å; D102-H104 IonicContact OD1-CD2 3.45Å; D102-H104 PolarHBondContact OD1-CD2 3.14Å; D102-H104 IonicContact OD1-CG 3.74Å; D102-H104 PolarHBondContact OD1-N 3.13Å; D102-L105 HydrophobicContact CB-CB 4.29Å; D102-L105 HydrophobicContact CB-CD1 4.29Å; D102-L105 PolarHBondContact O-N 3.42Å; D102-N106 PolarHBondContact O-N 3.09Å; D102-C114 VanDerWaalsContact C-SG 3.57Å
103	Q	80.1	Confident	76.2	Confident	100 Å²	100	87.3 Å²	87.3	47%	0.467	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-24.3	178.9	-62.2	-169.2	-55.2	0	0	112.6	M116 S123	Q103-M116 VanDerWaalsContact OE1-CE 3.24Å; Q103-S123 WeakPolarHBondContact CG-OG 3.28Å
104	H	76	Confident	76.8	Confident	172 Å²	172	86 Å²	86	80%	0.796	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-27.1	-178.3	-58.6	-67.1	0	0	0	113.4	D102	D102-H104 PolarHBondContact O-N 2.98Å; D102-H104 WeakPolarHBondContact OD1-CB 3.33Å; D102-H104 IonicContact OD1-CD2 3.45Å; D102-H104 PolarHBondContact OD1-CD2 3.14Å; D102-H104 IonicContact OD1-CG 3.74Å; D102-H104 PolarHBondContact OD1-N 3.13Å
105	L	74.4	Confident	77.4	Confident	126 Å²	126	82.6 Å²	82.6	66%	0.66	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	-11	-178.7	-76.9	96.4	0	0	0	114.4	D102 T107	D102-L105 HydrophobicContact CB-CB 4.29Å; D102-L105 HydrophobicContact CB-CD1 4.29Å; D102-L105 PolarHBondContact O-N 3.42Å; L105-T107 HydrophobicContact CB-CG2 4.05Å; L105-T107 PolarHBondContact O-N 3.02Å
106	N	67.7	Low	78.1	Confident	86 Å²	86	80 Å²	80	46%	0.46	40%	0.402	S	S	.	.			trans	38.8	63.5	-174.8	-166	20.8	0	0	0	112.9	D102 C108 C114	D102-N106 PolarHBondContact O-N 3.09Å; N106-C108 PolarHBondContact O-N 2.99Å; N106-C114 PolarHBondContact OD1-N 2.76Å
107	T	81.9	Confident	79	Confident	85 Å²	85	73.3 Å²	73.3	52%	0.521	37%	0.372	S	S	.	.			trans	-72.4	15.6	-178.2	53.9	0	0	0	0	114.1	L105	L105-T107 HydrophobicContact CB-CG2 4.05Å; L105-T107 PolarHBondContact O-N 3.02Å
108	C	82.1	Confident	79.3	Confident	20 Å²	20	74.3 Å²	74.3	14%	0.135	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-84.1	145.7	-173.8	-64.1	0	0	0	0	112.5	C101 N106 F112 C125	C101-C108 VanDerWaalsContact CB-SG 3.52Å; N106-C108 PolarHBondContact O-N 2.99Å; C108-F112 HydrophobicContact CB-CB 3.91Å; C108-C125 WeakPolarHBondContact CA-SG 3.13Å; C108-C125 HydrophobicContact CB-CB 3.78Å; C108-C125 WeakPolarHBondContact CB-SG 3.06Å; C108-C125 WeakPolarHBondContact SG-CA 3.05Å; C108-C125 WeakPolarHBondContact SG-CB 3.28Å; C108-C125 CovalentContact SG-SG 2.04Å; C108-C125 PolarHBondContact SG-SG 2.01Å
109	L	81.1	Confident	79	Confident	106 Å²	106	80.5 Å²	80.5	56%	0.555	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-61.2	149.3	174.3	-171.4	66.9	0	0	0	110	G111 F112	L109-G111 PolarHBondContact O-N 2.97Å; L109-F112 HydrophobicContact CB-CD2 4.06Å; L109-F112 WeakPolarHBondContact O-CB 2.96Å; L109-F112 PolarHBondContact O-N 2.75Å
110	K	70.5	Confident	78.4	Confident	205 Å²	205	80.4 Å²	80.4	89%	0.891	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	126.2	178.1	-172.8	177.3	-178.6	176.9	0	110.9
111	G	66.7	Low	78.1	Confident	31 Å²	31	84.9 Å²	84.9	32%	0.32	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.1	-6.3	-174.7	0	0	0	0	0	114.4	L109	L109-G111 PolarHBondContact O-N 2.97Å
112	F	74.6	Confident	77.9	Confident	45 Å²	45	85.4 Å²	85.4	20%	0.197	43%	0.428	C	S	.	.			trans	-111.5	150.6	170.2	-62	-94.2	0	0	0	110	H92 C108 L109 C125 C126 M127	H92-F112 HydrophobicContact CB-CD1 3.61Å; H92-F112 HydrophobicContact CB-CD2 4.49Å; H92-F112 HydrophobicContact CB-CE1 3.53Å; H92-F112 HydrophobicContact CB-CE2 4.43Å; H92-F112 HydrophobicContact CB-CG 4.11Å; H92-F112 HydrophobicContact CB-CZ 3.97Å; H92-F112 AromaticContact CD2-CE2 4Å; H92-F112 AromaticContact CD2-CZ 3.81Å; C108-F112 HydrophobicContact CB-CB 3.91Å; L109-F112 HydrophobicContact CB-CD2 4.06Å; L109-F112 WeakPolarHBondContact O-CB 2.96Å; L109-F112 PolarHBondContact O-N 2.75Å; F112-C125 HydrophobicContact CB-CB 4.11Å; F112-C126 CarbonylContact C-O 3.51Å; F112-C126 WeakPolarHBondContact CA-O 3.48Å; F112-M127 HydrophobicContact CD1-CB 3.98Å; F112-M127 HydrophobicContact CE1-CB 3.93Å
113	T	81.5	Confident	78.1	Confident	31 Å²	31	82.7 Å²	82.7	19%	0.19	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	139.8	176.2	-57.8	0	0	0	0	108.5	E115 C126 R128 T130	T113-E115 PolarHBondContact O-N 2.94Å; T113-C126 PolarHBondContact N-O 3.17Å; T113-C126 PolarHBondContact O-N 3.26Å; T113-C126 VanDerWaalsContact O-O 3.13Å; T113-R128 HydrophobicContact CG2-CG 4.42Å; T113-T130 VanDerWaalsContact OG1-CG2 3.25Å; T113-T130 WeakPolarHBondContact OG1-CG2 3.24Å
114	C	86.8	Confident	78.4	Confident	16 Å²	16	78.5 Å²	78.5	11%	0.108	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	112.9	175.8	-169.7	0	0	0	0	110.6	C101 D102 N106 S123	C101-C114 HydrophobicContact CB-CB 3.77Å; C101-C114 WeakPolarHBondContact CB-SG 3.44Å; C101-C114 WeakPolarHBondContact SG-CA 2.99Å; C101-C114 WeakPolarHBondContact SG-CB 3.38Å; C101-C114 CovalentContact SG-SG 2.02Å; C101-C114 PolarHBondContact SG-SG 3.47Å; D102-C114 VanDerWaalsContact C-SG 3.57Å; N106-C114 PolarHBondContact OD1-N 2.76Å; C114-S123 VanDerWaalsContact SG-CB 3.57Å
115	E	84.6	Confident	78.9	Confident	21 Å²	21	70.3 Å²	70.3	10%	0.098	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	142.8	174.4	-56.6	-169.5	-147	0	0	111.1	T113 S123 Y124 C126 R128	T113-E115 PolarHBondContact O-N 2.94Å; E115-S123 CarbonylContact O-C 3.59Å; E115-S123 WeakPolarHBondContact O-CA 3.24Å; E115-S123 WeakPolarHBondContact O-CB 3.46Å; E115-Y124 PolarHBondContact N-O 2.86Å; E115-Y124 PolarHBondContact O-N 3.45Å; E115-C126 HydrophobicContact CB-CB 4.17Å; E115-C126 VanDerWaalsContact CB-SG 3.59Å; E115-C126 HydrophobicContact CG-CB 3.68Å; E115-C126 VanDerWaalsContact OE1-CB 3.24Å; E115-C126 WeakPolarHBondContact OE1-CB 3.4Å; E115-R128 VanDerWaalsContact CD-NH2 3.27Å; E115-R128 HydrophobicContact CG-CG 3.96Å; E115-R128 VanDerWaalsContact CG-CZ 3.41Å; E115-R128 VanDerWaalsContact CG-NE 3.3Å; E115-R128 VanDerWaalsContact OE1-CD 3.3Å; E115-R128 WeakPolarHBondContact OE1-CD 3.39Å; E115-R128 WeakPolarHBondContact OE1-CG 3.33Å; E115-R128 IonicContact OE1-CZ 3.68Å; E115-R128 IonicContact OE1-NE 2.86Å; E115-R128 PolarHBondContact OE1-NE 2.7Å; E115-R128 IonicContact OE1-NH2 3.93Å; E115-R128 IonicContact OE2-CZ 3.13Å; E115-R128 IonicContact OE2-NE 3.09Å; E115-R128 PolarHBondContact OE2-NE 3.37Å; E115-R128 VanDerWaalsContact OE2-NE 3.09Å; E115-R128 IonicContact OE2-NH2 2.66Å; E115-R128 PolarHBondContact OE2-NH2 2.87Å
116	M	83	Confident	79.2	Confident	94 Å²	94	64.4 Å²	64.4	46%	0.463	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	127.5	170.2	-174.8	172.3	-75.5	0	0	109.8	Q103	Q103-M116 VanDerWaalsContact OE1-CE 3.24Å
117	D	79.9	Confident	79.5	Confident	19 Å²	19	64.2 Å²	64.2	10%	0.102	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	122.6	169	174.8	82.3	0	0	0	109.1	E119 T120 R121 S122 Y124	D117-E119 VanDerWaalsContact C-N 3.29Å; D117-E119 PolarHBondContact O-N 2.81Å; D117-E119 PolarHBondContact OD2-N 3.2Å; D117-T120 WeakPolarHBondContact CB-OG1 3.49Å; D117-T120 PolarHBondContact O-OG1 3.31Å; D117-T120 WeakPolarHBondContact OD2-CB 3.21Å; D117-T120 WeakPolarHBondContact OD2-CG2 3.45Å; D117-T120 PolarHBondContact OD2-N 3Å; D117-T120 PolarHBondContact OD2-OG1 3.47Å; D117-R121 WeakPolarHBondContact O-CA 3.33Å; D117-R121 PolarHBondContact O-N 3.22Å; D117-R121 VanDerWaalsContact O-N 3.07Å; D117-S122 PolarHBondContact N-O 3.24Å; D117-Y124 HydrophobicContact CB-CD2 3.8Å; D117-Y124 HydrophobicContact CB-CE2 3.89Å
118	N	75	Confident	78.6	Confident	146 Å²	146	65.8 Å²	65.8	78%	0.781	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-26.5	-174	-82.2	-8.7	0	0	0	112.7
119	E	69.5	Low	77.1	Confident	144 Å²	144	70 Å²	70	67%	0.673	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-45	-177.3	-168.1	177	179.3	0	0	111.3	D117	D117-E119 VanDerWaalsContact C-N 3.29Å; D117-E119 PolarHBondContact O-N 2.81Å; D117-E119 PolarHBondContact OD2-N 3.2Å
120	T	72.1	Confident	75.3	Confident	26 Å²	26	68.1 Å²	68.1	16%	0.16	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-12.8	-179	61.9	0	0	0	0	114.1	F80 I85 D117 S122 Y124	F80-T120 HydrophobicContact CD1-CG2 4.42Å; F80-T120 HydrophobicContact CE1-CG2 3.22Å; F80-T120 HydrophobicContact CE2-CG2 4.4Å; F80-T120 HydrophobicContact CZ-CG2 3.22Å; I85-T120 HydrophobicContact CD1-CG2 4.15Å; I85-T120 HydrophobicContact CG1-CG2 4.29Å; D117-T120 WeakPolarHBondContact CB-OG1 3.49Å; D117-T120 PolarHBondContact O-OG1 3.31Å; D117-T120 WeakPolarHBondContact OD2-CB 3.21Å; D117-T120 WeakPolarHBondContact OD2-CG2 3.45Å; D117-T120 PolarHBondContact OD2-N 3Å; D117-T120 PolarHBondContact OD2-OG1 3.47Å; T120-S122 PolarHBondContact O-N 2.91Å; T120-S122 PolarHBondContact O-OG 2.78Å; T120-S122 PolarHBondContact OG1-N 2.87Å; T120-S122 VanDerWaalsContact OG1-N 3.09Å; T120-Y124 HydrophobicContact CG2-CE2 4.05Å; T120-Y124 WeakPolarHBondContact OG1-CE2 3.39Å
121	R	80.6	Confident	73.7	Confident	223 Å²	223	66 Å²	66	84%	0.842	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	26.7	-166.2	-59.3	-175.6	179.5	178.8	0.1	113.2	D117	D117-R121 WeakPolarHBondContact O-CA 3.33Å; D117-R121 PolarHBondContact O-N 3.22Å; D117-R121 VanDerWaalsContact O-N 3.07Å
122	S	83.6	Confident	72.3	Confident	27 Å²	27	71.5 Å²	71.5	19%	0.189	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	149.4	179.3	-68.3	0	0	0	0	108.8	K100 D117 T120	K100-S122 PolarHBondContact NZ-OG 2.76Å; D117-S122 PolarHBondContact N-O 3.24Å; T120-S122 PolarHBondContact O-N 2.91Å; T120-S122 PolarHBondContact O-OG 2.78Å; T120-S122 PolarHBondContact OG1-N 2.87Å; T120-S122 VanDerWaalsContact OG1-N 3.09Å
123	S	87.6	Confident	70.2	Confident	14 Å²	14	74.4 Å²	74.4	10%	0.098	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	138	172.6	-58.1	0	0	0	0	111.1	K100 C101 Q103 C114 E115	K100-S123 CarbonylContact C-O 3.55Å; K100-S123 VanDerWaalsContact CA-O 3.23Å; K100-S123 WeakPolarHBondContact CA-O 2.97Å; C101-S123 PolarHBondContact N-O 3.01Å; C101-S123 WeakPolarHBondContact O-CB 3.36Å; Q103-S123 WeakPolarHBondContact CG-OG 3.28Å; C114-S123 VanDerWaalsContact SG-CB 3.57Å; E115-S123 CarbonylContact O-C 3.59Å; E115-S123 WeakPolarHBondContact O-CA 3.24Å; E115-S123 WeakPolarHBondContact O-CB 3.46Å
124	Y	87.2	Confident	68.2	Low	11 Å²	11	78.1 Å²	78.1	4%	0.043	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	151	-178.4	-60.7	-84.8	0	0	0	111.4	I85 P98 V99 K100 C101 E115 D117 T120 C126	I85-Y124 HydrophobicContact CD1-CE1 4.31Å; I85-Y124 HydrophobicContact CD1-CE2 3.96Å; I85-Y124 HydrophobicContact CG1-CE2 4.34Å; I85-Y124 HydrophobicContact CG2-CD1 4.23Å; I85-Y124 HydrophobicContact CG2-CD2 3.36Å; I85-Y124 HydrophobicContact CG2-CE2 3.85Å; I85-Y124 HydrophobicContact CG2-CG 3.56Å; P98-Y124 HydrophobicContact CB-CD1 3.63Å; P98-Y124 HydrophobicContact CB-CE1 3.96Å; P98-Y124 HydrophobicContact CB-CG 4.43Å; P98-Y124 HydrophobicContact CG-CD1 3.88Å; P98-Y124 HydrophobicContact CG-CE1 3.64Å; V99-Y124 CarbonylContact O-C 3.58Å; V99-Y124 VanDerWaalsContact O-CA 3.31Å; V99-Y124 WeakPolarHBondContact O-CA 3.37Å; K100-Y124 HydrophobicContact CD-CE1 4.41Å; K100-Y124 HydrophobicContact CG-CD1 3.89Å; K100-Y124 HydrophobicContact CG-CE1 3.56Å; C101-Y124 PolarHBondContact SG-N 3.27Å; C101-Y124 VanDerWaalsContact SG-N 3.4Å; C101-Y124 PolarHBondContact SG-O 2.87Å; C101-Y124 VanDerWaalsContact SG-O 3.36Å; E115-Y124 PolarHBondContact N-O 2.86Å; E115-Y124 PolarHBondContact O-N 3.45Å; D117-Y124 HydrophobicContact CB-CD2 3.8Å; D117-Y124 HydrophobicContact CB-CE2 3.89Å; T120-Y124 HydrophobicContact CG2-CE2 4.05Å; T120-Y124 WeakPolarHBondContact OG1-CE2 3.39Å; Y124-C126 PolarHBondContact O-N 2.85Å; Y124-C126 VanDerWaalsContact O-N 3.1Å; Y124-C126 PolarHBondContact O-SG 2.95Å; Y124-C126 VanDerWaalsContact O-SG 3.42Å
125	C	85.4	Confident	65.7	Low	0 Å²	0	84.9 Å²	84.9	0%	0	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	102.3	172.3	-67.6	0	0	0	0	109.6	H92 V99 C108 F112	H92-C125 HydrophobicContact CB-CB 3.81Å; H92-C125 WeakPolarHBondContact CB-O 2.9Å; H92-C125 PolarHBondContact N-O 3.42Å; V99-C125 HydrophobicContact CB-CB 4.32Å; V99-C125 HydrophobicContact CG1-CB 4.47Å; V99-C125 PolarHBondContact O-N 2.88Å; C108-C125 WeakPolarHBondContact CA-SG 3.13Å; C108-C125 HydrophobicContact CB-CB 3.78Å; C108-C125 WeakPolarHBondContact CB-SG 3.06Å; C108-C125 WeakPolarHBondContact SG-CA 3.05Å; C108-C125 WeakPolarHBondContact SG-CB 3.28Å; C108-C125 CovalentContact SG-SG 2.04Å; C108-C125 PolarHBondContact SG-SG 2.01Å; F112-C125 HydrophobicContact CB-CB 4.11Å
126	C	80.9	Confident	63.4	Low	2 Å²	2	89.8 Å²	89.8	1%	0.014	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	144.8	179.8	-55.3	0	0	0	0	110.2	C86 F112 T113 E115 Y124 R128	C86-C126 WeakPolarHBondContact CA-SG 3.4Å; C86-C126 HydrophobicContact CB-CB 3.46Å; C86-C126 VanDerWaalsContact CB-CB 3.46Å; C86-C126 WeakPolarHBondContact CB-SG 3.02Å; C86-C126 WeakPolarHBondContact SG-CA 3.43Å; C86-C126 WeakPolarHBondContact SG-CB 3.31Å; C86-C126 CovalentContact SG-SG 2.01Å; C86-C126 PolarHBondContact SG-SG 3.08Å; F112-C126 CarbonylContact C-O 3.51Å; F112-C126 WeakPolarHBondContact CA-O 3.48Å; T113-C126 PolarHBondContact N-O 3.17Å; T113-C126 PolarHBondContact O-N 3.26Å; T113-C126 VanDerWaalsContact O-O 3.13Å; E115-C126 HydrophobicContact CB-CB 4.17Å; E115-C126 VanDerWaalsContact CB-SG 3.59Å; E115-C126 HydrophobicContact CG-CB 3.68Å; E115-C126 VanDerWaalsContact OE1-CB 3.24Å; E115-C126 WeakPolarHBondContact OE1-CB 3.4Å; Y124-C126 PolarHBondContact O-N 2.85Å; Y124-C126 VanDerWaalsContact O-N 3.1Å; Y124-C126 PolarHBondContact O-SG 2.95Å; Y124-C126 VanDerWaalsContact O-SG 3.42Å; C126-R128 PolarHBondContact O-N 3.34Å
127	M	74.2	Confident	61.2	Low	83 Å²	83	91.4 Å²	91.4	41%	0.409	46%	0.46	S	S	.	.			trans	-75.8	77.1	176.3	-167.8	175.2	-177.7	0	0	110.3	W89 A90 F112 Y167	W89-M127 WeakPolarHBondContact CB-O 2.97Å; A90-M127 PolarHBondContact O-N 2.87Å; A90-M127 VanDerWaalsContact O-N 3.08Å; F112-M127 HydrophobicContact CD1-CB 3.98Å; F112-M127 HydrophobicContact CE1-CB 3.93Å; M127-Y167 HydrophobicContact CE-CE1 4.22Å
128	R	64	Low	59.1	Low	117 Å²	117	94.2 Å²	94.2	44%	0.442	49%	0.486	S	S	.	.			trans	-72.3	150.9	171.1	-76.6	-163	157.5	158.2	1.1	111.1	T113 E115 C126 T130	T113-R128 HydrophobicContact CG2-CG 4.42Å; E115-R128 VanDerWaalsContact CD-NH2 3.27Å; E115-R128 HydrophobicContact CG-CG 3.96Å; E115-R128 VanDerWaalsContact CG-CZ 3.41Å; E115-R128 VanDerWaalsContact CG-NE 3.3Å; E115-R128 VanDerWaalsContact OE1-CD 3.3Å; E115-R128 WeakPolarHBondContact OE1-CD 3.39Å; E115-R128 WeakPolarHBondContact OE1-CG 3.33Å; E115-R128 IonicContact OE1-CZ 3.68Å; E115-R128 IonicContact OE1-NE 2.86Å; E115-R128 PolarHBondContact OE1-NE 2.7Å; E115-R128 IonicContact OE1-NH2 3.93Å; E115-R128 IonicContact OE2-CZ 3.13Å; E115-R128 IonicContact OE2-NE 3.09Å; E115-R128 PolarHBondContact OE2-NE 3.37Å; E115-R128 VanDerWaalsContact OE2-NE 3.09Å; E115-R128 IonicContact OE2-NH2 2.66Å; E115-R128 PolarHBondContact OE2-NH2 2.87Å; C126-R128 PolarHBondContact O-N 3.34Å; R128-T130 PolarHBondContact O-N 2.74Å
129	R	49.4	Very low	57.4	Low	109 Å²	109	94 Å²	94	41%	0.411	49%	0.49	S	S	.	.			trans	-56.1	81.8	159.1	-65.8	177.8	172.8	176.6	2.2	110	W89 D165	W89-R129 HydrophobicContact CH2-CG 3.92Å; W89-R129 VanDerWaalsContact CH2-NE 3.26Å; W89-R129 HydrophobicContact CZ2-CG 4.06Å; W89-R129 HydrophobicContact CZ3-CG 4.49Å; R129-D165 IonicContact NH2-OD2 2.91Å; R129-D165 PolarHBondContact NH2-OD2 2.86Å
130	T	45.2	Very low	56	Low	67 Å²	67	95.5 Å²	95.5	41%	0.411	50%	0.497	S	S	.	.			trans	-85.9	121.2	161.6	52.7	0	0	0	0	107.7	T113 R128 L132	T113-T130 VanDerWaalsContact OG1-CG2 3.25Å; T113-T130 WeakPolarHBondContact OG1-CG2 3.24Å; R128-T130 PolarHBondContact O-N 2.74Å; T130-L132 PolarHBondContact O-N 3.1Å
131	K	35.2	Very low	54.3	Low	160 Å²	160	99.4 Å²	99.4	70%	0.696	52%	0.521	S	S	*	.			trans	-43	110.3	166.5	-168.9	179.9	-175.4	-179.1	0	107.8	T133	K131-T133 HydrophobicContact CD-CG2 4Å; K131-T133 HydrophobicContact CG-CG2 4.17Å; K131-T133 PolarHBondContact O-N 2.95Å
132	L	38.8	Very low	52.4	Low	147 Å²	147	96 Å²	96	77%	0.77	52%	0.518	S	S	*	.			trans	-67.6	88.6	161.4	-113.4	86	0	0	0	105	T130 V134	T130-L132 PolarHBondContact O-N 3.1Å; L132-V134 HydrophobicContact CB-CG2 4.15Å; L132-V134 HydrophobicContact CD2-CG2 3.92Å; L132-V134 HydrophobicContact CG-CG2 4.46Å; L132-V134 PolarHBondContact O-N 3.35Å
133	T	29.8	Very low	50.1	Low	106 Å²	106	101.1 Å²	101.1	65%	0.65	55%	0.549	S	S	*	.			trans	-65.7	83.1	155.4	35.5	0	0	0	0	105.8	K131 E135	K131-T133 HydrophobicContact CD-CG2 4Å; K131-T133 HydrophobicContact CG-CG2 4.17Å; K131-T133 PolarHBondContact O-N 2.95Å; T133-E135 PolarHBondContact O-N 2.05Å
134	V	40.2	Very low	47.6	Very low	109 Å²	109	105.7 Å²	105.7	66%	0.661	58%	0.581	S	S	*	*			trans	-71.2	91.3	158.2	-174	0	0	0	0	103.9	L132	L132-V134 HydrophobicContact CB-CG2 4.15Å; L132-V134 HydrophobicContact CD2-CG2 3.92Å; L132-V134 HydrophobicContact CG-CG2 4.46Å; L132-V134 PolarHBondContact O-N 3.35Å
135	E	34.1	Very low	45.2	Very low	157 Å²	157	114.7 Å²	114.7	73%	0.734	62%	0.62	S	S	*	*			trans	-55.8	129.3	156.3	-67.7	-154.4	149.8	0	0	106.4	T133 V137	T133-E135 PolarHBondContact O-N 2.05Å; E135-V137 PolarHBondContact O-N 2.75Å
136	P	36.4	Very low	42.8	Very low	125 Å²	125	119 Å²	119	81%	0.812	66%	0.656	S	S	*	*			trans	-65.9	89.8	176.2	26.9	-31.6	0	0	0	107.5	A138	P136-A138 PolarHBondContact O-N 2.72Å
137	V	35.4	Very low	40.5	Very low	127 Å²	127	124.3 Å²	124.3	77%	0.77	69%	0.69	S	S	*	*			trans	-64.1	110.5	162.2	178.3	0	0	0	0	104.9	E135 V139	E135-V137 PolarHBondContact O-N 2.75Å; V137-V139 PolarHBondContact O-N 2.94Å; V137-V139 VanDerWaalsContact O-N 3.09Å
138	A	35.8	Very low	38.5	Very low	78 Å²	78	131.7 Å²	131.7	65%	0.645	71%	0.714	S	S	*	*			trans	-46.1	119.1	170.4	0	0	0	0	0	107.9	P136 E140	P136-A138 PolarHBondContact O-N 2.72Å; A138-E140 PolarHBondContact O-N 3.32Å
139	V	39.5	Very low	37	Very low	141 Å²	141	133 Å²	133	86%	0.855	73%	0.728	S	S	*	*			trans	-70.9	84.2	173.9	178.6	0	0	0	0	106.3	V137 T141	V137-V139 PolarHBondContact O-N 2.94Å; V137-V139 VanDerWaalsContact O-N 3.09Å; V139-T141 VanDerWaalsContact C-N 3.35Å; V139-T141 PolarHBondContact O-N 3.49Å; V139-T141 VanDerWaalsContact O-N 3.14Å
140	E	41.5	Very low	36.3	Very low	177 Å²	177	136.5 Å²	136.5	83%	0.827	75%	0.749	S	S	*	*			trans	-72.7	101.1	158.3	-74.3	-169.7	169.1	0	0	107.3	A138	A138-E140 PolarHBondContact O-N 3.32Å
141	T	36.5	Very low	36.2	Very low	108 Å²	108	137 Å²	137	66%	0.663	75%	0.752	S	S	*	*			trans	-3.3	126.6	150.5	15.2	0	0	0	0	116.7	V139	V139-T141 VanDerWaalsContact C-N 3.35Å; V139-T141 PolarHBondContact O-N 3.49Å; V139-T141 VanDerWaalsContact O-N 3.14Å
142	L	39.3	Very low	37.1	Very low	151 Å²	151	134.7 Å²	134.7	79%	0.791	74%	0.742	S	S	*	*			trans	78.4	103.6	143.7	-55.4	156.7	0	0	0	116.3
143	T	36	Very low	38.4	Very low	135 Å²	135	134.3 Å²	134.3	83%	0.828	74%	0.736	S	S	*	*				170.6	132	103.5	40.5	0	0	0	0	112.2
144	S	35.9	Very low	40.4	Very low	110 Å²	110	129.7 Å²	129.7	77%	0.769	71%	0.707	S	S	*	*	S	Bend	trans	19	98.3	162	64.9	0	0	0	0	120.6
145	K	35.4	Very low	42.2	Very low	200 Å²	200	125 Å²	125	87%	0.87	68%	0.679	S	S	*	*			trans	150.4	74.8	141.3	-87.3	174.2	-179.4	176.2	0	107.9	P147	K145-P147 WeakPolarHBondContact O-CD 3.43Å
146	A	35.7	Very low	44	Very low	91 Å²	91	120.3 Å²	120.3	75%	0.752	66%	0.662	S	S	*	*			trans	-57.2	124	174.2	0	0	0	0	0	109	R148	A146-R148 PolarHBondContact O-N 3.32Å; A146-R148 VanDerWaalsContact O-N 3.12Å
147	P	31.9	Very low	45.1	Very low	113 Å²	113	120.6 Å²	120.6	73%	0.734	66%	0.662	S	S	*	*			trans	-62.4	120.3	170.5	25.8	-29.8	0	0	0	106.6	K145 I149	K145-P147 WeakPolarHBondContact O-CD 3.43Å; P147-I149 VanDerWaalsContact C-N 3.32Å; P147-I149 PolarHBondContact O-N 3.04Å
148	R	32.1	Very low	46.2	Very low	238 Å²	238	122.2 Å²	122.2	90%	0.898	67%	0.665	S	S	*	*			trans	-60.3	99.3	169.2	-74.7	-178.3	176.5	158.5	-1.4	106.7	A146 Q150	A146-R148 PolarHBondContact O-N 3.32Å; A146-R148 VanDerWaalsContact O-N 3.12Å; R148-Q150 PolarHBondContact O-N 2.91Å
149	I	33.3	Very low	47.9	Very low	144 Å²	144	121.1 Å²	121.1	74%	0.738	65%	0.645	S	S	*	*			trans	-64	104.3	167.4	-59.1	174.5	0	0	0	104.9	P147 V151	P147-I149 VanDerWaalsContact C-N 3.32Å; P147-I149 PolarHBondContact O-N 3.04Å; I149-V151 PolarHBondContact O-N 3.16Å
150	Q	34.3	Very low	49.3	Very low	182 Å²	182	115.6 Å²	115.6	85%	0.85	61%	0.613	S	S	*	*			trans	-67.6	103.9	175.2	-68.2	-176.5	5.2	0	0	106.9	R148 F152	R148-Q150 PolarHBondContact O-N 2.91Å; Q150-F152 PolarHBondContact O-N 2.03Å; Q150-F152 VanDerWaalsContact O-N 3.15Å
151	V	43.6	Very low	51.1	Low	79 Å²	79	109 Å²	109	48%	0.479	59%	0.585	S	S	.	*			trans	-64.2	115.5	171.7	179	0	0	0	0	106.4	I149 H153	I149-V151 PolarHBondContact O-N 3.16Å; V151-H153 PolarHBondContact O-CD2 2.91Å; V151-H153 VanDerWaalsContact O-CD2 3.25Å; V151-H153 PolarHBondContact O-N 3.35Å
152	F	54.1	Low	53	Low	110 Å²	110	107.1 Å²	107.1	48%	0.482	57%	0.566	S	S	.	*			trans	-70.3	95.7	178.2	-176.5	-106.8	0	0	0	108.5	Q150 V154 H188 T191	Q150-F152 PolarHBondContact O-N 2.03Å; Q150-F152 VanDerWaalsContact O-N 3.15Å; F152-V154 HydrophobicContact CD1-CG2 3.46Å; F152-V154 VanDerWaalsContact CD1-CG2 3.46Å; F152-V154 HydrophobicContact CE1-CB 4.38Å; F152-V154 HydrophobicContact CE1-CG1 4.42Å; F152-V154 HydrophobicContact CE1-CG2 3.56Å; F152-V154 WeakPolarHBondContact O-CG2 3.25Å; F152-V154 PolarHBondContact O-N 3.04Å; F152-V154 VanDerWaalsContact O-N 3.14Å; F152-H188 AromaticContact CE2-CE1 3.31Å; F152-H188 WeakPolarHBondContact CE2-CE1 3.18Å; F152-H188 AromaticContact CZ-CE1 3.21Å; F152-H188 WeakPolarHBondContact CZ-CE1 3.23Å; F152-H188 AromaticContact CZ-ND1 3.58Å; F152-T191 HydrophobicContact CE2-CG2 3.68Å; F152-T191 HydrophobicContact CZ-CG2 3.42Å; F152-T191 VanDerWaalsContact CZ-CG2 3.42Å
153	H	64.8	Low	54.5	Low	139 Å²	139	103 Å²	103	64%	0.644	55%	0.545	S	S	*	.			trans	-79.2	92	178.6	-72.9	-71.7	0	0	0	110	V151 C155 H188	V151-H153 PolarHBondContact O-CD2 2.91Å; V151-H153 VanDerWaalsContact O-CD2 3.25Å; V151-H153 PolarHBondContact O-N 3.35Å; H153-C155 VanDerWaalsContact C-N 3.28Å; H153-C155 PolarHBondContact O-N 2.83Å; H153-H188 PolarHBondContact O-CD2 3.07Å; H153-H188 PolarHBondContact O-NE2 2.64Å; H153-H188 VanDerWaalsContact O-NE2 3.09Å
154	V	73.2	Confident	55.9	Low	9 Å²	9	100.9 Å²	100.9	6%	0.055	53%	0.528	C	S	.	.			trans	-67.1	-30.4	-175.9	-166.8	0	0	0	0	113.4	F152 P161 P168 H188 F195	F152-V154 HydrophobicContact CD1-CG2 3.46Å; F152-V154 VanDerWaalsContact CD1-CG2 3.46Å; F152-V154 HydrophobicContact CE1-CB 4.38Å; F152-V154 HydrophobicContact CE1-CG1 4.42Å; F152-V154 HydrophobicContact CE1-CG2 3.56Å; F152-V154 WeakPolarHBondContact O-CG2 3.25Å; F152-V154 PolarHBondContact O-N 3.04Å; F152-V154 VanDerWaalsContact O-N 3.14Å; V154-P161 HydrophobicContact CB-CB 4.48Å; V154-P168 HydrophobicContact CB-CB 4.43Å; V154-P168 HydrophobicContact CG1-CB 4.11Å; V154-P168 HydrophobicContact CG2-CB 4.06Å; V154-P168 HydrophobicContact CG2-CG 4.01Å; V154-H188 PolarHBondContact O-CD2 3.45Å; V154-H188 VanDerWaalsContact O-CD2 3.26Å; V154-F195 HydrophobicContact CB-CG 4.48Å; V154-F195 HydrophobicContact CG1-CB 3.55Å; V154-F195 HydrophobicContact CG1-CD1 3.34Å; V154-F195 HydrophobicContact CG1-CD2 3.07Å; V154-F195 HydrophobicContact CG1-CE1 3.63Å; V154-F195 HydrophobicContact CG1-CE2 3.37Å; V154-F195 HydrophobicContact CG1-CG 3.02Å; V154-F195 HydrophobicContact CG1-CZ 3.64Å
155	C	77.7	Confident	56.8	Low	11 Å²	11	100.8 Å²	100.8	7%	0.074	52%	0.519	C	S	.	.	S	Bend	trans	-109.5	157	-177.4	-68.2	0	0	0	0	111	H153 Y159 P161 C197	H153-C155 VanDerWaalsContact C-N 3.28Å; H153-C155 PolarHBondContact O-N 2.83Å; C155-Y159 WeakPolarHBondContact CB-O 3.3Å; C155-P161 WeakPolarHBondContact SG-CA 3.02Å; C155-C197 WeakPolarHBondContact CA-SG 3.38Å; C155-C197 HydrophobicContact CB-CB 3.74Å; C155-C197 WeakPolarHBondContact CB-SG 3.19Å; C155-C197 WeakPolarHBondContact SG-CA 3.22Å; C155-C197 WeakPolarHBondContact SG-CB 3.23Å; C155-C197 CovalentContact SG-SG 2.03Å; C155-C197 PolarHBondContact SG-SG 3.06Å
156	P	72.1	Confident	57.8	Low	58 Å²	58	93 Å²	93	38%	0.377	50%	0.495	S	S	.	.			trans	-55.3	159.1	174.4	-19.7	30.1	0	0	0	111.7	L158 Y159	P156-L158 PolarHBondContact O-N 3.45Å; P156-Y159 HydrophobicContact CB-CD2 3.73Å; P156-Y159 HydrophobicContact CB-CE2 4.18Å; P156-Y159 HydrophobicContact CG-CD2 4.25Å; P156-Y159 WeakPolarHBondContact O-CB 3.48Å; P156-Y159 PolarHBondContact O-N 2.95Å
157	V	59.4	Low	58.9	Low	132 Å²	132	91.9 Å²	91.9	80%	0.8	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	133.7	-179.9	-170.4	0	0	0	0	109.5	Y159	V157-Y159 WeakPolarHBondContact O-CD2 3.45Å
158	L	59.3	Low	60.9	Low	160 Å²	160	88.5 Å²	88.5	84%	0.838	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.4	-5.6	-173.8	-52.1	170.6	0	0	0	116.6	P156	P156-L158 PolarHBondContact O-N 3.45Å
159	Y	69.9	Low	63.1	Low	55 Å²	55	79 Å²	79	22%	0.216	42%	0.417	C	S	.	.			trans	-104.8	136.3	178.8	-63.8	-88.7	0	0	0	111.7	C155 P156 V157 L198 E200	C155-Y159 WeakPolarHBondContact CB-O 3.3Å; P156-Y159 HydrophobicContact CB-CD2 3.73Å; P156-Y159 HydrophobicContact CB-CE2 4.18Å; P156-Y159 HydrophobicContact CG-CD2 4.25Å; P156-Y159 WeakPolarHBondContact O-CB 3.48Å; P156-Y159 PolarHBondContact O-N 2.95Å; V157-Y159 WeakPolarHBondContact O-CD2 3.45Å; Y159-L198 WeakPolarHBondContact CD1-O 3.43Å; Y159-L198 WeakPolarHBondContact CE1-O 3.21Å; Y159-E200 HydrophobicContact CE1-CB 3.91Å; Y159-E200 HydrophobicContact CE1-CG 3.66Å; Y159-E200 VanDerWaalsContact CE1-N 3.33Å; Y159-E200 HydrophobicContact CE2-CG 4.26Å; Y159-E200 WeakPolarHBondContact CE2-OE1 3.02Å; Y159-E200 VanDerWaalsContact CZ-CD 3.48Å; Y159-E200 VanDerWaalsContact CZ-CG 3.48Å; Y159-E200 VanDerWaalsContact OH-CG 3.23Å; Y159-E200 WeakPolarHBondContact OH-CG 3.42Å; Y159-E200 PolarHBondContact OH-OE1 3.23Å; Y159-E200 PolarHBondContact OH-OE2 3.35Å
160	S	69.8	Low	65.5	Low	26 Å²	26	75.4 Å²	75.4	18%	0.182	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-96.9	138.1	172.3	52.8	0	0	0	0	110.8	L198	S160-L198 PolarHBondContact O-N 3.12Å
161	P	79.4	Confident	67.7	Low	38 Å²	38	67.7 Å²	67.7	25%	0.247	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-68.8	147.2	170.4	29.4	-33.4	0	0	0	110.3	V154 C155 L163 P168 C196	V154-P161 HydrophobicContact CB-CB 4.48Å; C155-P161 WeakPolarHBondContact SG-CA 3.02Å; P161-L163 HydrophobicContact CB-CD2 4.45Å; P161-L163 HydrophobicContact CG-CD2 4.04Å; P161-L163 PolarHBondContact O-N 2.96Å; P161-P168 HydrophobicContact CB-CB 3.91Å; P161-P168 HydrophobicContact CG-CB 4.47Å; P161-C196 CarbonylContact C-O 3.51Å; P161-C196 WeakPolarHBondContact CA-O 3.02Å
162	Y	75.4	Confident	69.3	Low	68 Å²	68	68.5 Å²	68.5	27%	0.267	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-69.5	123.7	163.6	-176.1	-99.1	0	0	0	107.9	L164 P168 L169 P180 Y183 C196	Y162-L164 HydrophobicContact CE1-CB 4.13Å; Y162-L164 HydrophobicContact CE1-CD1 4.35Å; Y162-P168 WeakPolarHBondContact O-CA 3.46Å; Y162-L169 HydrophobicContact CD1-CB 3.71Å; Y162-L169 HydrophobicContact CD1-CD2 3.5Å; Y162-L169 VanDerWaalsContact CD1-CD2 3.5Å; Y162-L169 HydrophobicContact CD1-CG 4.24Å; Y162-L169 HydrophobicContact CE1-CD2 3.91Å; Y162-L169 HydrophobicContact CG-CD2 4.45Å; Y162-L169 PolarHBondContact O-N 2.88Å; Y162-P180 HydrophobicContact CD1-CG 4.02Å; Y162-P180 HydrophobicContact CD2-CB 4.33Å; Y162-P180 HydrophobicContact CD2-CG 3.79Å; Y162-P180 HydrophobicContact CE1-CG 3.79Å; Y162-P180 HydrophobicContact CE2-CB 4.1Å; Y162-P180 HydrophobicContact CE2-CG 3.57Å; Y162-P180 HydrophobicContact CG-CG 4.01Å; Y162-Y183 HydrophobicContact CD2-CD2 4.13Å; Y162-Y183 HydrophobicContact CD2-CE1 4.19Å; Y162-Y183 AromaticContact CD2-CE2 3.75Å; Y162-Y183 HydrophobicContact CD2-CE2 3.75Å; Y162-Y183 AromaticContact CD2-CZ 3.78Å; Y162-Y183 HydrophobicContact CG-CE1 4.38Å; Y162-C196 PolarHBondContact N-O 2.02Å
163	L	71.4	Confident	70.6	Confident	66 Å²	66	66.4 Å²	66.4	35%	0.346	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	116.9	179	-60.3	178.8	0	0	0	109.5	P161 Y167 P168 L276	P161-L163 HydrophobicContact CB-CD2 4.45Å; P161-L163 HydrophobicContact CG-CD2 4.04Å; P161-L163 PolarHBondContact O-N 2.96Å; L163-Y167 CarbonylContact C-O 3.57Å; L163-Y167 VanDerWaalsContact CA-O 3.27Å; L163-Y167 WeakPolarHBondContact CA-O 3.32Å; L163-P168 HydrophobicContact CD2-CB 4.38Å; L163-L276 HydrophobicContact CD1-CD2 4.48Å
164	L	66.3	Low	70.7	Confident	89 Å²	89	64.1 Å²	64.1	47%	0.466	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	120.1	168.1	-171.7	65.4	0	0	0	107.6	Y162 G166 Y167 L169	Y162-L164 HydrophobicContact CE1-CB 4.13Å; Y162-L164 HydrophobicContact CE1-CD1 4.35Å; L164-G166 PolarHBondContact O-N 2.97Å; L164-G166 VanDerWaalsContact O-N 3.13Å; L164-Y167 PolarHBondContact N-O 2.02Å; L164-Y167 PolarHBondContact O-N 3.02Å; L164-L169 HydrophobicContact CB-CD1 4.46Å; L164-L169 HydrophobicContact CD2-CD1 4.02Å
165	D	54.5	Low	70.2	Confident	109 Å²	109	65.2 Å²	65.2	58%	0.583	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	31	-173.8	-62	-15.5	0	0	0	114.6	R129 Y167	R129-D165 IonicContact NH2-OD2 2.91Å; R129-D165 PolarHBondContact NH2-OD2 2.86Å; D165-Y167 VanDerWaalsContact C-N 3.34Å; D165-Y167 VanDerWaalsContact O-CD2 3.23Å; D165-Y167 WeakPolarHBondContact O-CD2 3.01Å
166	G	55.4	Low	69.4	Low	35 Å²	35	68.7 Å²	68.7	36%	0.361	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	3.1	-178.3	0	0	0	0	0	115.2	L164	L164-G166 PolarHBondContact O-N 2.97Å; L164-G166 VanDerWaalsContact O-N 3.13Å
167	Y	58.7	Low	69.2	Low	69 Å²	69	75.7 Å²	75.7	27%	0.271	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	143.2	177.3	-62.8	-89.1	0	0	0	111.3	M127 L163 L164 D165 L169	M127-Y167 HydrophobicContact CE-CE1 4.22Å; L163-Y167 CarbonylContact C-O 3.57Å; L163-Y167 VanDerWaalsContact CA-O 3.27Å; L163-Y167 WeakPolarHBondContact CA-O 3.32Å; L164-Y167 PolarHBondContact N-O 2.02Å; L164-Y167 PolarHBondContact O-N 3.02Å; D165-Y167 VanDerWaalsContact C-N 3.34Å; D165-Y167 VanDerWaalsContact O-CD2 3.23Å; D165-Y167 WeakPolarHBondContact O-CD2 3.01Å; Y167-L169 PolarHBondContact O-N 3.4Å
168	P	73.4	Confident	69.9	Low	41 Å²	41	75.1 Å²	75.1	27%	0.266	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	122.6	177.3	28	-34.9	0	0	0	110.5	V154 P161 Y162 L163 T170 F195	V154-P168 HydrophobicContact CB-CB 4.43Å; V154-P168 HydrophobicContact CG1-CB 4.11Å; V154-P168 HydrophobicContact CG2-CB 4.06Å; V154-P168 HydrophobicContact CG2-CG 4.01Å; P161-P168 HydrophobicContact CB-CB 3.91Å; P161-P168 HydrophobicContact CG-CB 4.47Å; Y162-P168 WeakPolarHBondContact O-CA 3.46Å; L163-P168 HydrophobicContact CD2-CB 4.38Å; P168-T170 PolarHBondContact O-N 3.36Å; P168-F195 HydrophobicContact CB-CD1 3.91Å; P168-F195 HydrophobicContact CB-CE1 4.19Å; P168-F195 HydrophobicContact CG-CD1 4.33Å; P168-F195 HydrophobicContact CG-CE1 4.09Å
169	L	80.1	Confident	70.9	Confident	40 Å²	40	68 Å²	68	21%	0.209	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-70.5	122.4	-179.5	179.4	65.4	0	0	0	110.5	Y162 L164 Y167 F195 C196	Y162-L169 HydrophobicContact CD1-CB 3.71Å; Y162-L169 HydrophobicContact CD1-CD2 3.5Å; Y162-L169 VanDerWaalsContact CD1-CD2 3.5Å; Y162-L169 HydrophobicContact CD1-CG 4.24Å; Y162-L169 HydrophobicContact CE1-CD2 3.91Å; Y162-L169 HydrophobicContact CG-CD2 4.45Å; Y162-L169 PolarHBondContact O-N 2.88Å; L164-L169 HydrophobicContact CB-CD1 4.46Å; L164-L169 HydrophobicContact CD2-CD1 4.02Å; Y167-L169 PolarHBondContact O-N 3.4Å; L169-F195 CarbonylContact O-C 3.53Å; L169-F195 WeakPolarHBondContact O-CA 3.33Å; L169-C196 HydrophobicContact CB-CB 4.4Å; L169-C196 HydrophobicContact CD2-CB 4.41Å; L169-C196 PolarHBondContact O-N 2.04Å
170	T	81.9	Confident	71.6	Confident	67 Å²	67	67.5 Å²	67.5	41%	0.411	38%	0.379	S	S	.	.	B	Isolated β-bridge	trans	-78.3	151.4	172	51.3	0	0	0	0	111.2	P168 Y194 F195	P168-T170 PolarHBondContact O-N 3.36Å; T170-Y194 CarbonylContact C-O 3.33Å; T170-Y194 WeakPolarHBondContact CA-O 2.99Å; T170-F195 HydrophobicContact CG2-CD1 3.77Å; T170-F195 HydrophobicContact CG2-CE1 3.52Å; T170-F195 HydrophobicContact CG2-CZ 4.24Å
171	C	81.9	Confident	72	Confident	20 Å²	20	73.4 Å²	73.4	14%	0.135	41%	0.414	C	S	.	.			trans	-141.8	174.5	-177.9	60.2	0	0	0	0	112.2	C185 Y194 F195 C196	C171-C185 HydrophobicContact CB-CB 3.84Å; C171-C185 WeakPolarHBondContact CB-SG 3.21Å; C171-C185 WeakPolarHBondContact SG-CA 3.2Å; C171-C185 WeakPolarHBondContact SG-CB 3.44Å; C171-C185 CovalentContact SG-SG 2.02Å; C171-C185 PolarHBondContact SG-SG 2.88Å; C171-Y194 PolarHBondContact N-O 3.45Å; C171-Y194 WeakPolarHBondContact O-CB 2.97Å; C171-Y194 VanDerWaalsContact SG-C 3.6Å; C171-F195 PolarHBondContact SG-O 2.84Å; C171-C196 VanDerWaalsContact CB-SG 3.56Å
172	K	77.5	Confident	71.9	Confident	96 Å²	96	73.4 Å²	73.4	42%	0.417	42%	0.42	S	S	.	.			trans	-105.3	136.2	176.1	-167.7	176.7	-177.1	171.1	0	110.8	Y178 C185	K172-Y178 HydrophobicContact CB-CD2 3.73Å; K172-Y178 HydrophobicContact CB-CE2 3.64Å; K172-Y178 HydrophobicContact CB-CG 4.4Å; K172-Y178 HydrophobicContact CD-CE2 4.18Å; K172-Y178 HydrophobicContact CG-CE2 4.47Å; K172-C185 PolarHBondContact O-SG 2.97Å
173	P	80.7	Confident	72.3	Confident	66 Å²	66	72 Å²	72	43%	0.429	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	143.1	175.4	21.5	-32	0	0	0	111.4	S175 Y194	P173-S175 VanDerWaalsContact C-N 3.35Å; P173-S175 PolarHBondContact O-N 3.25Å; P173-Y194 HydrophobicContact CB-CD1 4.15Å; P173-Y194 HydrophobicContact CB-CE1 3.64Å; P173-Y194 HydrophobicContact CB-CE2 4.2Å; P173-Y194 HydrophobicContact CG-CD2 4.25Å; P173-Y194 HydrophobicContact CG-CE1 4.16Å; P173-Y194 HydrophobicContact CG-CE2 3.78Å
174	G	66.8	Low	72.9	Confident	92 Å²	92	69.7 Å²	69.7	95%	0.948	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.8	6.7	172.3	0	0	0	0	0	116
175	S	62.3	Low	73.8	Confident	31 Å²	31	66.9 Å²	66.9	22%	0.217	39%	0.392	C	S	.	.			trans	-130.5	123.1	175.3	171.1	0	0	0	0	111.8	P173 R177 Y178	P173-S175 VanDerWaalsContact C-N 3.35Å; P173-S175 PolarHBondContact O-N 3.25Å; S175-R177 PolarHBondContact O-N 3.15Å; S175-R177 PolarHBondContact OG-N 3.03Å; S175-Y178 VanDerWaalsContact CB-CD2 3.4Å; S175-Y178 WeakPolarHBondContact OG-CD2 3.48Å; S175-Y178 WeakPolarHBondContact OG-CE2 3.43Å
176	S	61.3	Low	75.3	Confident	84 Å²	84	64.9 Å²	64.9	59%	0.587	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-5.8	172.2	55.3	0	0	0	0	113.3	Y178 C179	S176-Y178 VanDerWaalsContact C-N 3.34Å; S176-C179 VanDerWaalsContact O-O 3.04Å
177	R	67.6	Low	76.5	Confident	205 Å²	205	67 Å²	67	77%	0.774	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-21.2	-179.4	-69.5	-165.2	-95.4	-128	3.8	113.5	S175	S175-R177 PolarHBondContact O-N 3.15Å; S175-R177 PolarHBondContact OG-N 3.03Å
178	Y	75.1	Confident	77.4	Confident	120 Å²	120	64.8 Å²	64.8	47%	0.471	37%	0.374	S	S	.	.	S	Bend	trans	-86.5	-13.8	-179	-59.8	-74.8	0	0	0	113.4	K172 S175 S176 C196	K172-Y178 HydrophobicContact CB-CD2 3.73Å; K172-Y178 HydrophobicContact CB-CE2 3.64Å; K172-Y178 HydrophobicContact CB-CG 4.4Å; K172-Y178 HydrophobicContact CD-CE2 4.18Å; K172-Y178 HydrophobicContact CG-CE2 4.47Å; S175-Y178 VanDerWaalsContact CB-CD2 3.4Å; S175-Y178 WeakPolarHBondContact OG-CD2 3.48Å; S175-Y178 WeakPolarHBondContact OG-CE2 3.43Å; S176-Y178 VanDerWaalsContact C-N 3.34Å; Y178-C196 PolarHBondContact O-SG 3.09Å; Y178-C196 VanDerWaalsContact O-SG 3.35Å
179	C	80.6	Confident	77.3	Confident	12 Å²	12	71.6 Å²	71.6	8%	0.081	40%	0.402	C	S	.	.	S	Bend	trans	-114.6	135	177.9	-64.8	0	0	0	0	110.1	S176 C196	S176-C179 VanDerWaalsContact O-O 3.04Å; C179-C196 WeakPolarHBondContact CA-SG 2.94Å; C179-C196 HydrophobicContact CB-CB 3.84Å; C179-C196 WeakPolarHBondContact CB-SG 3.22Å; C179-C196 WeakPolarHBondContact SG-CA 3.44Å; C179-C196 WeakPolarHBondContact SG-CB 2.89Å; C179-C196 CovalentContact SG-SG 2.05Å; C179-C196 PolarHBondContact SG-SG 3.42Å
180	P	82.9	Confident	76.3	Confident	44 Å²	44	74.4 Å²	74.4	29%	0.286	43%	0.425	S	S	.	.			trans	-55.1	159.1	172.7	-27.4	37	0	0	0	112.2	Y162 G182 Y183	Y162-P180 HydrophobicContact CD1-CG 4.02Å; Y162-P180 HydrophobicContact CD2-CB 4.33Å; Y162-P180 HydrophobicContact CD2-CG 3.79Å; Y162-P180 HydrophobicContact CE1-CG 3.79Å; Y162-P180 HydrophobicContact CE2-CB 4.1Å; Y162-P180 HydrophobicContact CE2-CG 3.57Å; Y162-P180 HydrophobicContact CG-CG 4.01Å; P180-G182 PolarHBondContact O-N 2.87Å; P180-Y183 HydrophobicContact CB-CD2 4.33Å; P180-Y183 WeakPolarHBondContact O-CB 3.05Å; P180-Y183 PolarHBondContact O-N 2.79Å
181	T	78.4	Confident	75.5	Confident	150 Å²	150	73 Å²	73	92%	0.92	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	132.7	175.2	-54.4	0	0	0	0	110.6
182	G	77.6	Confident	74.9	Confident	37 Å²	37	73.9 Å²	73.9	38%	0.381	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.2	-0.5	-175.5	0	0	0	0	0	114.6	P180 L198 R199	P180-G182 PolarHBondContact O-N 2.87Å; G182-L198 CarbonylContact O-C 3.42Å; G182-R199 PolarHBondContact O-N 3.1Å
183	Y	83.1	Confident	74.8	Confident	39 Å²	39	71.4 Å²	71.4	15%	0.153	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	153.8	174.5	-68.2	-102.7	0	0	0	111.8	Y162 P180 C196 C197 L198 R199	Y162-Y183 HydrophobicContact CD2-CD2 4.13Å; Y162-Y183 HydrophobicContact CD2-CE1 4.19Å; Y162-Y183 AromaticContact CD2-CE2 3.75Å; Y162-Y183 HydrophobicContact CD2-CE2 3.75Å; Y162-Y183 AromaticContact CD2-CZ 3.78Å; Y162-Y183 HydrophobicContact CG-CE1 4.38Å; P180-Y183 HydrophobicContact CB-CD2 4.33Å; P180-Y183 WeakPolarHBondContact O-CB 3.05Å; P180-Y183 PolarHBondContact O-N 2.79Å; Y183-C196 HydrophobicContact CD1-CB 4.48Å; Y183-C197 CarbonylContact C-O 3.59Å; Y183-C197 VanDerWaalsContact CA-O 3.31Å; Y183-C197 WeakPolarHBondContact CA-O 3.34Å; Y183-L198 HydrophobicContact CD1-CB 4.29Å; Y183-L198 HydrophobicContact CD2-CD1 4.38Å; Y183-L198 HydrophobicContact CE1-CB 4.07Å; Y183-L198 HydrophobicContact CE1-CD1 4.04Å; Y183-L198 HydrophobicContact CE2-CD1 3.9Å; Y183-R199 PolarHBondContact O-NE 2.93Å; Y183-R199 PolarHBondContact O-NH2 3.23Å
184	S	84.9	Confident	74.9	Confident	18 Å²	18	71.9 Å²	71.9	13%	0.126	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	144.6	176.4	56.4	0	0	0	0	109.8	Q186 C197	S184-Q186 PolarHBondContact O-N 3.39Å; S184-Q186 PolarHBondContact OG-NE2 3.14Å; S184-C197 PolarHBondContact N-O 3.41Å; S184-C197 PolarHBondContact O-N 2.71Å; S184-C197 VanDerWaalsContact O-O 3.09Å; S184-C197 PolarHBondContact OG-O 2.95Å
185	C	86.1	Confident	75.6	Confident	29 Å²	29	68 Å²	68	20%	0.196	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	110.2	178.6	-169.3	0	0	0	0	109.8	C171 K172 Y194	C171-C185 HydrophobicContact CB-CB 3.84Å; C171-C185 WeakPolarHBondContact CB-SG 3.21Å; C171-C185 WeakPolarHBondContact SG-CA 3.2Å; C171-C185 WeakPolarHBondContact SG-CB 3.44Å; C171-C185 CovalentContact SG-SG 2.02Å; C171-C185 PolarHBondContact SG-SG 2.88Å; K172-C185 PolarHBondContact O-SG 2.97Å; C185-Y194 VanDerWaalsContact SG-CB 3.5Å
186	Q	85.5	Confident	76.6	Confident	67 Å²	67	66.5 Å²	66.5	31%	0.313	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	138.5	-175.5	-63.3	-64.6	-23	0	0	110.7	S184 Y194 F195 C197	S184-Q186 PolarHBondContact O-N 3.39Å; S184-Q186 PolarHBondContact OG-NE2 3.14Å; Q186-Y194 CarbonylContact O-C 3.58Å; Q186-Y194 WeakPolarHBondContact O-CA 3.4Å; Q186-F195 PolarHBondContact N-O 2.03Å; Q186-F195 PolarHBondContact O-N 3.09Å; Q186-C197 HydrophobicContact CB-CB 4.08Å; Q186-C197 HydrophobicContact CG-CB 3.66Å
187	L	80.2	Confident	77.8	Confident	81 Å²	81	62.5 Å²	62.5	42%	0.424	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	131.7	174.5	179.3	64.4	0	0	0	109.8	Y194	L187-Y194 HydrophobicContact CB-CD1 3.94Å; L187-Y194 HydrophobicContact CB-CE1 3.65Å; L187-Y194 HydrophobicContact CD1-CD1 4.47Å; L187-Y194 HydrophobicContact CD1-CD2 4.04Å; L187-Y194 HydrophobicContact CD1-CE1 4.2Å; L187-Y194 HydrophobicContact CD1-CE2 3.76Å; L187-Y194 HydrophobicContact CD1-CG 4.37Å; L187-Y194 HydrophobicContact CG-CE1 4.44Å
188	H	77.3	Confident	78.4	Confident	22 Å²	22	54.4 Å²	54.4	10%	0.102	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	107.9	168.3	-177.3	-112.8	0	0	0	109.6	F152 H153 V154 S190 T191 G192 L193 F195	F152-H188 AromaticContact CE2-CE1 3.31Å; F152-H188 WeakPolarHBondContact CE2-CE1 3.18Å; F152-H188 AromaticContact CZ-CE1 3.21Å; F152-H188 WeakPolarHBondContact CZ-CE1 3.23Å; F152-H188 AromaticContact CZ-ND1 3.58Å; H153-H188 PolarHBondContact O-CD2 3.07Å; H153-H188 PolarHBondContact O-NE2 2.64Å; H153-H188 VanDerWaalsContact O-NE2 3.09Å; V154-H188 PolarHBondContact O-CD2 3.45Å; V154-H188 VanDerWaalsContact O-CD2 3.26Å; H188-S190 VanDerWaalsContact C-N 3.27Å; H188-S190 PolarHBondContact CE1-OG 3.3Å; H188-S190 PolarHBondContact ND1-OG 3.42Å; H188-S190 PolarHBondContact NE2-OG 3.4Å; H188-S190 PolarHBondContact O-N 2.77Å; H188-T191 PolarHBondContact ND1-N 3.32Å; H188-T191 PolarHBondContact ND1-OG1 2.9Å; H188-T191 PolarHBondContact O-N 3.41Å; H188-G192 PolarHBondContact O-N 2.69Å; H188-L193 WeakPolarHBondContact CB-O 3.36Å; H188-L193 PolarHBondContact N-O 3.21Å; H188-F195 HydrophobicContact CB-CD2 3.77Å; H188-F195 HydrophobicContact CB-CE2 3.75Å
189	E	70.6	Confident	78.3	Confident	184 Å²	184	54.8 Å²	54.8	86%	0.86	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-37.5	-169.3	-64.8	-174.7	166.2	0	0	113.6
190	S	59.5	Low	77.3	Confident	98 Å²	98	59.4 Å²	59.4	69%	0.685	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-22.2	-174.5	66.3	0	0	0	0	114.3	H188	H188-S190 VanDerWaalsContact C-N 3.27Å; H188-S190 PolarHBondContact CE1-OG 3.3Å; H188-S190 PolarHBondContact ND1-OG 3.42Å; H188-S190 PolarHBondContact NE2-OG 3.4Å; H188-S190 PolarHBondContact O-N 2.77Å
191	T	65.5	Low	75.4	Confident	39 Å²	39	61.9 Å²	61.9	24%	0.239	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-15.4	175.5	57.6	0	0	0	0	114	F152 H188 L193	F152-T191 HydrophobicContact CE2-CG2 3.68Å; F152-T191 HydrophobicContact CZ-CG2 3.42Å; F152-T191 VanDerWaalsContact CZ-CG2 3.42Å; H188-T191 PolarHBondContact ND1-N 3.32Å; H188-T191 PolarHBondContact ND1-OG1 2.9Å; H188-T191 PolarHBondContact O-N 3.41Å; T191-L193 PolarHBondContact O-N 2.86Å
192	G	69.8	Low	73.6	Confident	38 Å²	38	62 Å²	62	39%	0.392	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	8.8	-173	0	0	0	0	0	113.9	H188	H188-G192 PolarHBondContact O-N 2.69Å
193	L	74.7	Confident	71.4	Confident	43 Å²	43	71.1 Å²	71.1	23%	0.225	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	151.5	179.4	-65.4	176.6	0	0	0	110.5	A90 L93 H188 T191 F195	A90-L193 HydrophobicContact CB-CD1 4.3Å; L93-L193 HydrophobicContact CD1-CD2 3.97Å; L93-L193 HydrophobicContact CD1-CG 4.18Å; H188-L193 WeakPolarHBondContact CB-O 3.36Å; H188-L193 PolarHBondContact N-O 3.21Å; T191-L193 PolarHBondContact O-N 2.86Å; L193-F195 HydrophobicContact CB-CD2 4.33Å; L193-F195 HydrophobicContact CB-CE2 3.56Å; L193-F195 HydrophobicContact CB-CZ 3.85Å; L193-F195 HydrophobicContact CD1-CZ 4.06Å
194	Y	83.1	Confident	68.9	Low	77 Å²	77	73 Å²	73	30%	0.302	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	139.2	173.7	-67	-102.4	0	0	0	110.9	T170 C171 P173 C185 Q186 L187	T170-Y194 CarbonylContact C-O 3.33Å; T170-Y194 WeakPolarHBondContact CA-O 2.99Å; C171-Y194 PolarHBondContact N-O 3.45Å; C171-Y194 WeakPolarHBondContact O-CB 2.97Å; C171-Y194 VanDerWaalsContact SG-C 3.6Å; P173-Y194 HydrophobicContact CB-CD1 4.15Å; P173-Y194 HydrophobicContact CB-CE1 3.64Å; P173-Y194 HydrophobicContact CB-CE2 4.2Å; P173-Y194 HydrophobicContact CG-CD2 4.25Å; P173-Y194 HydrophobicContact CG-CE1 4.16Å; P173-Y194 HydrophobicContact CG-CE2 3.78Å; C185-Y194 VanDerWaalsContact SG-CB 3.5Å; Q186-Y194 CarbonylContact O-C 3.58Å; Q186-Y194 WeakPolarHBondContact O-CA 3.4Å; L187-Y194 HydrophobicContact CB-CD1 3.94Å; L187-Y194 HydrophobicContact CB-CE1 3.65Å; L187-Y194 HydrophobicContact CD1-CD1 4.47Å; L187-Y194 HydrophobicContact CD1-CD2 4.04Å; L187-Y194 HydrophobicContact CD1-CE1 4.2Å; L187-Y194 HydrophobicContact CD1-CE2 3.76Å; L187-Y194 HydrophobicContact CD1-CG 4.37Å; L187-Y194 HydrophobicContact CG-CE1 4.44Å
195	F	82.2	Confident	66.4	Low	10 Å²	10	82.3 Å²	82.3	4%	0.044	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	149.6	-179.7	-62	-90.5	0	0	0	111.6	V154 P168 L169 T170 C171 Q186 H188 L193 C197	V154-F195 HydrophobicContact CB-CG 4.48Å; V154-F195 HydrophobicContact CG1-CB 3.55Å; V154-F195 HydrophobicContact CG1-CD1 3.34Å; V154-F195 HydrophobicContact CG1-CD2 3.07Å; V154-F195 HydrophobicContact CG1-CE1 3.63Å; V154-F195 HydrophobicContact CG1-CE2 3.37Å; V154-F195 HydrophobicContact CG1-CG 3.02Å; V154-F195 HydrophobicContact CG1-CZ 3.64Å; P168-F195 HydrophobicContact CB-CD1 3.91Å; P168-F195 HydrophobicContact CB-CE1 4.19Å; P168-F195 HydrophobicContact CG-CD1 4.33Å; P168-F195 HydrophobicContact CG-CE1 4.09Å; L169-F195 CarbonylContact O-C 3.53Å; L169-F195 WeakPolarHBondContact O-CA 3.33Å; T170-F195 HydrophobicContact CG2-CD1 3.77Å; T170-F195 HydrophobicContact CG2-CE1 3.52Å; T170-F195 HydrophobicContact CG2-CZ 4.24Å; C171-F195 PolarHBondContact SG-O 2.84Å; Q186-F195 PolarHBondContact N-O 2.03Å; Q186-F195 PolarHBondContact O-N 3.09Å; H188-F195 HydrophobicContact CB-CD2 3.77Å; H188-F195 HydrophobicContact CB-CE2 3.75Å; L193-F195 HydrophobicContact CB-CD2 4.33Å; L193-F195 HydrophobicContact CB-CE2 3.56Å; L193-F195 HydrophobicContact CB-CZ 3.85Å; L193-F195 HydrophobicContact CD1-CZ 4.06Å; F195-C197 PolarHBondContact O-N 2.85Å; F195-C197 VanDerWaalsContact O-N 3.09Å
196	C	83.1	Confident	64.1	Low	0 Å²	0	86.5 Å²	86.5	0%	0	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	103.3	172.4	-68.7	0	0	0	0	109.1	P161 Y162 L169 C171 Y178 C179 Y183	P161-C196 CarbonylContact C-O 3.51Å; P161-C196 WeakPolarHBondContact CA-O 3.02Å; Y162-C196 PolarHBondContact N-O 2.02Å; L169-C196 HydrophobicContact CB-CB 4.4Å; L169-C196 HydrophobicContact CD2-CB 4.41Å; L169-C196 PolarHBondContact O-N 2.04Å; C171-C196 VanDerWaalsContact CB-SG 3.56Å; Y178-C196 PolarHBondContact O-SG 3.09Å; Y178-C196 VanDerWaalsContact O-SG 3.35Å; C179-C196 WeakPolarHBondContact CA-SG 2.94Å; C179-C196 HydrophobicContact CB-CB 3.84Å; C179-C196 WeakPolarHBondContact CB-SG 3.22Å; C179-C196 WeakPolarHBondContact SG-CA 3.44Å; C179-C196 WeakPolarHBondContact SG-CB 2.89Å; C179-C196 CovalentContact SG-SG 2.05Å; C179-C196 PolarHBondContact SG-SG 3.42Å; Y183-C196 HydrophobicContact CD1-CB 4.48Å
197	C	85.3	Confident	61.6	Low	0 Å²	0	89 Å²	89	0%	0	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	143.4	175	-61.4	0	0	0	0	108.9	C155 Y183 S184 Q186 F195 R199	C155-C197 WeakPolarHBondContact CA-SG 3.38Å; C155-C197 HydrophobicContact CB-CB 3.74Å; C155-C197 WeakPolarHBondContact CB-SG 3.19Å; C155-C197 WeakPolarHBondContact SG-CA 3.22Å; C155-C197 WeakPolarHBondContact SG-CB 3.23Å; C155-C197 CovalentContact SG-SG 2.03Å; C155-C197 PolarHBondContact SG-SG 3.06Å; Y183-C197 CarbonylContact C-O 3.59Å; Y183-C197 VanDerWaalsContact CA-O 3.31Å; Y183-C197 WeakPolarHBondContact CA-O 3.34Å; S184-C197 PolarHBondContact N-O 3.41Å; S184-C197 PolarHBondContact O-N 2.71Å; S184-C197 VanDerWaalsContact O-O 3.09Å; S184-C197 PolarHBondContact OG-O 2.95Å; Q186-C197 HydrophobicContact CB-CB 4.08Å; Q186-C197 HydrophobicContact CG-CB 3.66Å; F195-C197 PolarHBondContact O-N 2.85Å; F195-C197 VanDerWaalsContact O-N 3.09Å; C197-R199 PolarHBondContact O-N 3.32Å
198	L	82	Confident	59.8	Low	34 Å²	34	93.7 Å²	93.7	18%	0.178	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-48.4	142.1	177.1	-166.7	73.9	0	0	0	109.6	Y159 S160 G182 Y183	Y159-L198 WeakPolarHBondContact CD1-O 3.43Å; Y159-L198 WeakPolarHBondContact CE1-O 3.21Å; S160-L198 PolarHBondContact O-N 3.12Å; G182-L198 CarbonylContact O-C 3.42Å; Y183-L198 HydrophobicContact CD1-CB 4.29Å; Y183-L198 HydrophobicContact CD2-CD1 4.38Å; Y183-L198 HydrophobicContact CE1-CB 4.07Å; Y183-L198 HydrophobicContact CE1-CD1 4.04Å; Y183-L198 HydrophobicContact CE2-CD1 3.9Å
199	R	71.6	Confident	57.9	Low	128 Å²	128	99.4 Å²	99.4	48%	0.483	52%	0.516	S	S	.	.			trans	-76.5	128.6	164.4	-72.5	-180	-160.5	-161	2.8	105.1	G182 Y183 C197 A201	G182-R199 PolarHBondContact O-N 3.1Å; Y183-R199 PolarHBondContact O-NE 2.93Å; Y183-R199 PolarHBondContact O-NH2 3.23Å; C197-R199 PolarHBondContact O-N 3.32Å; R199-A201 PolarHBondContact O-N 2.92Å
200	E	59.6	Low	56.1	Low	109 Å²	109	97 Å²	97	51%	0.509	51%	0.509	S	S	.	.			trans	-43.8	125.2	166.4	-106.2	167.9	-146.8	0	0	106	Y159 I202	Y159-E200 HydrophobicContact CE1-CB 3.91Å; Y159-E200 HydrophobicContact CE1-CG 3.66Å; Y159-E200 VanDerWaalsContact CE1-N 3.33Å; Y159-E200 HydrophobicContact CE2-CG 4.26Å; Y159-E200 WeakPolarHBondContact CE2-OE1 3.02Å; Y159-E200 VanDerWaalsContact CZ-CD 3.48Å; Y159-E200 VanDerWaalsContact CZ-CG 3.48Å; Y159-E200 VanDerWaalsContact OH-CG 3.23Å; Y159-E200 WeakPolarHBondContact OH-CG 3.42Å; Y159-E200 PolarHBondContact OH-OE1 3.23Å; Y159-E200 PolarHBondContact OH-OE2 3.35Å; E200-I202 VanDerWaalsContact C-N 3.28Å; E200-I202 PolarHBondContact O-N 3.46Å
201	A	43.2	Very low	55	Low	97 Å²	97	101.3 Å²	101.3	80%	0.802	52%	0.516	S	S	*	.	S	Bend	trans	-52.4	107.5	168.4	0	0	0	0	0	105.3	R199	R199-A201 PolarHBondContact O-N 2.92Å
202	I	40.5	Very low	53.8	Low	153 Å²	153	106.6 Å²	106.6	79%	0.785	54%	0.538	S	S	*	.			trans	19.2	111.4	165.4	-55.7	174.3	0	0	0	112.2	E200 A204	E200-I202 VanDerWaalsContact C-N 3.28Å; E200-I202 PolarHBondContact O-N 3.46Å; I202-A204 PolarHBondContact O-N 3.28Å
203	R	32.6	Very low	52.2	Low	228 Å²	228	109.4 Å²	109.4	86%	0.86	55%	0.549	S	S	*	.			trans	-15.6	96.6	154.2	-72.4	176.3	178.7	157.9	-1.5	109.8	R205	R203-R205 VanDerWaalsContact C-N 3.28Å; R203-R205 PolarHBondContact O-N 2.77Å
204	A	30.6	Very low	50.2	Low	77 Å²	77	113.5 Å²	113.5	64%	0.636	58%	0.575	S	S	*	*			trans	-57.4	111.6	160.6	0	0	0	0	0	102.5	I202 S206	I202-A204 PolarHBondContact O-N 3.28Å; A204-S206 PolarHBondContact O-N 2.85Å; A204-S206 VanDerWaalsContact O-N 3.12Å
205	R	32.4	Very low	47.8	Very low	215 Å²	215	116.3 Å²	116.3	81%	0.811	60%	0.595	S	S	*	*			trans	-41.5	128.9	173.3	-89.2	178.3	175.1	167.2	-2.7	106.1	R203 D207	R203-R205 VanDerWaalsContact C-N 3.28Å; R203-R205 PolarHBondContact O-N 2.77Å; R205-D207 PolarHBondContact O-N 2.74Å
206	S	36.5	Very low	45.4	Very low	116 Å²	116	123.4 Å²	123.4	81%	0.811	63%	0.632	S	S	*	*	S	Bend	trans	-59.2	81.6	162.6	169.1	0	0	0	0	106.8	A204	A204-S206 PolarHBondContact O-N 2.85Å; A204-S206 VanDerWaalsContact O-N 3.12Å
207	D	33.7	Very low	43.1	Very low	119 Å²	119	132 Å²	132	64%	0.636	67%	0.669	S	S	*	*	S	Bend	trans	-173.4	99	170.4	-81.6	-35.7	0	0	0	107.8	R205 L209	R205-D207 PolarHBondContact O-N 2.74Å; D207-L209 PolarHBondContact O-N 3.16Å
208	H	42.2	Very low	40.7	Very low	180 Å²	180	141.1 Å²	141.1	83%	0.833	71%	0.712	S	S	*	*			trans	59.2	36.8	150.5	-75.9	-74.8	0	0	0	121.7
209	L	38	Very low	38.3	Very low	142 Å²	142	144.8 Å²	144.8	74%	0.743	74%	0.74	S	S	*	*			trans	-102.9	91.7	165.7	-78.1	163.2	0	0	0	112.2	D207 F211	D207-L209 PolarHBondContact O-N 3.16Å; L209-F211 PolarHBondContact O-N 2.78Å
210	N	32.4	Very low	36.6	Very low	135 Å²	135	144 Å²	144	72%	0.722	75%	0.752	S	S	*	*			trans	-49.1	96.6	160.1	-73.8	-49.8	0	0	0	110	H212	N210-H212 PolarHBondContact O-N 2.94Å
211	F	36.9	Very low	35.4	Very low	188 Å²	188	143.6 Å²	143.6	83%	0.825	76%	0.761	S	S	*	*			trans	-72.9	81.1	152.6	-82.8	-84.9	0	0	0	107	L209 P213	L209-F211 PolarHBondContact O-N 2.78Å; F211-P213 WeakPolarHBondContact O-CD 3.35Å
212	H	39.1	Very low	34.9	Very low	149 Å²	149	145 Å²	145	69%	0.69	76%	0.76	S	S	*	*			trans	-55.4	121.7	159.3	-102.4	-83.4	0	0	0	106.7	N210 V214	N210-H212 PolarHBondContact O-N 2.94Å; H212-V214 PolarHBondContact O-N 2.04Å; H212-V214 VanDerWaalsContact O-N 3.1Å
213	P	36.8	Very low	34.5	Very low	97 Å²	97	142.2 Å²	142.2	63%	0.63	75%	0.754	S	S	*	*			trans	-61.3	119.9	165.7	26	-29	0	0	0	105.8	F211 L215	F211-P213 WeakPolarHBondContact O-CD 3.35Å; P213-L215 HydrophobicContact CG-CD1 4.34Å; P213-L215 PolarHBondContact O-N 3.41Å
214	V	32.3	Very low	34.6	Very low	129 Å²	129	137.6 Å²	137.6	78%	0.782	75%	0.746	S	S	*	*			trans	-65.3	90.3	168.7	-179.1	0	0	0	0	106.2	H212 I216	H212-V214 PolarHBondContact O-N 2.04Å; H212-V214 VanDerWaalsContact O-N 3.1Å; V214-I216 VanDerWaalsContact C-N 3.26Å; V214-I216 HydrophobicContact CG1-CD1 4.39Å; V214-I216 HydrophobicContact CG1-CG1 3.7Å; V214-I216 PolarHBondContact O-N 2.04Å
215	L	33	Very low	35.1	Very low	137 Å²	137	141.4 Å²	141.4	72%	0.717	75%	0.754	S	S	*	*			trans	-67.6	90.9	163.2	-108.1	108.1	0	0	0	106.3	P213 K217	P213-L215 HydrophobicContact CG-CD1 4.34Å; P213-L215 PolarHBondContact O-N 3.41Å; L215-K217 HydrophobicContact CD2-CB 4.28Å; L215-K217 PolarHBondContact O-N 2.88Å; L215-K217 VanDerWaalsContact O-N 3.09Å
216	I	31.5	Very low	35.3	Very low	158 Å²	158	142.7 Å²	142.7	81%	0.81	76%	0.759	S	S	*	*			trans	-80.2	79.3	155.2	-38.2	177.4	0	0	0	105.4	V214	V214-I216 VanDerWaalsContact C-N 3.26Å; V214-I216 HydrophobicContact CG1-CD1 4.39Å; V214-I216 HydrophobicContact CG1-CG1 3.7Å; V214-I216 PolarHBondContact O-N 2.04Å
217	K	34.4	Very low	35.5	Very low	180 Å²	180	144.2 Å²	144.2	78%	0.783	76%	0.758	S	S	*	*			trans	-131.7	113.2	161.2	-122	-178.3	-177.9	-174.3	0	106.4	L215 S219	L215-K217 HydrophobicContact CD2-CB 4.28Å; L215-K217 PolarHBondContact O-N 2.88Å; L215-K217 VanDerWaalsContact O-N 3.09Å; K217-S219 PolarHBondContact O-N 2.77Å
218	E	35	Very low	35.8	Very low	192 Å²	192	145.7 Å²	145.7	90%	0.897	77%	0.765	S	S	*	*			trans	-33.1	120.4	164.8	-61.1	171.3	159.4	0	0	109.6
219	S	32	Very low	35.8	Very low	112 Å²	112	147.8 Å²	147.8	78%	0.783	77%	0.766	S	S	*	*			trans	-55.7	154.6	159.7	-120.8	0	0	0	0	108.6	K217	K217-S219 PolarHBondContact O-N 2.77Å
220	P	36.1	Very low	36	Very low	112 Å²	112	148.7 Å²	148.7	73%	0.727	77%	0.772	S	S	*	*			cis	-147.8	178.6	37.3	35.9	-12.9	0	0	0	116.7
221	S	33.8	Very low	36.7	Very low	100 Å²	100	148.3 Å²	148.3	70%	0.699	77%	0.768	S	S	*	*			trans	85.8	90.3	154.8	73.8	0	0	0	0	118.2
222	T	33.7	Very low	36.8	Very low	127 Å²	127	148 Å²	148	78%	0.779	77%	0.766	S	S	*	*				26.3	113.1	120.1	57.2	0	0	0	0	116.8
223	S	32.1	Very low	36.9	Very low	93 Å²	93	146.9 Å²	146.9	65%	0.65	77%	0.765	S	S	*	*				154.4	134.2	103.4	54.1	0	0	0	0	110
224	N	35.1	Very low	36.8	Very low	132 Å²	132	150.8 Å²	150.8	71%	0.706	77%	0.772	S	S	*	*			trans	74.8	114.7	165.2	-36.6	-48.1	0	0	0	114.3
225	I	40.9	Very low	37.1	Very low	157 Å²	157	152.3 Å²	152.3	81%	0.805	77%	0.768	S	S	*	*				-169.1	96.6	121.8	-83	140.9	0	0	0	106.1	N227	I225-N227 HydrophobicContact CG2-CB 4.43Å; I225-N227 PolarHBondContact O-N 2.85Å
226	W	35.6	Very low	37.1	Very low	242 Å²	242	150.4 Å²	150.4	92%	0.917	77%	0.773	S	S	*	*			trans	-59.5	105.9	154.4	-72.2	78.1	0	0	0	107.6
227	N	40.4	Very low	37.4	Very low	148 Å²	148	151.9 Å²	151.9	79%	0.791	77%	0.773	S	S	*	*			trans	177.8	77.4	155.1	-93.9	-42.8	0	0	0	110.6	I225 R229	I225-N227 HydrophobicContact CG2-CB 4.43Å; I225-N227 PolarHBondContact O-N 2.85Å; N227-R229 PolarHBondContact O-N 2.81Å
228	L	41.4	Very low	37.4	Very low	149 Å²	149	148.6 Å²	148.6	78%	0.78	77%	0.773	S	S	*	*			trans	-95.4	69	172.6	-87.9	149	0	0	0	110.3	I231	L228-I231 HydrophobicContact CD2-CD1 3.48Å; L228-I231 VanDerWaalsContact CD2-CD1 3.48Å; L228-I231 HydrophobicContact CD2-CG1 4.26Å
229	R	40.9	Very low	37.4	Very low	225 Å²	225	144 Å²	144	85%	0.849	76%	0.762	S	S	*	*	S	Bend	trans	-142.1	118.6	159.2	-75	-174.5	176	169.8	-1.5	105.9	N227	N227-R229 PolarHBondContact O-N 2.81Å
230	N	42.6	Very low	37.9	Very low	161 Å²	161	143.6 Å²	143.6	86%	0.861	75%	0.754	S	S	*	*			trans	100.7	42.5	-175.1	-50.9	-36.6	0	0	0	117.4	K232	N230-K232 PolarHBondContact O-N 3.49Å
231	I	46.3	Very low	39	Very low	127 Å²	127	141.3 Å²	141.3	65%	0.651	74%	0.739	S	S	*	*			trans	-72.3	88.6	158	-61.6	177.4	0	0	0	108	L228 L233	L228-I231 HydrophobicContact CD2-CD1 3.48Å; L228-I231 VanDerWaalsContact CD2-CD1 3.48Å; L228-I231 HydrophobicContact CD2-CG1 4.26Å; I231-L233 HydrophobicContact CG2-CD1 4.33Å; I231-L233 HydrophobicContact CG2-CG 4.34Å; I231-L233 PolarHBondContact O-N 3.27Å; I231-L233 VanDerWaalsContact O-N 3.15Å
232	K	40.2	Very low	40.6	Very low	180 Å²	180	138.1 Å²	138.1	78%	0.783	71%	0.714	S	S	*	*			trans	-71	98.8	160.3	-154.9	170.3	-167.7	170.7	0	105	N230 K234	N230-K232 PolarHBondContact O-N 3.49Å; K232-K234 PolarHBondContact O-N 3.46Å
233	L	41.4	Very low	42.4	Very low	126 Å²	126	132.6 Å²	132.6	66%	0.66	68%	0.682	S	S	*	*			trans	-59.4	81	169.1	-96.6	122.7	0	0	0	108.6	I231 F235	I231-L233 HydrophobicContact CG2-CD1 4.33Å; I231-L233 HydrophobicContact CG2-CG 4.34Å; I231-L233 PolarHBondContact O-N 3.27Å; I231-L233 VanDerWaalsContact O-N 3.15Å; L233-F235 VanDerWaalsContact C-N 3.3Å; L233-F235 HydrophobicContact CB-CD2 4.4Å; L233-F235 HydrophobicContact CB-CE2 4.15Å; L233-F235 HydrophobicContact CD2-CD2 4.41Å; L233-F235 HydrophobicContact CD2-CE1 4.27Å; L233-F235 HydrophobicContact CD2-CE2 3.77Å; L233-F235 HydrophobicContact CD2-CZ 3.7Å; L233-F235 PolarHBondContact O-N 3.43Å
234	K	34	Very low	44.5	Very low	179 Å²	179	129.3 Å²	129.3	78%	0.778	66%	0.659	S	S	*	*			trans	-76.6	94.1	157.2	-84.6	-174.9	173.2	-176.5	0	104.8	K232 A236	K232-K234 PolarHBondContact O-N 3.46Å; K234-A236 VanDerWaalsContact C-N 3.29Å; K234-A236 PolarHBondContact O-N 2.89Å
235	F	38.4	Very low	46	Very low	162 Å²	162	124.9 Å²	124.9	71%	0.711	64%	0.638	S	S	*	*			trans	-53.6	101.5	162.2	-75.5	-89.1	0	0	0	107.3	L233 F237	L233-F235 VanDerWaalsContact C-N 3.3Å; L233-F235 HydrophobicContact CB-CD2 4.4Å; L233-F235 HydrophobicContact CB-CE2 4.15Å; L233-F235 HydrophobicContact CD2-CD2 4.41Å; L233-F235 HydrophobicContact CD2-CE1 4.27Å; L233-F235 HydrophobicContact CD2-CE2 3.77Å; L233-F235 HydrophobicContact CD2-CZ 3.7Å; L233-F235 PolarHBondContact O-N 3.43Å; F235-F237 PolarHBondContact O-N 3.37Å
236	A	32.8	Very low	47.2	Very low	97 Å²	97	122.5 Å²	122.5	80%	0.802	63%	0.632	S	S	*	*			trans	-69.9	89.1	166	0	0	0	0	0	106.1	K234 S238	K234-A236 VanDerWaalsContact C-N 3.29Å; K234-A236 PolarHBondContact O-N 2.89Å; A236-S238 VanDerWaalsContact C-N 3.35Å; A236-S238 PolarHBondContact O-N 3.45Å
237	F	38.6	Very low	48.6	Very low	189 Å²	189	115.9 Å²	115.9	83%	0.829	61%	0.612	S	S	*	*			trans	-53.6	110	153	-82.3	-93.1	0	0	0	105.1	F235 S239	F235-F237 PolarHBondContact O-N 3.37Å; F237-S239 PolarHBondContact O-N 2.94Å
238	S	33.5	Very low	50.2	Low	111 Å²	111	110.3 Å²	110.3	78%	0.776	58%	0.583	S	S	*	*			trans	-60.8	99.1	168.8	-169.6	0	0	0	0	105.8	A236 V240	A236-S238 VanDerWaalsContact C-N 3.35Å; A236-S238 PolarHBondContact O-N 3.45Å; S238-V240 PolarHBondContact O-N 2.89Å
239	S	35.6	Very low	52	Low	96 Å²	96	105 Å²	105	67%	0.671	56%	0.557	S	S	*	*			trans	-71.6	73.4	177.8	56.1	0	0	0	0	107.6	F237 T241	F237-S239 PolarHBondContact O-N 2.94Å; S239-T241 PolarHBondContact O-N 2.6Å
240	V	43.4	Very low	54.1	Low	102 Å²	102	94.4 Å²	94.4	62%	0.618	52%	0.517	S	S	*	.			trans	-84.8	86.4	143.7	-169.1	0	0	0	0	103.7	S238 D242	S238-V240 PolarHBondContact O-N 2.89Å; V240-D242 WeakPolarHBondContact CG1-OD1 3Å; V240-D242 PolarHBondContact O-N 3.23Å
241	T	57.1	Low	56.1	Low	65 Å²	65	87.4 Å²	87.4	40%	0.399	48%	0.48	S	S	.	.			trans	-72.9	67.6	173.2	44.7	0	0	0	0	108.2	S239 G243 H280 Y281	S239-T241 PolarHBondContact O-N 2.6Å; T241-G243 PolarHBondContact O-N 2.91Å; T241-H280 PolarHBondContact OG1-NE2 3.19Å; T241-Y281 WeakPolarHBondContact O-CE2 3.01Å; T241-Y281 PolarHBondContact O-OH 3.3Å
242	D	68.1	Low	57.9	Low	32 Å²	32	85.9 Å²	85.9	17%	0.171	47%	0.469	C	S	.	.			trans	-54.9	-15.8	166.7	-82.4	-8.2	0	0	0	110.3	V240 C244 T249 S250 Q285	V240-D242 WeakPolarHBondContact CG1-OD1 3Å; V240-D242 PolarHBondContact O-N 3.23Å; D242-C244 PolarHBondContact O-N 3.06Å; D242-T249 PolarHBondContact OD2-OG1 2.76Å; D242-S250 PolarHBondContact O-OG 3.09Å; D242-Q285 PolarHBondContact O-NE2 3.27Å
243	G	71.7	Confident	59.8	Low	12 Å²	12	78.5 Å²	78.5	12%	0.124	44%	0.444	C	S	.	.	S	Bend	trans	79.7	-4.9	175.1	0	0	0	0	0	112.3	T241 S278 Q285	T241-G243 PolarHBondContact O-N 2.91Å; G243-S278 VanDerWaalsContact C-OG 3.31Å; G243-S278 WeakPolarHBondContact CA-OG 3.35Å; G243-S278 WeakPolarHBondContact O-CA 3.45Å; G243-S278 WeakPolarHBondContact O-CB 3.45Å; G243-S278 PolarHBondContact O-OG 3.05Å; G243-Q285 VanDerWaalsContact C-NE2 3.28Å
244	C	76.2	Confident	61.4	Low	24 Å²	24	85.3 Å²	85.3	16%	0.162	46%	0.461	C	S	.	.	S	Bend	trans	-83.3	153.4	173.4	-71	0	0	0	0	111.3	D242 T248 T249 S250 Q285 C287	D242-C244 PolarHBondContact O-N 3.06Å; C244-T248 WeakPolarHBondContact CB-OG1 3.32Å; C244-T249 VanDerWaalsContact SG-C 3.53Å; C244-S250 WeakPolarHBondContact SG-CA 3.46Å; C244-S250 PolarHBondContact SG-N 3.43Å; C244-S250 VanDerWaalsContact SG-N 3.39Å; C244-Q285 PolarHBondContact SG-NE2 3.18Å; C244-C287 VanDerWaalsContact CA-SG 3.57Å; C244-C287 HydrophobicContact CB-CB 3.81Å; C244-C287 WeakPolarHBondContact CB-SG 3.33Å; C244-C287 VanDerWaalsContact SG-CA 3.59Å; C244-C287 WeakPolarHBondContact SG-CB 3.24Å; C244-C287 CovalentContact SG-SG 2.03Å; C244-C287 PolarHBondContact SG-SG 3.16Å
245	P	67.1	Low	63.3	Low	39 Å²	39	82.2 Å²	82.2	25%	0.253	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-63.8	162.6	173.4	25.3	-31.7	0	0	0	111.9	T248 L276	P245-T248 WeakPolarHBondContact CD-OG1 3.02Å; P245-T248 WeakPolarHBondContact CG-OG1 3.41Å; P245-T248 PolarHBondContact O-N 3.35Å; P245-T248 VanDerWaalsContact O-N 3.14Å; P245-T248 PolarHBondContact O-OG1 3.49Å; P245-L276 HydrophobicContact CG-CB 4.33Å; P245-L276 HydrophobicContact CG-CD1 3.44Å; P245-L276 VanDerWaalsContact CG-CD1 3.44Å; P245-L276 HydrophobicContact CG-CG 4.44Å
246	P	66.5	Low	65.2	Low	107 Å²	107	77 Å²	77	70%	0.695	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.4	147.1	177.8	-25.6	33.8	0	0	0	112.7	T248	P246-T248 PolarHBondContact O-N 2.84Å
247	Q	63.3	Low	67.3	Low	103 Å²	103	79.3 Å²	79.3	48%	0.481	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.3	7.2	-174.8	-52.6	179.1	31.8	0	0	115.6	I290	Q247-I290 PolarHBondContact O-N 3.43Å
248	T	74.1	Confident	69.3	Low	30 Å²	30	71 Å²	71	18%	0.184	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	152.1	170.4	64.5	0	0	0	0	110.7	C244 P245 P246 L276 Q288	C244-T248 WeakPolarHBondContact CB-OG1 3.32Å; P245-T248 WeakPolarHBondContact CD-OG1 3.02Å; P245-T248 WeakPolarHBondContact CG-OG1 3.41Å; P245-T248 PolarHBondContact O-N 3.35Å; P245-T248 VanDerWaalsContact O-N 3.14Å; P245-T248 PolarHBondContact O-OG1 3.49Å; P246-T248 PolarHBondContact O-N 2.84Å; T248-L276 HydrophobicContact CG2-CD1 4.13Å; T248-Q288 CarbonylContact C-O 3.56Å; T248-Q288 WeakPolarHBondContact CA-O 3.26Å; T248-Q288 VanDerWaalsContact CB-O 3.29Å; T248-Q288 WeakPolarHBondContact CB-O 2.89Å
249	T	80.4	Confident	71.8	Confident	38 Å²	38	68.5 Å²	68.5	23%	0.233	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	152.9	175.3	178.9	0	0	0	0	109.6	D242 C244 C287 Q288 I290	D242-T249 PolarHBondContact OD2-OG1 2.76Å; C244-T249 VanDerWaalsContact SG-C 3.53Å; T249-C287 CarbonylContact O-C 3.47Å; T249-C287 VanDerWaalsContact O-CA 3.3Å; T249-C287 WeakPolarHBondContact O-CA 3.34Å; T249-Q288 HydrophobicContact CG2-CG 3.61Å; T249-Q288 PolarHBondContact N-O 3.24Å; T249-Q288 PolarHBondContact O-N 3.35Å; T249-I290 HydrophobicContact CG2-CG1 4.4Å
250	S	84.4	Confident	74.1	Confident	2 Å²	2	67.9 Å²	67.9	1%	0.014	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	135.9	178.2	-100.7	0	0	0	0	111.3	D242 C244 F252 Q285	D242-S250 PolarHBondContact O-OG 3.09Å; C244-S250 WeakPolarHBondContact SG-CA 3.46Å; C244-S250 PolarHBondContact SG-N 3.43Å; C244-S250 VanDerWaalsContact SG-N 3.39Å; S250-F252 VanDerWaalsContact CB-CE2 3.45Å; S250-F252 VanDerWaalsContact O-CD2 3.26Å; S250-F252 WeakPolarHBondContact O-CD2 3.16Å; S250-F252 WeakPolarHBondContact O-CE2 3.43Å; S250-Q285 PolarHBondContact OG-NE2 3.15Å
251	V	84.8	Confident	75.8	Confident	15 Å²	15	63.8 Å²	63.8	9%	0.091	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-83.2	119.8	163.3	-173.3	0	0	0	0	107.3	P258 I259 I270 C286 Q288	V251-P258 WeakPolarHBondContact O-CA 3.2Å; V251-I259 HydrophobicContact CB-CD1 4.43Å; V251-I259 HydrophobicContact CG1-CD1 3.66Å; V251-I259 HydrophobicContact CG1-CG1 4.37Å; V251-I259 WeakPolarHBondContact O-CG1 3.42Å; V251-I259 PolarHBondContact O-N 3.26Å; V251-I270 HydrophobicContact CG1-CG2 4.06Å; V251-C286 HydrophobicContact CB-CB 3.88Å; V251-C286 HydrophobicContact CG2-CB 3.96Å; V251-C286 PolarHBondContact N-O 2.92Å; V251-Q288 HydrophobicContact CG2-CB 4.02Å; V251-Q288 HydrophobicContact CG2-CG 4.06Å
252	F	84.9	Confident	76.4	Confident	95 Å²	95	64.5 Å²	64.5	42%	0.417	35%	0.353	S	S	.	.	B	Isolated β-bridge	trans	-96.7	135.8	178.7	-66	-88.4	0	0	0	110.5	S250 G256 K257 P258	S250-F252 VanDerWaalsContact CB-CE2 3.45Å; S250-F252 VanDerWaalsContact O-CD2 3.26Å; S250-F252 WeakPolarHBondContact O-CD2 3.16Å; S250-F252 WeakPolarHBondContact O-CE2 3.43Å; F252-G256 VanDerWaalsContact CD1-O 3.27Å; F252-G256 WeakPolarHBondContact CD1-O 3.43Å; F252-K257 WeakPolarHBondContact CA-O 3.38Å; F252-P258 HydrophobicContact CD1-CG 4.17Å; F252-P258 HydrophobicContact CE1-CG 3.75Å
253	G	79.1	Confident	76.1	Confident	25 Å²	25	65.4 Å²	65.4	26%	0.258	36%	0.357	S	S	.	.			trans	-76.2	178.9	173.1	0	0	0	0	0	111.4	T255 G256 K257 I259	G253-T255 PolarHBondContact O-N 3.44Å; G253-G256 PolarHBondContact O-N 3.28Å; G253-K257 PolarHBondContact N-O 2.84Å; G253-I259 VanDerWaalsContact N-CG1 3.34Å
254	R	75.1	Confident	75.2	Confident	268 Å²	268	70.6 Å²	70.6	100%	1.011	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-21.5	177.1	-65.8	-174.8	179.9	-178.8	-0.2	114.1	G256	R254-G256 VanDerWaalsContact C-N 3.32Å
255	T	74.2	Confident	74.5	Confident	115 Å²	115	75.4 Å²	75.4	71%	0.706	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	1.9	180	57.4	0	0	0	0	113.7	G253 K257	G253-T255 PolarHBondContact O-N 3.44Å; T255-K257 PolarHBondContact O-N 3.22Å
256	G	78.1	Confident	73.9	Confident	53 Å²	53	78.4 Å²	78.4	55%	0.546	43%	0.425	S	S	.	.	S	Bend	trans	71.2	8.3	-174.7	0	0	0	0	0	114	F252 G253 R254	F252-G256 VanDerWaalsContact CD1-O 3.27Å; F252-G256 WeakPolarHBondContact CD1-O 3.43Å; G253-G256 PolarHBondContact O-N 3.28Å; R254-G256 VanDerWaalsContact C-N 3.32Å
257	K	77.4	Confident	74.2	Confident	145 Å²	145	80.2 Å²	80.2	63%	0.63	43%	0.429	S	S	*	.	S	Bend	trans	-96.2	146.2	174.5	-65.9	-175.2	179.8	-179.6	0	110.7	F252 G253 T255 I259	F252-K257 WeakPolarHBondContact CA-O 3.38Å; G253-K257 PolarHBondContact N-O 2.84Å; T255-K257 PolarHBondContact O-N 3.22Å; K257-I259 PolarHBondContact O-N 3.34Å
258	P	81.1	Confident	74.7	Confident	14 Å²	14	76.3 Å²	76.3	9%	0.091	41%	0.412	C	S	.	.	B	Isolated β-bridge	trans	-57.1	130.6	172.7	-20.6	29.1	0	0	0	110.3	V251 F252 T260 Y281 Q285	V251-P258 WeakPolarHBondContact O-CA 3.2Å; F252-P258 HydrophobicContact CD1-CG 4.17Å; F252-P258 HydrophobicContact CE1-CG 3.75Å; P258-T260 PolarHBondContact O-N 2.8Å; P258-Y281 HydrophobicContact CG-CE2 4.19Å; P258-Q285 HydrophobicContact CB-CB 4.46Å
259	I	85.3	Confident	75.1	Confident	59 Å²	59	76.1 Å²	76.1	30%	0.303	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-66.3	118.9	177.4	-60.7	-177.8	0	0	0	107.9	V251 G253 K257 Q285 C286	V251-I259 HydrophobicContact CB-CD1 4.43Å; V251-I259 HydrophobicContact CG1-CD1 3.66Å; V251-I259 HydrophobicContact CG1-CG1 4.37Å; V251-I259 WeakPolarHBondContact O-CG1 3.42Å; V251-I259 PolarHBondContact O-N 3.26Å; G253-I259 VanDerWaalsContact N-CG1 3.34Å; K257-I259 PolarHBondContact O-N 3.34Å; I259-Q285 CarbonylContact O-C 3.46Å; I259-Q285 WeakPolarHBondContact O-CA 3.4Å; I259-Q285 VanDerWaalsContact O-CB 3.29Å; I259-Q285 WeakPolarHBondContact O-CB 3.4Å; I259-C286 HydrophobicContact CB-CB 4.29Å; I259-C286 HydrophobicContact CG2-CB 4.46Å; I259-C286 PolarHBondContact O-N 2.88Å
260	T	84.1	Confident	75.3	Confident	82 Å²	82	79.7 Å²	79.7	50%	0.503	43%	0.429	S	S	.	.	B	Isolated β-bridge	trans	-76.2	145.3	170.7	49.1	0	0	0	0	110.2	P258 Y284	P258-T260 PolarHBondContact O-N 2.8Å; T260-Y284 WeakPolarHBondContact CA-O 3.31Å
261	C	79.1	Confident	75	Confident	16 Å²	16	85.6 Å²	85.6	11%	0.108	47%	0.47	C	S	.	.			trans	-131.9	155.7	178.6	56	0	0	0	0	111.1	C269 C275 Y284 Q285	C261-C269 WeakPolarHBondContact CB-SG 3.23Å; C261-C275 HydrophobicContact CB-CB 3.76Å; C261-C275 WeakPolarHBondContact CB-SG 3.28Å; C261-C275 WeakPolarHBondContact SG-CA 3.46Å; C261-C275 WeakPolarHBondContact SG-CB 3.31Å; C261-C275 CovalentContact SG-SG 2.02Å; C261-C275 PolarHBondContact SG-SG 3.29Å; C261-Y284 PolarHBondContact N-O 3.4Å; C261-Y284 VanDerWaalsContact O-CB 3.27Å; C261-Y284 WeakPolarHBondContact O-CB 3.48Å; C261-Q285 VanDerWaalsContact SG-CA 3.51Å; C261-Q285 PolarHBondContact SG-N 3.27Å; C261-Q285 VanDerWaalsContact SG-N 3.37Å; C261-Q285 PolarHBondContact SG-O 2.92Å
262	D	70	Confident	74.5	Confident	80 Å²	80	88 Å²	88	43%	0.428	50%	0.498	S	S	.	.			trans	-99.1	123.4	165.9	-171.1	-23.6	0	0	0	108.7	F264 Q265 S268	D262-F264 PolarHBondContact O-N 2.98Å; D262-F264 WeakPolarHBondContact OD1-CB 3.37Å; D262-F264 WeakPolarHBondContact OD1-CD2 3.31Å; D262-F264 PolarHBondContact OD1-N 2.87Å; D262-Q265 HydrophobicContact CB-CB 4.27Å; D262-Q265 PolarHBondContact O-N 2.99Å; D262-S268 PolarHBondContact N-OG 2.67Å; D262-S268 WeakPolarHBondContact O-CB 3.36Å; D262-S268 PolarHBondContact O-OG 3.43Å
263	I	61.3	Low	74.3	Confident	52 Å²	52	84.2 Å²	84.2	27%	0.267	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-19.7	178.5	57.1	171.7	0	0	0	113.2	C275 Y284	I263-C275 HydrophobicContact CG2-CB 4.27Å; I263-C275 VanDerWaalsContact CG2-SG 3.56Å; I263-Y284 HydrophobicContact CD1-CE2 4.24Å; I263-Y284 HydrophobicContact CG2-CD1 3.27Å; I263-Y284 HydrophobicContact CG2-CD2 4.16Å; I263-Y284 HydrophobicContact CG2-CE1 3.3Å; I263-Y284 HydrophobicContact CG2-CE2 4.19Å; I263-Y284 HydrophobicContact CG2-CG 3.72Å
264	F	52.5	Low	74.3	Confident	121 Å²	121	86.4 Å²	86.4	53%	0.531	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-6.8	-178.8	-58.7	-68.5	0	0	0	113.2	D262	D262-F264 PolarHBondContact O-N 2.98Å; D262-F264 WeakPolarHBondContact OD1-CB 3.37Å; D262-F264 WeakPolarHBondContact OD1-CD2 3.31Å; D262-F264 PolarHBondContact OD1-N 2.87Å
265	Q	61.3	Low	74.7	Confident	125 Å²	125	74.8 Å²	74.8	58%	0.584	45%	0.454	S	S	*	.			trans	-108.9	111.9	178.5	173	174.6	53.8	0	0	109.6	D262 N267 S268	D262-Q265 HydrophobicContact CB-CB 4.27Å; D262-Q265 PolarHBondContact O-N 2.99Å; Q265-N267 PolarHBondContact O-N 3.24Å; Q265-S268 VanDerWaalsContact CB-OG 3.24Å; Q265-S268 WeakPolarHBondContact CB-OG 3.42Å; Q265-S268 WeakPolarHBondContact O-CB 3.35Å; Q265-S268 PolarHBondContact O-N 3.37Å; Q265-S268 PolarHBondContact O-OG 2.86Å
266	A	55	Low	74.9	Confident	102 Å²	102	70.2 Å²	70.2	84%	0.843	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-22.1	-175	0	0	0	0	0	113.9
267	N	72	Confident	74.7	Confident	145 Å²	145	73 Å²	73	78%	0.775	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.6	19.3	-178.1	-60.9	-17.6	0	0	0	113	Q265 C269	Q265-N267 PolarHBondContact O-N 3.24Å; N267-C269 PolarHBondContact O-N 3.12Å
268	S	73.8	Confident	74.4	Confident	20 Å²	20	66.1 Å²	66.1	14%	0.14	39%	0.39	C	S	.	.	S	Bend	trans	-66.9	-20.5	177.8	-68.6	0	0	0	0	113.7	D262 Q265 C286	D262-S268 PolarHBondContact N-OG 2.67Å; D262-S268 WeakPolarHBondContact O-CB 3.36Å; D262-S268 PolarHBondContact O-OG 3.43Å; Q265-S268 VanDerWaalsContact CB-OG 3.24Å; Q265-S268 WeakPolarHBondContact CB-OG 3.42Å; Q265-S268 WeakPolarHBondContact O-CB 3.35Å; Q265-S268 PolarHBondContact O-N 3.37Å; Q265-S268 PolarHBondContact O-OG 2.86Å; S268-C286 PolarHBondContact O-SG 3.48Å
269	C	83.3	Confident	73.6	Confident	26 Å²	26	71.5 Å²	71.5	18%	0.176	42%	0.417	C	S	.	.	S	Bend	trans	-124.8	152	-176.1	-71.8	0	0	0	0	110.9	C261 N267 S273 C286	C261-C269 WeakPolarHBondContact CB-SG 3.23Å; N267-C269 PolarHBondContact O-N 3.12Å; C269-S273 WeakPolarHBondContact CB-OG 3.32Å; C269-C286 WeakPolarHBondContact CA-SG 3.1Å; C269-C286 HydrophobicContact CB-CB 3.91Å; C269-C286 WeakPolarHBondContact CB-SG 3.24Å; C269-C286 WeakPolarHBondContact SG-CA 3.29Å; C269-C286 WeakPolarHBondContact SG-CB 3.32Å; C269-C286 CovalentContact SG-SG 2.05Å; C269-C286 PolarHBondContact SG-SG 2.82Å
270	I	83.6	Confident	72.7	Confident	113 Å²	113	73.5 Å²	73.5	58%	0.579	43%	0.425	S	S	*	.			trans	-65.3	147	174.8	-172.2	165.8	0	0	0	110	V251 G272 S273	V251-I270 HydrophobicContact CG1-CG2 4.06Å; I270-G272 PolarHBondContact O-N 2.71Å; I270-S273 VanDerWaalsContact CG2-OG 3.27Å; I270-S273 WeakPolarHBondContact CG2-OG 3.38Å; I270-S273 PolarHBondContact N-OG 2.6Å; I270-S273 PolarHBondContact O-N 3.3Å; I270-S273 PolarHBondContact O-OG 3.41Å
271	S	78.7	Confident	72	Confident	127 Å²	127	73.9 Å²	73.9	89%	0.888	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.7	129	176	-56.5	0	0	0	0	111.6
272	G	74.6	Confident	71.6	Confident	65 Å²	65	80.7 Å²	80.7	67%	0.67	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.4	0.4	-176.3	0	0	0	0	0	115.1	I270 P289	I270-G272 PolarHBondContact O-N 2.71Å; G272-P289 VanDerWaalsContact O-CD 3.28Å; G272-P289 WeakPolarHBondContact O-CD 3.2Å
273	S	81	Confident	71.8	Confident	16 Å²	16	80.8 Å²	80.8	11%	0.112	44%	0.44	C	S	.	.			trans	-117.1	152.6	170.4	66.8	0	0	0	0	111.8	C269 I270 C287	C269-S273 WeakPolarHBondContact CB-OG 3.32Å; I270-S273 VanDerWaalsContact CG2-OG 3.27Å; I270-S273 WeakPolarHBondContact CG2-OG 3.38Å; I270-S273 PolarHBondContact N-OG 2.6Å; I270-S273 PolarHBondContact O-N 3.3Å; I270-S273 PolarHBondContact O-OG 3.41Å; S273-C287 CarbonylContact C-O 3.56Å; S273-C287 WeakPolarHBondContact CA-O 3.32Å
274	S	79.6	Confident	72.7	Confident	70 Å²	70	82.2 Å²	82.2	49%	0.49	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	145.5	-177.4	-60.2	0	0	0	0	110.5	L276 C287	S274-L276 PolarHBondContact O-N 2.72Å; S274-C287 PolarHBondContact N-O 3.24Å; S274-C287 PolarHBondContact O-N 2.84Å
275	C	82.1	Confident	74.3	Confident	25 Å²	25	76.4 Å²	76.4	17%	0.169	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	104.2	177.2	-171.6	0	0	0	0	110.5	C261 I263	C261-C275 HydrophobicContact CB-CB 3.76Å; C261-C275 WeakPolarHBondContact CB-SG 3.28Å; C261-C275 WeakPolarHBondContact SG-CA 3.46Å; C261-C275 WeakPolarHBondContact SG-CB 3.31Å; C261-C275 CovalentContact SG-SG 2.02Å; C261-C275 PolarHBondContact SG-SG 3.29Å; I263-C275 HydrophobicContact CG2-CB 4.27Å; I263-C275 VanDerWaalsContact CG2-SG 3.56Å
276	L	78.7	Confident	75.4	Confident	19 Å²	19	70.5 Å²	70.5	10%	0.099	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	148.2	-176	-55.8	-179.6	0	0	0	111.1	L163 P245 T248 S274 S278 Y284 Q285 C287	L163-L276 HydrophobicContact CD1-CD2 4.48Å; P245-L276 HydrophobicContact CG-CB 4.33Å; P245-L276 HydrophobicContact CG-CD1 3.44Å; P245-L276 VanDerWaalsContact CG-CD1 3.44Å; P245-L276 HydrophobicContact CG-CG 4.44Å; T248-L276 HydrophobicContact CG2-CD1 4.13Å; S274-L276 PolarHBondContact O-N 2.72Å; L276-S278 PolarHBondContact O-N 3.46Å; L276-Y284 WeakPolarHBondContact O-CA 3.46Å; L276-Q285 PolarHBondContact N-O 3.03Å; L276-Q285 PolarHBondContact O-N 3.42Å; L276-Q285 VanDerWaalsContact O-O 3.1Å; L276-C287 HydrophobicContact CB-CB 4.13Å; L276-C287 HydrophobicContact CD1-CB 3.58Å; L276-C287 HydrophobicContact CG-CB 3.97Å
277	Y	74.2	Confident	76.8	Confident	111 Å²	111	65.7 Å²	65.7	44%	0.435	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	125.7	179.4	-173.9	-99.6	0	0	0	110.8	K282 Y284	Y277-K282 WeakPolarHBondContact OH-CA 3.3Å; Y277-Y284 HydrophobicContact CD2-CD1 4.31Å; Y277-Y284 HydrophobicContact CD2-CD2 4.12Å; Y277-Y284 HydrophobicContact CD2-CE1 4.16Å; Y277-Y284 AromaticContact CD2-CE2 3.96Å; Y277-Y284 HydrophobicContact CD2-CE2 3.96Å; Y277-Y284 HydrophobicContact CD2-CG 4.29Å; Y277-Y284 AromaticContact CD2-CZ 3.99Å; Y277-Y284 HydrophobicContact CG-CE1 4.41Å
278	S	71.2	Confident	77.4	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	115.5	171.5	-174.7	0	0	0	0	112.1	G243 L276 H280 Y281 K282 R283	G243-S278 VanDerWaalsContact C-OG 3.31Å; G243-S278 WeakPolarHBondContact CA-OG 3.35Å; G243-S278 WeakPolarHBondContact O-CA 3.45Å; G243-S278 WeakPolarHBondContact O-CB 3.45Å; G243-S278 PolarHBondContact O-OG 3.05Å; L276-S278 PolarHBondContact O-N 3.46Å; S278-H280 PolarHBondContact O-N 3.24Å; S278-H280 PolarHBondContact OG-N 3.02Å; S278-Y281 VanDerWaalsContact OG-CD2 3.3Å; S278-Y281 WeakPolarHBondContact OG-CD2 3.35Å; S278-Y281 PolarHBondContact OG-N 2.77Å; S278-K282 VanDerWaalsContact O-CA 3.22Å; S278-K282 WeakPolarHBondContact O-CA 3.4Å; S278-K282 PolarHBondContact O-N 2.82Å; S278-R283 WeakPolarHBondContact CB-O 3.14Å; S278-R283 PolarHBondContact N-O 3.11Å
279	I	65.4	Low	77.5	Confident	127 Å²	127	65.5 Å²	65.5	65%	0.651	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-37.1	171.1	-57.1	174.4	0	0	0	110.2
280	H	65.6	Low	77	Confident	102 Å²	102	69.2 Å²	69.2	47%	0.472	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-47.2	-178.8	-176	-97	0	0	0	112	T241 S278	T241-H280 PolarHBondContact OG1-NE2 3.19Å; S278-H280 PolarHBondContact O-N 3.24Å; S278-H280 PolarHBondContact OG-N 3.02Å
281	Y	69	Low	76.2	Confident	89 Å²	89	73 Å²	73	35%	0.349	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-1.7	-176.3	-58.8	-67.3	0	0	0	114.3	T241 P258 S278 R283	T241-Y281 WeakPolarHBondContact O-CE2 3.01Å; T241-Y281 PolarHBondContact O-OH 3.3Å; P258-Y281 HydrophobicContact CG-CE2 4.19Å; S278-Y281 VanDerWaalsContact OG-CD2 3.3Å; S278-Y281 WeakPolarHBondContact OG-CD2 3.35Å; S278-Y281 PolarHBondContact OG-N 2.77Å; Y281-R283 PolarHBondContact O-N 2.77Å; Y281-R283 VanDerWaalsContact O-N 3.17Å
282	K	71.1	Confident	74.8	Confident	159 Å²	159	71.4 Å²	71.4	69%	0.691	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	37.7	-177.3	-60.1	-175.4	179.4	-179.9	0	114.1	Y277 S278	Y277-K282 WeakPolarHBondContact OH-CA 3.3Å; S278-K282 VanDerWaalsContact O-CA 3.22Å; S278-K282 WeakPolarHBondContact O-CA 3.4Å; S278-K282 PolarHBondContact O-N 2.82Å
283	R	74.9	Confident	73.1	Confident	83 Å²	83	73.9 Å²	73.9	31%	0.313	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	158.4	-178.3	67.4	-171.3	175.3	135.7	8	109.9	S278 Y281	S278-R283 WeakPolarHBondContact CB-O 3.14Å; S278-R283 PolarHBondContact N-O 3.11Å; Y281-R283 PolarHBondContact O-N 2.77Å; Y281-R283 VanDerWaalsContact O-N 3.17Å
284	Y	79.5	Confident	70.8	Confident	81 Å²	81	78.2 Å²	78.2	32%	0.318	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	137	170.8	-73.7	-80.6	0	0	0	111	T260 C261 I263 L276 Y277	T260-Y284 WeakPolarHBondContact CA-O 3.31Å; C261-Y284 PolarHBondContact N-O 3.4Å; C261-Y284 VanDerWaalsContact O-CB 3.27Å; C261-Y284 WeakPolarHBondContact O-CB 3.48Å; I263-Y284 HydrophobicContact CD1-CE2 4.24Å; I263-Y284 HydrophobicContact CG2-CD1 3.27Å; I263-Y284 HydrophobicContact CG2-CD2 4.16Å; I263-Y284 HydrophobicContact CG2-CE1 3.3Å; I263-Y284 HydrophobicContact CG2-CE2 4.19Å; I263-Y284 HydrophobicContact CG2-CG 3.72Å; L276-Y284 WeakPolarHBondContact O-CA 3.46Å; Y277-Y284 HydrophobicContact CD2-CD1 4.31Å; Y277-Y284 HydrophobicContact CD2-CD2 4.12Å; Y277-Y284 HydrophobicContact CD2-CE1 4.16Å; Y277-Y284 AromaticContact CD2-CE2 3.96Å; Y277-Y284 HydrophobicContact CD2-CE2 3.96Å; Y277-Y284 HydrophobicContact CD2-CG 4.29Å; Y277-Y284 AromaticContact CD2-CZ 3.99Å; Y277-Y284 HydrophobicContact CG-CE1 4.41Å
285	Q	85	Confident	68.6	Low	0 Å²	0	81.9 Å²	81.9	0%	0	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	154.4	179	64.4	-176.8	40.6	0	0	111.3	D242 G243 C244 S250 P258 I259 C261 L276 C287	D242-Q285 PolarHBondContact O-NE2 3.27Å; G243-Q285 VanDerWaalsContact C-NE2 3.28Å; C244-Q285 PolarHBondContact SG-NE2 3.18Å; S250-Q285 PolarHBondContact OG-NE2 3.15Å; P258-Q285 HydrophobicContact CB-CB 4.46Å; I259-Q285 CarbonylContact O-C 3.46Å; I259-Q285 WeakPolarHBondContact O-CA 3.4Å; I259-Q285 VanDerWaalsContact O-CB 3.29Å; I259-Q285 WeakPolarHBondContact O-CB 3.4Å; C261-Q285 VanDerWaalsContact SG-CA 3.51Å; C261-Q285 PolarHBondContact SG-N 3.27Å; C261-Q285 VanDerWaalsContact SG-N 3.37Å; C261-Q285 PolarHBondContact SG-O 2.92Å; L276-Q285 PolarHBondContact N-O 3.03Å; L276-Q285 PolarHBondContact O-N 3.42Å; L276-Q285 VanDerWaalsContact O-O 3.1Å; Q285-C287 PolarHBondContact O-N 3.18Å
286	C	86.2	Confident	66.4	Low	0 Å²	0	86.7 Å²	86.7	0%	0	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	124.8	176.8	-60.8	0	0	0	0	109.8	V251 I259 S268 C269	V251-C286 HydrophobicContact CB-CB 3.88Å; V251-C286 HydrophobicContact CG2-CB 3.96Å; V251-C286 PolarHBondContact N-O 2.92Å; I259-C286 HydrophobicContact CB-CB 4.29Å; I259-C286 HydrophobicContact CG2-CB 4.46Å; I259-C286 PolarHBondContact O-N 2.88Å; S268-C286 PolarHBondContact O-SG 3.48Å; C269-C286 WeakPolarHBondContact CA-SG 3.1Å; C269-C286 HydrophobicContact CB-CB 3.91Å; C269-C286 WeakPolarHBondContact CB-SG 3.24Å; C269-C286 WeakPolarHBondContact SG-CA 3.29Å; C269-C286 WeakPolarHBondContact SG-CB 3.32Å; C269-C286 CovalentContact SG-SG 2.05Å; C269-C286 PolarHBondContact SG-SG 2.82Å
287	C	83.9	Confident	64.4	Low	1 Å²	1	90 Å²	90	1%	0.007	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	133	178	-63.7	0	0	0	0	108.6	C244 T249 S273 S274 L276 Q285	C244-C287 VanDerWaalsContact CA-SG 3.57Å; C244-C287 HydrophobicContact CB-CB 3.81Å; C244-C287 WeakPolarHBondContact CB-SG 3.33Å; C244-C287 VanDerWaalsContact SG-CA 3.59Å; C244-C287 WeakPolarHBondContact SG-CB 3.24Å; C244-C287 CovalentContact SG-SG 2.03Å; C244-C287 PolarHBondContact SG-SG 3.16Å; T249-C287 CarbonylContact O-C 3.47Å; T249-C287 VanDerWaalsContact O-CA 3.3Å; T249-C287 WeakPolarHBondContact O-CA 3.34Å; S273-C287 CarbonylContact C-O 3.56Å; S273-C287 WeakPolarHBondContact CA-O 3.32Å; S274-C287 PolarHBondContact N-O 3.24Å; S274-C287 PolarHBondContact O-N 2.84Å; L276-C287 HydrophobicContact CB-CB 4.13Å; L276-C287 HydrophobicContact CD1-CB 3.58Å; L276-C287 HydrophobicContact CG-CB 3.97Å; Q285-C287 PolarHBondContact O-N 3.18Å
288	Q	83.9	Confident	62.6	Low	81 Å²	81	93.7 Å²	93.7	38%	0.379	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	151.1	177.6	61.9	-179.6	-28.3	0	0	110.7	T248 T249 V251 I290	T248-Q288 CarbonylContact C-O 3.56Å; T248-Q288 WeakPolarHBondContact CA-O 3.26Å; T248-Q288 VanDerWaalsContact CB-O 3.29Å; T248-Q288 WeakPolarHBondContact CB-O 2.89Å; T249-Q288 HydrophobicContact CG2-CG 3.61Å; T249-Q288 PolarHBondContact N-O 3.24Å; T249-Q288 PolarHBondContact O-N 3.35Å; V251-Q288 HydrophobicContact CG2-CB 4.02Å; V251-Q288 HydrophobicContact CG2-CG 4.06Å; Q288-I290 PolarHBondContact O-N 2.7Å
289	P	76.8	Confident	61.1	Low	81 Å²	81	101.9 Å²	101.9	53%	0.526	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57	134.9	173.3	-19.9	30.9	0	0	0	110.8	G272 K291	G272-P289 VanDerWaalsContact O-CD 3.28Å; G272-P289 WeakPolarHBondContact O-CD 3.2Å; P289-K291 PolarHBondContact O-N 3.46Å; P289-K291 VanDerWaalsContact O-N 3.09Å
290	I	73.2	Confident	59.6	Low	103 Å²	103	107.3 Å²	107.3	53%	0.528	55%	0.554	S	S	.	*			trans	-67.1	110.5	167.3	-60.7	173.2	0	0	0	105.9	Q247 T249 Q288 A292	Q247-I290 PolarHBondContact O-N 3.43Å; T249-I290 HydrophobicContact CG2-CG1 4.4Å; Q288-I290 PolarHBondContact O-N 2.7Å; I290-A292 PolarHBondContact O-N 2.93Å
291	K	64.8	Low	58.5	Low	194 Å²	194	108.9 Å²	108.9	84%	0.843	57%	0.565	S	S	*	*			trans	-62	112.2	170.8	-68.6	-176.8	-180	179.4	0	106.9	P289 S293	P289-K291 PolarHBondContact O-N 3.46Å; P289-K291 VanDerWaalsContact O-N 3.09Å; K291-S293 PolarHBondContact O-N 3.02Å; K291-S293 VanDerWaalsContact O-N 3.12Å
292	A	50.2	Low	57.1	Low	93 Å²	93	112.6 Å²	112.6	77%	0.769	59%	0.585	S	S	*	*			trans	-55.4	120.1	168.9	0	0	0	0	0	106.9	I290 S294	I290-A292 PolarHBondContact O-N 2.93Å; A292-S294 PolarHBondContact O-N 2.85Å
293	S	38.6	Very low	55.4	Low	116 Å²	116	109.7 Å²	109.7	81%	0.811	59%	0.591	S	S	*	*			trans	-50.2	103.6	-178.3	51.9	0	0	0	0	111.1	K291	K291-S293 PolarHBondContact O-N 3.02Å; K291-S293 VanDerWaalsContact O-N 3.12Å
294	S	33.5	Very low	53.8	Low	108 Å²	108	112.5 Å²	112.5	76%	0.755	61%	0.61	S	S	*	*			trans	-69.1	128	138.3	54.5	0	0	0	0	105.9	A292 S296	A292-S294 PolarHBondContact O-N 2.85Å; S294-S296 PolarHBondContact O-N 3.22Å
295	D	33.1	Very low	51.9	Low	147 Å²	147	115.4 Å²	115.4	79%	0.786	64%	0.637	S	S	*	*			trans	-29.6	119.6	172.3	-79	-48.4	0	0	0	113
296	S	36.2	Very low	49.8	Very low	125 Å²	125	119.8 Å²	119.8	87%	0.874	67%	0.668	S	S	*	*			trans	-115.8	53.3	155.4	75.4	0	0	0	0	108.6	S294	S294-S296 PolarHBondContact O-N 3.22Å
297	S	35.4	Very low	47.8	Very low	89 Å²	89	124.6 Å²	124.6	62%	0.622	70%	0.701	S	S	*	*			trans	-96.9	86.1	149.2	54.9	0	0	0	0	106.7
298	E	37.2	Very low	45.9	Very low	189 Å²	189	132.4 Å²	132.4	88%	0.883	74%	0.743	S	S	*	*			trans	157.4	84	156.9	-91.9	173.1	173.1	0	0	110.2
299	E	39.6	Very low	44.2	Very low	171 Å²	171	136.2 Å²	136.2	80%	0.799	76%	0.764	S	S	*	*			trans	-158.5	63.5	135.4	-134.8	177.4	165.7	0	0	109.5	I301	E299-I301 VanDerWaalsContact C-N 3.28Å; E299-I301 HydrophobicContact CG-CB 4.48Å; E299-I301 HydrophobicContact CG-CD1 4.09Å; E299-I301 HydrophobicContact CG-CG1 4.07Å
300	R	33.5	Very low	42.4	Very low	241 Å²	241	135.2 Å²	135.2	91%	0.909	77%	0.769	S	S	*	*			trans	-90.6	78.1	148.3	-179.2	-173.6	-92.4	-175.7	-6.1	104.9
301	I	43.7	Very low	41	Very low	135 Å²	135	139 Å²	139	69%	0.692	78%	0.784	S	S	*	*			trans	-101	116	164.8	-63.2	-179.3	0	0	0	106.8	E299 A303	E299-I301 VanDerWaalsContact C-N 3.28Å; E299-I301 HydrophobicContact CG-CB 4.48Å; E299-I301 HydrophobicContact CG-CD1 4.09Å; E299-I301 HydrophobicContact CG-CG1 4.07Å; I301-A303 PolarHBondContact O-N 3.29Å
302	E	39.4	Very low	40.1	Very low	168 Å²	168	141.1 Å²	141.1	79%	0.785	80%	0.802	S	S	*	*			trans	-53	118.7	175.3	-62.8	172.9	138.5	0	0	110.4
303	A	35.4	Very low	39.6	Very low	98 Å²	98	143.5 Å²	143.5	81%	0.81	80%	0.803	S	S	*	*			trans	-99.4	71.5	157.4	0	0	0	0	0	108.1	I301	I301-A303 PolarHBondContact O-N 3.29Å
304	I	40	Very low	39.6	Very low	141 Å²	141	144.9 Å²	144.9	72%	0.723	80%	0.803	S	S	*	*			trans	-124.1	75.9	159.8	-54.1	177.8	0	0	0	106.3	S306	I304-S306 VanDerWaalsContact C-N 3.34Å; I304-S306 PolarHBondContact O-N 2.88Å
305	T	39.3	Very low	40	Very low	142 Å²	142	147 Å²	147	87%	0.871	81%	0.806	S	S	*	*			trans	-83.1	88.2	161.8	53.9	0	0	0	0	107.5
306	S	42.6	Very low	40.4	Very low	93 Å²	93	147 Å²	147	65%	0.65	81%	0.807	S	S	*	*			trans	-82.8	139.4	152.8	-64.9	0	0	0	0	107.9	I304	I304-S306 VanDerWaalsContact C-N 3.34Å; I304-S306 PolarHBondContact O-N 2.88Å
307	S	42.8	Very low	40.7	Very low	101 Å²	101	148.4 Å²	148.4	71%	0.706	80%	0.803	S	S	*	*			trans	104.2	91.8	167.4	-39.9	0	0	0	0	115.6
308	D	43.9	Very low	41	Very low	165 Å²	165	152.3 Å²	152.3	88%	0.882	82%	0.815	S	S	*	*			trans	-158.2	82.3	137	-87.6	-29.5	0	0	0	104.4
309	I	49.8	Very low	41.3	Very low	160 Å²	160	149.7 Å²	149.7	82%	0.821	81%	0.81	S	S	*	*				22.3	93.2	87.3	-53.3	-177.1	0	0	0	113.6
310	G	38.5	Very low	41.4	Very low	60 Å²	60	148.1 Å²	148.1	62%	0.619	81%	0.81	S	S	*	*			trans	84.8	110.4	135.3	0	0	0	0	0	117.2
311	H	43	Very low	42.1	Very low	184 Å²	184	140.3 Å²	140.3	85%	0.852	80%	0.802	S	S	*	*				-171.1	123.8	114.9	-104.4	-69.9	0	0	0	111.4
312	I	46.3	Very low	41.9	Very low	237 Å²	237	140.8 Å²	140.8	100%	1.215	81%	0.812	S	S	*	*			trans	77.7	0	161	-48.2	172.7	0	0	0	116.7

Retrieved 312 of 312 residues in 141.8 ms (Link to these results)

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