A0A077ZLH7_TRITR Loading...

CRAL TRIO domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZLH7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 234 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	26.8	Very low	36.1	Very low	207 Å²	207	122.4 Å²	122.4	100%	1.02	57%	0.573	S	S	*	*				0	74.5	0	-163.3	165.9	48.6	0	0	109.5	L3	M1-L3 VanDerWaalsContact C-N 3.26Å; M1-L3 HydrophobicContact CG-CB 4.41Å; M1-L3 HydrophobicContact CG-CD1 3.51Å; M1-L3 PolarHBondContact O-N 2.91Å; M1-L3 HydrophobicContact SD-CD1 4.37Å
2	K	29.5	Very low	36.7	Very low	185 Å²	185	122.3 Å²	122.3	80%	0.804	60%	0.595	S	S	*	*			trans	-87.2	73	165.6	-84.9	-176.5	173.4	-173.6	0	105.5	F4 D51	K2-F4 PolarHBondContact O-N 3.23Å; K2-D51 IonicContact NZ-OD1 3.78Å
3	L	27.7	Very low	37.8	Very low	132 Å²	132	117.7 Å²	117.7	69%	0.691	57%	0.574	S	S	*	*			trans	-85.8	112.3	178.6	-114	97.9	0	0	0	109.2	M1	M1-L3 VanDerWaalsContact C-N 3.26Å; M1-L3 HydrophobicContact CG-CB 4.41Å; M1-L3 HydrophobicContact CG-CD1 3.51Å; M1-L3 PolarHBondContact O-N 2.91Å; M1-L3 HydrophobicContact SD-CD1 4.37Å
4	F	33.6	Very low	39.1	Very low	174 Å²	174	115 Å²	115	76%	0.763	57%	0.568	S	S	*	*			trans	43.7	90.6	132.4	-78.6	-97.1	0	0	0	117.4	K2	K2-F4 PolarHBondContact O-N 3.23Å
5	L	37	Very low	40.8	Very low	83 Å²	83	113.8 Å²	113.8	44%	0.435	57%	0.573	S	S	.	*			trans	-131.6	42.6	152.8	-110.7	163	0	0	0	109.3	L8 I37	L5-L8 HydrophobicContact CD2-CD1 3.93Å; L5-I37 HydrophobicContact CD1-CB 4.37Å; L5-I37 HydrophobicContact CD1-CD1 3.5Å; L5-I37 VanDerWaalsContact CD1-CD1 3.5Å; L5-I37 HydrophobicContact CD1-CG1 3.55Å; L5-I37 HydrophobicContact CD1-CG2 3.98Å
6	L	39.3	Very low	42.7	Very low	63 Å²	63	112.8 Å²	112.8	33%	0.33	57%	0.574	S	S	.	*			trans	-100.6	-11	-175.8	-95.3	163.1	0	0	0	114.6	L8 L48	L6-L8 PolarHBondContact O-N 3.38Å; L6-L48 HydrophobicContact CD1-CD2 3.72Å; L6-L48 HydrophobicContact CD2-CD1 3.96Å; L6-L48 HydrophobicContact CD2-CD2 3.43Å; L6-L48 VanDerWaalsContact CD2-CD2 3.43Å; L6-L48 HydrophobicContact CD2-CG 4.23Å; L6-L48 HydrophobicContact CG-CD2 4.15Å
7	E	39.2	Very low	44.9	Very low	144 Å²	144	110.6 Å²	110.6	67%	0.673	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-11.6	-179.9	-78.3	-171.8	136.8	0	0	114.7	I9	E7-I9 PolarHBondContact O-N 3.38Å
8	L	36.4	Very low	46.8	Very low	63 Å²	63	106.2 Å²	106.2	33%	0.33	54%	0.54	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-5.6	-176.3	-94.5	160	0	0	0	115.2	L5 L6 I13 F18	L5-L8 HydrophobicContact CD2-CD1 3.93Å; L6-L8 PolarHBondContact O-N 3.38Å; L8-I13 HydrophobicContact CD2-CD1 3.98Å; L8-F18 HydrophobicContact CB-CD2 4.29Å; L8-F18 HydrophobicContact CB-CE2 4.3Å; L8-F18 HydrophobicContact CD1-CD2 4.12Å; L8-F18 HydrophobicContact CD1-CE2 3.89Å; L8-F18 HydrophobicContact CD2-CD2 4.3Å; L8-F18 HydrophobicContact CG-CD2 4.47Å
9	I	41.7	Very low	48.6	Very low	45 Å²	45	105.6 Å²	105.6	23%	0.231	54%	0.538	C	S	.	.	S	Bend	trans	-103.3	-14.7	-170.5	-55.6	-176.9	0	0	0	112.9	E7 L40 Y44	E7-I9 PolarHBondContact O-N 3.38Å; I9-L40 HydrophobicContact CD1-CB 3.87Å; I9-L40 HydrophobicContact CD1-CG 4.31Å; I9-Y44 HydrophobicContact CG2-CD1 3.92Å; I9-Y44 HydrophobicContact CG2-CD2 4.29Å; I9-Y44 HydrophobicContact CG2-CE1 4.46Å; I9-Y44 HydrophobicContact CG2-CG 3.82Å
10	Q	44.1	Very low	50.4	Low	55 Å²	55	104.7 Å²	104.7	26%	0.257	54%	0.538	S	S	.	.	S	Bend	trans	-79.4	-25.9	-171.7	-155.7	80.5	29.6	0	0	114.3	F60 Y61	Q10-F60 HydrophobicContact CG-CE1 3.66Å; Q10-F60 HydrophobicContact CG-CZ 3.9Å; Q10-Y61 VanDerWaalsContact OE1-CD1 3.23Å
11	Y	42.2	Very low	52	Low	195 Å²	195	105.2 Å²	105.2	77%	0.765	54%	0.536	S	S	*	.	S	Bend	trans	-102.2	140.7	175.8	-104.8	-100.3	0	0	0	109.2	I13	Y11-I13 PolarHBondContact O-N 3.36Å
12	S	43	Very low	54.8	Low	121 Å²	121	97.7 Å²	97.7	85%	0.846	50%	0.497	S	S	*	.			trans	-51.3	57.8	169.2	165.9	0	0	0	0	113.2	T14	S12-T14 PolarHBondContact O-N 3.44Å
13	I	51.1	Low	57.5	Low	63 Å²	63	94.1 Å²	94.1	32%	0.323	48%	0.483	S	S	.	.			trans	-85.4	99	169.5	-60.9	177.6	0	0	0	102.8	L8 Y11 I17	L8-I13 HydrophobicContact CD2-CD1 3.98Å; Y11-I13 PolarHBondContact O-N 3.36Å; I13-I17 HydrophobicContact CG2-CB 3.44Å; I13-I17 VanDerWaalsContact CG2-CB 3.44Å; I13-I17 HydrophobicContact CG2-CD1 4.5Å; I13-I17 HydrophobicContact CG2-CG2 3.41Å; I13-I17 VanDerWaalsContact CG2-CG2 3.41Å
14	T	55.7	Low	60.4	Low	80 Å²	80	93.4 Å²	93.4	49%	0.491	48%	0.478	S	S	.	.			trans	-44.1	140	176.4	-12.1	0	0	0	0	108.6	S12 T16 I17	S12-T14 PolarHBondContact O-N 3.44Å; T14-T16 CarbonylContact O-C 3.56Å; T14-T16 PolarHBondContact O-N 3.03Å; T14-I17 PolarHBondContact O-N 3.3Å
15	P	64.6	Low	63	Low	97 Å²	97	88.6 Å²	88.6	63%	0.63	46%	0.463	S	S	*	.	H	α-helix	trans	-45.8	-30.2	-176.6	-29.7	33.1	0	0	0	113.9	N19	P15-N19 PolarHBondContact O-N 3.12Å
16	T	71.2	Confident	65.3	Low	98 Å²	98	88.3 Å²	88.3	60%	0.601	46%	0.458	S	S	*	.	H	α-helix	trans	-55.1	-47.6	174.3	-33.1	0	0	0	0	113.8	T14 V20	T14-T16 CarbonylContact O-C 3.56Å; T14-T16 PolarHBondContact O-N 3.03Å; T16-V20 WeakPolarHBondContact O-CG2 3.36Å; T16-V20 PolarHBondContact O-N 2.58Å
17	I	80.1	Confident	67.7	Low	76 Å²	76	90.3 Å²	90.3	39%	0.39	48%	0.475	S	S	.	.	H	α-helix	trans	-74	-39.7	-175.8	-68.1	169.3	0	0	0	110.7	I13 T14 N19 V20 F21	I13-I17 HydrophobicContact CG2-CB 3.44Å; I13-I17 VanDerWaalsContact CG2-CB 3.44Å; I13-I17 HydrophobicContact CG2-CD1 4.5Å; I13-I17 HydrophobicContact CG2-CG2 3.41Å; I13-I17 VanDerWaalsContact CG2-CG2 3.41Å; T14-I17 PolarHBondContact O-N 3.3Å; I17-N19 VanDerWaalsContact C-N 3.29Å; I17-N19 PolarHBondContact O-N 3.41Å; I17-V20 WeakPolarHBondContact O-CB 3.26Å; I17-V20 PolarHBondContact O-N 3.33Å; I17-V20 VanDerWaalsContact O-N 3.15Å; I17-F21 HydrophobicContact CG2-CD2 3.57Å; I17-F21 HydrophobicContact CG2-CE2 3.54Å; I17-F21 WeakPolarHBondContact O-CD2 3.39Å; I17-F21 PolarHBondContact O-N 2.99Å
18	F	79.2	Confident	70.2	Confident	31 Å²	31	89.3 Å²	89.3	14%	0.136	48%	0.479	C	S	.	.	H	α-helix	trans	-57.5	-44.6	175.7	175.4	-91.3	0	0	0	111.3	L8 V20 F21 Y22 V39	L8-F18 HydrophobicContact CB-CD2 4.29Å; L8-F18 HydrophobicContact CB-CE2 4.3Å; L8-F18 HydrophobicContact CD1-CD2 4.12Å; L8-F18 HydrophobicContact CD1-CE2 3.89Å; L8-F18 HydrophobicContact CD2-CD2 4.3Å; L8-F18 HydrophobicContact CG-CD2 4.47Å; F18-V20 VanDerWaalsContact C-N 3.3Å; F18-V20 PolarHBondContact O-N 2.94Å; F18-F21 PolarHBondContact O-N 2.89Å; F18-Y22 HydrophobicContact CE1-CG 4.46Å; F18-Y22 HydrophobicContact CZ-CD2 4.47Å; F18-Y22 WeakPolarHBondContact O-CB 3.45Å; F18-Y22 PolarHBondContact O-N 3.44Å; F18-V39 HydrophobicContact CD1-CG1 4.47Å; F18-V39 HydrophobicContact CD1-CG2 4.47Å; F18-V39 HydrophobicContact CE1-CG1 4.18Å; F18-V39 HydrophobicContact CE1-CG2 3.48Å; F18-V39 VanDerWaalsContact CE1-CG2 3.48Å; F18-V39 HydrophobicContact CZ-CG1 4.49Å; F18-V39 HydrophobicContact CZ-CG2 3.62Å
19	N	81.8	Confident	72.6	Confident	95 Å²	95	88.4 Å²	88.4	51%	0.508	47%	0.474	S	S	.	.	H	α-helix	trans	-59.2	-41.6	177.6	-78.6	-21.6	0	0	0	112.1	P15 I17 Y22 Q23	P15-N19 PolarHBondContact O-N 3.12Å; I17-N19 VanDerWaalsContact C-N 3.29Å; I17-N19 PolarHBondContact O-N 3.41Å; N19-Y22 PolarHBondContact O-N 2.94Å; N19-Q23 WeakPolarHBondContact O-CG 3.46Å; N19-Q23 PolarHBondContact O-N 3.29Å; N19-Q23 VanDerWaalsContact O-N 3.13Å
20	V	84.4	Confident	74.9	Confident	87 Å²	87	90.1 Å²	90.1	53%	0.527	48%	0.484	S	S	.	.	H	α-helix	trans	-61.2	-51.5	176.4	174.5	0	0	0	0	110.6	T16 I17 F18 Y22 Q23 I24	T16-V20 WeakPolarHBondContact O-CG2 3.36Å; T16-V20 PolarHBondContact O-N 2.58Å; I17-V20 WeakPolarHBondContact O-CB 3.26Å; I17-V20 PolarHBondContact O-N 3.33Å; I17-V20 VanDerWaalsContact O-N 3.15Å; F18-V20 VanDerWaalsContact C-N 3.3Å; F18-V20 PolarHBondContact O-N 2.94Å; V20-Y22 PolarHBondContact O-N 3.1Å; V20-Q23 PolarHBondContact O-N 3.36Å; V20-I24 HydrophobicContact CG1-CD1 4.34Å; V20-I24 WeakPolarHBondContact O-CG1 3.37Å; V20-I24 PolarHBondContact O-N 3.29Å
21	F	83.7	Confident	77.1	Confident	115 Å²	115	93 Å²	93	50%	0.504	50%	0.497	S	S	.	.	H	α-helix	trans	-60.6	-45.7	178.5	-83.9	-74.2	0	0	0	112.1	I17 F18 Q23 I24 V25	I17-F21 HydrophobicContact CG2-CD2 3.57Å; I17-F21 HydrophobicContact CG2-CE2 3.54Å; I17-F21 WeakPolarHBondContact O-CD2 3.39Å; I17-F21 PolarHBondContact O-N 2.99Å; F18-F21 PolarHBondContact O-N 2.89Å; F21-Q23 VanDerWaalsContact C-N 3.27Å; F21-Q23 PolarHBondContact O-N 3.3Å; F21-I24 WeakPolarHBondContact O-CA 3.45Å; F21-I24 WeakPolarHBondContact O-CB 3.42Å; F21-I24 PolarHBondContact O-N 3.03Å; F21-V25 WeakPolarHBondContact O-CG2 3.18Å; F21-V25 PolarHBondContact O-N 3.29Å; F21-V25 VanDerWaalsContact O-N 3.11Å
22	Y	84.4	Confident	79.3	Confident	49 Å²	49	88.7 Å²	88.7	19%	0.192	49%	0.487	C	S	.	.	H	α-helix	trans	-57.2	-41.3	179.8	-176.6	-108.1	0	0	0	111.7	F18 N19 V20 I24 V25 K26 L29 I37	F18-Y22 HydrophobicContact CE1-CG 4.46Å; F18-Y22 HydrophobicContact CZ-CD2 4.47Å; F18-Y22 WeakPolarHBondContact O-CB 3.45Å; F18-Y22 PolarHBondContact O-N 3.44Å; N19-Y22 PolarHBondContact O-N 2.94Å; V20-Y22 PolarHBondContact O-N 3.1Å; Y22-I24 VanDerWaalsContact C-N 3.27Å; Y22-I24 PolarHBondContact O-N 2.95Å; Y22-V25 PolarHBondContact O-N 3.39Å; Y22-K26 HydrophobicContact CE1-CB 4.48Å; Y22-K26 HydrophobicContact CE1-CD 4.12Å; Y22-K26 HydrophobicContact CE1-CG 4.39Å; Y22-K26 WeakPolarHBondContact O-CB 3.44Å; Y22-K26 PolarHBondContact O-N 2.92Å; Y22-L29 HydrophobicContact CE2-CD1 4.42Å; Y22-I37 HydrophobicContact CE2-CD1 3.88Å; Y22-I37 HydrophobicContact CE2-CG2 4.48Å
23	Q	88	Confident	81.3	Confident	111 Å²	111	85.5 Å²	85.5	52%	0.519	46%	0.463	S	S	.	.	H	α-helix	trans	-64.8	-29.2	176.4	-64.6	-60.3	-17	0	0	113.3	N19 V20 F21 P27	N19-Q23 WeakPolarHBondContact O-CG 3.46Å; N19-Q23 PolarHBondContact O-N 3.29Å; N19-Q23 VanDerWaalsContact O-N 3.13Å; V20-Q23 PolarHBondContact O-N 3.36Å; F21-Q23 VanDerWaalsContact C-N 3.27Å; F21-Q23 PolarHBondContact O-N 3.3Å; Q23-P27 WeakPolarHBondContact O-CD 3.43Å
24	I	88.1	Confident	83	Confident	116 Å²	116	86.3 Å²	86.3	60%	0.595	46%	0.462	S	S	*	.	H	α-helix	trans	-71.1	-43.2	175.8	-63.8	167.7	0	0	0	110.9	V20 F21 Y22 P27	V20-I24 HydrophobicContact CG1-CD1 4.34Å; V20-I24 WeakPolarHBondContact O-CG1 3.37Å; V20-I24 PolarHBondContact O-N 3.29Å; F21-I24 WeakPolarHBondContact O-CA 3.45Å; F21-I24 WeakPolarHBondContact O-CB 3.42Å; F21-I24 PolarHBondContact O-N 3.03Å; Y22-I24 VanDerWaalsContact C-N 3.27Å; Y22-I24 PolarHBondContact O-N 2.95Å; I24-P27 WeakPolarHBondContact O-CD 3.3Å
25	V	87.2	Confident	84.5	Confident	74 Å²	74	90 Å²	90	45%	0.448	47%	0.471	S	S	.	.	H	α-helix	trans	-83.2	-26	-177.7	-119	0	0	0	0	113.3	F21 Y22 P27 V28	F21-V25 WeakPolarHBondContact O-CG2 3.18Å; F21-V25 PolarHBondContact O-N 3.29Å; F21-V25 VanDerWaalsContact O-N 3.11Å; Y22-V25 PolarHBondContact O-N 3.39Å; V25-P27 VanDerWaalsContact C-N 3.34Å; V25-V28 WeakPolarHBondContact O-CB 3.41Å; V25-V28 WeakPolarHBondContact O-CG2 3.19Å; V25-V28 PolarHBondContact O-N 3.47Å
26	K	85.9	Confident	85.4	Confident	76 Å²	76	92.8 Å²	92.8	33%	0.33	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-49.7	-41.1	-176.2	-177.9	-176	178.4	-175.1	0	114.8	Y22 V28 L29	Y22-K26 HydrophobicContact CE1-CB 4.48Å; Y22-K26 HydrophobicContact CE1-CD 4.12Å; Y22-K26 HydrophobicContact CE1-CG 4.39Å; Y22-K26 WeakPolarHBondContact O-CB 3.44Å; Y22-K26 PolarHBondContact O-N 2.92Å; K26-V28 PolarHBondContact O-N 3.33Å; K26-L29 PolarHBondContact O-N 3.31Å
27	P	90.8	Very high	86	Confident	106 Å²	106	89.7 Å²	89.7	69%	0.688	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-62.7	-24.3	178.6	-23.2	35.3	0	0	0	113.9	Q23 I24 V25	Q23-P27 WeakPolarHBondContact O-CD 3.43Å; I24-P27 WeakPolarHBondContact O-CD 3.3Å; V25-P27 VanDerWaalsContact C-N 3.34Å
28	V	91	Very high	86	Confident	122 Å²	122	92.6 Å²	92.6	74%	0.739	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-87.3	-13	-178.5	-150.3	0	0	0	0	111.8	V25 K26	V25-V28 WeakPolarHBondContact O-CB 3.41Å; V25-V28 WeakPolarHBondContact O-CG2 3.19Å; V25-V28 PolarHBondContact O-N 3.47Å; K26-V28 PolarHBondContact O-N 3.33Å
29	L	86.4	Confident	86.1	Confident	45 Å²	45	95.6 Å²	95.6	24%	0.236	48%	0.479	C	S	.	.	S	Bend	trans	-95.2	130.8	-178.6	-59.6	175.6	0	0	0	111.2	Y22 K26 T33 R34 I37	Y22-L29 HydrophobicContact CE2-CD1 4.42Å; K26-L29 PolarHBondContact O-N 3.31Å; L29-T33 HydrophobicContact CD2-CG2 4.08Å; L29-R34 HydrophobicContact CB-CG 3.86Å; L29-R34 PolarHBondContact O-NE 3.46Å; L29-R34 PolarHBondContact O-NH2 2.97Å; L29-I37 HydrophobicContact CD1-CD1 3.73Å
30	D	90	Very high	86.1	Confident	80 Å²	80	92.7 Å²	92.7	43%	0.428	46%	0.464	S	S	.	.			trans	-68.3	161.9	171.2	74.1	-81.6	0	0	0	111.5	N32 T33 R34	D30-N32 VanDerWaalsContact C-N 3.32Å; D30-N32 PolarHBondContact O-N 3.48Å; D30-N32 WeakPolarHBondContact OD2-CA 3.16Å; D30-N32 VanDerWaalsContact OD2-CB 3.26Å; D30-N32 WeakPolarHBondContact OD2-CB 3.31Å; D30-N32 PolarHBondContact OD2-N 3Å; D30-T33 PolarHBondContact O-N 2.99Å; D30-T33 WeakPolarHBondContact OD1-CB 3.29Å; D30-T33 PolarHBondContact OD1-OG1 3.24Å; D30-T33 PolarHBondContact OD2-N 3.1Å; D30-R34 WeakPolarHBondContact O-CG 3.27Å; D30-R34 PolarHBondContact O-N 3.2Å
31	E	89.7	Confident	85.9	Confident	117 Å²	117	90.6 Å²	90.6	55%	0.547	46%	0.46	S	S	.	.	H	α-helix	trans	-63.1	-35.1	-176.7	-75	-166.6	161.3	0	0	113.9	T33 R34 K35	E31-T33 VanDerWaalsContact C-N 3.33Å; E31-R34 PolarHBondContact O-N 3.14Å; E31-K35 WeakPolarHBondContact O-CG 3.46Å; E31-K35 PolarHBondContact O-N 3.48Å
32	N	88.8	Confident	85.8	Confident	104 Å²	104	91.7 Å²	91.7	56%	0.556	48%	0.48	S	S	*	.	H	α-helix	trans	-69.6	-37.2	-180	-68.1	-35.7	0	0	0	110.6	D30 K36	D30-N32 VanDerWaalsContact C-N 3.32Å; D30-N32 PolarHBondContact O-N 3.48Å; D30-N32 WeakPolarHBondContact OD2-CA 3.16Å; D30-N32 VanDerWaalsContact OD2-CB 3.26Å; D30-N32 WeakPolarHBondContact OD2-CB 3.31Å; D30-N32 PolarHBondContact OD2-N 3Å; N32-K36 WeakPolarHBondContact O-CG 3.43Å
33	T	85.5	Confident	85.8	Confident	54 Å²	54	94.5 Å²	94.5	33%	0.331	50%	0.498	S	S	.	.	H	α-helix	trans	-66.4	-45	172.6	-61.8	0	0	0	0	110.8	L29 D30 E31 K35 K36	L29-T33 HydrophobicContact CD2-CG2 4.08Å; D30-T33 PolarHBondContact O-N 2.99Å; D30-T33 WeakPolarHBondContact OD1-CB 3.29Å; D30-T33 PolarHBondContact OD1-OG1 3.24Å; D30-T33 PolarHBondContact OD2-N 3.1Å; E31-T33 VanDerWaalsContact C-N 3.33Å; T33-K35 VanDerWaalsContact C-N 3.31Å; T33-K35 PolarHBondContact O-N 3.19Å; T33-K36 PolarHBondContact O-N 2.82Å
34	R	85.7	Confident	85.8	Confident	80 Å²	80	91 Å²	91	30%	0.302	48%	0.48	S	S	.	.	H	α-helix	trans	-56.2	-42.2	177.4	-76.2	-178.6	-104.4	161.2	-10.8	113	L29 D30 E31 K36 I37	L29-R34 HydrophobicContact CB-CG 3.86Å; L29-R34 PolarHBondContact O-NE 3.46Å; L29-R34 PolarHBondContact O-NH2 2.97Å; D30-R34 WeakPolarHBondContact O-CG 3.27Å; D30-R34 PolarHBondContact O-N 3.2Å; E31-R34 PolarHBondContact O-N 3.14Å; R34-K36 PolarHBondContact O-N 3.27Å; R34-I37 PolarHBondContact O-N 3.42Å
35	K	87	Confident	85.8	Confident	156 Å²	156	89.4 Å²	89.4	68%	0.678	47%	0.469	S	S	*	.	H	α-helix	trans	-65.9	-21.1	178.8	-72.8	172.2	-174.4	170.7	0	114	E31 T33	E31-K35 WeakPolarHBondContact O-CG 3.46Å; E31-K35 PolarHBondContact O-N 3.48Å; T33-K35 VanDerWaalsContact C-N 3.31Å; T33-K35 PolarHBondContact O-N 3.19Å
36	K	84.8	Confident	86	Confident	156 Å²	156	88.8 Å²	88.8	68%	0.678	47%	0.472	S	S	*	.	H	α-helix	trans	-88.6	-10.9	-179.6	-68.9	169.6	-176.1	170.5	0	113.2	N32 T33 R34 R38	N32-K36 WeakPolarHBondContact O-CG 3.43Å; T33-K36 PolarHBondContact O-N 2.82Å; R34-K36 PolarHBondContact O-N 3.27Å; K36-R38 PolarHBondContact O-N 2.98Å
37	I	84.1	Confident	86.1	Confident	33 Å²	33	85.6 Å²	85.6	17%	0.169	46%	0.46	C	S	.	.			trans	-78.4	117.4	-178.8	-63	175.2	0	0	0	108.8	L5 Y22 L29 R34	L5-I37 HydrophobicContact CD1-CB 4.37Å; L5-I37 HydrophobicContact CD1-CD1 3.5Å; L5-I37 VanDerWaalsContact CD1-CD1 3.5Å; L5-I37 HydrophobicContact CD1-CG1 3.55Å; L5-I37 HydrophobicContact CD1-CG2 3.98Å; Y22-I37 HydrophobicContact CE2-CD1 3.88Å; Y22-I37 HydrophobicContact CE2-CG2 4.48Å; L29-I37 HydrophobicContact CD1-CD1 3.73Å; R34-I37 PolarHBondContact O-N 3.42Å
38	R	79.7	Confident	86	Confident	138 Å²	138	81.1 Å²	81.1	52%	0.521	43%	0.43	S	S	.	.			trans	-109.4	126.9	171	-67.4	174	67.4	-166.5	3.4	108.4	K36 L40 E50 D51	K36-R38 PolarHBondContact O-N 2.98Å; R38-L40 HydrophobicContact CB-CD2 4.48Å; R38-E50 IonicContact NH2-OE2 2.91Å; R38-D51 IonicContact NH1-OD2 2.77Å; R38-D51 PolarHBondContact NH1-OD2 2.9Å
39	V	81.9	Confident	86.1	Confident	93 Å²	93	78.4 Å²	78.4	56%	0.564	41%	0.411	S	S	*	.			trans	-96.4	115.5	172.4	-174.8	0	0	0	0	107.2	F18	F18-V39 HydrophobicContact CD1-CG1 4.47Å; F18-V39 HydrophobicContact CD1-CG2 4.47Å; F18-V39 HydrophobicContact CE1-CG1 4.18Å; F18-V39 HydrophobicContact CE1-CG2 3.48Å; F18-V39 VanDerWaalsContact CE1-CG2 3.48Å; F18-V39 HydrophobicContact CZ-CG1 4.49Å; F18-V39 HydrophobicContact CZ-CG2 3.62Å
40	L	81.7	Confident	86.3	Confident	35 Å²	35	83.1 Å²	83.1	18%	0.183	43%	0.432	C	S	.	.			trans	-90.4	146.9	-178.3	-53.9	176	0	0	0	110.3	I9 R38 A47 L48	I9-L40 HydrophobicContact CD1-CB 3.87Å; I9-L40 HydrophobicContact CD1-CG 4.31Å; R38-L40 HydrophobicContact CB-CD2 4.48Å; L40-A47 HydrophobicContact CD1-CB 4.02Å; L40-A47 HydrophobicContact CD2-CB 3.75Å; L40-A47 HydrophobicContact CG-CB 4.4Å; L40-L48 HydrophobicContact CD1-CD2 4.28Å; L40-L48 HydrophobicContact CD1-CG 4.23Å
41	G	79.9	Confident	86.2	Confident	43 Å²	43	83.6 Å²	83.6	44%	0.443	44%	0.435	S	S	.	.			trans	-86.6	-156.3	179.5	0	0	0	0	0	113.3	D43 Y44	G41-D43 PolarHBondContact O-N 2.98Å; G41-D43 VanDerWaalsContact O-N 3.14Å; G41-Y44 WeakPolarHBondContact O-CB 3.33Å; G41-Y44 PolarHBondContact O-N 2.82Å; G41-Y44 VanDerWaalsContact O-N 3.1Å
42	C	81.1	Confident	86.3	Confident	137 Å²	137	80.7 Å²	80.7	93%	0.926	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-22.5	178.1	-59.2	0	0	0	0	113.2	Y44	C42-Y44 VanDerWaalsContact C-N 3.31Å
43	D	85.4	Confident	86.5	Confident	109 Å²	109	78.5 Å²	78.5	58%	0.583	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	16.2	178.8	62.6	-29.4	0	0	0	113.5	G41 K45 A46 A47	G41-D43 PolarHBondContact O-N 2.98Å; G41-D43 VanDerWaalsContact O-N 3.14Å; D43-K45 PolarHBondContact O-N 3.03Å; D43-A46 PolarHBondContact O-N 3.25Å; D43-A47 PolarHBondContact O-N 3.35Å
44	Y	86.3	Confident	86.9	Confident	36 Å²	36	78.3 Å²	78.3	14%	0.141	42%	0.418	C	S	.	.	H	α-helix	trans	-51.2	-33.9	-175.2	74.1	-86.3	0	0	0	114.4	I9 G41 C42 A46 A47 L48	I9-Y44 HydrophobicContact CG2-CD1 3.92Å; I9-Y44 HydrophobicContact CG2-CD2 4.29Å; I9-Y44 HydrophobicContact CG2-CE1 4.46Å; I9-Y44 HydrophobicContact CG2-CG 3.82Å; G41-Y44 WeakPolarHBondContact O-CB 3.33Å; G41-Y44 PolarHBondContact O-N 2.82Å; G41-Y44 VanDerWaalsContact O-N 3.1Å; C42-Y44 VanDerWaalsContact C-N 3.31Å; Y44-A46 VanDerWaalsContact C-N 3.34Å; Y44-A46 PolarHBondContact O-N 3.18Å; Y44-A47 PolarHBondContact O-N 3.13Å; Y44-L48 HydrophobicContact CD2-CD1 3.91Å; Y44-L48 HydrophobicContact CE2-CD1 4.46Å; Y44-L48 VanDerWaalsContact O-CG 3.3Å; Y44-L48 WeakPolarHBondContact O-CG 3.39Å; Y44-L48 PolarHBondContact O-N 3.28Å
45	K	89.6	Confident	87.3	Confident	83 Å²	83	80 Å²	80	36%	0.361	43%	0.43	S	S	.	.	H	α-helix	trans	-61.6	-42.4	179	-64.5	-166.5	174.1	-164.6	0	112	D43 L48 L49 F60 Y61	D43-K45 PolarHBondContact O-N 3.03Å; K45-L48 PolarHBondContact O-N 3.3Å; K45-L49 WeakPolarHBondContact O-CG 3.4Å; K45-L49 PolarHBondContact O-N 3.48Å; K45-F60 WeakPolarHBondContact CE-O 3.13Å; K45-F60 PolarHBondContact NZ-O 2.96Å; K45-Y61 WeakPolarHBondContact CG-O 3.45Å
46	A	90.6	Very high	87.6	Confident	61 Å²	61	79.7 Å²	79.7	50%	0.504	43%	0.43	S	S	.	.	H	α-helix	trans	-67.7	-44.6	177.5	0	0	0	0	0	110.7	D43 Y44 L48 L49 E50	D43-A46 PolarHBondContact O-N 3.25Å; Y44-A46 VanDerWaalsContact C-N 3.34Å; Y44-A46 PolarHBondContact O-N 3.18Å; A46-L48 VanDerWaalsContact C-N 3.27Å; A46-L48 PolarHBondContact O-N 2.84Å; A46-L49 PolarHBondContact O-N 3.37Å; A46-L49 VanDerWaalsContact O-N 3.1Å; A46-E50 PolarHBondContact O-N 3.21Å
47	A	88.2	Confident	87.9	Confident	10 Å²	10	72.8 Å²	72.8	8%	0.083	40%	0.401	C	S	.	.	H	α-helix	trans	-61.9	-32.5	178	0	0	0	0	0	113.1	L40 D43 Y44 L49 E50	L40-A47 HydrophobicContact CD1-CB 4.02Å; L40-A47 HydrophobicContact CD2-CB 3.75Å; L40-A47 HydrophobicContact CG-CB 4.4Å; D43-A47 PolarHBondContact O-N 3.35Å; Y44-A47 PolarHBondContact O-N 3.13Å; A47-L49 VanDerWaalsContact C-N 3.33Å; A47-E50 WeakPolarHBondContact O-CB 3.32Å; A47-E50 PolarHBondContact O-N 2.8Å
48	L	89.6	Confident	88.4	Confident	11 Å²	11	71.9 Å²	71.9	6%	0.058	40%	0.397	C	S	.	.	H	α-helix	trans	-66.3	-35.4	174.9	-74.8	170.3	0	0	0	113	L6 L40 Y44 K45 A46 E50 D51 I52 L57	L6-L48 HydrophobicContact CD1-CD2 3.72Å; L6-L48 HydrophobicContact CD2-CD1 3.96Å; L6-L48 HydrophobicContact CD2-CD2 3.43Å; L6-L48 VanDerWaalsContact CD2-CD2 3.43Å; L6-L48 HydrophobicContact CD2-CG 4.23Å; L6-L48 HydrophobicContact CG-CD2 4.15Å; L40-L48 HydrophobicContact CD1-CD2 4.28Å; L40-L48 HydrophobicContact CD1-CG 4.23Å; Y44-L48 HydrophobicContact CD2-CD1 3.91Å; Y44-L48 HydrophobicContact CE2-CD1 4.46Å; Y44-L48 VanDerWaalsContact O-CG 3.3Å; Y44-L48 WeakPolarHBondContact O-CG 3.39Å; Y44-L48 PolarHBondContact O-N 3.28Å; K45-L48 PolarHBondContact O-N 3.3Å; A46-L48 VanDerWaalsContact C-N 3.27Å; A46-L48 PolarHBondContact O-N 2.84Å; L48-E50 PolarHBondContact O-N 3.46Å; L48-D51 PolarHBondContact O-N 3.47Å; L48-I52 HydrophobicContact CD2-CD1 4.38Å; L48-I52 WeakPolarHBondContact O-CB 3.49Å; L48-I52 PolarHBondContact O-N 2.82Å; L48-L57 HydrophobicContact CB-CD2 3.93Å
49	L	91.2	Very high	89.2	Confident	65 Å²	65	66.3 Å²	66.3	34%	0.34	38%	0.381	S	S	.	.	H	α-helix	trans	-72.6	-16	179.6	-65	173.7	0	0	0	113.1	K45 A46 A47 D51 I52 P54 L57	K45-L49 WeakPolarHBondContact O-CG 3.4Å; K45-L49 PolarHBondContact O-N 3.48Å; A46-L49 PolarHBondContact O-N 3.37Å; A46-L49 VanDerWaalsContact O-N 3.1Å; A47-L49 VanDerWaalsContact C-N 3.33Å; L49-D51 VanDerWaalsContact C-N 3.31Å; L49-I52 WeakPolarHBondContact CA-O 3.4Å; L49-P54 HydrophobicContact CD2-CB 4.1Å; L49-P54 HydrophobicContact CD2-CG 4.06Å; L49-L57 HydrophobicContact CD2-CD2 3.76Å; L49-L57 HydrophobicContact CG-CD2 4.39Å
50	E	91.6	Very high	89.7	Confident	144 Å²	144	64.1 Å²	64.1	67%	0.673	36%	0.364	S	S	*	.	H	α-helix	trans	-68.8	-33.3	171.1	-61.1	179.7	168.9	0	0	111.9	R38 A46 A47 L48	R38-E50 IonicContact NH2-OE2 2.91Å; A46-E50 PolarHBondContact O-N 3.21Å; A47-E50 WeakPolarHBondContact O-CB 3.32Å; A47-E50 PolarHBondContact O-N 2.8Å; L48-E50 PolarHBondContact O-N 3.46Å
51	D	87.8	Confident	90.2	Very high	91 Å²	91	63.8 Å²	63.8	49%	0.487	36%	0.36	S	S	.	.	H	α-helix	trans	-102.8	-22.9	-174.3	-83.3	-59.1	0	0	0	113	K2 R38 L48 L49	K2-D51 IonicContact NZ-OD1 3.78Å; R38-D51 IonicContact NH1-OD2 2.77Å; R38-D51 PolarHBondContact NH1-OD2 2.9Å; L48-D51 PolarHBondContact O-N 3.47Å; L49-D51 VanDerWaalsContact C-N 3.31Å
52	I	91.2	Very high	90.7	Very high	56 Å²	56	63 Å²	63	29%	0.287	35%	0.353	S	S	.	.	S	Bend	trans	-131	127.6	-171.8	-52	174.5	0	0	0	109.3	L48 L49 Q56 L57	L48-I52 HydrophobicContact CD2-CD1 4.38Å; L48-I52 WeakPolarHBondContact O-CB 3.49Å; L48-I52 PolarHBondContact O-N 2.82Å; L49-I52 WeakPolarHBondContact CA-O 3.4Å; I52-Q56 HydrophobicContact CG2-CB 4.25Å; I52-L57 HydrophobicContact CD1-CD1 4.2Å; I52-L57 HydrophobicContact CG2-CB 4.07Å
53	A	93.6	Very high	91.3	Very high	57 Å²	57	56.9 Å²	56.9	47%	0.471	31%	0.312	S	S	.	.			trans	-58.3	138.2	176.2	0	0	0	0	0	111.3	E55 Q56 L57	A53-E55 PolarHBondContact O-N 3.13Å; A53-E55 VanDerWaalsContact O-N 3.12Å; A53-Q56 HydrophobicContact CB-CG 4.34Å; A53-Q56 PolarHBondContact O-N 3.2Å; A53-L57 PolarHBondContact O-N 2.87Å
54	P	94	Very high	91.8	Very high	51 Å²	51	56.5 Å²	56.5	33%	0.331	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-52.3	-39.1	-177.5	-25.1	29.7	0	0	0	113.5	L49 Q56 L57 L64	L49-P54 HydrophobicContact CD2-CB 4.1Å; L49-P54 HydrophobicContact CD2-CG 4.06Å; P54-Q56 PolarHBondContact O-N 3.49Å; P54-L57 PolarHBondContact O-N 3.31Å; P54-L64 HydrophobicContact CB-CB 4.46Å; P54-L64 HydrophobicContact CB-CD1 4.01Å; P54-L64 HydrophobicContact CB-CG 4.07Å; P54-L64 PolarHBondContact O-N 3.28Å
55	E	94.4	Very high	92.1	Very high	116 Å²	116	56.7 Å²	56.7	54%	0.542	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-70.9	-11.9	-177.4	-36.8	-53.4	177.1	0	0	113.8	A53 L64	A53-E55 PolarHBondContact O-N 3.13Å; A53-E55 VanDerWaalsContact O-N 3.12Å; E55-L64 WeakPolarHBondContact OE2-CB 3.48Å; E55-L64 WeakPolarHBondContact OE2-CD1 3.49Å
56	Q	92.7	Very high	92.4	Very high	148 Å²	148	58 Å²	58	69%	0.692	32%	0.322	S	S	*	.	G	3₁₀ helix	trans	-107.4	-3.6	179.3	-61.3	-64.1	-75.4	0	0	112.4	I52 A53 P54	I52-Q56 HydrophobicContact CG2-CB 4.25Å; A53-Q56 HydrophobicContact CB-CG 4.34Å; A53-Q56 PolarHBondContact O-N 3.2Å; P54-Q56 PolarHBondContact O-N 3.49Å
57	L	92.1	Very high	92.4	Very high	12 Å²	12	55.5 Å²	55.5	6%	0.063	30%	0.302	C	S	.	.	S	Bend	trans	-108.4	128.9	-179.8	-174.9	70.1	0	0	0	109.4	L48 L49 I52 A53 P54 A59 G63 L64 C65	L48-L57 HydrophobicContact CB-CD2 3.93Å; L49-L57 HydrophobicContact CD2-CD2 3.76Å; L49-L57 HydrophobicContact CG-CD2 4.39Å; I52-L57 HydrophobicContact CD1-CD1 4.2Å; I52-L57 HydrophobicContact CG2-CB 4.07Å; A53-L57 PolarHBondContact O-N 2.87Å; P54-L57 PolarHBondContact O-N 3.31Å; L57-A59 PolarHBondContact O-N 3.11Å; L57-G63 CarbonylContact O-C 3.49Å; L57-G63 VanDerWaalsContact O-CA 3.27Å; L57-G63 WeakPolarHBondContact O-CA 3.26Å; L57-L64 PolarHBondContact O-N 3.44Å; L57-C65 WeakPolarHBondContact O-CB 3.47Å; L57-C65 PolarHBondContact O-N 2.96Å
58	P	94.4	Very high	92.5	Very high	13 Å²	13	59 Å²	59	8%	0.084	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-56.7	141.2	176.2	-23.5	31.5	0	0	0	112	F60 Y61 G62 G63 C65 C74 I78	P58-F60 PolarHBondContact O-N 3.32Å; P58-F60 VanDerWaalsContact O-N 3.13Å; P58-Y61 HydrophobicContact CB-CD2 3.93Å; P58-Y61 HydrophobicContact CG-CD2 3.97Å; P58-Y61 HydrophobicContact CG-CE2 4.4Å; P58-Y61 WeakPolarHBondContact O-CA 3.48Å; P58-Y61 PolarHBondContact O-N 3.46Å; P58-G62 PolarHBondContact O-N 3.26Å; P58-G63 PolarHBondContact O-N 3.37Å; P58-C65 CarbonylContact C-O 3.6Å; P58-C65 WeakPolarHBondContact CA-O 3.4Å; P58-C74 HydrophobicContact CB-CB 4.18Å; P58-C74 HydrophobicContact CG-CB 4.07Å; P58-I78 HydrophobicContact CG-CD1 3.66Å
59	A	94.9	Very high	92.5	Very high	22 Å²	22	66.9 Å²	66.9	18%	0.182	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-58.5	-28.5	-179.4	0	0	0	0	0	113.4	L57 Y61 G62 G63 C65 F66 N72	L57-A59 PolarHBondContact O-N 3.11Å; A59-Y61 PolarHBondContact O-N 2.82Å; A59-G62 PolarHBondContact O-N 3.03Å; A59-G63 VanDerWaalsContact CA-O 3.31Å; A59-G63 WeakPolarHBondContact CA-O 3Å; A59-C65 PolarHBondContact N-O 3.15Å; A59-F66 HydrophobicContact CB-CD1 4.28Å; A59-F66 HydrophobicContact CB-CD2 4.19Å; A59-F66 HydrophobicContact CB-CE1 3.74Å; A59-F66 HydrophobicContact CB-CE2 3.6Å; A59-F66 HydrophobicContact CB-CG 4.49Å; A59-F66 HydrophobicContact CB-CZ 3.34Å; A59-N72 HydrophobicContact CB-CB 3.92Å; A59-N72 PolarHBondContact N-O 3.04Å
60	F	92.7	Very high	92.6	Very high	47 Å²	47	66.3 Å²	66.3	21%	0.206	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-56.1	-36.8	171.2	-175.4	-110.6	0	0	0	112.9	Q10 K45 P58 N72 K73 Y80	Q10-F60 HydrophobicContact CG-CE1 3.66Å; Q10-F60 HydrophobicContact CG-CZ 3.9Å; K45-F60 WeakPolarHBondContact CE-O 3.13Å; K45-F60 PolarHBondContact NZ-O 2.96Å; P58-F60 PolarHBondContact O-N 3.32Å; P58-F60 VanDerWaalsContact O-N 3.13Å; F60-N72 VanDerWaalsContact CB-O 3.26Å; F60-N72 WeakPolarHBondContact CB-O 3.45Å; F60-N72 PolarHBondContact N-O 2.74Å; F60-K73 HydrophobicContact CB-CB 4.45Å; F60-K73 HydrophobicContact CB-CG 3.75Å; F60-K73 HydrophobicContact CD1-CG 3.95Å; F60-K73 HydrophobicContact CD2-CD 4.33Å; F60-K73 HydrophobicContact CD2-CG 3.72Å; F60-K73 HydrophobicContact CE1-CG 4.44Å; F60-K73 HydrophobicContact CE2-CD 4.44Å; F60-K73 HydrophobicContact CE2-CG 4.29Å; F60-K73 HydrophobicContact CG-CD 4.46Å; F60-K73 HydrophobicContact CG-CG 3.54Å; F60-Y80 HydrophobicContact CD1-CE1 4.31Å; F60-Y80 HydrophobicContact CE1-CE1 4.1Å
61	Y	92	Very high	92.7	Very high	27 Å²	27	61.5 Å²	61.5	11%	0.106	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-89.8	5.3	176	-62.7	-73.7	0	0	0	113.8	Q10 K45 P58 A59 I78	Q10-Y61 VanDerWaalsContact OE1-CD1 3.23Å; K45-Y61 WeakPolarHBondContact CG-O 3.45Å; P58-Y61 HydrophobicContact CB-CD2 3.93Å; P58-Y61 HydrophobicContact CG-CD2 3.97Å; P58-Y61 HydrophobicContact CG-CE2 4.4Å; P58-Y61 WeakPolarHBondContact O-CA 3.48Å; P58-Y61 PolarHBondContact O-N 3.46Å; A59-Y61 PolarHBondContact O-N 2.82Å; Y61-I78 HydrophobicContact CE2-CD1 4.2Å
62	G	91.1	Very high	93.1	Very high	28 Å²	28	60.5 Å²	60.5	29%	0.289	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.9	4.4	177.8	0	0	0	0	0	115.6	P58 A59	P58-G62 PolarHBondContact O-N 3.26Å; A59-G62 PolarHBondContact O-N 3.03Å
63	G	93.5	Very high	93.2	Very high	7 Å²	7	61.2 Å²	61.2	7%	0.072	35%	0.353	C	S	.	.	S	Bend	trans	-87.2	-157	172.8	0	0	0	0	0	113.7	L57 P58 A59	L57-G63 CarbonylContact O-C 3.49Å; L57-G63 VanDerWaalsContact O-CA 3.27Å; L57-G63 WeakPolarHBondContact O-CA 3.26Å; P58-G63 PolarHBondContact O-N 3.37Å; A59-G63 VanDerWaalsContact CA-O 3.31Å; A59-G63 WeakPolarHBondContact CA-O 3Å
64	L	95.3	Very high	93.1	Very high	102 Å²	102	58.7 Å²	58.7	53%	0.534	33%	0.332	S	S	.	.	S	Bend	trans	-124.6	3.5	-177.1	-66	178.4	0	0	0	112.5	P54 E55 L57 F66	P54-L64 HydrophobicContact CB-CB 4.46Å; P54-L64 HydrophobicContact CB-CD1 4.01Å; P54-L64 HydrophobicContact CB-CG 4.07Å; P54-L64 PolarHBondContact O-N 3.28Å; E55-L64 WeakPolarHBondContact OE2-CB 3.48Å; E55-L64 WeakPolarHBondContact OE2-CD1 3.49Å; L57-L64 PolarHBondContact O-N 3.44Å; L64-F66 VanDerWaalsContact O-CD2 3.29Å; L64-F66 WeakPolarHBondContact O-CD2 3.37Å
65	C	93.4	Very high	93	Very high	40 Å²	40	59.1 Å²	59.1	27%	0.27	34%	0.336	S	S	.	.	B	Isolated β-bridge	trans	-77.8	131.5	175.6	-169	0	0	0	0	110.9	L57 P58 A59 C74	L57-C65 WeakPolarHBondContact O-CB 3.47Å; L57-C65 PolarHBondContact O-N 2.96Å; P58-C65 CarbonylContact C-O 3.6Å; P58-C65 WeakPolarHBondContact CA-O 3.4Å; A59-C65 PolarHBondContact N-O 3.15Å; C65-C74 PolarHBondContact O-SG 3.15Å
66	F	95.2	Very high	92.9	Very high	109 Å²	109	59.6 Å²	59.6	48%	0.478	34%	0.338	S	S	.	.			trans	-126.2	143.1	173.9	-70.4	-98.6	0	0	0	109.8	A59 L64 G70 N72	A59-F66 HydrophobicContact CB-CD1 4.28Å; A59-F66 HydrophobicContact CB-CD2 4.19Å; A59-F66 HydrophobicContact CB-CE1 3.74Å; A59-F66 HydrophobicContact CB-CE2 3.6Å; A59-F66 HydrophobicContact CB-CG 4.49Å; A59-F66 HydrophobicContact CB-CZ 3.34Å; L64-F66 VanDerWaalsContact O-CD2 3.29Å; L64-F66 WeakPolarHBondContact O-CD2 3.37Å; F66-G70 WeakPolarHBondContact CD1-O 3.5Å; F66-N72 HydrophobicContact CD1-CB 3.92Å; F66-N72 HydrophobicContact CE1-CB 3.63Å
67	G	90.9	Very high	92.8	Very high	10 Å²	10	56.2 Å²	56.2	10%	0.103	34%	0.335	C	S	.	.			trans	-74.7	-179.7	168.8	0	0	0	0	0	112.6	G70 D71 C74 H76	G67-G70 PolarHBondContact O-N 2.61Å; G67-D71 PolarHBondContact N-O 3.05Å; G67-C74 PolarHBondContact N-SG 3.08Å; G67-H76 VanDerWaalsContact CA-CE1 3.45Å; G67-H76 WeakPolarHBondContact CA-CE1 3.46Å; G67-H76 WeakPolarHBondContact CA-ND1 3.08Å
68	S	90.8	Very high	92.8	Very high	84 Å²	84	58 Å²	58	59%	0.587	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-49.5	141.3	170.2	50.9	0	0	0	0	111.4	G70	S68-G70 VanDerWaalsContact C-N 3.26Å; S68-G70 PolarHBondContact O-N 3.33Å
69	N	90.3	Very high	92.6	Very high	175 Å²	175	62.1 Å²	62.1	94%	0.936	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	62.7	23.2	-179.2	-53.2	-25	0	0	0	115.1
70	G	92.2	Very high	92.3	Very high	53 Å²	53	65 Å²	65	55%	0.546	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	76.5	23.8	177.1	0	0	0	0	0	113.7	F66 G67 S68 N72	F66-G70 WeakPolarHBondContact CD1-O 3.5Å; G67-G70 PolarHBondContact O-N 2.61Å; S68-G70 VanDerWaalsContact C-N 3.26Å; S68-G70 PolarHBondContact O-N 3.33Å; G70-N72 PolarHBondContact O-N 2.83Å; G70-N72 VanDerWaalsContact O-N 3.08Å
71	D	94.4	Very high	92.2	Very high	43 Å²	43	65.8 Å²	65.8	23%	0.23	40%	0.402	C	S	.	.			trans	-68.5	104.2	175.9	177	17.1	0	0	0	111.2	G67 K73 C74 S75	G67-D71 PolarHBondContact N-O 3.05Å; D71-K73 PolarHBondContact O-N 2.86Å; D71-K73 VanDerWaalsContact O-N 3.15Å; D71-K73 WeakPolarHBondContact OD1-CB 3.45Å; D71-K73 PolarHBondContact OD1-N 3.34Å; D71-C74 PolarHBondContact O-N 3.1Å; D71-C74 VanDerWaalsContact O-N 3.1Å; D71-S75 WeakPolarHBondContact OD2-CA 3.43Å; D71-S75 WeakPolarHBondContact OD2-CB 3.38Å; D71-S75 PolarHBondContact OD2-N 3.22Å; D71-S75 PolarHBondContact OD2-OG 3.44Å
72	N	95.5	Very high	92.1	Very high	71 Å²	71	67.4 Å²	67.4	38%	0.38	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-16.1	-178.8	70.1	0.7	0	0	0	113.9	A59 F60 F66 G70	A59-N72 HydrophobicContact CB-CB 3.92Å; A59-N72 PolarHBondContact N-O 3.04Å; F60-N72 VanDerWaalsContact CB-O 3.26Å; F60-N72 WeakPolarHBondContact CB-O 3.45Å; F60-N72 PolarHBondContact N-O 2.74Å; F66-N72 HydrophobicContact CD1-CB 3.92Å; F66-N72 HydrophobicContact CE1-CB 3.63Å; G70-N72 PolarHBondContact O-N 2.83Å; G70-N72 VanDerWaalsContact O-N 3.08Å
73	K	92.8	Very high	92	Very high	70 Å²	70	72.2 Å²	72.2	30%	0.304	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-11.9	177.7	-80.3	-178.7	179.2	-174.1	0	113.2	F60 D71 S75 Y80	F60-K73 HydrophobicContact CB-CB 4.45Å; F60-K73 HydrophobicContact CB-CG 3.75Å; F60-K73 HydrophobicContact CD1-CG 3.95Å; F60-K73 HydrophobicContact CD2-CD 4.33Å; F60-K73 HydrophobicContact CD2-CG 3.72Å; F60-K73 HydrophobicContact CE1-CG 4.44Å; F60-K73 HydrophobicContact CE2-CD 4.44Å; F60-K73 HydrophobicContact CE2-CG 4.29Å; F60-K73 HydrophobicContact CG-CD 4.46Å; F60-K73 HydrophobicContact CG-CG 3.54Å; D71-K73 PolarHBondContact O-N 2.86Å; D71-K73 VanDerWaalsContact O-N 3.15Å; D71-K73 WeakPolarHBondContact OD1-CB 3.45Å; D71-K73 PolarHBondContact OD1-N 3.34Å; K73-S75 PolarHBondContact O-N 3.34Å; K73-Y80 HydrophobicContact CB-CD2 4.48Å; K73-Y80 HydrophobicContact CB-CE2 3.56Å; K73-Y80 WeakPolarHBondContact CB-OH 3.38Å; K73-Y80 HydrophobicContact CD-CD2 4.35Å; K73-Y80 HydrophobicContact CD-CE1 4.19Å; K73-Y80 HydrophobicContact CD-CE2 4.03Å; K73-Y80 HydrophobicContact CG-CE1 4.36Å; K73-Y80 HydrophobicContact CG-CE2 4.09Å; K73-Y80 PolarHBondContact O-OH 2.67Å
74	C	93	Very high	91.8	Very high	4 Å²	4	76.2 Å²	76.2	3%	0.027	48%	0.475	C	S	.	.			trans	52.1	45.2	-173.4	-60.7	0	0	0	0	111.7	P58 C65 G67 D71 H76 A77 I78	P58-C74 HydrophobicContact CB-CB 4.18Å; P58-C74 HydrophobicContact CG-CB 4.07Å; C65-C74 PolarHBondContact O-SG 3.15Å; G67-C74 PolarHBondContact N-SG 3.08Å; D71-C74 PolarHBondContact O-N 3.1Å; D71-C74 VanDerWaalsContact O-N 3.1Å; C74-H76 PolarHBondContact O-N 2.81Å; C74-A77 PolarHBondContact O-N 2.92Å; C74-I78 PolarHBondContact O-N 3.28Å
75	S	91.7	Very high	91.7	Very high	60 Å²	60	74.6 Å²	74.6	42%	0.42	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-15	-173.6	-44.2	0	0	0	0	113.5	D71 K73 A77 I78	D71-S75 WeakPolarHBondContact OD2-CA 3.43Å; D71-S75 WeakPolarHBondContact OD2-CB 3.38Å; D71-S75 PolarHBondContact OD2-N 3.22Å; D71-S75 PolarHBondContact OD2-OG 3.44Å; K73-S75 PolarHBondContact O-N 3.34Å; S75-A77 PolarHBondContact O-N 3.02Å; S75-I78 WeakPolarHBondContact CA-O 3.42Å
76	H	91.6	Very high	91.4	Very high	126 Å²	126	80.7 Å²	80.7	58%	0.583	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-24.5	169.3	70.8	-77.8	0	0	0	113.1	G67 C74	G67-H76 VanDerWaalsContact CA-CE1 3.45Å; G67-H76 WeakPolarHBondContact CA-CE1 3.46Å; G67-H76 WeakPolarHBondContact CA-ND1 3.08Å; C74-H76 PolarHBondContact O-N 2.81Å
77	A	91.8	Very high	91.1	Very high	77 Å²	77	83.1 Å²	83.1	64%	0.636	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-115	-24.8	-179.3	0	0	0	0	0	113.1	C74 S75	C74-A77 PolarHBondContact O-N 2.92Å; S75-A77 PolarHBondContact O-N 3.02Å
78	I	90.7	Very high	91.1	Very high	51 Å²	51	89 Å²	89	26%	0.262	53%	0.534	S	S	.	.			trans	-116.7	120.6	-177.9	-56.9	177.1	0	0	0	109.7	P58 Y61 C74 S75 Y80	P58-I78 HydrophobicContact CG-CD1 3.66Å; Y61-I78 HydrophobicContact CE2-CD1 4.2Å; C74-I78 PolarHBondContact O-N 3.28Å; S75-I78 WeakPolarHBondContact CA-O 3.42Å; I78-Y80 HydrophobicContact CB-CE2 3.92Å; I78-Y80 HydrophobicContact CG2-CD2 4.29Å; I78-Y80 HydrophobicContact CG2-CE1 4.4Å; I78-Y80 HydrophobicContact CG2-CE2 3.76Å; I78-Y80 WeakPolarHBondContact O-CD2 3.4Å
79	S	90.9	Very high	90.9	Very high	98 Å²	98	90 Å²	90	69%	0.685	53%	0.529	S	S	*	.			trans	-82.5	123	171.1	-178.7	0	0	0	0	109.9	G81	S79-G81 VanDerWaalsContact C-N 3.29Å; S79-G81 PolarHBondContact OG-N 3.45Å
80	Y	89.1	Confident	90.6	Very high	83 Å²	83	85.9 Å²	85.9	33%	0.325	50%	0.503	S	S	.	.			trans	-92.1	10.6	176.3	-71.5	-87.4	0	0	0	113	F60 K73 I78	F60-Y80 HydrophobicContact CD1-CE1 4.31Å; F60-Y80 HydrophobicContact CE1-CE1 4.1Å; K73-Y80 HydrophobicContact CB-CD2 4.48Å; K73-Y80 HydrophobicContact CB-CE2 3.56Å; K73-Y80 WeakPolarHBondContact CB-OH 3.38Å; K73-Y80 HydrophobicContact CD-CD2 4.35Å; K73-Y80 HydrophobicContact CD-CE1 4.19Å; K73-Y80 HydrophobicContact CD-CE2 4.03Å; K73-Y80 HydrophobicContact CG-CE1 4.36Å; K73-Y80 HydrophobicContact CG-CE2 4.09Å; K73-Y80 PolarHBondContact O-OH 2.67Å; I78-Y80 HydrophobicContact CB-CE2 3.92Å; I78-Y80 HydrophobicContact CG2-CD2 4.29Å; I78-Y80 HydrophobicContact CG2-CE1 4.4Å; I78-Y80 HydrophobicContact CG2-CE2 3.76Å; I78-Y80 WeakPolarHBondContact O-CD2 3.4Å
81	G	89.4	Confident	90.2	Very high	64 Å²	64	89.1 Å²	89.1	66%	0.66	51%	0.508	S	S	*	.			trans	60.9	-153.4	-173.6	0	0	0	0	0	112.5	S79	S79-G81 VanDerWaalsContact C-N 3.29Å; S79-G81 PolarHBondContact OG-N 3.45Å
82	G	90.4	Very high	89.7	Confident	60 Å²	60	88.4 Å²	88.4	62%	0.619	50%	0.504	S	S	*	.			trans	145.3	173.4	-177.1	0	0	0	0	0	111.5	V84	G82-V84 PolarHBondContact O-N 3.34Å
83	P	89.9	Confident	89.2	Confident	129 Å²	129	90.5 Å²	90.5	84%	0.838	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-60.6	129.8	172.2	26.5	-32.6	0	0	0	109.6	P85	P83-P85 WeakPolarHBondContact O-CD 3.48Å
84	V	88.9	Confident	88.9	Confident	91 Å²	91	89.8 Å²	89.8	55%	0.552	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-67.8	127	174.9	-179.8	0	0	0	0	108.2	G82 L88 H89	G82-V84 PolarHBondContact O-N 3.34Å; V84-L88 HydrophobicContact CG1-CB 3.99Å; V84-H89 PolarHBondContact O-NE2 2.75Å
85	P	92	Very high	88.9	Confident	68 Å²	68	94.3 Å²	94.3	44%	0.442	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-55.3	140.2	175.4	-24.6	32.3	0	0	0	111.8	P83 E87 L88 H89	P83-P85 WeakPolarHBondContact O-CD 3.48Å; P85-E87 WeakPolarHBondContact CB-OE2 3.34Å; P85-E87 PolarHBondContact O-N 3.11Å; P85-E87 VanDerWaalsContact O-N 3.15Å; P85-L88 HydrophobicContact CG-CD1 4.32Å; P85-L88 WeakPolarHBondContact O-CB 3.45Å; P85-L88 PolarHBondContact O-N 2.67Å; P85-H89 PolarHBondContact O-CD2 3.16Å
86	K	87.6	Confident	88.8	Confident	169 Å²	169	93.1 Å²	93.1	74%	0.735	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-63.3	-25.2	-173.4	-72.7	-175.7	179	179	0	112.6	L88 H89	K86-L88 PolarHBondContact O-N 3.16Å; K86-H89 VanDerWaalsContact O-CB 3.29Å; K86-H89 WeakPolarHBondContact O-CB 3.08Å; K86-H89 PolarHBondContact O-N 3.13Å; K86-H89 VanDerWaalsContact O-N 3.14Å
87	E	89.9	Confident	88.8	Confident	160 Å²	160	93.6 Å²	93.6	75%	0.748	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-69.8	-22.5	179.5	-47	72.1	-150.4	0	0	111.4	P85	P85-E87 WeakPolarHBondContact CB-OE2 3.34Å; P85-E87 PolarHBondContact O-N 3.11Å; P85-E87 VanDerWaalsContact O-N 3.15Å
88	L	89.3	Confident	88.9	Confident	133 Å²	133	97.2 Å²	97.2	70%	0.696	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-91.7	-3.8	174.9	-59.3	-178.9	0	0	0	112.6	V84 P85 K86	V84-L88 HydrophobicContact CG1-CB 3.99Å; P85-L88 HydrophobicContact CG-CD1 4.32Å; P85-L88 WeakPolarHBondContact O-CB 3.45Å; P85-L88 PolarHBondContact O-N 2.67Å; K86-L88 PolarHBondContact O-N 3.16Å
89	H	86.7	Confident	89	Confident	105 Å²	105	96.7 Å²	96.7	49%	0.486	55%	0.545	S	S	.	.	S	Bend	trans	-66.2	148	172.2	-66.7	-176.8	0	0	0	109.7	V84 P85 K86 N91	V84-H89 PolarHBondContact O-NE2 2.75Å; P85-H89 PolarHBondContact O-CD2 3.16Å; K86-H89 VanDerWaalsContact O-CB 3.29Å; K86-H89 WeakPolarHBondContact O-CB 3.08Å; K86-H89 PolarHBondContact O-N 3.13Å; K86-H89 VanDerWaalsContact O-N 3.14Å; H89-N91 PolarHBondContact O-N 3.11Å
90	F	84.3	Confident	89.2	Confident	88 Å²	88	95.1 Å²	95.1	39%	0.386	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-55.6	116.3	173.3	178.7	-97.3	0	0	0	109.7	D92 V94 V167 P168 Y170	F90-D92 HydrophobicContact CE1-CB 4.03Å; F90-V94 HydrophobicContact CZ-CG2 4.35Å; F90-V167 HydrophobicContact CB-CG2 4.19Å; F90-V167 HydrophobicContact CD1-CG1 4.26Å; F90-V167 HydrophobicContact CD1-CG2 4.32Å; F90-V167 HydrophobicContact CD2-CG1 4.26Å; F90-V167 HydrophobicContact CE1-CG1 4.16Å; F90-V167 HydrophobicContact CE2-CG1 4.16Å; F90-V167 HydrophobicContact CG-CG1 4.31Å; F90-V167 HydrophobicContact CG-CG2 4.12Å; F90-V167 HydrophobicContact CZ-CG1 4.11Å; F90-P168 VanDerWaalsContact CE1-CD 3.42Å; F90-P168 HydrophobicContact CE1-CG 4.01Å; F90-P168 HydrophobicContact CZ-CG 4.31Å; F90-Y170 HydrophobicContact CZ-CE1 4.29Å
91	N	84.3	Confident	89.4	Confident	121 Å²	121	95 Å²	95	65%	0.647	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-92.7	124.9	171.1	-170.2	1.6	0	0	0	108	H89 T93	H89-N91 PolarHBondContact O-N 3.11Å; N91-T93 HydrophobicContact CB-CG2 4.18Å; N91-T93 PolarHBondContact O-N 3Å
92	D	83.7	Confident	89.6	Confident	28 Å²	28	93 Å²	93	15%	0.15	52%	0.522	C	S	.	.			trans	-78.5	56.4	-173	-158.9	-8.7	0	0	0	111.5	F90 V94 R95 Y126 K128	F90-D92 HydrophobicContact CE1-CB 4.03Å; D92-V94 PolarHBondContact O-N 3.18Å; D92-R95 HydrophobicContact CB-CB 4.43Å; D92-R95 VanDerWaalsContact O-CB 3.22Å; D92-R95 WeakPolarHBondContact O-CB 3.48Å; D92-R95 PolarHBondContact O-N 3.4Å; D92-Y126 VanDerWaalsContact CG-OH 3.26Å; D92-Y126 WeakPolarHBondContact OD1-CE2 3.47Å; D92-Y126 PolarHBondContact OD1-OH 3.41Å; D92-Y126 PolarHBondContact OD2-OH 3.03Å; D92-K128 IonicContact OD2-NZ 3.65Å; D92-K128 PolarHBondContact OD2-NZ 3.42Å
93	T	85.4	Confident	89.8	Confident	115 Å²	115	93 Å²	93	71%	0.706	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-17.2	-176.8	55.7	0	0	0	0	113	N91 R95	N91-T93 HydrophobicContact CB-CG2 4.18Å; N91-T93 PolarHBondContact O-N 3Å; T93-R95 VanDerWaalsContact C-N 3.34Å
94	V	87	Confident	89.9	Confident	56 Å²	56	86.9 Å²	86.9	34%	0.339	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-2.6	176.6	-63	0	0	0	0	112.9	F90 D92 P96 Y126 Y170	F90-V94 HydrophobicContact CZ-CG2 4.35Å; D92-V94 PolarHBondContact O-N 3.18Å; V94-P96 WeakPolarHBondContact O-CD 3.36Å; V94-Y126 HydrophobicContact CG2-CD2 4.41Å; V94-Y126 HydrophobicContact CG2-CE2 4.23Å; V94-Y170 HydrophobicContact CB-CD2 4.28Å; V94-Y170 HydrophobicContact CB-CE2 4.29Å; V94-Y170 HydrophobicContact CG1-CD2 4.28Å; V94-Y170 HydrophobicContact CG1-CE2 3.84Å; V94-Y170 HydrophobicContact CG2-CD1 3.78Å; V94-Y170 HydrophobicContact CG2-CD2 4.14Å; V94-Y170 HydrophobicContact CG2-CE1 3.81Å; V94-Y170 HydrophobicContact CG2-CE2 4.16Å; V94-Y170 HydrophobicContact CG2-CG 3.95Å
95	R	91.7	Very high	90.2	Very high	99 Å²	99	87.3 Å²	87.3	37%	0.374	47%	0.469	S	S	.	.			trans	-61.3	120.1	-178.6	-173.9	168.7	175.9	93.8	-6.4	111	D92 T93 L99 Y126 E216	D92-R95 HydrophobicContact CB-CB 4.43Å; D92-R95 VanDerWaalsContact O-CB 3.22Å; D92-R95 WeakPolarHBondContact O-CB 3.48Å; D92-R95 PolarHBondContact O-N 3.4Å; T93-R95 VanDerWaalsContact C-N 3.34Å; R95-L99 HydrophobicContact CG-CD1 4.05Å; R95-Y126 HydrophobicContact CB-CE2 4.21Å; R95-Y126 PolarHBondContact NH1-OH 3.16Å; R95-E216 IonicContact CZ-OE2 2.64Å; R95-E216 VanDerWaalsContact CZ-OE2 3.3Å; R95-E216 IonicContact NH1-OE2 2.78Å; R95-E216 PolarHBondContact NH1-OE2 3.21Å; R95-E216 IonicContact NH2-OE1 3.13Å; R95-E216 IonicContact NH2-OE2 3.99Å; R95-E216 PolarHBondContact NH2-OE2 3.13Å
96	P	91.3	Very high	90.2	Very high	34 Å²	34	91.1 Å²	91.1	22%	0.221	48%	0.475	C	S	.	.			trans	-66.1	152.1	175.9	-24.7	38.1	0	0	0	111.9	V94 K98 Y126 N218	V94-P96 WeakPolarHBondContact O-CD 3.36Å; P96-K98 VanDerWaalsContact C-N 3.27Å; P96-K98 PolarHBondContact O-N 2.82Å; P96-Y126 VanDerWaalsContact CD-CG 3.49Å; P96-Y126 HydrophobicContact CG-CD2 4.38Å; P96-Y126 HydrophobicContact CG-CG 4.05Å; P96-N218 HydrophobicContact CB-CB 3.96Å; P96-N218 HydrophobicContact CG-CB 3.76Å
97	S	90.9	Very high	90.4	Very high	137 Å²	137	88 Å²	88	96%	0.958	46%	0.463	S	S	*	.	S	Bend	trans	-64.7	-31.4	177.8	56	0	0	0	0	113.1
98	K	93.1	Very high	90.5	Very high	152 Å²	152	81.9 Å²	81.9	66%	0.661	44%	0.438	S	S	*	.			trans	-115.4	123.2	179.6	-172.9	179.1	179.3	-177.1	0	110.4	P96 N218	P96-K98 VanDerWaalsContact C-N 3.27Å; P96-K98 PolarHBondContact O-N 2.82Å; K98-N218 PolarHBondContact O-ND2 3.12Å
99	L	93.9	Very high	90.7	Very high	41 Å²	41	78.2 Å²	78.2	22%	0.215	42%	0.417	C	S	.	.			trans	-125	147.7	176.2	-71.8	163.1	0	0	0	110.4	R95 Y126 E216 Y217 N218	R95-L99 HydrophobicContact CG-CD1 4.05Å; L99-Y126 HydrophobicContact CD1-CE1 4.34Å; L99-Y126 HydrophobicContact CD2-CD1 3.51Å; L99-Y126 HydrophobicContact CD2-CE1 3.67Å; L99-E216 HydrophobicContact CB-CB 4.3Å; L99-E216 HydrophobicContact CD1-CB 4.36Å; L99-E216 HydrophobicContact CD2-CB 4.37Å; L99-Y217 WeakPolarHBondContact CA-O 3.36Å; L99-N218 HydrophobicContact CD2-CB 4Å
100	T	94.7	Very high	91	Very high	64 Å²	64	75.4 Å²	75.4	39%	0.393	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	131	174.6	-60	0	0	0	0	109	E216 Y217	T100-E216 CarbonylContact O-C 3.58Å; T100-E216 WeakPolarHBondContact O-CA 3.21Å; T100-Y217 HydrophobicContact CG2-CE1 3.65Å; T100-Y217 PolarHBondContact N-O 3.17Å; T100-Y217 WeakPolarHBondContact O-CD1 3.34Å; T100-Y217 PolarHBondContact O-N 3.23Å
101	A	93.8	Very high	91.3	Very high	80 Å²	80	73.2 Å²	73.2	66%	0.661	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	138.4	174.6	0	0	0	0	0	110.5	L215	A101-L215 CarbonylContact C-O 3.52Å; A101-L215 WeakPolarHBondContact CA-O 3.48Å
102	V	93.4	Very high	91.5	Very high	24 Å²	24	68.4 Å²	68.4	15%	0.145	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	146	175.2	66	0	0	0	0	110.4	I110 L203 L215 Y217	V102-I110 HydrophobicContact CG2-CD1 3.64Å; V102-L203 HydrophobicContact CG1-CD1 3.78Å; V102-L215 HydrophobicContact CG1-CB 3.96Å; V102-L215 HydrophobicContact CG1-CD1 4.34Å; V102-L215 PolarHBondContact N-O 2.71Å; V102-L215 PolarHBondContact O-N 2.89Å; V102-Y217 HydrophobicContact CB-CD1 4.14Å; V102-Y217 HydrophobicContact CB-CE1 3.92Å; V102-Y217 HydrophobicContact CG1-CD1 3.67Å; V102-Y217 HydrophobicContact CG1-CE1 3.95Å
103	T	93.7	Very high	91.7	Very high	60 Å²	60	70.5 Å²	70.5	37%	0.368	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	117	172.4	-60.2	0	0	0	0	109.2	I110 K213 H214	T103-I110 VanDerWaalsContact O-CD1 3.3Å; T103-I110 WeakPolarHBondContact O-CD1 3.32Å; T103-K213 CarbonylContact C-O 3.53Å; T103-K213 WeakPolarHBondContact CA-O 3.21Å; T103-H214 VanDerWaalsContact CG2-CE1 3.42Å; T103-H214 WeakPolarHBondContact CG2-CE1 3.06Å; T103-H214 WeakPolarHBondContact CG2-ND1 3.43Å; T103-H214 PolarHBondContact OG1-CE1 2.81Å; T103-H214 PolarHBondContact OG1-ND1 2.84Å
104	V	93.2	Very high	91.5	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	111.5	171.1	-166.3	0	0	0	0	107.4	I110 L203 N205 S212 K213 L215	V104-I110 HydrophobicContact CB-CD1 4.43Å; V104-I110 HydrophobicContact CG1-CG1 4.35Å; V104-I110 HydrophobicContact CG2-CD1 4.1Å; V104-I110 HydrophobicContact CG2-CG1 4.47Å; V104-L203 HydrophobicContact CG2-CB 3.74Å; V104-L203 HydrophobicContact CG2-CD1 4.14Å; V104-N205 HydrophobicContact CB-CB 4.11Å; V104-N205 HydrophobicContact CG1-CB 3.5Å; V104-N205 VanDerWaalsContact CG1-CB 3.5Å; V104-N205 PolarHBondContact O-ND2 2.87Å; V104-S212 CarbonylContact O-C 3.55Å; V104-S212 WeakPolarHBondContact O-CA 3.14Å; V104-K213 PolarHBondContact N-O 2.75Å; V104-K213 PolarHBondContact O-N 3.24Å; V104-L215 HydrophobicContact CG2-CD1 3.77Å
105	N	93.9	Very high	91	Very high	99 Å²	99	68.4 Å²	68.4	53%	0.529	37%	0.365	S	S	.	.			trans	-62.1	162.1	-179.8	-71.7	-37	0	0	0	111.7	S108 N205	N105-S108 WeakPolarHBondContact CA-OG 3.36Å; N105-S108 WeakPolarHBondContact CB-OG 3.38Å; N105-S108 PolarHBondContact N-OG 3.31Å; N105-S108 VanDerWaalsContact N-OG 3.17Å; N105-S108 PolarHBondContact O-N 3.03Å; N105-S108 PolarHBondContact O-OG 3.14Å; N105-N205 WeakPolarHBondContact O-CB 3.09Å; N105-N205 PolarHBondContact O-ND2 3.45Å
106	R	91.6	Very high	90.2	Very high	148 Å²	148	64.6 Å²	64.6	56%	0.558	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	146	171.8	67.8	172.3	-177.2	163.7	-1.6	110	S108 N205 S208 Y209	R106-S108 PolarHBondContact O-N 3.36Å; R106-N205 WeakPolarHBondContact CA-ND2 3.36Å; R106-S208 WeakPolarHBondContact CB-O 3.42Å; R106-Y209 WeakPolarHBondContact CD-O 3.39Å; R106-Y209 PolarHBondContact NH1-O 3.31Å; R106-Y209 VanDerWaalsContact NH1-O 3.11Å
107	Q	92.1	Very high	88.9	Confident	104 Å²	104	69 Å²	69	49%	0.486	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	21.9	178.9	-57.6	-177.3	-47.5	0	0	114.6	N205 K206 S208	Q107-N205 PolarHBondContact N-O 2.81Å; Q107-N205 VanDerWaalsContact N-O 3.14Å; Q107-K206 WeakPolarHBondContact CA-O 3.3Å; Q107-S208 WeakPolarHBondContact CG-O 3.43Å; Q107-S208 PolarHBondContact N-O 2.86Å
108	S	93.4	Very high	87.8	Confident	32 Å²	32	64.5 Å²	64.5	22%	0.224	34%	0.338	C	S	.	.			trans	-125.3	171.3	-178.9	85.9	0	0	0	0	111.9	N105 R106 N205 K206	N105-S108 WeakPolarHBondContact CA-OG 3.36Å; N105-S108 WeakPolarHBondContact CB-OG 3.38Å; N105-S108 PolarHBondContact N-OG 3.31Å; N105-S108 VanDerWaalsContact N-OG 3.17Å; N105-S108 PolarHBondContact O-N 3.03Å; N105-S108 PolarHBondContact O-OG 3.14Å; R106-S108 PolarHBondContact O-N 3.36Å; S108-N205 CarbonylContact O-C 3.5Å; S108-N205 VanDerWaalsContact O-CA 3.3Å; S108-N205 WeakPolarHBondContact O-CA 3.38Å; S108-N205 PolarHBondContact O-N 2.84Å; S108-K206 PolarHBondContact O-N 3.08Å; S108-K206 VanDerWaalsContact O-N 3.16Å
109	E	93.3	Very high	86.7	Confident	55 Å²	55	61.4 Å²	61.4	26%	0.257	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	160.9	167.7	68.5	-169.4	156.8	0	0	109.5	R202 L203 N204 K206	E109-R202 IonicContact OE2-CZ 2.67Å; E109-R202 IonicContact OE2-NE 3.21Å; E109-R202 PolarHBondContact OE2-NE 3.4Å; E109-R202 IonicContact OE2-NH2 3.8Å; E109-R202 PolarHBondContact OE2-NH2 2.88Å; E109-L203 CarbonylContact C-O 3.57Å; E109-L203 WeakPolarHBondContact CA-O 3.32Å; E109-L203 WeakPolarHBondContact CB-O 3.37Å; E109-N204 HydrophobicContact CB-CB 4.38Å; E109-K206 VanDerWaalsContact CD-CE 3.46Å; E109-K206 WeakPolarHBondContact OE1-CE 3.4Å; E109-K206 IonicContact OE1-NZ 2.82Å; E109-K206 PolarHBondContact OE1-NZ 2.82Å; E109-K206 IonicContact OE2-NZ 2.61Å
110	I	92.2	Very high	86	Confident	47 Å²	47	62.9 Å²	62.9	24%	0.241	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	135.1	175.2	-63	179.3	0	0	0	107.4	V102 T103 V104 I112 L203	V102-I110 HydrophobicContact CG2-CD1 3.64Å; T103-I110 VanDerWaalsContact O-CD1 3.3Å; T103-I110 WeakPolarHBondContact O-CD1 3.32Å; V104-I110 HydrophobicContact CB-CD1 4.43Å; V104-I110 HydrophobicContact CG1-CG1 4.35Å; V104-I110 HydrophobicContact CG2-CD1 4.1Å; V104-I110 HydrophobicContact CG2-CG1 4.47Å; I110-I112 HydrophobicContact CG2-CD1 4.39Å; I110-I112 HydrophobicContact CG2-CG1 3.84Å; I110-L203 PolarHBondContact N-O 2.61Å; I110-L203 PolarHBondContact O-N 2.82Å
111	L	90.8	Very high	85.5	Confident	41 Å²	41	59.9 Å²	59.9	22%	0.215	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	114.5	168.2	-63.9	174.5	0	0	0	107.7	T147 I150 M153 F200 M201 R202	L111-T147 HydrophobicContact CD1-CG2 4.09Å; L111-I150 HydrophobicContact CD1-CD1 4.4Å; L111-I150 HydrophobicContact CD2-CD1 3.98Å; L111-M153 HydrophobicContact CD1-CE 4.08Å; L111-F200 HydrophobicContact CB-CB 4.39Å; L111-F200 HydrophobicContact CB-CD1 4.13Å; L111-F200 HydrophobicContact CD2-CB 4.3Å; L111-M201 CarbonylContact C-O 3.58Å; L111-M201 WeakPolarHBondContact CA-O 3.36Å; L111-R202 HydrophobicContact CD2-CB 3.69Å; L111-R202 HydrophobicContact CD2-CG 3.76Å
112	I	89.1	Confident	85.2	Confident	20 Å²	20	57.2 Å²	57.2	10%	0.103	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	115.6	176.3	-68	170.8	0	0	0	107.2	I110 F200 M201 L203 Y217	I110-I112 HydrophobicContact CG2-CD1 4.39Å; I110-I112 HydrophobicContact CG2-CG1 3.84Å; I112-F200 CarbonylContact O-C 3.55Å; I112-F200 VanDerWaalsContact O-CA 3.32Å; I112-F200 WeakPolarHBondContact O-CA 3.46Å; I112-M201 HydrophobicContact CB-CB 4.36Å; I112-M201 HydrophobicContact CB-CE 3.86Å; I112-M201 HydrophobicContact CD1-CE 3.18Å; I112-M201 HydrophobicContact CG1-CE 3.94Å; I112-M201 HydrophobicContact CG2-CE 4.36Å; I112-M201 PolarHBondContact N-O 3.09Å; I112-M201 PolarHBondContact O-N 3.34Å; I112-L203 HydrophobicContact CD1-CD1 4.19Å; I112-Y217 HydrophobicContact CD1-CD1 4.2Å; I112-Y217 HydrophobicContact CD1-CD2 4.5Å; I112-Y217 HydrophobicContact CD1-CE1 3.58Å; I112-Y217 HydrophobicContact CD1-CE2 3.91Å; I112-Y217 HydrophobicContact CG2-CE2 4.19Å
113	P	86.4	Confident	85	Confident	72 Å²	72	56.1 Å²	56.1	47%	0.468	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	144	-179.8	25.8	-33	0	0	0	111.6	I197 D199 F200	P113-I197 HydrophobicContact CB-CB 4.46Å; P113-I197 HydrophobicContact CB-CD1 4.13Å; P113-I197 HydrophobicContact CB-CG2 3.32Å; P113-D199 CarbonylContact C-O 3.5Å; P113-F200 HydrophobicContact CB-CD1 4.33Å; P113-F200 HydrophobicContact CB-CE1 4.17Å
114	L	81.8	Confident	84.9	Confident	8 Å²	8	55 Å²	55	4%	0.042	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	118.6	176.6	-60.6	170.8	0	0	0	108.9	V116 I123 I139 I197 D199 F219	L114-V116 PolarHBondContact O-N 2.88Å; L114-I123 HydrophobicContact CD1-CG2 4.1Å; L114-I139 HydrophobicContact CD1-CG2 4.27Å; L114-I197 WeakPolarHBondContact O-CG2 3.23Å; L114-D199 HydrophobicContact CB-CB 3.67Å; L114-D199 HydrophobicContact CD1-CB 4.23Å; L114-D199 HydrophobicContact CG-CB 4.48Å; L114-D199 PolarHBondContact N-O 3.31Å; L114-F219 HydrophobicContact CD1-CD1 3.98Å; L114-F219 HydrophobicContact CD1-CE1 4.17Å; L114-F219 HydrophobicContact CD2-CB 3.6Å; L114-F219 HydrophobicContact CD2-CD1 3.35Å; L114-F219 HydrophobicContact CD2-CD2 4.38Å; L114-F219 HydrophobicContact CD2-CE1 4.19Å; L114-F219 HydrophobicContact CD2-CG 3.47Å; L114-F219 VanDerWaalsContact CD2-CG 3.47Å; L114-F219 HydrophobicContact CG-CD1 4.3Å
115	E	76.6	Confident	84.9	Confident	119 Å²	119	56.3 Å²	56.3	56%	0.556	29%	0.286	S	S	*	.			trans	-80.1	104.1	175.5	-74.9	168	-161.4	0	0	109.3	I197	E115-I197 HydrophobicContact CG-CD1 3.9Å; E115-I197 HydrophobicContact CG-CG1 3.79Å
116	V	74.6	Confident	84.8	Confident	20 Å²	20	51.8 Å²	51.8	12%	0.121	26%	0.262	C	S	.	.			trans	-113.2	100.1	176.5	-176.9	0	0	0	0	108.7	L114 A121 I123 V175 D199 V221	L114-V116 PolarHBondContact O-N 2.88Å; V116-A121 HydrophobicContact CG1-CB 3.57Å; V116-I123 HydrophobicContact CG2-CD1 4.1Å; V116-I123 HydrophobicContact CG2-CG1 4.17Å; V116-V175 HydrophobicContact CG1-CG2 4.31Å; V116-D199 HydrophobicContact CG2-CB 4.03Å; V116-D199 WeakPolarHBondContact CG2-OD2 3.38Å; V116-V221 HydrophobicContact CG1-CG1 4.37Å; V116-V221 HydrophobicContact CG2-CG1 4.15Å; V116-V221 HydrophobicContact CG2-CG2 4.11Å
117	E	65.5	Low	84.8	Confident	125 Å²	125	44.8 Å²	44.8	58%	0.584	24%	0.235	S	C	*	.			trans	-82.6	-18.2	-171.8	-54.9	-172.2	170.3	0	0	114.2	F195	E117-F195 HydrophobicContact CB-CD1 4.13Å; E117-F195 HydrophobicContact CB-CE1 4Å; E117-F195 HydrophobicContact CG-CD1 3.56Å; E117-F195 HydrophobicContact CG-CE1 3.51Å; E117-F195 HydrophobicContact CG-CG 4.47Å; E117-F195 HydrophobicContact CG-CZ 4.4Å; E117-F195 WeakPolarHBondContact OE1-CE1 3.39Å; E117-F195 WeakPolarHBondContact OE1-CZ 3.18Å
118	T	66.4	Low	84.8	Confident	44 Å²	44	41.8 Å²	41.8	27%	0.27	22%	0.221	S	C	.	.	S	Bend	trans	-124.4	149.7	-169	64.3	0	0	0	0	112.5	L120 V223	T118-L120 PolarHBondContact O-N 3.35Å; T118-L120 VanDerWaalsContact O-N 3.08Å; T118-L120 PolarHBondContact OG1-O 2.72Å; T118-V223 HydrophobicContact CG2-CB 4.44Å; T118-V223 HydrophobicContact CG2-CG1 3.87Å; T118-V223 HydrophobicContact CG2-CG2 3.67Å
119	D	69.4	Low	84.6	Confident	86 Å²	86	40.4 Å²	40.4	46%	0.46	21%	0.211	S	C	.	.	S	Bend	trans	-63.1	-13.1	176.4	-69.9	-19.5	0	0	0	113.3	N176 R177 K178	D119-N176 CarbonylContact O-C 3.57Å; D119-N176 WeakPolarHBondContact O-CA 3.34Å; D119-N176 PolarHBondContact O-OD1 2.88Å; D119-R177 PolarHBondContact O-N 2.9Å; D119-K178 HydrophobicContact CB-CG 4.1Å
120	L	79.9	Confident	84.5	Confident	73 Å²	73	42.7 Å²	42.7	38%	0.382	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	86.4	179.9	-165.6	73	0	0	0	110.1	T118 N176 V224	T118-L120 PolarHBondContact O-N 3.35Å; T118-L120 VanDerWaalsContact O-N 3.08Å; T118-L120 PolarHBondContact OG1-O 2.72Å; L120-N176 HydrophobicContact CD1-CB 4.09Å; L120-V224 HydrophobicContact CD2-CB 3.72Å; L120-V224 HydrophobicContact CD2-CG1 3.9Å; L120-V224 HydrophobicContact CD2-CG2 4.01Å; L120-V224 HydrophobicContact CG-CB 3.98Å; L120-V224 HydrophobicContact CG-CG2 3.81Å; L120-V224 PolarHBondContact O-N 3.4Å
121	A	84.5	Confident	83.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	151.1	-179.4	0	0	0	0	0	111.4	V116 Q174 V175 V221 A222	V116-A121 HydrophobicContact CG1-CB 3.57Å; A121-Q174 WeakPolarHBondContact O-CA 3.33Å; A121-V175 HydrophobicContact CB-CG2 4.11Å; A121-V175 PolarHBondContact N-O 2.88Å; A121-V175 VanDerWaalsContact O-CG2 3.26Å; A121-V175 WeakPolarHBondContact O-CG2 3.48Å; A121-V175 PolarHBondContact O-N 3.11Å; A121-V221 HydrophobicContact CB-CG1 3.76Å; A121-A222 CarbonylContact C-O 3.59Å; A121-A222 WeakPolarHBondContact CA-O 3.38Å
122	T	88.4	Confident	83.6	Confident	25 Å²	25	47.1 Å²	47.1	15%	0.153	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	114.3	168.3	-56.5	0	0	0	0	108.4	V173 V221 A222	T122-V173 WeakPolarHBondContact CA-O 3.12Å; T122-V221 WeakPolarHBondContact O-CA 3.25Å; T122-A222 PolarHBondContact N-O 2.85Å; T122-A222 PolarHBondContact O-N 2.89Å
123	I	88.5	Confident	83.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	125	170.5	-58.6	169	0	0	0	106.8	L114 V116 I139 S172 V173 V175 F219 V221	L114-I123 HydrophobicContact CD1-CG2 4.1Å; V116-I123 HydrophobicContact CG2-CD1 4.1Å; V116-I123 HydrophobicContact CG2-CG1 4.17Å; I123-I139 HydrophobicContact CD1-CG2 4.45Å; I123-I139 HydrophobicContact CG2-CD1 4.08Å; I123-S172 CarbonylContact O-C 3.44Å; I123-S172 WeakPolarHBondContact O-CA 3.43Å; I123-S172 WeakPolarHBondContact O-CB 3.49Å; I123-V173 HydrophobicContact CB-CG1 4.05Å; I123-V173 PolarHBondContact N-O 3.42Å; I123-V173 PolarHBondContact O-N 3.03Å; I123-V175 HydrophobicContact CD1-CG1 4.12Å; I123-V175 HydrophobicContact CD1-CG2 3.87Å; I123-V175 HydrophobicContact CG1-CG2 4Å; I123-F219 HydrophobicContact CG2-CD1 4.18Å; I123-F219 HydrophobicContact CG2-CE1 4.48Å; I123-V221 HydrophobicContact CG1-CG2 4.45Å
124	S	91.6	Very high	83.4	Confident	36 Å²	36	47 Å²	47	25%	0.252	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	140.1	173.7	-52.3	0	0	0	0	110.1	G171 S172 F219 S220	S124-G171 WeakPolarHBondContact CA-O 3.45Å; S124-S172 WeakPolarHBondContact OG-CB 3.03Å; S124-F219 WeakPolarHBondContact O-CA 3.4Å; S124-S220 PolarHBondContact N-O 3.39Å; S124-S220 PolarHBondContact O-N 2.82Å
125	W	92.1	Very high	83.7	Confident	29 Å²	29	46.7 Å²	46.7	11%	0.11	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	152.7	-179.3	64.3	94.2	0	0	0	112.1	F137 I139 A157 E169 Y170 G171 S172 V173 N218 F219	W125-F137 HydrophobicContact CB-CZ 4.28Å; W125-F137 AromaticContact CD1-CE1 3.85Å; W125-F137 AromaticContact CD1-CZ 3.37Å; W125-F137 HydrophobicContact CD2-CE1 4.4Å; W125-F137 AromaticContact CD2-CZ 3.94Å; W125-F137 HydrophobicContact CD2-CZ 3.94Å; W125-F137 AromaticContact CE2-CE1 3.87Å; W125-F137 AromaticContact CE2-CZ 3.87Å; W125-F137 HydrophobicContact CG-CE1 4.38Å; W125-F137 HydrophobicContact CG-CE2 4.39Å; W125-F137 AromaticContact CG-CZ 3.63Å; W125-F137 HydrophobicContact CG-CZ 3.63Å; W125-F137 HydrophobicContact CZ2-CE1 4.39Å; W125-F137 AromaticContact NE1-CE1 3.5Å; W125-F137 AromaticContact NE1-CZ 3.52Å; W125-I139 HydrophobicContact CD2-CD1 3.85Å; W125-I139 HydrophobicContact CE3-CD1 3.29Å; W125-I139 HydrophobicContact CH2-CD1 4.28Å; W125-I139 HydrophobicContact CZ3-CD1 3.53Å; W125-A157 HydrophobicContact CH2-CB 4Å; W125-A157 HydrophobicContact CZ2-CB 4.47Å; W125-A157 HydrophobicContact CZ3-CB 4.46Å; W125-E169 PolarHBondContact NE1-OE1 2.83Å; W125-Y170 WeakPolarHBondContact O-CA 3.26Å; W125-Y170 WeakPolarHBondContact O-CB 3.46Å; W125-G171 VanDerWaalsContact CE3-O 3.3Å; W125-G171 PolarHBondContact N-O 3.05Å; W125-G171 PolarHBondContact O-N 3.43Å; W125-G171 VanDerWaalsContact O-N 3.15Å; W125-S172 VanDerWaalsContact CZ3-CA 3.48Å; W125-V173 HydrophobicContact CH2-CB 4.43Å; W125-V173 HydrophobicContact CZ3-CB 4.09Å; W125-V173 HydrophobicContact CZ3-CG1 3.92Å; W125-N218 WeakPolarHBondContact CA-O 3.33Å; W125-F219 HydrophobicContact CB-CD1 4.02Å; W125-F219 HydrophobicContact CB-CE1 3.37Å; W125-F219 HydrophobicContact CB-CE2 4.09Å; W125-F219 HydrophobicContact CB-CZ 3.35Å; W125-F219 HydrophobicContact CG-CE1 4.43Å; W125-F219 HydrophobicContact CG-CZ 4.39Å
126	Y	93.1	Very high	84.5	Confident	3 Å²	3	41 Å²	41	1%	0.012	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	128.8	165.1	175.9	-80.6	0	0	0	107.5	D92 V94 R95 P96 L99 K128 P168 E169 Y217 N218	D92-Y126 VanDerWaalsContact CG-OH 3.26Å; D92-Y126 WeakPolarHBondContact OD1-CE2 3.47Å; D92-Y126 PolarHBondContact OD1-OH 3.41Å; D92-Y126 PolarHBondContact OD2-OH 3.03Å; V94-Y126 HydrophobicContact CG2-CD2 4.41Å; V94-Y126 HydrophobicContact CG2-CE2 4.23Å; R95-Y126 HydrophobicContact CB-CE2 4.21Å; R95-Y126 PolarHBondContact NH1-OH 3.16Å; P96-Y126 VanDerWaalsContact CD-CG 3.49Å; P96-Y126 HydrophobicContact CG-CD2 4.38Å; P96-Y126 HydrophobicContact CG-CG 4.05Å; L99-Y126 HydrophobicContact CD1-CE1 4.34Å; L99-Y126 HydrophobicContact CD2-CD1 3.51Å; L99-Y126 HydrophobicContact CD2-CE1 3.67Å; Y126-K128 HydrophobicContact CE1-CB 3.91Å; Y126-P168 HydrophobicContact CD2-CB 4.06Å; Y126-P168 HydrophobicContact CD2-CG 4.27Å; Y126-P168 HydrophobicContact CE1-CB 4.18Å; Y126-P168 HydrophobicContact CE2-CB 3.48Å; Y126-P168 VanDerWaalsContact CE2-CB 3.48Å; Y126-P168 HydrophobicContact CE2-CG 3.47Å; Y126-P168 VanDerWaalsContact CE2-CG 3.47Å; Y126-E169 CarbonylContact C-O 3.5Å; Y126-E169 WeakPolarHBondContact CA-O 3.18Å; Y126-Y217 CarbonylContact O-C 3.37Å; Y126-Y217 WeakPolarHBondContact O-CA 3.49Å; Y126-Y217 WeakPolarHBondContact O-CB 3.48Å; Y126-N218 PolarHBondContact N-O 3.48Å; Y126-N218 PolarHBondContact O-N 2.79Å
127	V	91.7	Very high	85.3	Confident	1 Å²	1	40.3 Å²	40.3	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	120.2	-179.5	-175.7	0	0	0	0	109.2	F137 P168 E169 M201 L203 L215 E216 F219	V127-F137 HydrophobicContact CG2-CD2 4.03Å; V127-F137 HydrophobicContact CG2-CE2 3.82Å; V127-P168 CarbonylContact O-C 3.46Å; V127-P168 WeakPolarHBondContact O-CA 3.37Å; V127-E169 HydrophobicContact CB-CB 4.47Å; V127-E169 PolarHBondContact N-O 2.85Å; V127-E169 PolarHBondContact O-N 3.17Å; V127-M201 HydrophobicContact CG2-SD 3.87Å; V127-L203 HydrophobicContact CG1-CD2 4.25Å; V127-L215 HydrophobicContact CG1-CD2 3.71Å; V127-E216 WeakPolarHBondContact CA-O 3.21Å; V127-F219 HydrophobicContact CG2-CE2 4.4Å
128	K	91.9	Very high	86.5	Confident	41 Å²	41	34.4 Å²	34.4	18%	0.178	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	124.1	177.7	-163.4	174.3	-171.1	167.1	0	110.1	D92 Y126 T164 P168 L215 E216	D92-K128 IonicContact OD2-NZ 3.65Å; D92-K128 PolarHBondContact OD2-NZ 3.42Å; Y126-K128 HydrophobicContact CE1-CB 3.91Å; K128-T164 WeakPolarHBondContact CG-O 3.48Å; K128-P168 HydrophobicContact CB-CB 4Å; K128-P168 HydrophobicContact CD-CB 4.38Å; K128-P168 HydrophobicContact CG-CB 4.14Å; K128-L215 CarbonylContact O-C 3.6Å; K128-L215 VanDerWaalsContact O-CA 3.29Å; K128-L215 WeakPolarHBondContact O-CA 3.22Å; K128-E216 PolarHBondContact N-O 2.94Å; K128-E216 PolarHBondContact O-N 2.99Å
129	S	89.9	Confident	87.7	Confident	3 Å²	3	32.3 Å²	32.3	2%	0.021	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	128.1	172.2	-177.8	0	0	0	0	109.4	S131 N133 T164 C165	S129-S131 WeakPolarHBondContact CB-O 3.3Å; S129-S131 PolarHBondContact OG-N 3.34Å; S129-S131 VanDerWaalsContact OG-N 3.16Å; S129-S131 PolarHBondContact OG-O 3.02Å; S129-S131 PolarHBondContact OG-OG 2.83Å; S129-N133 PolarHBondContact OG-O 3.46Å; S129-T164 WeakPolarHBondContact CB-OG1 3.4Å; S129-T164 PolarHBondContact N-O 3.16Å; S129-T164 PolarHBondContact N-OG1 2.98Å; S129-C165 VanDerWaalsContact O-CA 3.31Å; S129-C165 WeakPolarHBondContact O-CA 3.46Å
130	L	89.7	Confident	88.7	Confident	103 Å²	103	29 Å²	29	54%	0.539	15%	0.149	S	C	.	.	S	Bend	trans	-80.8	-7.5	169.7	-61	-177.2	0	0	0	112.1	H214 E216	L130-H214 HydrophobicContact CB-CB 4.32Å; L130-H214 PolarHBondContact N-O 3.2Å; L130-E216 HydrophobicContact CD1-CG 3.86Å; L130-E216 HydrophobicContact CD2-CG 3.91Å; L130-E216 HydrophobicContact CG-CG 3.98Å
131	S	81	Confident	89	Confident	21 Å²	21	27.2 Å²	27.2	15%	0.147	14%	0.138	C	C	.	.	S	Bend	trans	-112.7	148.9	178.1	68.8	0	0	0	0	111	S129 N133 C165	S129-S131 WeakPolarHBondContact CB-O 3.3Å; S129-S131 PolarHBondContact OG-N 3.34Å; S129-S131 VanDerWaalsContact OG-N 3.16Å; S129-S131 PolarHBondContact OG-O 3.02Å; S129-S131 PolarHBondContact OG-OG 2.83Å; S131-N133 PolarHBondContact O-N 3.14Å; S131-C165 WeakPolarHBondContact O-CB 3.01Å
132	Q	83.3	Confident	89.1	Confident	161 Å²	161	27.3 Å²	27.3	75%	0.752	14%	0.138	S	C	*	.	S	Bend	trans	-75.8	52.7	176.3	-63.2	-178.9	33.7	0	0	111.9
133	N	82.3	Confident	88.6	Confident	40 Å²	40	29.1 Å²	29.1	21%	0.214	15%	0.15	C	C	.	.	S	Bend	trans	-138.9	151.1	-178.1	-71.6	-73	0	0	0	110.2	S129 S131 L163 K213	S129-N133 PolarHBondContact OG-O 3.46Å; S131-N133 PolarHBondContact O-N 3.14Å; N133-L163 VanDerWaalsContact N-CD1 3.31Å; N133-L163 WeakPolarHBondContact O-CD1 3.18Å; N133-K213 HydrophobicContact CB-CD 3.37Å; N133-K213 PolarHBondContact OD1-NZ 3.3Å
134	D	88.5	Confident	88	Confident	50 Å²	50	35.8 Å²	35.8	27%	0.267	19%	0.186	S	C	.	.			trans	-78.6	154.7	174.4	73.5	-45.1	0	0	0	112	R161 L162 K213	D134-R161 VanDerWaalsContact CG-NH2 3.27Å; D134-R161 IonicContact OD1-NH2 2.75Å; D134-R161 PolarHBondContact OD1-NH2 2.89Å; D134-R161 VanDerWaalsContact OD1-NH2 3.11Å; D134-R161 IonicContact OD2-CZ 3.91Å; D134-R161 IonicContact OD2-NE 3.11Å; D134-R161 PolarHBondContact OD2-NE 2.8Å; D134-R161 IonicContact OD2-NH2 2.98Å; D134-R161 PolarHBondContact OD2-NH2 3.43Å; D134-L162 VanDerWaalsContact CA-O 3.23Å; D134-L162 WeakPolarHBondContact CA-O 3.39Å; D134-K213 WeakPolarHBondContact O-CE 3.49Å
135	V	89.8	Confident	87.1	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	146.9	170.9	72.7	0	0	0	0	108.7	R161 L162 L203 L215	V135-R161 WeakPolarHBondContact O-CA 3.31Å; V135-L162 PolarHBondContact N-O 2.86Å; V135-L162 VanDerWaalsContact N-O 3.14Å; V135-L162 PolarHBondContact O-N 2.92Å; V135-L203 HydrophobicContact CG2-CB 4.49Å; V135-L215 HydrophobicContact CB-CD2 4.19Å; V135-L215 HydrophobicContact CG1-CD2 3.56Å; V135-L215 HydrophobicContact CG2-CD1 4.44Å; V135-L215 HydrophobicContact CG2-CD2 4.49Å
136	G	92	Very high	86.3	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	133.2	167.2	0	0	0	0	0	111.3	Y159 F160 L203 N204	G136-Y159 WeakPolarHBondContact CA-OH 3.33Å; G136-F160 CarbonylContact C-O 3.6Å; G136-F160 WeakPolarHBondContact CA-O 3.34Å; G136-L203 CarbonylContact O-C 3.2Å; G136-L203 WeakPolarHBondContact O-CA 2.93Å; G136-N204 PolarHBondContact N-O 2.85Å; G136-N204 PolarHBondContact O-N 3.19Å
137	F	91.7	Very high	85.6	Confident	5 Å²	5	39.8 Å²	39.8	2%	0.022	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	141.1	179.8	170.7	-97.1	0	0	0	110.2	W125 V127 I139 Y159 F160 E169 M201 R202 L203 F219	W125-F137 HydrophobicContact CB-CZ 4.28Å; W125-F137 AromaticContact CD1-CE1 3.85Å; W125-F137 AromaticContact CD1-CZ 3.37Å; W125-F137 HydrophobicContact CD2-CE1 4.4Å; W125-F137 AromaticContact CD2-CZ 3.94Å; W125-F137 HydrophobicContact CD2-CZ 3.94Å; W125-F137 AromaticContact CE2-CE1 3.87Å; W125-F137 AromaticContact CE2-CZ 3.87Å; W125-F137 HydrophobicContact CG-CE1 4.38Å; W125-F137 HydrophobicContact CG-CE2 4.39Å; W125-F137 AromaticContact CG-CZ 3.63Å; W125-F137 HydrophobicContact CG-CZ 3.63Å; W125-F137 HydrophobicContact CZ2-CE1 4.39Å; W125-F137 AromaticContact NE1-CE1 3.5Å; W125-F137 AromaticContact NE1-CZ 3.52Å; V127-F137 HydrophobicContact CG2-CD2 4.03Å; V127-F137 HydrophobicContact CG2-CE2 3.82Å; F137-I139 HydrophobicContact CZ-CD1 4.24Å; F137-I139 HydrophobicContact CZ-CG1 3.98Å; F137-Y159 CarbonylContact O-C 3.56Å; F137-Y159 WeakPolarHBondContact O-CA 3.4Å; F137-Y159 WeakPolarHBondContact O-CD2 3.41Å; F137-F160 PolarHBondContact N-O 3.2Å; F137-F160 PolarHBondContact O-N 2.88Å; F137-E169 HydrophobicContact CD1-CG 4.04Å; F137-E169 HydrophobicContact CE1-CG 4.21Å; F137-E169 HydrophobicContact CG-CG 4.47Å; F137-M201 HydrophobicContact CD2-CG 4.06Å; F137-M201 HydrophobicContact CD2-SD 3.93Å; F137-M201 HydrophobicContact CE2-CG 3.65Å; F137-M201 HydrophobicContact CE2-SD 3.6Å; F137-M201 VanDerWaalsContact CE2-SD 3.6Å; F137-R202 WeakPolarHBondContact CA-O 3.39Å; F137-L203 HydrophobicContact CD2-CD2 4.12Å; F137-F219 HydrophobicContact CE2-CZ 4.08Å
138	G	91.5	Very high	84.9	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.3	161.2	167.5	0	0	0	0	0	111.7	R202	G138-R202 PolarHBondContact N-O 3.05Å; G138-R202 PolarHBondContact O-N 2.74Å
139	I	91.1	Very high	84.4	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	128.9	177.6	-58.3	177.5	0	0	0	108.7	L114 I123 W125 F137 I156 A157 F200 F219	L114-I139 HydrophobicContact CD1-CG2 4.27Å; I123-I139 HydrophobicContact CD1-CG2 4.45Å; I123-I139 HydrophobicContact CG2-CD1 4.08Å; W125-I139 HydrophobicContact CD2-CD1 3.85Å; W125-I139 HydrophobicContact CE3-CD1 3.29Å; W125-I139 HydrophobicContact CH2-CD1 4.28Å; W125-I139 HydrophobicContact CZ3-CD1 3.53Å; F137-I139 HydrophobicContact CZ-CD1 4.24Å; F137-I139 HydrophobicContact CZ-CG1 3.98Å; I139-I156 HydrophobicContact CB-CB 4.46Å; I139-I156 HydrophobicContact CG2-CB 4.16Å; I139-I156 HydrophobicContact CG2-CD1 4.12Å; I139-I156 PolarHBondContact O-N 2.81Å; I139-A157 HydrophobicContact CB-CB 3.81Å; I139-A157 HydrophobicContact CD1-CB 4.01Å; I139-A157 HydrophobicContact CG1-CB 3.98Å; I139-A157 PolarHBondContact O-N 3.14Å; I139-F200 WeakPolarHBondContact CA-O 3.39Å; I139-F219 HydrophobicContact CD1-CE1 4.19Å
140	Y	90	Very high	84.1	Confident	18 Å²	18	52 Å²	52	7%	0.071	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	147.9	-173.5	-68	-100.9	0	0	0	110.8	I150 M153 E154 L155 D199 F200 R202	Y140-I150 HydrophobicContact CD1-CG1 4.08Å; Y140-I150 HydrophobicContact CE1-CG1 3.81Å; Y140-M153 HydrophobicContact CD1-CB 3.86Å; Y140-M153 HydrophobicContact CD1-SD 4.3Å; Y140-M153 HydrophobicContact CG-CB 4.46Å; Y140-M153 HydrophobicContact CG-SD 4.26Å; Y140-E154 CarbonylContact C-O 3.58Å; Y140-E154 VanDerWaalsContact CA-O 3.25Å; Y140-E154 WeakPolarHBondContact CA-O 3.16Å; Y140-L155 HydrophobicContact CD1-CD1 4.15Å; Y140-L155 HydrophobicContact CD2-CD1 4.3Å; Y140-L155 HydrophobicContact CE1-CD1 3.7Å; Y140-L155 HydrophobicContact CE2-CD1 3.8Å; Y140-L155 HydrophobicContact CG-CD1 4.45Å; Y140-L155 VanDerWaalsContact CZ-CD1 3.5Å; Y140-D199 CarbonylContact O-C 3.57Å; Y140-D199 WeakPolarHBondContact O-CA 3.13Å; Y140-F200 PolarHBondContact N-O 3.28Å; Y140-F200 PolarHBondContact O-N 2.77Å; Y140-R202 HydrophobicContact CD2-CB 3.71Å; Y140-R202 HydrophobicContact CE2-CB 3.66Å; Y140-R202 VanDerWaalsContact CE2-CD 3.49Å; Y140-R202 HydrophobicContact CE2-CG 4.24Å; Y140-R202 PolarHBondContact OH-NH1 2.82Å; Y140-R202 VanDerWaalsContact OH-NH1 3.13Å
141	Y	87.1	Confident	83.8	Confident	35 Å²	35	55.6 Å²	55.6	14%	0.137	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	129.2	168.2	168.8	-120.5	0	0	0	109.4	P143 M153 E154 L198	Y141-P143 HydrophobicContact CD1-CG 4.04Å; Y141-P143 HydrophobicContact CE1-CB 4.07Å; Y141-P143 HydrophobicContact CE1-CG 3.71Å; Y141-P143 WeakPolarHBondContact O-CD 3.48Å; Y141-M153 CarbonylContact O-C 3.47Å; Y141-M153 WeakPolarHBondContact O-CA 3.43Å; Y141-M153 WeakPolarHBondContact O-CB 3.45Å; Y141-E154 HydrophobicContact CD1-CB 4.28Å; Y141-E154 PolarHBondContact N-O 3.21Å; Y141-E154 PolarHBondContact O-N 2.82Å; Y141-L198 CarbonylContact C-O 3.55Å; Y141-L198 WeakPolarHBondContact CA-O 3.38Å; Y141-L198 HydrophobicContact CD2-CB 3.64Å; Y141-L198 WeakPolarHBondContact CD2-O 3.5Å; Y141-L198 HydrophobicContact CE2-CB 3.35Å; Y141-L198 HydrophobicContact CE2-CD1 3.62Å; Y141-L198 HydrophobicContact CE2-CG 4.12Å
142	S	86.7	Confident	84	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.014	31%	0.307	C	S	.	.			trans	-106.7	104.7	172.4	-173.8	0	0	0	0	109.3	N144 G145 N146 L198	S142-N144 PolarHBondContact O-N 2.76Å; S142-N144 VanDerWaalsContact O-N 3.09Å; S142-G145 PolarHBondContact O-N 2.68Å; S142-G145 VanDerWaalsContact O-N 3.08Å; S142-G145 PolarHBondContact OG-N 2.84Å; S142-N146 PolarHBondContact OG-N 3.01Å; S142-N146 PolarHBondContact OG-O 3.39Å; S142-L198 PolarHBondContact N-O 3.2Å; S142-L198 WeakPolarHBondContact O-CB 2.96Å; S142-L198 VanDerWaalsContact O-CD2 3.32Å; S142-L198 WeakPolarHBondContact O-CD2 3.35Å
143	P	77.3	Confident	84.2	Confident	63 Å²	63	52.1 Å²	52.1	41%	0.409	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-30.2	-180	-24.4	32	0	0	0	113.8	Y141	Y141-P143 HydrophobicContact CD1-CG 4.04Å; Y141-P143 HydrophobicContact CE1-CB 4.07Å; Y141-P143 HydrophobicContact CE1-CG 3.71Å; Y141-P143 WeakPolarHBondContact O-CD 3.48Å
144	N	75.8	Confident	84.5	Confident	140 Å²	140	54.2 Å²	54.2	75%	0.749	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.6	2.6	-175.6	-57.5	-27	0	0	0	112.7	S142 N146	S142-N144 PolarHBondContact O-N 2.76Å; S142-N144 VanDerWaalsContact O-N 3.09Å; N144-N146 PolarHBondContact O-N 3.32Å; N144-N146 VanDerWaalsContact O-N 3.09Å
145	G	72.7	Confident	84.5	Confident	30 Å²	30	55.8 Å²	55.8	31%	0.309	29%	0.292	S	S	.	.			trans	66.6	1.8	-171.8	0	0	0	0	0	114.6	S142 T147	S142-G145 PolarHBondContact O-N 2.68Å; S142-G145 VanDerWaalsContact O-N 3.08Å; S142-G145 PolarHBondContact OG-N 2.84Å; G145-T147 PolarHBondContact O-N 3.44Å
146	N	75.1	Confident	84.4	Confident	64 Å²	64	57.5 Å²	57.5	34%	0.342	30%	0.3	S	S	.	.			trans	-71	124.7	178.1	-173.9	-4.9	0	0	0	110.1	S142 N144 D148 M153	S142-N146 PolarHBondContact OG-N 3.01Å; S142-N146 PolarHBondContact OG-O 3.39Å; N144-N146 PolarHBondContact O-N 3.32Å; N144-N146 VanDerWaalsContact O-N 3.09Å; N146-D148 WeakPolarHBondContact OD1-CB 3.25Å; N146-D148 PolarHBondContact OD1-N 3.01Å; N146-M153 VanDerWaalsContact O-CE 3.27Å; N146-M153 WeakPolarHBondContact O-CE 3.43Å
147	T	77.9	Confident	84.1	Confident	58 Å²	58	57.7 Å²	57.7	36%	0.356	30%	0.302	S	S	.	.			trans	-101.8	-5.6	-179.1	52.3	0	0	0	0	114.7	L111 G145 M153 F200	L111-T147 HydrophobicContact CD1-CG2 4.09Å; G145-T147 PolarHBondContact O-N 3.44Å; T147-M153 VanDerWaalsContact CA-CE 3.43Å; T147-M153 HydrophobicContact CG2-CE 4.45Å; T147-F200 HydrophobicContact CG2-CD1 4.22Å; T147-F200 HydrophobicContact CG2-CE1 3.59Å; T147-F200 HydrophobicContact CG2-CE2 4.07Å; T147-F200 HydrophobicContact CG2-CZ 3.52Å
148	D	77.4	Confident	83.7	Confident	139 Å²	139	61.3 Å²	61.3	74%	0.743	33%	0.326	S	S	*	.	S	Bend	trans	-78.2	-27.3	-168.4	-64.4	-21.1	0	0	0	113.2	N146	N146-D148 WeakPolarHBondContact OD1-CB 3.25Å; N146-D148 PolarHBondContact OD1-N 3.01Å
149	K	81.8	Confident	83.4	Confident	125 Å²	125	64.5 Å²	64.5	54%	0.543	34%	0.338	S	S	.	.			trans	-128.3	108	-176.7	-67.8	-177.4	-179	-179	0	110.6	E151 D152	K149-E151 PolarHBondContact O-N 3.15Å; K149-D152 HydrophobicContact CB-CB 4.39Å; K149-D152 WeakPolarHBondContact CB-OD2 3.4Å; K149-D152 WeakPolarHBondContact CD-OD2 3.47Å; K149-D152 PolarHBondContact O-N 2.8Å
150	I	83.7	Confident	83.2	Confident	37 Å²	37	69.5 Å²	69.5	19%	0.19	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-62.7	-25.5	177.4	-128.1	84.5	0	0	0	112.6	L111 Y140 D152 M153 R202	L111-I150 HydrophobicContact CD1-CD1 4.4Å; L111-I150 HydrophobicContact CD2-CD1 3.98Å; Y140-I150 HydrophobicContact CD1-CG1 4.08Å; Y140-I150 HydrophobicContact CE1-CG1 3.81Å; I150-D152 PolarHBondContact O-N 2.81Å; I150-M153 HydrophobicContact CD1-CE 4.12Å; I150-M153 HydrophobicContact CD1-SD 3.74Å; I150-M153 HydrophobicContact CG1-SD 3.98Å; I150-M153 WeakPolarHBondContact O-CB 3.5Å; I150-M153 PolarHBondContact O-N 2.87Å; I150-M153 VanDerWaalsContact O-N 3.16Å; I150-R202 HydrophobicContact CD1-CG 4.48Å
151	E	84.3	Confident	83.1	Confident	179 Å²	179	73.1 Å²	73.1	84%	0.836	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-67.8	-24.6	-179.9	-63.8	171.6	-166.4	0	0	112.5	K149 M153	K149-E151 PolarHBondContact O-N 3.15Å; E151-M153 VanDerWaalsContact C-N 3.28Å
152	D	84.6	Confident	82.8	Confident	90 Å²	90	73.9 Å²	73.9	48%	0.481	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-87	-2.7	177.3	-60.9	-26.2	0	0	0	111.8	K149 I150	K149-D152 HydrophobicContact CB-CB 4.39Å; K149-D152 WeakPolarHBondContact CB-OD2 3.4Å; K149-D152 WeakPolarHBondContact CD-OD2 3.47Å; K149-D152 PolarHBondContact O-N 2.8Å; I150-D152 PolarHBondContact O-N 2.81Å
153	M	88	Confident	82.8	Confident	18 Å²	18	77.7 Å²	77.7	9%	0.089	40%	0.4	C	S	.	.	S	Bend	trans	-97.4	150.8	179.1	-58.7	178.9	-176.1	0	0	111.8	L111 Y140 Y141 N146 T147 I150 E151	L111-M153 HydrophobicContact CD1-CE 4.08Å; Y140-M153 HydrophobicContact CD1-CB 3.86Å; Y140-M153 HydrophobicContact CD1-SD 4.3Å; Y140-M153 HydrophobicContact CG-CB 4.46Å; Y140-M153 HydrophobicContact CG-SD 4.26Å; Y141-M153 CarbonylContact O-C 3.47Å; Y141-M153 WeakPolarHBondContact O-CA 3.43Å; Y141-M153 WeakPolarHBondContact O-CB 3.45Å; N146-M153 VanDerWaalsContact O-CE 3.27Å; N146-M153 WeakPolarHBondContact O-CE 3.43Å; T147-M153 VanDerWaalsContact CA-CE 3.43Å; T147-M153 HydrophobicContact CG2-CE 4.45Å; I150-M153 HydrophobicContact CD1-CE 4.12Å; I150-M153 HydrophobicContact CD1-SD 3.74Å; I150-M153 HydrophobicContact CG1-SD 3.98Å; I150-M153 WeakPolarHBondContact O-CB 3.5Å; I150-M153 PolarHBondContact O-N 2.87Å; I150-M153 VanDerWaalsContact O-N 3.16Å; E151-M153 VanDerWaalsContact C-N 3.28Å
154	E	88.3	Confident	83	Confident	84 Å²	84	75 Å²	75	39%	0.393	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	130.2	172.2	-179.5	175	-174.9	0	0	110.5	Y140 Y141 I156 K180	Y140-E154 CarbonylContact C-O 3.58Å; Y140-E154 VanDerWaalsContact CA-O 3.25Å; Y140-E154 WeakPolarHBondContact CA-O 3.16Å; Y141-E154 HydrophobicContact CD1-CB 4.28Å; Y141-E154 PolarHBondContact N-O 3.21Å; Y141-E154 PolarHBondContact O-N 2.82Å; E154-I156 PolarHBondContact O-N 3.5Å; E154-K180 IonicContact OE1-NZ 2.68Å; E154-K180 PolarHBondContact OE1-NZ 2.78Å; E154-K180 IonicContact OE2-NZ 2.72Å; E154-K180 PolarHBondContact OE2-NZ 2.93Å
155	L	88	Confident	83.3	Confident	83 Å²	83	69.6 Å²	69.6	44%	0.435	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	111.9	175.4	-173.8	69	0	0	0	109.9	Y140 A157	Y140-L155 HydrophobicContact CD1-CD1 4.15Å; Y140-L155 HydrophobicContact CD2-CD1 4.3Å; Y140-L155 HydrophobicContact CE1-CD1 3.7Å; Y140-L155 HydrophobicContact CE2-CD1 3.8Å; Y140-L155 HydrophobicContact CG-CD1 4.45Å; Y140-L155 VanDerWaalsContact CZ-CD1 3.5Å; L155-A157 WeakPolarHBondContact CD1-O 3.27Å; L155-A157 WeakPolarHBondContact CG-O 3.29Å
156	I	87.7	Confident	83.8	Confident	37 Å²	37	75 Å²	75	19%	0.19	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-47.6	179.3	-60.1	168.8	0	0	0	110.8	I139 E154 V173 V175 D199	I139-I156 HydrophobicContact CB-CB 4.46Å; I139-I156 HydrophobicContact CG2-CB 4.16Å; I139-I156 HydrophobicContact CG2-CD1 4.12Å; I139-I156 PolarHBondContact O-N 2.81Å; E154-I156 PolarHBondContact O-N 3.5Å; I156-V173 HydrophobicContact CG2-CB 4.45Å; I156-V173 HydrophobicContact CG2-CG1 3.74Å; I156-V173 HydrophobicContact CG2-CG2 3.88Å; I156-V175 HydrophobicContact CD1-CG1 4Å; I156-V175 HydrophobicContact CG1-CG1 4.47Å; I156-V175 HydrophobicContact CG2-CG1 3.6Å; I156-D199 WeakPolarHBondContact CD1-OD1 3.18Å
157	A	84.9	Confident	84.4	Confident	4 Å²	4	75.3 Å²	75.3	3%	0.033	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	136.1	177.3	0	0	0	0	0	109.3	W125 I139 L155	W125-A157 HydrophobicContact CH2-CB 4Å; W125-A157 HydrophobicContact CZ2-CB 4.47Å; W125-A157 HydrophobicContact CZ3-CB 4.46Å; I139-A157 HydrophobicContact CB-CB 3.81Å; I139-A157 HydrophobicContact CD1-CB 4.01Å; I139-A157 HydrophobicContact CG1-CB 3.98Å; I139-A157 PolarHBondContact O-N 3.14Å; L155-A157 WeakPolarHBondContact CD1-O 3.27Å; L155-A157 WeakPolarHBondContact CG-O 3.29Å
158	P	83.1	Confident	85	Confident	81 Å²	81	72.7 Å²	72.7	53%	0.526	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.2	143.7	-174.5	-22.7	30.7	0	0	0	112.9	F160	P158-F160 HydrophobicContact CB-CD2 4.35Å; P158-F160 HydrophobicContact CB-CE2 3.55Å; P158-F160 HydrophobicContact CB-CZ 3.71Å; P158-F160 HydrophobicContact CG-CE2 4.32Å; P158-F160 HydrophobicContact CG-CZ 4.49Å; P158-F160 WeakPolarHBondContact O-CD2 3.35Å
159	Y	87.1	Confident	85.6	Confident	67 Å²	67	68.2 Å²	68.2	26%	0.263	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	127.3	179.4	174.7	-93.1	0	0	0	111.2	G136 F137 R161 N204	G136-Y159 WeakPolarHBondContact CA-OH 3.33Å; F137-Y159 CarbonylContact O-C 3.56Å; F137-Y159 WeakPolarHBondContact O-CA 3.4Å; F137-Y159 WeakPolarHBondContact O-CD2 3.41Å; Y159-R161 HydrophobicContact CE1-CG 4.37Å; Y159-N204 HydrophobicContact CE2-CB 4.22Å; Y159-N204 PolarHBondContact OH-ND2 2.72Å
160	F	86.5	Confident	86	Confident	106 Å²	106	67.5 Å²	67.5	47%	0.465	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	150.7	176	-59.8	-74	0	0	0	111.4	G136 F137 P158 L162	G136-F160 CarbonylContact C-O 3.6Å; G136-F160 WeakPolarHBondContact CA-O 3.34Å; F137-F160 PolarHBondContact N-O 3.2Å; F137-F160 PolarHBondContact O-N 2.88Å; P158-F160 HydrophobicContact CB-CD2 4.35Å; P158-F160 HydrophobicContact CB-CE2 3.55Å; P158-F160 HydrophobicContact CB-CZ 3.71Å; P158-F160 HydrophobicContact CG-CE2 4.32Å; P158-F160 HydrophobicContact CG-CZ 4.49Å; P158-F160 WeakPolarHBondContact O-CD2 3.35Å; F160-L162 HydrophobicContact CB-CD1 4.02Å; F160-L162 HydrophobicContact CB-CD2 4.05Å; F160-L162 HydrophobicContact CB-CG 3.74Å
161	R	87.4	Confident	86.4	Confident	94 Å²	94	66.9 Å²	66.9	36%	0.355	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	114.9	161.7	-74.3	-168.9	71.5	171.1	-1.1	108.7	D134 V135 Y159 Y207	D134-R161 VanDerWaalsContact CG-NH2 3.27Å; D134-R161 IonicContact OD1-NH2 2.75Å; D134-R161 PolarHBondContact OD1-NH2 2.89Å; D134-R161 VanDerWaalsContact OD1-NH2 3.11Å; D134-R161 IonicContact OD2-CZ 3.91Å; D134-R161 IonicContact OD2-NE 3.11Å; D134-R161 PolarHBondContact OD2-NE 2.8Å; D134-R161 IonicContact OD2-NH2 2.98Å; D134-R161 PolarHBondContact OD2-NH2 3.43Å; V135-R161 WeakPolarHBondContact O-CA 3.31Å; Y159-R161 HydrophobicContact CE1-CG 4.37Å; R161-Y207 VanDerWaalsContact NH1-CB 3.26Å
162	L	81.4	Confident	86.7	Confident	50 Å²	50	62.1 Å²	62.1	26%	0.262	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	137.8	-171.3	-63.4	172.1	0	0	0	110.9	D134 V135 F160 T164 E169	D134-L162 VanDerWaalsContact CA-O 3.23Å; D134-L162 WeakPolarHBondContact CA-O 3.39Å; V135-L162 PolarHBondContact N-O 2.86Å; V135-L162 VanDerWaalsContact N-O 3.14Å; V135-L162 PolarHBondContact O-N 2.92Å; F160-L162 HydrophobicContact CB-CD1 4.02Å; F160-L162 HydrophobicContact CB-CD2 4.05Å; F160-L162 HydrophobicContact CB-CG 3.74Å; L162-T164 HydrophobicContact CB-CG2 3.6Å; L162-T164 HydrophobicContact CD1-CG2 4.5Å; L162-T164 PolarHBondContact O-N 2.67Å; L162-E169 HydrophobicContact CD1-CB 4Å; L162-E169 HydrophobicContact CD1-CG 3.79Å; L162-E169 WeakPolarHBondContact CD1-OE2 3.36Å
163	L	85.1	Confident	86.9	Confident	83 Å²	83	59.4 Å²	59.4	44%	0.435	30%	0.304	S	S	.	.			trans	-85.2	87.2	167	-177.2	65.8	0	0	0	108.9	N133 C165 F166	N133-L163 VanDerWaalsContact N-CD1 3.31Å; N133-L163 WeakPolarHBondContact O-CD1 3.18Å; L163-C165 VanDerWaalsContact C-N 3.3Å; L163-C165 PolarHBondContact O-N 3.16Å; L163-F166 HydrophobicContact CD2-CD2 4.13Å; L163-F166 HydrophobicContact CD2-CE2 3.81Å; L163-F166 HydrophobicContact CG-CD2 4.46Å; L163-F166 HydrophobicContact CG-CE2 4.48Å
164	T	82.1	Confident	86.9	Confident	6 Å²	6	65.1 Å²	65.1	4%	0.037	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	16.6	-171.6	60.1	0	0	0	0	114.1	K128 S129 L162 V167 E169	K128-T164 WeakPolarHBondContact CG-O 3.48Å; S129-T164 WeakPolarHBondContact CB-OG1 3.4Å; S129-T164 PolarHBondContact N-O 3.16Å; S129-T164 PolarHBondContact N-OG1 2.98Å; L162-T164 HydrophobicContact CB-CG2 3.6Å; L162-T164 HydrophobicContact CD1-CG2 4.5Å; L162-T164 PolarHBondContact O-N 2.67Å; T164-V167 CarbonylContact C-O 3.54Å; T164-V167 WeakPolarHBondContact CA-O 3.48Å; T164-V167 WeakPolarHBondContact CB-O 3.32Å; T164-E169 HydrophobicContact CG2-CB 3.68Å
165	C	82.7	Confident	86.6	Confident	27 Å²	27	61.7 Å²	61.7	18%	0.182	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-26.1	180	62.8	0	0	0	0	113.5	S129 S131 L163	S129-C165 VanDerWaalsContact O-CA 3.31Å; S129-C165 WeakPolarHBondContact O-CA 3.46Å; S131-C165 WeakPolarHBondContact O-CB 3.01Å; L163-C165 VanDerWaalsContact C-N 3.3Å; L163-C165 PolarHBondContact O-N 3.16Å
166	F	82.4	Confident	86.1	Confident	143 Å²	143	62.9 Å²	62.9	63%	0.627	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-44.9	177.7	-60.2	-68.3	0	0	0	111.8	L163	L163-F166 HydrophobicContact CD2-CD2 4.13Å; L163-F166 HydrophobicContact CD2-CE2 3.81Å; L163-F166 HydrophobicContact CG-CD2 4.46Å; L163-F166 HydrophobicContact CG-CE2 4.48Å
167	V	87.4	Confident	85.2	Confident	70 Å²	70	63.5 Å²	63.5	42%	0.424	32%	0.322	S	S	.	.	S	Bend	trans	-129.5	126	178.8	-177	0	0	0	0	107.2	F90 T164	F90-V167 HydrophobicContact CB-CG2 4.19Å; F90-V167 HydrophobicContact CD1-CG1 4.26Å; F90-V167 HydrophobicContact CD1-CG2 4.32Å; F90-V167 HydrophobicContact CD2-CG1 4.26Å; F90-V167 HydrophobicContact CE1-CG1 4.16Å; F90-V167 HydrophobicContact CE2-CG1 4.16Å; F90-V167 HydrophobicContact CG-CG1 4.31Å; F90-V167 HydrophobicContact CG-CG2 4.12Å; F90-V167 HydrophobicContact CZ-CG1 4.11Å; T164-V167 CarbonylContact C-O 3.54Å; T164-V167 WeakPolarHBondContact CA-O 3.48Å; T164-V167 WeakPolarHBondContact CB-O 3.32Å
168	P	90.5	Very high	83.4	Confident	4 Å²	4	71.3 Å²	71.3	3%	0.026	36%	0.355	C	S	.	.			trans	-64.6	150.5	175.2	30.3	-34.5	0	0	0	110.5	F90 Y126 V127 K128 Y170	F90-P168 VanDerWaalsContact CE1-CD 3.42Å; F90-P168 HydrophobicContact CE1-CG 4.01Å; F90-P168 HydrophobicContact CZ-CG 4.31Å; Y126-P168 HydrophobicContact CD2-CB 4.06Å; Y126-P168 HydrophobicContact CD2-CG 4.27Å; Y126-P168 HydrophobicContact CE1-CB 4.18Å; Y126-P168 HydrophobicContact CE2-CB 3.48Å; Y126-P168 VanDerWaalsContact CE2-CB 3.48Å; Y126-P168 HydrophobicContact CE2-CG 3.47Å; Y126-P168 VanDerWaalsContact CE2-CG 3.47Å; V127-P168 CarbonylContact O-C 3.46Å; V127-P168 WeakPolarHBondContact O-CA 3.37Å; K128-P168 HydrophobicContact CB-CB 4Å; K128-P168 HydrophobicContact CD-CB 4.38Å; K128-P168 HydrophobicContact CG-CB 4.14Å; P168-Y170 HydrophobicContact CG-CD1 4.27Å; P168-Y170 WeakPolarHBondContact O-CD1 3.44Å
169	E	90.4	Very high	81.3	Confident	45 Å²	45	71.2 Å²	71.2	21%	0.21	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	120.3	166.2	173.2	54.8	-154.1	0	0	108.3	W125 Y126 V127 F137 L162 T164	W125-E169 PolarHBondContact NE1-OE1 2.83Å; Y126-E169 CarbonylContact C-O 3.5Å; Y126-E169 WeakPolarHBondContact CA-O 3.18Å; V127-E169 HydrophobicContact CB-CB 4.47Å; V127-E169 PolarHBondContact N-O 2.85Å; V127-E169 PolarHBondContact O-N 3.17Å; F137-E169 HydrophobicContact CD1-CG 4.04Å; F137-E169 HydrophobicContact CE1-CG 4.21Å; F137-E169 HydrophobicContact CG-CG 4.47Å; L162-E169 HydrophobicContact CD1-CB 4Å; L162-E169 HydrophobicContact CD1-CG 3.79Å; L162-E169 WeakPolarHBondContact CD1-OE2 3.36Å; T164-E169 HydrophobicContact CG2-CB 3.68Å
170	Y	91.1	Very high	79.2	Confident	109 Å²	109	74.6 Å²	74.6	43%	0.427	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	150.7	178.6	68.4	-82.9	0	0	0	110.6	F90 V94 W125 P168	F90-Y170 HydrophobicContact CZ-CE1 4.29Å; V94-Y170 HydrophobicContact CB-CD2 4.28Å; V94-Y170 HydrophobicContact CB-CE2 4.29Å; V94-Y170 HydrophobicContact CG1-CD2 4.28Å; V94-Y170 HydrophobicContact CG1-CE2 3.84Å; V94-Y170 HydrophobicContact CG2-CD1 3.78Å; V94-Y170 HydrophobicContact CG2-CD2 4.14Å; V94-Y170 HydrophobicContact CG2-CE1 3.81Å; V94-Y170 HydrophobicContact CG2-CE2 4.16Å; V94-Y170 HydrophobicContact CG2-CG 3.95Å; W125-Y170 WeakPolarHBondContact O-CA 3.26Å; W125-Y170 WeakPolarHBondContact O-CB 3.46Å; P168-Y170 HydrophobicContact CG-CD1 4.27Å; P168-Y170 WeakPolarHBondContact O-CD1 3.44Å
171	G	90.9	Very high	76.4	Confident	25 Å²	25	75.9 Å²	75.9	26%	0.258	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	178.5	-178.6	-178.4	0	0	0	0	0	111.7	S124 W125	S124-G171 WeakPolarHBondContact CA-O 3.45Å; W125-G171 VanDerWaalsContact CE3-O 3.3Å; W125-G171 PolarHBondContact N-O 3.05Å; W125-G171 PolarHBondContact O-N 3.43Å; W125-G171 VanDerWaalsContact O-N 3.15Å
172	S	91.1	Very high	73.6	Confident	79 Å²	79	80.3 Å²	80.3	55%	0.552	43%	0.43	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.4	153	172.9	64.4	0	0	0	0	111.4	I123 S124 W125	I123-S172 CarbonylContact O-C 3.44Å; I123-S172 WeakPolarHBondContact O-CA 3.43Å; I123-S172 WeakPolarHBondContact O-CB 3.49Å; S124-S172 WeakPolarHBondContact OG-CB 3.03Å; W125-S172 VanDerWaalsContact CZ3-CA 3.48Å
173	V	89.1	Confident	71.1	Confident	32 Å²	32	83.7 Å²	83.7	19%	0.194	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	133.1	176.4	66.5	0	0	0	0	109.4	T122 I123 W125 I156	T122-V173 WeakPolarHBondContact CA-O 3.12Å; I123-V173 HydrophobicContact CB-CG1 4.05Å; I123-V173 PolarHBondContact N-O 3.42Å; I123-V173 PolarHBondContact O-N 3.03Å; W125-V173 HydrophobicContact CH2-CB 4.43Å; W125-V173 HydrophobicContact CZ3-CB 4.09Å; W125-V173 HydrophobicContact CZ3-CG1 3.92Å; I156-V173 HydrophobicContact CG2-CB 4.45Å; I156-V173 HydrophobicContact CG2-CG1 3.74Å; I156-V173 HydrophobicContact CG2-CG2 3.88Å
174	Q	87.3	Confident	68.4	Low	139 Å²	139	85.6 Å²	85.6	65%	0.65	47%	0.47	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	122.9	170	-71	-173.2	-14	0	0	108.8	A121	A121-Q174 WeakPolarHBondContact O-CA 3.33Å
175	V	83.3	Confident	65.9	Low	12 Å²	12	94.5 Å²	94.5	7%	0.073	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	121.5	172.8	-83.9	0	0	0	0	108.6	V116 A121 I123 I156	V116-V175 HydrophobicContact CG1-CG2 4.31Å; A121-V175 HydrophobicContact CB-CG2 4.11Å; A121-V175 PolarHBondContact N-O 2.88Å; A121-V175 VanDerWaalsContact O-CG2 3.26Å; A121-V175 WeakPolarHBondContact O-CG2 3.48Å; A121-V175 PolarHBondContact O-N 3.11Å; I123-V175 HydrophobicContact CD1-CG1 4.12Å; I123-V175 HydrophobicContact CD1-CG2 3.87Å; I123-V175 HydrophobicContact CG1-CG2 4Å; I156-V175 HydrophobicContact CD1-CG1 4Å; I156-V175 HydrophobicContact CG1-CG1 4.47Å; I156-V175 HydrophobicContact CG2-CG1 3.6Å
176	N	77.6	Confident	63.2	Low	107 Å²	107	102.7 Å²	102.7	57%	0.572	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	118.6	171.5	-175.1	-5.7	0	0	0	109.6	D119 L120 K178	D119-N176 CarbonylContact O-C 3.57Å; D119-N176 WeakPolarHBondContact O-CA 3.34Å; D119-N176 PolarHBondContact O-OD1 2.88Å; L120-N176 HydrophobicContact CD1-CB 4.09Å; N176-K178 PolarHBondContact OD1-N 2.98Å
177	R	67.4	Low	60.6	Low	51 Å²	51	106.8 Å²	106.8	19%	0.192	55%	0.552	C	S	.	*			trans	-103.5	-0.4	-178.3	-63.2	-155.3	160.2	143.7	15.7	115.1	D119 G179 D199	D119-R177 PolarHBondContact O-N 2.9Å; R177-G179 PolarHBondContact O-N 2.64Å; R177-D199 IonicContact CZ-OD1 2.74Å; R177-D199 IonicContact CZ-OD2 2.76Å; R177-D199 IonicContact NH1-OD1 2.71Å; R177-D199 IonicContact NH1-OD2 2.99Å; R177-D199 PolarHBondContact NH1-OD2 3.17Å; R177-D199 IonicContact NH2-OD1 3.3Å; R177-D199 PolarHBondContact NH2-OD1 2.65Å; R177-D199 IonicContact NH2-OD2 3.72Å; R177-D199 PolarHBondContact NH2-OD2 2.86Å
178	K	46.7	Very low	57.7	Low	168 Å²	168	111.7 Å²	111.7	73%	0.73	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	113.2	174.6	-79.4	-171.7	173.5	179.8	0	110.6	D119 N176	D119-K178 HydrophobicContact CB-CG 4.1Å; N176-K178 PolarHBondContact OD1-N 2.98Å
179	G	39.8	Very low	54.8	Low	79 Å²	79	120.6 Å²	120.6	81%	0.814	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	119.6	-1.2	166.8	0	0	0	0	0	117.6	R177	R177-G179 PolarHBondContact O-N 2.64Å
180	K	43.2	Very low	51.8	Low	138 Å²	138	128 Å²	128	60%	0.6	64%	0.639	S	S	*	*			trans	-96.6	11.2	-179.9	-85.9	-178.2	175.5	172.5	0	115.7	E154 E182	E154-K180 IonicContact OE1-NZ 2.68Å; E154-K180 PolarHBondContact OE1-NZ 2.78Å; E154-K180 IonicContact OE2-NZ 2.72Å; E154-K180 PolarHBondContact OE2-NZ 2.93Å; K180-E182 VanDerWaalsContact C-N 3.33Å; K180-E182 PolarHBondContact O-N 3.15Å; K180-E182 VanDerWaalsContact O-N 3.11Å
181	C	26.6	Very low	48.7	Very low	133 Å²	133	131.6 Å²	131.6	90%	0.899	67%	0.665	S	S	*	*			trans	-83.3	71.3	171	-96.1	0	0	0	0	111.8
182	E	28.4	Very low	45.9	Very low	186 Å²	186	133.7 Å²	133.7	87%	0.869	68%	0.675	S	S	*	*			trans	-138.8	72.6	154.4	-75	-164.4	173.1	0	0	109.4	K180	K180-E182 VanDerWaalsContact C-N 3.33Å; K180-E182 PolarHBondContact O-N 3.15Å; K180-E182 VanDerWaalsContact O-N 3.11Å
183	V	30.4	Very low	43.3	Very low	121 Å²	121	137 Å²	137	73%	0.733	69%	0.693	S	S	*	*			trans	-121.5	106.7	157.4	-159.9	0	0	0	0	107.2	F185	V183-F185 VanDerWaalsContact C-N 3.28Å; V183-F185 PolarHBondContact O-N 2.81Å
184	P	27.8	Very low	41	Very low	124 Å²	124	142.5 Å²	142.5	81%	0.805	72%	0.716	S	S	*	*			trans	-79.8	82.1	175.2	32.2	-29.8	0	0	0	107.9
185	F	30.6	Very low	39.4	Very low	192 Å²	192	142 Å²	142	84%	0.842	71%	0.712	S	S	*	*			trans	-126.4	105.2	164.8	-130.8	-95.5	0	0	0	112.2	V183	V183-F185 VanDerWaalsContact C-N 3.28Å; V183-F185 PolarHBondContact O-N 2.81Å
186	K	26.2	Very low	38.2	Very low	199 Å²	199	147.8 Å²	147.8	87%	0.865	74%	0.742	S	S	*	*			trans	-82.2	111	179.3	-164.1	-176.6	-167.3	-178.5	0	108.6
187	R	25.8	Very low	37.5	Very low	229 Å²	229	145.3 Å²	145.3	86%	0.864	73%	0.728	S	S	*	*			trans	173.4	96.4	148.1	-101.6	171.3	-177.5	-166.8	0.6	108.7
188	M	27.3	Very low	38.2	Very low	174 Å²	174	144.4 Å²	144.4	86%	0.857	73%	0.728	S	S	*	*				68.2	81.2	89.6	-170.6	167.5	-87.1	0	0	112.8
189	F	28.9	Very low	40.1	Very low	190 Å²	190	136.5 Å²	136.5	83%	0.833	69%	0.693	S	S	*	*			trans	-141.4	131.5	146.3	-82.2	-83.7	0	0	0	109.7
190	Y	28.4	Very low	42.3	Very low	202 Å²	202	133.5 Å²	133.5	79%	0.792	66%	0.658	S	S	*	*			trans	-11.8	142.1	177.8	-58.9	-93	0	0	0	121.5	S192	Y190-S192 PolarHBondContact O-N 3.09Å
191	L	25.9	Very low	44.4	Very low	184 Å²	184	126.9 Å²	126.9	96%	0.963	63%	0.629	S	S	*	*			trans	-27.7	102.2	153	-69.1	150.4	0	0	0	112.6
192	S	31.5	Very low	47.5	Very low	68 Å²	68	121.7 Å²	121.7	48%	0.476	59%	0.591	S	S	.	*			trans	-147.9	119.2	163.2	-179.9	0	0	0	0	106.7	Y190 E194	Y190-S192 PolarHBondContact O-N 3.09Å; S192-E194 PolarHBondContact O-N 3.08Å; S192-E194 WeakPolarHBondContact OG-CB 3.32Å; S192-E194 WeakPolarHBondContact OG-CG 3.43Å; S192-E194 PolarHBondContact OG-OE2 2.77Å
193	T	36.6	Very low	50.4	Low	150 Å²	150	112.9 Å²	112.9	92%	0.92	55%	0.549	S	S	*	.			trans	-70.9	61	167.3	40.1	0	0	0	0	109.3
194	E	42.2	Very low	53.3	Low	147 Å²	147	107.3 Å²	107.3	69%	0.687	52%	0.515	S	S	*	.			trans	-112.3	121	177	-85.2	171.7	159.9	0	0	108.2	S192 N196	S192-E194 PolarHBondContact O-N 3.08Å; S192-E194 WeakPolarHBondContact OG-CB 3.32Å; S192-E194 WeakPolarHBondContact OG-CG 3.43Å; S192-E194 PolarHBondContact OG-OE2 2.77Å; E194-N196 PolarHBondContact O-N 2.8Å; E194-N196 VanDerWaalsContact O-N 3.12Å
195	F	52.2	Low	56.4	Low	128 Å²	128	101.4 Å²	101.4	56%	0.561	48%	0.477	S	S	*	.			trans	-55.4	116.3	174.2	-66.5	-88.1	0	0	0	108.7	E117 I197	E117-F195 HydrophobicContact CB-CD1 4.13Å; E117-F195 HydrophobicContact CB-CE1 4Å; E117-F195 HydrophobicContact CG-CD1 3.56Å; E117-F195 HydrophobicContact CG-CE1 3.51Å; E117-F195 HydrophobicContact CG-CG 4.47Å; E117-F195 HydrophobicContact CG-CZ 4.4Å; E117-F195 WeakPolarHBondContact OE1-CE1 3.39Å; E117-F195 WeakPolarHBondContact OE1-CZ 3.18Å; F195-I197 PolarHBondContact O-N 2.74Å
196	N	58.4	Low	59.2	Low	133 Å²	133	97 Å²	97	71%	0.711	46%	0.458	S	S	*	.			trans	-68.5	101.3	177.4	-79.4	-32.5	0	0	0	108.5	E194 L198	E194-N196 PolarHBondContact O-N 2.8Å; E194-N196 VanDerWaalsContact O-N 3.12Å; N196-L198 HydrophobicContact CB-CD2 4.33Å; N196-L198 HydrophobicContact CB-CG 4.23Å; N196-L198 PolarHBondContact O-N 2.95Å
197	I	64.2	Low	62	Low	55 Å²	55	94.8 Å²	94.8	28%	0.282	45%	0.445	S	S	.	.			trans	-71.5	107.2	173.8	-53.2	178	0	0	0	108.1	P113 L114 E115 F195 F200	P113-I197 HydrophobicContact CB-CB 4.46Å; P113-I197 HydrophobicContact CB-CD1 4.13Å; P113-I197 HydrophobicContact CB-CG2 3.32Å; L114-I197 WeakPolarHBondContact O-CG2 3.23Å; E115-I197 HydrophobicContact CG-CD1 3.9Å; E115-I197 HydrophobicContact CG-CG1 3.79Å; F195-I197 PolarHBondContact O-N 2.74Å; I197-F200 HydrophobicContact CG2-CE1 4.48Å
198	L	81.8	Confident	64.8	Low	33 Å²	33	84.5 Å²	84.5	17%	0.173	41%	0.408	C	S	.	.			trans	-117.3	-11.5	-178.7	-58.2	179.3	0	0	0	112.7	Y141 S142 N196 F200	Y141-L198 CarbonylContact C-O 3.55Å; Y141-L198 WeakPolarHBondContact CA-O 3.38Å; Y141-L198 HydrophobicContact CD2-CB 3.64Å; Y141-L198 WeakPolarHBondContact CD2-O 3.5Å; Y141-L198 HydrophobicContact CE2-CB 3.35Å; Y141-L198 HydrophobicContact CE2-CD1 3.62Å; Y141-L198 HydrophobicContact CE2-CG 4.12Å; S142-L198 PolarHBondContact N-O 3.2Å; S142-L198 WeakPolarHBondContact O-CB 2.96Å; S142-L198 VanDerWaalsContact O-CD2 3.32Å; S142-L198 WeakPolarHBondContact O-CD2 3.35Å; N196-L198 HydrophobicContact CB-CD2 4.33Å; N196-L198 HydrophobicContact CB-CG 4.23Å; N196-L198 PolarHBondContact O-N 2.95Å; L198-F200 VanDerWaalsContact C-CE2 3.49Å; L198-F200 WeakPolarHBondContact O-CD2 3.27Å; L198-F200 VanDerWaalsContact O-CE2 3.27Å; L198-F200 WeakPolarHBondContact O-CE2 3.37Å
199	D	85.2	Confident	67.4	Low	1 Å²	1	83.4 Å²	83.4	1%	0.005	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	141.9	179.6	-70.1	-73.3	0	0	0	110.8	P113 L114 V116 Y140 I156 R177	P113-D199 CarbonylContact C-O 3.5Å; L114-D199 HydrophobicContact CB-CB 3.67Å; L114-D199 HydrophobicContact CD1-CB 4.23Å; L114-D199 HydrophobicContact CG-CB 4.48Å; L114-D199 PolarHBondContact N-O 3.31Å; V116-D199 HydrophobicContact CG2-CB 4.03Å; V116-D199 WeakPolarHBondContact CG2-OD2 3.38Å; Y140-D199 CarbonylContact O-C 3.57Å; Y140-D199 WeakPolarHBondContact O-CA 3.13Å; I156-D199 WeakPolarHBondContact CD1-OD1 3.18Å; R177-D199 IonicContact CZ-OD1 2.74Å; R177-D199 IonicContact CZ-OD2 2.76Å; R177-D199 IonicContact NH1-OD1 2.71Å; R177-D199 IonicContact NH1-OD2 2.99Å; R177-D199 PolarHBondContact NH1-OD2 3.17Å; R177-D199 IonicContact NH2-OD1 3.3Å; R177-D199 PolarHBondContact NH2-OD1 2.65Å; R177-D199 IonicContact NH2-OD2 3.72Å; R177-D199 PolarHBondContact NH2-OD2 2.86Å
200	F	86.3	Confident	69.9	Low	16 Å²	16	82.8 Å²	82.8	7%	0.07	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	129.5	-176.3	-58.1	-86.8	0	0	0	110.6	L111 I112 P113 I139 Y140 T147 I197 L198	L111-F200 HydrophobicContact CB-CB 4.39Å; L111-F200 HydrophobicContact CB-CD1 4.13Å; L111-F200 HydrophobicContact CD2-CB 4.3Å; I112-F200 CarbonylContact O-C 3.55Å; I112-F200 VanDerWaalsContact O-CA 3.32Å; I112-F200 WeakPolarHBondContact O-CA 3.46Å; P113-F200 HydrophobicContact CB-CD1 4.33Å; P113-F200 HydrophobicContact CB-CE1 4.17Å; I139-F200 WeakPolarHBondContact CA-O 3.39Å; Y140-F200 PolarHBondContact N-O 3.28Å; Y140-F200 PolarHBondContact O-N 2.77Å; T147-F200 HydrophobicContact CG2-CD1 4.22Å; T147-F200 HydrophobicContact CG2-CE1 3.59Å; T147-F200 HydrophobicContact CG2-CE2 4.07Å; T147-F200 HydrophobicContact CG2-CZ 3.52Å; I197-F200 HydrophobicContact CG2-CE1 4.48Å; L198-F200 VanDerWaalsContact C-CE2 3.49Å; L198-F200 WeakPolarHBondContact O-CD2 3.27Å; L198-F200 VanDerWaalsContact O-CE2 3.27Å; L198-F200 WeakPolarHBondContact O-CE2 3.37Å
201	M	87.5	Confident	72.7	Confident	0 Å²	0	77.2 Å²	77.2	0%	0	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	126.3	156.8	177.8	-167.2	40.3	0	0	108.4	L111 I112 V127 F137 L203 Y217 F219	L111-M201 CarbonylContact C-O 3.58Å; L111-M201 WeakPolarHBondContact CA-O 3.36Å; I112-M201 HydrophobicContact CB-CB 4.36Å; I112-M201 HydrophobicContact CB-CE 3.86Å; I112-M201 HydrophobicContact CD1-CE 3.18Å; I112-M201 HydrophobicContact CG1-CE 3.94Å; I112-M201 HydrophobicContact CG2-CE 4.36Å; I112-M201 PolarHBondContact N-O 3.09Å; I112-M201 PolarHBondContact O-N 3.34Å; V127-M201 HydrophobicContact CG2-SD 3.87Å; F137-M201 HydrophobicContact CD2-CG 4.06Å; F137-M201 HydrophobicContact CD2-SD 3.93Å; F137-M201 HydrophobicContact CE2-CG 3.65Å; F137-M201 HydrophobicContact CE2-SD 3.6Å; F137-M201 VanDerWaalsContact CE2-SD 3.6Å; M201-L203 HydrophobicContact CE-CD1 3.91Å; M201-L203 HydrophobicContact CE-CD2 4.44Å; M201-L203 HydrophobicContact CE-CG 4.01Å; M201-L203 HydrophobicContact CG-CG 4.46Å; M201-L203 HydrophobicContact SD-CD1 4.29Å; M201-L203 HydrophobicContact SD-CD2 3.74Å; M201-L203 HydrophobicContact SD-CG 3.89Å; M201-Y217 HydrophobicContact CE-CD2 3.9Å; M201-Y217 HydrophobicContact CE-CE2 4.16Å; M201-Y217 HydrophobicContact CE-CG 4.13Å; M201-F219 HydrophobicContact CB-CE1 3.86Å; M201-F219 HydrophobicContact CB-CE2 3.95Å; M201-F219 HydrophobicContact CB-CZ 3.5Å; M201-F219 VanDerWaalsContact CB-CZ 3.5Å; M201-F219 HydrophobicContact CE-CD2 3.93Å; M201-F219 HydrophobicContact CE-CE2 3.23Å; M201-F219 HydrophobicContact CE-CZ 3.86Å; M201-F219 HydrophobicContact CG-CE1 4.23Å; M201-F219 HydrophobicContact CG-CE2 3.91Å; M201-F219 HydrophobicContact CG-CZ 3.45Å; M201-F219 VanDerWaalsContact CG-CZ 3.45Å; M201-F219 HydrophobicContact SD-CD2 4.26Å; M201-F219 HydrophobicContact SD-CE1 4.36Å; M201-F219 HydrophobicContact SD-CE2 3.07Å; M201-F219 WeakPolarHBondContact SD-CE2 3.15Å; M201-F219 HydrophobicContact SD-CZ 3.13Å; M201-F219 WeakPolarHBondContact SD-CZ 3.44Å
202	R	91.4	Very high	75.8	Confident	24 Å²	24	70.4 Å²	70.4	9%	0.091	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	125.4	171.1	-174.7	-176.1	-177.7	-165	4.9	111.2	E109 L111 F137 G138 Y140 I150 N204	E109-R202 IonicContact OE2-CZ 2.67Å; E109-R202 IonicContact OE2-NE 3.21Å; E109-R202 PolarHBondContact OE2-NE 3.4Å; E109-R202 IonicContact OE2-NH2 3.8Å; E109-R202 PolarHBondContact OE2-NH2 2.88Å; L111-R202 HydrophobicContact CD2-CB 3.69Å; L111-R202 HydrophobicContact CD2-CG 3.76Å; F137-R202 WeakPolarHBondContact CA-O 3.39Å; G138-R202 PolarHBondContact N-O 3.05Å; G138-R202 PolarHBondContact O-N 2.74Å; Y140-R202 HydrophobicContact CD2-CB 3.71Å; Y140-R202 HydrophobicContact CE2-CB 3.66Å; Y140-R202 VanDerWaalsContact CE2-CD 3.49Å; Y140-R202 HydrophobicContact CE2-CG 4.24Å; Y140-R202 PolarHBondContact OH-NH1 2.82Å; Y140-R202 VanDerWaalsContact OH-NH1 3.13Å; I150-R202 HydrophobicContact CD1-CG 4.48Å; R202-N204 PolarHBondContact NH2-ND2 2.86Å
203	L	90.9	Very high	78.5	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	115.9	166.1	-62.3	175.3	0	0	0	109.4	V102 V104 E109 I110 I112 V127 V135 G136 F137 M201	V102-L203 HydrophobicContact CG1-CD1 3.78Å; V104-L203 HydrophobicContact CG2-CB 3.74Å; V104-L203 HydrophobicContact CG2-CD1 4.14Å; E109-L203 CarbonylContact C-O 3.57Å; E109-L203 WeakPolarHBondContact CA-O 3.32Å; E109-L203 WeakPolarHBondContact CB-O 3.37Å; I110-L203 PolarHBondContact N-O 2.61Å; I110-L203 PolarHBondContact O-N 2.82Å; I112-L203 HydrophobicContact CD1-CD1 4.19Å; V127-L203 HydrophobicContact CG1-CD2 4.25Å; V135-L203 HydrophobicContact CG2-CB 4.49Å; G136-L203 CarbonylContact O-C 3.2Å; G136-L203 WeakPolarHBondContact O-CA 2.93Å; F137-L203 HydrophobicContact CD2-CD2 4.12Å; M201-L203 HydrophobicContact CE-CD1 3.91Å; M201-L203 HydrophobicContact CE-CD2 4.44Å; M201-L203 HydrophobicContact CE-CG 4.01Å; M201-L203 HydrophobicContact CG-CG 4.46Å; M201-L203 HydrophobicContact SD-CD1 4.29Å; M201-L203 HydrophobicContact SD-CD2 3.74Å; M201-L203 HydrophobicContact SD-CG 3.89Å
204	N	91.2	Very high	81.2	Confident	4 Å²	4	64.3 Å²	64.3	2%	0.021	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	120.6	-170.7	-177.6	1.4	0	0	0	111.7	E109 G136 Y159 R202 K206	E109-N204 HydrophobicContact CB-CB 4.38Å; G136-N204 PolarHBondContact N-O 2.85Å; G136-N204 PolarHBondContact O-N 3.19Å; Y159-N204 HydrophobicContact CE2-CB 4.22Å; Y159-N204 PolarHBondContact OH-ND2 2.72Å; R202-N204 PolarHBondContact NH2-ND2 2.86Å; N204-K206 VanDerWaalsContact OD1-CB 3.25Å; N204-K206 WeakPolarHBondContact OD1-CB 3.07Å; N204-K206 WeakPolarHBondContact OD1-CG 3.48Å; N204-K206 PolarHBondContact OD1-N 2.89Å
205	N	91.7	Very high	83.6	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	27%	0.265	C	S	.	.			trans	-124.9	22.7	174.5	-167.6	36.4	0	0	0	112.4	V104 N105 R106 Q107 S108 Y207 S208 L211 K213	V104-N205 HydrophobicContact CB-CB 4.11Å; V104-N205 HydrophobicContact CG1-CB 3.5Å; V104-N205 VanDerWaalsContact CG1-CB 3.5Å; V104-N205 PolarHBondContact O-ND2 2.87Å; N105-N205 WeakPolarHBondContact O-CB 3.09Å; N105-N205 PolarHBondContact O-ND2 3.45Å; R106-N205 WeakPolarHBondContact CA-ND2 3.36Å; Q107-N205 PolarHBondContact N-O 2.81Å; Q107-N205 VanDerWaalsContact N-O 3.14Å; S108-N205 CarbonylContact O-C 3.5Å; S108-N205 VanDerWaalsContact O-CA 3.3Å; S108-N205 WeakPolarHBondContact O-CA 3.38Å; S108-N205 PolarHBondContact O-N 2.84Å; N205-Y207 PolarHBondContact O-N 3.39Å; N205-Y207 VanDerWaalsContact O-N 3.13Å; N205-S208 PolarHBondContact O-N 2.74Å; N205-S208 VanDerWaalsContact O-N 3.16Å; N205-S208 WeakPolarHBondContact OD1-CB 3.49Å; N205-L211 PolarHBondContact ND2-O 3.22Å; N205-K213 HydrophobicContact CB-CG 4.21Å; N205-K213 VanDerWaalsContact CG-CG 3.49Å; N205-K213 WeakPolarHBondContact OD1-CE 3.48Å; N205-K213 WeakPolarHBondContact OD1-CG 3.29Å
206	K	90.1	Very high	85.6	Confident	99 Å²	99	53.3 Å²	53.3	43%	0.43	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-28.4	-175.9	-78.2	179.4	160.6	175.6	0	113.9	Q107 S108 E109 N204	Q107-K206 WeakPolarHBondContact CA-O 3.3Å; S108-K206 PolarHBondContact O-N 3.08Å; S108-K206 VanDerWaalsContact O-N 3.16Å; E109-K206 VanDerWaalsContact CD-CE 3.46Å; E109-K206 WeakPolarHBondContact OE1-CE 3.4Å; E109-K206 IonicContact OE1-NZ 2.82Å; E109-K206 PolarHBondContact OE1-NZ 2.82Å; E109-K206 IonicContact OE2-NZ 2.61Å; N204-K206 VanDerWaalsContact OD1-CB 3.25Å; N204-K206 WeakPolarHBondContact OD1-CB 3.07Å; N204-K206 WeakPolarHBondContact OD1-CG 3.48Å; N204-K206 PolarHBondContact OD1-N 2.89Å
207	Y	85.1	Confident	87.2	Confident	152 Å²	152	48.6 Å²	48.6	60%	0.596	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-7	-176.8	-58.3	-75	0	0	0	114.5	R161 N205	R161-Y207 VanDerWaalsContact NH1-CB 3.26Å; N205-Y207 PolarHBondContact O-N 3.39Å; N205-Y207 VanDerWaalsContact O-N 3.13Å
208	S	84.1	Confident	88.6	Confident	14 Å²	14	47.7 Å²	47.7	10%	0.098	22%	0.216	C	C	.	.			trans	-85.3	116.7	178.3	-177.2	0	0	0	0	109.9	R106 Q107 N205 L211 K213	R106-S208 WeakPolarHBondContact CB-O 3.42Å; Q107-S208 WeakPolarHBondContact CG-O 3.43Å; Q107-S208 PolarHBondContact N-O 2.86Å; N205-S208 PolarHBondContact O-N 2.74Å; N205-S208 VanDerWaalsContact O-N 3.16Å; N205-S208 WeakPolarHBondContact OD1-CB 3.49Å; S208-L211 WeakPolarHBondContact CB-O 3.43Å; S208-L211 PolarHBondContact OG-N 2.97Å; S208-L211 PolarHBondContact OG-O 3.18Å; S208-K213 PolarHBondContact OG-NZ 3.04Å
209	Y	81.9	Confident	88.9	Confident	150 Å²	150	47.8 Å²	47.8	59%	0.588	22%	0.215	S	C	*	.	S	Bend	trans	-81.2	-28.2	177.3	-68.7	-82.4	0	0	0	113.3	R106	R106-Y209 WeakPolarHBondContact CD-O 3.39Å; R106-Y209 PolarHBondContact NH1-O 3.31Å; R106-Y209 VanDerWaalsContact NH1-O 3.11Å
210	F	80.4	Confident	88.9	Confident	178 Å²	178	50.4 Å²	50.4	78%	0.781	23%	0.233	S	C	*	.	S	Bend	trans	-112.4	-30.7	-164.5	-57.5	-69.6	0	0	0	113.9
211	L	87.4	Confident	88.8	Confident	85 Å²	85	52.1 Å²	52.1	45%	0.445	25%	0.245	S	C	.	.			trans	-130.5	132.7	-165.3	-60.6	174.6	0	0	0	112.3	N205 S208	N205-L211 PolarHBondContact ND2-O 3.22Å; S208-L211 WeakPolarHBondContact CB-O 3.43Å; S208-L211 PolarHBondContact OG-N 2.97Å; S208-L211 PolarHBondContact OG-O 3.18Å
212	S	90.9	Very high	88.7	Confident	41 Å²	41	54.4 Å²	54.4	29%	0.287	26%	0.264	S	S	.	.			trans	-66.9	158.9	157.5	50.3	0	0	0	0	110.3	V104 H214	V104-S212 CarbonylContact O-C 3.55Å; V104-S212 WeakPolarHBondContact O-CA 3.14Å; S212-H214 PolarHBondContact OG-NE2 2.93Å
213	K	89.8	Confident	87.8	Confident	6 Å²	6	56.1 Å²	56.1	3%	0.026	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	126.3	176	-49.1	-62.1	173.9	-161.1	0	108.4	T103 V104 N133 D134 N205 S208 L215	T103-K213 CarbonylContact C-O 3.53Å; T103-K213 WeakPolarHBondContact CA-O 3.21Å; V104-K213 PolarHBondContact N-O 2.75Å; V104-K213 PolarHBondContact O-N 3.24Å; N133-K213 HydrophobicContact CB-CD 3.37Å; N133-K213 PolarHBondContact OD1-NZ 3.3Å; D134-K213 WeakPolarHBondContact O-CE 3.49Å; N205-K213 HydrophobicContact CB-CG 4.21Å; N205-K213 VanDerWaalsContact CG-CG 3.49Å; N205-K213 WeakPolarHBondContact OD1-CE 3.48Å; N205-K213 WeakPolarHBondContact OD1-CG 3.29Å; S208-K213 PolarHBondContact OG-NZ 3.04Å; K213-L215 HydrophobicContact CB-CD1 3.95Å
214	H	92.4	Very high	86.6	Confident	83 Å²	83	59.5 Å²	59.5	38%	0.384	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	127.2	176.2	-58.4	-76	0	0	0	108.3	T103 L130 S212	T103-H214 VanDerWaalsContact CG2-CE1 3.42Å; T103-H214 WeakPolarHBondContact CG2-CE1 3.06Å; T103-H214 WeakPolarHBondContact CG2-ND1 3.43Å; T103-H214 PolarHBondContact OG1-CE1 2.81Å; T103-H214 PolarHBondContact OG1-ND1 2.84Å; L130-H214 HydrophobicContact CB-CB 4.32Å; L130-H214 PolarHBondContact N-O 3.2Å; S212-H214 PolarHBondContact OG-NE2 2.93Å
215	L	92.5	Very high	84.9	Confident	1 Å²	1	63 Å²	63	1%	0.005	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	152.8	-175.5	-55.5	106.2	0	0	0	110.9	A101 V102 V104 V127 K128 V135 K213	A101-L215 CarbonylContact C-O 3.52Å; A101-L215 WeakPolarHBondContact CA-O 3.48Å; V102-L215 HydrophobicContact CG1-CB 3.96Å; V102-L215 HydrophobicContact CG1-CD1 4.34Å; V102-L215 PolarHBondContact N-O 2.71Å; V102-L215 PolarHBondContact O-N 2.89Å; V104-L215 HydrophobicContact CG2-CD1 3.77Å; V127-L215 HydrophobicContact CG1-CD2 3.71Å; K128-L215 CarbonylContact O-C 3.6Å; K128-L215 VanDerWaalsContact O-CA 3.29Å; K128-L215 WeakPolarHBondContact O-CA 3.22Å; V135-L215 HydrophobicContact CB-CD2 4.19Å; V135-L215 HydrophobicContact CG1-CD2 3.56Å; V135-L215 HydrophobicContact CG2-CD1 4.44Å; V135-L215 HydrophobicContact CG2-CD2 4.49Å; K213-L215 HydrophobicContact CB-CD1 3.95Å
216	E	93.9	Very high	82.8	Confident	44 Å²	44	67.6 Å²	67.6	21%	0.206	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	140.5	160.4	-68.9	179.2	154.2	0	0	108.6	R95 L99 T100 V127 K128 L130	R95-E216 IonicContact CZ-OE2 2.64Å; R95-E216 VanDerWaalsContact CZ-OE2 3.3Å; R95-E216 IonicContact NH1-OE2 2.78Å; R95-E216 PolarHBondContact NH1-OE2 3.21Å; R95-E216 IonicContact NH2-OE1 3.13Å; R95-E216 IonicContact NH2-OE2 3.99Å; R95-E216 PolarHBondContact NH2-OE2 3.13Å; L99-E216 HydrophobicContact CB-CB 4.3Å; L99-E216 HydrophobicContact CD1-CB 4.36Å; L99-E216 HydrophobicContact CD2-CB 4.37Å; T100-E216 CarbonylContact O-C 3.58Å; T100-E216 WeakPolarHBondContact O-CA 3.21Å; V127-E216 WeakPolarHBondContact CA-O 3.21Å; K128-E216 PolarHBondContact N-O 2.94Å; K128-E216 PolarHBondContact O-N 2.99Å; L130-E216 HydrophobicContact CD1-CG 3.86Å; L130-E216 HydrophobicContact CD2-CG 3.91Å; L130-E216 HydrophobicContact CG-CG 3.98Å
217	Y	92.8	Very high	80.2	Confident	34 Å²	34	68.6 Å²	68.6	13%	0.133	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	160.5	177.5	77.2	-86.8	0	0	0	112.5	L99 T100 V102 I112 Y126 M201 F219	L99-Y217 WeakPolarHBondContact CA-O 3.36Å; T100-Y217 HydrophobicContact CG2-CE1 3.65Å; T100-Y217 PolarHBondContact N-O 3.17Å; T100-Y217 WeakPolarHBondContact O-CD1 3.34Å; T100-Y217 PolarHBondContact O-N 3.23Å; V102-Y217 HydrophobicContact CB-CD1 4.14Å; V102-Y217 HydrophobicContact CB-CE1 3.92Å; V102-Y217 HydrophobicContact CG1-CD1 3.67Å; V102-Y217 HydrophobicContact CG1-CE1 3.95Å; I112-Y217 HydrophobicContact CD1-CD1 4.2Å; I112-Y217 HydrophobicContact CD1-CD2 4.5Å; I112-Y217 HydrophobicContact CD1-CE1 3.58Å; I112-Y217 HydrophobicContact CD1-CE2 3.91Å; I112-Y217 HydrophobicContact CG2-CE2 4.19Å; Y126-Y217 CarbonylContact O-C 3.37Å; Y126-Y217 WeakPolarHBondContact O-CA 3.49Å; Y126-Y217 WeakPolarHBondContact O-CB 3.48Å; M201-Y217 HydrophobicContact CE-CD2 3.9Å; M201-Y217 HydrophobicContact CE-CE2 4.16Å; M201-Y217 HydrophobicContact CE-CG 4.13Å; Y217-F219 AromaticContact CD2-CD2 3.53Å; Y217-F219 HydrophobicContact CD2-CD2 3.53Å; Y217-F219 AromaticContact CD2-CE2 3.81Å; Y217-F219 HydrophobicContact CD2-CE2 3.81Å; Y217-F219 AromaticContact CE2-CD2 3.91Å; Y217-F219 HydrophobicContact CE2-CD2 3.91Å; Y217-F219 HydrophobicContact CE2-CE2 4.47Å
218	N	93.3	Very high	78.1	Confident	35 Å²	35	66.1 Å²	66.1	19%	0.187	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	139.2	167.2	179.3	-85.1	0	0	0	108.6	P96 K98 L99 W125 Y126	P96-N218 HydrophobicContact CB-CB 3.96Å; P96-N218 HydrophobicContact CG-CB 3.76Å; K98-N218 PolarHBondContact O-ND2 3.12Å; L99-N218 HydrophobicContact CD2-CB 4Å; W125-N218 WeakPolarHBondContact CA-O 3.33Å; Y126-N218 PolarHBondContact N-O 3.48Å; Y126-N218 PolarHBondContact O-N 2.79Å
219	F	88.4	Confident	75.7	Confident	36 Å²	36	74.8 Å²	74.8	16%	0.158	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	140.5	165.8	-82.1	-95.6	0	0	0	109	L114 I123 S124 W125 V127 F137 I139 M201 Y217	L114-F219 HydrophobicContact CD1-CD1 3.98Å; L114-F219 HydrophobicContact CD1-CE1 4.17Å; L114-F219 HydrophobicContact CD2-CB 3.6Å; L114-F219 HydrophobicContact CD2-CD1 3.35Å; L114-F219 HydrophobicContact CD2-CD2 4.38Å; L114-F219 HydrophobicContact CD2-CE1 4.19Å; L114-F219 HydrophobicContact CD2-CG 3.47Å; L114-F219 VanDerWaalsContact CD2-CG 3.47Å; L114-F219 HydrophobicContact CG-CD1 4.3Å; I123-F219 HydrophobicContact CG2-CD1 4.18Å; I123-F219 HydrophobicContact CG2-CE1 4.48Å; S124-F219 WeakPolarHBondContact O-CA 3.4Å; W125-F219 HydrophobicContact CB-CD1 4.02Å; W125-F219 HydrophobicContact CB-CE1 3.37Å; W125-F219 HydrophobicContact CB-CE2 4.09Å; W125-F219 HydrophobicContact CB-CZ 3.35Å; W125-F219 HydrophobicContact CG-CE1 4.43Å; W125-F219 HydrophobicContact CG-CZ 4.39Å; V127-F219 HydrophobicContact CG2-CE2 4.4Å; F137-F219 HydrophobicContact CE2-CZ 4.08Å; I139-F219 HydrophobicContact CD1-CE1 4.19Å; M201-F219 HydrophobicContact CB-CE1 3.86Å; M201-F219 HydrophobicContact CB-CE2 3.95Å; M201-F219 HydrophobicContact CB-CZ 3.5Å; M201-F219 VanDerWaalsContact CB-CZ 3.5Å; M201-F219 HydrophobicContact CE-CD2 3.93Å; M201-F219 HydrophobicContact CE-CE2 3.23Å; M201-F219 HydrophobicContact CE-CZ 3.86Å; M201-F219 HydrophobicContact CG-CE1 4.23Å; M201-F219 HydrophobicContact CG-CE2 3.91Å; M201-F219 HydrophobicContact CG-CZ 3.45Å; M201-F219 VanDerWaalsContact CG-CZ 3.45Å; M201-F219 HydrophobicContact SD-CD2 4.26Å; M201-F219 HydrophobicContact SD-CE1 4.36Å; M201-F219 HydrophobicContact SD-CE2 3.07Å; M201-F219 WeakPolarHBondContact SD-CE2 3.15Å; M201-F219 HydrophobicContact SD-CZ 3.13Å; M201-F219 WeakPolarHBondContact SD-CZ 3.44Å; Y217-F219 AromaticContact CD2-CD2 3.53Å; Y217-F219 HydrophobicContact CD2-CD2 3.53Å; Y217-F219 AromaticContact CD2-CE2 3.81Å; Y217-F219 HydrophobicContact CD2-CE2 3.81Å; Y217-F219 AromaticContact CE2-CD2 3.91Å; Y217-F219 HydrophobicContact CE2-CD2 3.91Å; Y217-F219 HydrophobicContact CE2-CE2 4.47Å
220	S	85.7	Confident	73.3	Confident	55 Å²	55	78.8 Å²	78.8	39%	0.385	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	143.7	168.6	53.9	0	0	0	0	109.6	S124	S124-S220 PolarHBondContact N-O 3.39Å; S124-S220 PolarHBondContact O-N 2.82Å
221	V	84.4	Confident	70.9	Confident	52 Å²	52	73.7 Å²	73.7	32%	0.315	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	121.4	173.2	-177.7	0	0	0	0	106.4	V116 A121 T122 I123	V116-V221 HydrophobicContact CG1-CG1 4.37Å; V116-V221 HydrophobicContact CG2-CG1 4.15Å; V116-V221 HydrophobicContact CG2-CG2 4.11Å; A121-V221 HydrophobicContact CB-CG1 3.76Å; T122-V221 WeakPolarHBondContact O-CA 3.25Å; I123-V221 HydrophobicContact CG1-CG2 4.45Å
222	A	83.6	Confident	68.1	Low	48 Å²	48	79.4 Å²	79.4	40%	0.397	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	129.6	176.6	0	0	0	0	0	109.8	A121 T122	A121-A222 CarbonylContact C-O 3.59Å; A121-A222 WeakPolarHBondContact CA-O 3.38Å; T122-A222 PolarHBondContact N-O 2.85Å; T122-A222 PolarHBondContact O-N 2.89Å
223	V	74.4	Confident	65	Low	60 Å²	60	82 Å²	82	36%	0.364	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	132.9	171.9	-176.7	0	0	0	0	108.4	T118 G225 T226	T118-V223 HydrophobicContact CG2-CB 4.44Å; T118-V223 HydrophobicContact CG2-CG1 3.87Å; T118-V223 HydrophobicContact CG2-CG2 3.67Å; V223-G225 PolarHBondContact O-N 3.16Å; V223-T226 PolarHBondContact O-N 2.74Å; V223-T226 PolarHBondContact O-OG1 3.26Å
224	V	64.6	Low	62.3	Low	72 Å²	72	94.7 Å²	94.7	44%	0.436	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	104.9	177.4	177.2	0	0	0	0	108.9	L120	L120-V224 HydrophobicContact CD2-CB 3.72Å; L120-V224 HydrophobicContact CD2-CG1 3.9Å; L120-V224 HydrophobicContact CD2-CG2 4.01Å; L120-V224 HydrophobicContact CG-CB 3.98Å; L120-V224 HydrophobicContact CG-CG2 3.81Å; L120-V224 PolarHBondContact O-N 3.4Å
225	G	56	Low	60.8	Low	77 Å²	77	95.3 Å²	95.3	79%	0.794	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	135.6	-12.1	178.1	0	0	0	0	0	115.6	V223	V223-G225 PolarHBondContact O-N 3.16Å
226	T	47.4	Very low	59.1	Low	98 Å²	98	100.2 Å²	100.2	60%	0.601	58%	0.579	S	S	*	*	S	Bend	trans	-87.5	127.7	170.6	37	0	0	0	0	110.4	V223 S228	V223-T226 PolarHBondContact O-N 2.74Å; V223-T226 PolarHBondContact O-OG1 3.26Å; T226-S228 PolarHBondContact O-N 2.88Å
227	P	36	Very low	57.2	Low	120 Å²	120	103.3 Å²	103.3	78%	0.779	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-63.5	124.4	171.2	-9.1	23.3	0	0	0	107.8	E229	P227-E229 PolarHBondContact O-N 2.78Å; P227-E229 VanDerWaalsContact O-N 3.16Å
228	S	41.1	Very low	55.1	Low	99 Å²	99	107.4 Å²	107.4	69%	0.692	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-58.3	122.4	164	66.6	0	0	0	0	106.7	T226 R230	T226-S228 PolarHBondContact O-N 2.88Å; S228-R230 VanDerWaalsContact C-N 3.31Å; S228-R230 PolarHBondContact O-N 3.06Å
229	E	32.7	Very low	52.7	Low	197 Å²	197	111.9 Å²	111.9	92%	0.921	66%	0.655	S	S	*	*			trans	-49.8	98.6	172.7	-72.7	177.3	162.9	0	0	108.6	P227	P227-E229 PolarHBondContact O-N 2.78Å; P227-E229 VanDerWaalsContact O-N 3.16Å
230	R	31.5	Very low	50.3	Low	234 Å²	234	117 Å²	117	88%	0.883	69%	0.688	S	S	*	*			trans	-75.3	121.9	164.4	-107.6	-175.6	-83.9	-174.6	-6.1	104.3	S228	S228-R230 VanDerWaalsContact C-N 3.31Å; S228-R230 PolarHBondContact O-N 3.06Å
231	G	30	Very low	47.8	Very low	71 Å²	71	121.4 Å²	121.4	73%	0.732	71%	0.709	S	S	*	*			trans	-43.9	139.5	-168.5	0	0	0	0	0	114.4	A233	G231-A233 PolarHBondContact O-N 3.1Å; G231-A233 VanDerWaalsContact O-N 3.1Å
232	E	28.3	Very low	44.9	Very low	204 Å²	204	126.8 Å²	126.8	95%	0.953	74%	0.74	S	S	*	*			trans	-59.7	108.4	155.5	-70.3	178.7	157	0	0	107.3
233	A	27.2	Very low	41.7	Very low	96 Å²	96	133.3 Å²	133.3	79%	0.793	77%	0.768	S	S	*	*			trans	-88.5	111.1	155.8	0	0	0	0	0	107	G231	G231-A233 PolarHBondContact O-N 3.1Å; G231-A233 VanDerWaalsContact O-N 3.1Å
234	E	31.6	Very low	38.8	Very low	272 Å²	272	140 Å²	140	100%	1.271	81%	0.805	S	S	*	*			trans	-134.6	0	141	-83.9	-164.8	155.4	0	0	108.4

Retrieved 234 of 234 residues in 1373.2 ms (Link to these results)

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