A0A096NQ93_PAPAN Loading...

Chymotrypsin like

AlphaFold DB (G7NQ74), UniProt , Accession A0A096NQ93, Species PAPAN (Papio anubis, Olive baboon), Gene CTRL, Length 264 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	40.8	Very low	49.3	Very low	235 Å²	235	145.1 Å²	145.1	100%	1.158	80%	0.804	S	S	*	*				0	100.4	0	-80.8	155	63.1	0	0	107.7
2	L	40.7	Very low	49.3	Very low	163 Å²	163	145.7 Å²	145.7	85%	0.853	80%	0.804	S	S	*	*			trans	-88.9	112.4	177.4	-131.1	83.2	0	0	0	107.5	L4	L2-L4 HydrophobicContact CD2-CD1 4.44Å; L2-L4 PolarHBondContact O-N 3.44Å
3	L	43.9	Very low	49.2	Very low	168 Å²	168	146.8 Å²	146.8	88%	0.88	81%	0.806	S	S	*	*			trans	-86.2	101.9	173.7	-81.8	151.2	0	0	0	108.1	S5	L3-S5 PolarHBondContact O-N 3.3Å
4	L	46	Very low	48.9	Very low	143 Å²	143	141.1 Å²	141.1	75%	0.749	80%	0.798	S	S	*	*			trans	-73.8	105.4	166.7	-113.6	82.4	0	0	0	108.1	L2 L6	L2-L4 HydrophobicContact CD2-CD1 4.44Å; L2-L4 PolarHBondContact O-N 3.44Å; L4-L6 PolarHBondContact O-N 3.28Å
5	S	54.3	Low	49.1	Very low	107 Å²	107	137.5 Å²	137.5	75%	0.748	79%	0.785	S	S	*	*			trans	-77.8	105.6	169.5	49.6	0	0	0	0	109.4	L3 T7	L3-S5 PolarHBondContact O-N 3.3Å; S5-T7 PolarHBondContact O-N 3.32Å
6	L	52.2	Low	49.5	Very low	153 Å²	153	135.9 Å²	135.9	80%	0.801	79%	0.786	S	S	*	*			trans	-77.1	101.5	173.6	-139.1	88.5	0	0	0	108.9	L4 L8	L4-L6 PolarHBondContact O-N 3.28Å; L6-L8 PolarHBondContact O-N 3.17Å
7	T	55	Low	50.6	Low	122 Å²	122	134.9 Å²	134.9	75%	0.748	77%	0.766	S	S	*	*			trans	-78	106.6	170.5	49	0	0	0	0	109	S5 S9	S5-T7 PolarHBondContact O-N 3.32Å; T7-S9 PolarHBondContact O-N 3.5Å; T7-S9 VanDerWaalsContact O-N 3.17Å
8	L	51.8	Low	52.7	Low	152 Å²	152	129.9 Å²	129.9	80%	0.796	75%	0.749	S	S	*	*			trans	-77	96.4	174	-162.9	77.1	0	0	0	108.9	L6 L10	L6-L8 PolarHBondContact O-N 3.17Å; L8-L10 PolarHBondContact O-N 2.76Å; L8-L10 VanDerWaalsContact O-N 3.07Å
9	S	51.4	Low	55	Low	100 Å²	100	125.6 Å²	125.6	70%	0.699	73%	0.727	S	S	*	*			trans	-69.2	101.3	173.6	-55.4	0	0	0	0	109.4	T7 V11	T7-S9 PolarHBondContact O-N 3.5Å; T7-S9 VanDerWaalsContact O-N 3.17Å; S9-V11 PolarHBondContact O-N 2.56Å
10	L	53.7	Low	57.1	Low	141 Å²	141	119.4 Å²	119.4	74%	0.738	69%	0.691	S	S	*	*			trans	-70.4	94.6	172.6	-157.7	80.8	0	0	0	108.4	L8 L12	L8-L10 PolarHBondContact O-N 2.76Å; L8-L10 VanDerWaalsContact O-N 3.07Å; L10-L12 PolarHBondContact O-N 3.3Å
11	V	52	Low	59	Low	112 Å²	112	116.7 Å²	116.7	68%	0.679	68%	0.676	S	S	*	*			trans	-71.7	97	171.4	-178.2	0	0	0	0	107.1	S9 L13	S9-V11 PolarHBondContact O-N 2.56Å; V11-L13 VanDerWaalsContact C-N 3.3Å; V11-L13 HydrophobicContact CG1-CD2 4.42Å; V11-L13 HydrophobicContact CG1-CG 4.42Å; V11-L13 PolarHBondContact O-N 3.01Å
12	L	50.2	Low	61.7	Low	152 Å²	152	105.6 Å²	105.6	80%	0.796	62%	0.622	S	S	*	*			trans	-64.3	96.9	164.3	-73.5	164.6	0	0	0	106.9	L10 G14	L10-L12 PolarHBondContact O-N 3.3Å; L12-G14 PolarHBondContact O-N 3.15Å
13	L	48	Very low	64.3	Low	160 Å²	160	101.1 Å²	101.1	84%	0.838	61%	0.608	S	S	*	*			trans	-65.9	82.5	164.9	-71.9	165.7	0	0	0	107	V11 S15	V11-L13 VanDerWaalsContact C-N 3.3Å; V11-L13 HydrophobicContact CG1-CD2 4.42Å; V11-L13 HydrophobicContact CG1-CG 4.42Å; V11-L13 PolarHBondContact O-N 3.01Å; L13-S15 PolarHBondContact O-N 3.32Å
14	G	44.8	Very low	66.8	Low	67 Å²	67	95.6 Å²	95.6	69%	0.691	58%	0.579	S	S	*	*			trans	-60.2	108.8	165.5	0	0	0	0	0	107	L12 S16	L12-G14 PolarHBondContact O-N 3.15Å; G14-S16 PolarHBondContact O-N 3.1Å
15	S	51.5	Low	69.2	Low	87 Å²	87	94.5 Å²	94.5	61%	0.608	57%	0.568	S	S	*	*			trans	-60	106.5	165.6	35.2	0	0	0	0	106.4	L13 W17	L13-S15 PolarHBondContact O-N 3.32Å; S15-W17 PolarHBondContact O-N 3.35Å; S15-W17 PolarHBondContact OG-NE1 3.3Å
16	S	56.3	Low	71.1	Confident	113 Å²	113	90.5 Å²	90.5	79%	0.79	54%	0.54	S	S	*	.			trans	-67.5	103.6	166.9	64	0	0	0	0	106	G14 G18	G14-S16 PolarHBondContact O-N 3.1Å; S16-G18 PolarHBondContact O-N 3.07Å
17	W	67.9	Low	73	Confident	118 Å²	118	86.3 Å²	86.3	45%	0.447	53%	0.527	S	S	.	.			trans	-66.7	92.5	172.5	-65.8	71.9	0	0	0	107	S15 Y133 T134	S15-W17 PolarHBondContact O-N 3.35Å; S15-W17 PolarHBondContact OG-NE1 3.3Å; W17-Y133 HydrophobicContact CB-CD2 3.67Å; W17-Y133 HydrophobicContact CB-CE2 4.17Å; W17-Y133 HydrophobicContact CD2-CD2 4.2Å; W17-Y133 HydrophobicContact CD2-CG 4.47Å; W17-Y133 HydrophobicContact CE3-CD2 4.33Å; W17-Y133 HydrophobicContact CE3-CG 4.27Å; W17-Y133 AromaticContact CG-CD2 3.95Å; W17-Y133 HydrophobicContact CG-CD2 3.95Å; W17-T134 VanDerWaalsContact CZ3-C 3.46Å; W17-T134 VanDerWaalsContact CZ3-O 3.23Å; W17-T134 WeakPolarHBondContact CZ3-O 2.82Å
18	G	87.4	Confident	74.4	Confident	45 Å²	45	81.9 Å²	81.9	46%	0.464	50%	0.499	S	S	.	.			trans	-66.3	167.3	172.5	0	0	0	0	0	110.8	S16	S16-G18 PolarHBondContact O-N 3.07Å
19	C	96.7	Very high	75.4	Confident	49 Å²	49	77.1 Å²	77.1	33%	0.331	48%	0.478	S	S	.	.	S	Bend	trans	-86.7	156.5	173.3	61	0	0	0	0	111.4	V21 P139 C141	C19-V21 PolarHBondContact O-N 2.8Å; C19-P139 CarbonylContact C-O 3.48Å; C19-P139 WeakPolarHBondContact CA-O 3.34Å; C19-P139 HydrophobicContact CB-CG 4.12Å; C19-C141 HydrophobicContact CB-CB 3.98Å; C19-C141 WeakPolarHBondContact CB-SG 3.43Å; C19-C141 PolarHBondContact O-SG 3Å; C19-C141 WeakPolarHBondContact SG-CA 3.14Å; C19-C141 WeakPolarHBondContact SG-CB 3.42Å; C19-C141 CovalentContact SG-SG 2.04Å; C19-C141 PolarHBondContact SG-SG 3.42Å
20	G	97.5	Very high	76.1	Confident	0 Å²	0	79.2 Å²	79.2	0%	0	48%	0.475	C	S	.	.	S	Bend	trans	69.3	6.6	166.9	0	0	0	0	0	115.8	P22 P139 W226	G20-P22 WeakPolarHBondContact O-CD 3.29Å; G20-P139 PolarHBondContact N-O 3.01Å; G20-W226 VanDerWaalsContact CA-O 3.28Å; G20-W226 WeakPolarHBondContact CA-O 3.09Å; G20-W226 PolarHBondContact O-N 2.93Å
21	V	97.1	Very high	75.7	Confident	64 Å²	64	76.3 Å²	76.3	39%	0.388	47%	0.466	S	S	.	.			trans	-114.8	93.6	179.4	-174.1	0	0	0	0	108.8	C19	C19-V21 PolarHBondContact O-N 2.8Å
22	P	96.6	Very high	75.1	Confident	2 Å²	2	79 Å²	79	1%	0.013	47%	0.471	C	S	.	.			trans	-71.2	138.9	-177.3	31.8	-36.3	0	0	0	109.9	G20 I24 K25 S44 P46 W47	G20-P22 WeakPolarHBondContact O-CD 3.29Å; P22-I24 VanDerWaalsContact C-N 3.3Å; P22-I24 WeakPolarHBondContact CB-O 3.25Å; P22-K25 HydrophobicContact CG-CD 4.44Å; P22-K25 PolarHBondContact O-NZ 2.95Å; P22-S44 WeakPolarHBondContact CB-O 3.42Å; P22-P46 HydrophobicContact CB-CG 3.78Å; P22-W47 HydrophobicContact CB-CH2 4.46Å; P22-W47 HydrophobicContact CB-CZ3 4.34Å; P22-W47 HydrophobicContact CG-CH2 4.28Å
23	A	96.4	Very high	74.6	Confident	69 Å²	69	82.9 Å²	82.9	57%	0.57	48%	0.475	S	S	*	.	S	Bend	trans	-66.2	-35.9	175.7	0	0	0	0	0	111.2	T135	A23-T135 HydrophobicContact CB-CG2 4.27Å
24	I	96.5	Very high	74.3	Confident	51 Å²	51	78.4 Å²	78.4	26%	0.262	45%	0.452	S	S	.	.	S	Bend	trans	-100.4	119.4	172.1	-58.5	171.1	0	0	0	107.5	P22 V41 P42 S44 R136	P22-I24 VanDerWaalsContact C-N 3.3Å; P22-I24 WeakPolarHBondContact CB-O 3.25Å; I24-V41 HydrophobicContact CG2-CG1 3.73Å; I24-P42 WeakPolarHBondContact CD1-O 3.07Å; I24-S44 WeakPolarHBondContact O-CA 3.25Å; I24-R136 HydrophobicContact CD1-CG 4.33Å
25	K	95.4	Very high	74.4	Confident	120 Å²	120	78.5 Å²	78.5	52%	0.522	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-75.2	138.1	-178.1	-63.3	-57.8	-176.2	-165.1	0	111.2	P22	P22-K25 HydrophobicContact CG-CD 4.44Å; P22-K25 PolarHBondContact O-NZ 2.95Å
26	P	94.4	Very high	74.8	Confident	24 Å²	24	77.8 Å²	77.8	16%	0.156	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-67.8	141.1	172	29.3	-34.1	0	0	0	109.8	L28 W45 W226	P26-L28 HydrophobicContact CB-CG 4.38Å; P26-L28 HydrophobicContact CG-CD1 4.46Å; P26-W45 HydrophobicContact CB-CH2 4.07Å; P26-W45 HydrophobicContact CB-CZ2 3.44Å; P26-W45 VanDerWaalsContact CB-CZ2 3.44Å; P26-W45 HydrophobicContact CG-CH2 3.88Å; P26-W45 HydrophobicContact CG-CZ2 3.79Å; P26-W226 HydrophobicContact CG-CZ2 4.06Å
27	A	91.7	Very high	75.3	Confident	64 Å²	64	73.3 Å²	73.3	53%	0.529	40%	0.4	S	S	.	.			trans	-98.2	98.4	169.6	0	0	0	0	0	107.6	V41 Q176	A27-V41 HydrophobicContact CB-CG2 3.72Å; A27-Q176 PolarHBondContact O-NE2 3.49Å
28	L	84.9	Confident	76.1	Confident	30 Å²	30	69.9 Å²	69.9	16%	0.157	39%	0.388	C	S	.	.			trans	-96.8	124.6	-177.5	-72.8	161.3	0	0	0	110.4	P26 F30 W45 V156 Q176 W226	P26-L28 HydrophobicContact CB-CG 4.38Å; P26-L28 HydrophobicContact CG-CD1 4.46Å; L28-F30 HydrophobicContact CB-CD2 4.28Å; L28-F30 HydrophobicContact CB-CE1 4.39Å; L28-F30 HydrophobicContact CB-CE2 3.75Å; L28-F30 HydrophobicContact CB-CZ 3.82Å; L28-F30 HydrophobicContact CD1-CE1 4.37Å; L28-F30 HydrophobicContact CD1-CE2 4.45Å; L28-F30 HydrophobicContact CD1-CZ 3.79Å; L28-F30 HydrophobicContact CG-CZ 4.45Å; L28-F30 PolarHBondContact O-N 3.02Å; L28-W45 HydrophobicContact CD1-CH2 4.49Å; L28-W45 HydrophobicContact CD1-CZ2 4.49Å; L28-W45 HydrophobicContact CD2-CZ2 4.22Å; L28-V156 HydrophobicContact CD1-CG2 3.81Å; L28-V156 HydrophobicContact CD2-CG1 4.07Å; L28-V156 HydrophobicContact CD2-CG2 3.79Å; L28-V156 HydrophobicContact CG-CG2 4.5Å; L28-Q176 HydrophobicContact CD2-CG 4.34Å; L28-Q176 VanDerWaalsContact CD2-NE2 3.34Å; L28-W226 HydrophobicContact CD1-CH2 3.67Å; L28-W226 HydrophobicContact CD1-CZ2 3.97Å
29	S	73.3	Confident	76.3	Confident	51 Å²	51	72.1 Å²	72.1	36%	0.357	39%	0.39	S	S	.	.			trans	-83.6	99.7	165.8	-170.3	0	0	0	0	110	S31 E38	S29-S31 PolarHBondContact O-N 2.78Å; S29-S31 PolarHBondContact OG-O 2.94Å; S29-E38 VanDerWaalsContact CB-OE2 3.29Å; S29-E38 WeakPolarHBondContact CB-OE2 3.1Å; S29-E38 PolarHBondContact N-OE1 3.1Å
30	F	64.9	Low	76.2	Confident	144 Å²	144	70 Å²	70	63%	0.632	38%	0.376	S	S	*	.			trans	-75.4	-9.9	173.9	-64	-78.5	0	0	0	113.1	L28 T154 A178	L28-F30 HydrophobicContact CB-CD2 4.28Å; L28-F30 HydrophobicContact CB-CE1 4.39Å; L28-F30 HydrophobicContact CB-CE2 3.75Å; L28-F30 HydrophobicContact CB-CZ 3.82Å; L28-F30 HydrophobicContact CD1-CE1 4.37Å; L28-F30 HydrophobicContact CD1-CE2 4.45Å; L28-F30 HydrophobicContact CD1-CZ 3.79Å; L28-F30 HydrophobicContact CG-CZ 4.45Å; L28-F30 PolarHBondContact O-N 3.02Å; F30-T154 HydrophobicContact CD1-CG2 4.24Å; F30-T154 HydrophobicContact CE1-CG2 4.16Å; F30-A178 HydrophobicContact CD1-CB 4.43Å
31	S	46.3	Very low	76.2	Confident	81 Å²	81	72.3 Å²	72.3	57%	0.566	39%	0.39	S	S	*	.	S	Bend	trans	-108.4	130.6	177.3	66.6	0	0	0	0	110.6	S29	S29-S31 PolarHBondContact O-N 2.78Å; S29-S31 PolarHBondContact OG-O 2.94Å
32	Q	39.6	Very low	76.2	Confident	168 Å²	168	71.8 Å²	71.8	79%	0.785	39%	0.388	S	S	*	.	S	Bend	trans	103.8	134.8	170.3	-57.4	-173.4	-17.2	0	0	115.2	I34	Q32-I34 HydrophobicContact CB-CG1 4.32Å; Q32-I34 PolarHBondContact O-N 3.12Å
33	R	39.9	Very low	76.2	Confident	233 Å²	233	72.1 Å²	72.1	88%	0.879	39%	0.392	S	S	*	.			trans	-63.2	63.9	176.6	-60.1	169.9	179	161.6	-1.8	110.3	V35	R33-V35 PolarHBondContact O-N 3.27Å
34	I	41.5	Very low	76.3	Confident	67 Å²	67	68.9 Å²	68.9	34%	0.344	37%	0.365	S	S	.	.			trans	-79.4	85.7	176.6	-51.5	-149.2	0	0	0	107.7	Q32 N36 G37	Q32-I34 HydrophobicContact CB-CG1 4.32Å; Q32-I34 PolarHBondContact O-N 3.12Å; I34-N36 PolarHBondContact O-N 2.04Å; I34-G37 WeakPolarHBondContact CG2-O 3.37Å
35	V	46.9	Very low	76.4	Confident	69 Å²	69	66.7 Å²	66.7	42%	0.418	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.7	129.9	151.1	-175.4	0	0	0	0	105.5	R33 V241	R33-V35 PolarHBondContact O-N 3.27Å; V35-V241 HydrophobicContact CG1-CG1 4.12Å; V35-V241 HydrophobicContact CG2-CG2 4.42Å
36	N	59.3	Low	76.5	Confident	72 Å²	72	61.1 Å²	61.1	39%	0.385	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	90	9.2	-179.4	-47.1	-45.5	0	0	0	118	I34 L163	I34-N36 PolarHBondContact O-N 2.04Å; N36-L163 HydrophobicContact CB-CB 3.91Å; N36-L163 HydrophobicContact CB-CD1 4.46Å; N36-L163 VanDerWaalsContact O-CD2 3.32Å; N36-L163 WeakPolarHBondContact O-CD2 3.48Å; N36-L163 VanDerWaalsContact OD1-C 3.32Å; N36-L163 PolarHBondContact OD1-O 2.95Å
37	G	66.4	Low	76.7	Confident	18 Å²	18	60 Å²	60	19%	0.186	32%	0.322	C	S	.	.			trans	61	-178.6	178.2	0	0	0	0	0	114.2	I34	I34-G37 WeakPolarHBondContact CG2-O 3.37Å
38	E	85.7	Confident	77.1	Confident	46 Å²	46	57.1 Å²	57.1	22%	0.215	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	154.3	175	67.6	-174.4	169.6	0	0	110.8	S29 A40 Q175 Q176	S29-E38 VanDerWaalsContact CB-OE2 3.29Å; S29-E38 WeakPolarHBondContact CB-OE2 3.1Å; S29-E38 PolarHBondContact N-OE1 3.1Å; E38-A40 PolarHBondContact O-N 3.13Å; E38-Q175 VanDerWaalsContact C-OE1 3.28Å; E38-Q175 CarbonylContact O-C 3.4Å; E38-Q175 VanDerWaalsContact O-CA 3.31Å; E38-Q175 WeakPolarHBondContact O-CA 3.48Å; E38-Q175 PolarHBondContact O-OE1 3.14Å; E38-Q176 HydrophobicContact CG-CG 3.59Å; E38-Q176 PolarHBondContact N-O 3.36Å; E38-Q176 PolarHBondContact O-N 3Å; E38-Q176 PolarHBondContact OE1-NE2 2.91Å
39	N	91.8	Very high	77.7	Confident	93 Å²	93	55.7 Å²	55.7	50%	0.497	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	125	173.5	-70.8	-38.7	0	0	0	109.5	Q175	N39-Q175 PolarHBondContact OD1-NE2 3.06Å
40	A	94.9	Very high	79	Confident	4 Å²	4	53.3 Å²	53.3	3%	0.033	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-67.4	154.7	171.7	0	0	0	0	0	110.9	E38 H90 L174 Q176	E38-A40 PolarHBondContact O-N 3.13Å; A40-H90 PolarHBondContact O-CE1 3.04Å; A40-L174 HydrophobicContact CB-CB 4.35Å; A40-L174 HydrophobicContact CB-CD2 4.18Å; A40-L174 HydrophobicContact CB-CG 4.07Å; A40-L174 WeakPolarHBondContact CB-O 3.16Å; A40-L174 PolarHBondContact N-O 3.34Å; A40-Q176 HydrophobicContact CB-CB 4.25Å; A40-Q176 HydrophobicContact CB-CG 4.24Å
41	V	97	Very high	80.6	Confident	49 Å²	49	46.4 Å²	46.4	30%	0.297	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-68.4	131.7	169	176.2	0	0	0	0	108.1	I24 A27 G43 S44	I24-V41 HydrophobicContact CG2-CG1 3.73Å; A27-V41 HydrophobicContact CB-CG2 3.72Å; V41-G43 PolarHBondContact O-N 2.75Å; V41-G43 VanDerWaalsContact O-N 3.13Å; V41-S44 WeakPolarHBondContact O-CB 3.2Å; V41-S44 PolarHBondContact O-N 3.07Å; V41-S44 PolarHBondContact O-OG 2.95Å
42	P	97.3	Very high	83	Confident	52 Å²	52	43.8 Å²	43.8	34%	0.338	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	121.5	-178.7	-26.8	32.6	0	0	0	112.5	I24 S44 H90	I24-P42 WeakPolarHBondContact CD1-O 3.07Å; P42-S44 VanDerWaalsContact C-N 3.34Å; P42-S44 PolarHBondContact O-N 3.48Å; P42-H90 HydrophobicContact CB-CB 4.4Å
43	G	96.9	Very high	85.8	Confident	10 Å²	10	38 Å²	38	10%	0.103	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	5.6	-178.5	0	0	0	0	0	116.1	V41 W45	V41-G43 PolarHBondContact O-N 2.75Å; V41-G43 VanDerWaalsContact O-N 3.13Å; G43-W45 PolarHBondContact O-N 2.65Å
44	S	97.8	Very high	88.5	Confident	0 Å²	0	32 Å²	32	0%	0	19%	0.19	C	C	.	.	S	Bend	trans	-74.6	-12.4	179.7	68.2	0	0	0	0	115	P22 I24 V41 P42 P46	P22-S44 WeakPolarHBondContact CB-O 3.42Å; I24-S44 WeakPolarHBondContact O-CA 3.25Å; V41-S44 WeakPolarHBondContact O-CB 3.2Å; V41-S44 PolarHBondContact O-N 3.07Å; V41-S44 PolarHBondContact O-OG 2.95Å; P42-S44 VanDerWaalsContact C-N 3.34Å; P42-S44 PolarHBondContact O-N 3.48Å; S44-P46 WeakPolarHBondContact O-CD 3.25Å
45	W	98.3	Very high	91	Very high	6 Å²	6	33.4 Å²	33.4	2%	0.023	21%	0.206	C	C	.	.	S	Bend	trans	-120	67.2	175.6	-58.6	108.4	0	0	0	109.9	P26 L28 G43 W47 Q48 V156 T158 L174 V219 W226	P26-W45 HydrophobicContact CB-CH2 4.07Å; P26-W45 HydrophobicContact CB-CZ2 3.44Å; P26-W45 VanDerWaalsContact CB-CZ2 3.44Å; P26-W45 HydrophobicContact CG-CH2 3.88Å; P26-W45 HydrophobicContact CG-CZ2 3.79Å; L28-W45 HydrophobicContact CD1-CH2 4.49Å; L28-W45 HydrophobicContact CD1-CZ2 4.49Å; L28-W45 HydrophobicContact CD2-CZ2 4.22Å; G43-W45 PolarHBondContact O-N 2.65Å; W45-W47 AromaticContact CE3-CE2 3.9Å; W45-W47 HydrophobicContact CE3-CH2 4.28Å; W45-W47 AromaticContact CE3-CZ2 3.42Å; W45-W47 HydrophobicContact CE3-CZ2 3.42Å; W45-W47 VanDerWaalsContact CE3-CZ2 3.42Å; W45-W47 HydrophobicContact CZ3-CH2 4.47Å; W45-W47 AromaticContact CZ3-CZ2 3.7Å; W45-W47 HydrophobicContact CZ3-CZ2 3.7Å; W45-W47 PolarHBondContact O-N 3.21Å; W45-Q48 HydrophobicContact CB-CB 4.25Å; W45-Q48 VanDerWaalsContact O-CB 3.23Å; W45-Q48 WeakPolarHBondContact O-CB 3.3Å; W45-Q48 PolarHBondContact O-N 3.11Å; W45-V156 HydrophobicContact CH2-CB 3.95Å; W45-V156 HydrophobicContact CH2-CG1 3.79Å; W45-V156 HydrophobicContact CH2-CG2 4.15Å; W45-V156 HydrophobicContact CZ2-CB 4.31Å; W45-V156 HydrophobicContact CZ2-CG1 3.65Å; W45-T158 HydrophobicContact CD2-CG2 3.77Å; W45-T158 HydrophobicContact CE3-CG2 4.49Å; W45-T158 HydrophobicContact CG-CG2 3.74Å; W45-T158 HydrophobicContact CZ2-CG2 4.41Å; W45-L174 HydrophobicContact CB-CD2 4.25Å; W45-V219 HydrophobicContact CE3-CG2 4.36Å; W45-V219 HydrophobicContact CH2-CG2 4.4Å; W45-V219 HydrophobicContact CZ3-CG2 3.73Å; W45-W226 HydrophobicContact CH2-CD2 4.16Å; W45-W226 AromaticContact CH2-CE2 3.94Å; W45-W226 HydrophobicContact CH2-CE3 4.15Å; W45-W226 AromaticContact CH2-CH2 3.74Å; W45-W226 HydrophobicContact CH2-CH2 3.74Å; W45-W226 AromaticContact CH2-CZ2 3.74Å; W45-W226 HydrophobicContact CH2-CZ2 3.74Å; W45-W226 AromaticContact CH2-CZ3 3.94Å; W45-W226 HydrophobicContact CH2-CZ3 3.94Å; W45-W226 AromaticContact CZ3-CD2 3.8Å; W45-W226 HydrophobicContact CZ3-CD2 3.8Å; W45-W226 AromaticContact CZ3-CE2 3.92Å; W45-W226 AromaticContact CZ3-CE3 3.96Å; W45-W226 HydrophobicContact CZ3-CE3 3.96Å; W45-W226 HydrophobicContact CZ3-CG 4.29Å; W45-W226 HydrophobicContact CZ3-CH2 4.35Å; W45-W226 HydrophobicContact CZ3-CZ2 4.21Å; W45-W226 HydrophobicContact CZ3-CZ3 4.22Å
46	P	98.4	Very high	93.3	Very high	2 Å²	2	32 Å²	32	1%	0.013	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-6.2	-164.9	31.4	-39.9	0	0	0	114.6	P22 S44 R136 I137 S138	P22-P46 HydrophobicContact CB-CG 3.78Å; S44-P46 WeakPolarHBondContact O-CD 3.25Å; P46-R136 VanDerWaalsContact CA-O 3.22Å; P46-R136 WeakPolarHBondContact CA-O 3.2Å; P46-R136 WeakPolarHBondContact CB-O 3.37Å; P46-I137 WeakPolarHBondContact O-CA 3.24Å; P46-S138 CarbonylContact C-O 3.57Å; P46-S138 VanDerWaalsContact C-O 3.27Å; P46-S138 WeakPolarHBondContact CB-OG 3.3Å; P46-S138 WeakPolarHBondContact CG-OG 3.47Å; P46-S138 PolarHBondContact O-N 2.99Å
47	W	98.8	Very high	95	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-12.1	171.9	45.8	81	0	0	0	113.2	P22 W45 V49 S63 L64 S138 V140 W226	P22-W47 HydrophobicContact CB-CH2 4.46Å; P22-W47 HydrophobicContact CB-CZ3 4.34Å; P22-W47 HydrophobicContact CG-CH2 4.28Å; W45-W47 AromaticContact CE3-CE2 3.9Å; W45-W47 HydrophobicContact CE3-CH2 4.28Å; W45-W47 AromaticContact CE3-CZ2 3.42Å; W45-W47 HydrophobicContact CE3-CZ2 3.42Å; W45-W47 VanDerWaalsContact CE3-CZ2 3.42Å; W45-W47 HydrophobicContact CZ3-CH2 4.47Å; W45-W47 AromaticContact CZ3-CZ2 3.7Å; W45-W47 HydrophobicContact CZ3-CZ2 3.7Å; W45-W47 PolarHBondContact O-N 3.21Å; W47-V49 PolarHBondContact O-N 3.47Å; W47-S63 CarbonylContact O-C 3.51Å; W47-S63 WeakPolarHBondContact O-CA 3.45Å; W47-L64 HydrophobicContact CB-CB 4.33Å; W47-L64 PolarHBondContact O-N 3.49Å; W47-S138 VanDerWaalsContact CA-O 3.27Å; W47-S138 WeakPolarHBondContact CA-O 3.43Å; W47-S138 WeakPolarHBondContact CB-O 3.48Å; W47-S138 PolarHBondContact N-O 3.3Å; W47-V140 HydrophobicContact CB-CB 3.82Å; W47-V140 HydrophobicContact CB-CG1 4.36Å; W47-V140 HydrophobicContact CD2-CB 3.65Å; W47-V140 HydrophobicContact CD2-CG2 3.95Å; W47-V140 HydrophobicContact CE3-CB 4.08Å; W47-V140 HydrophobicContact CE3-CG2 4.41Å; W47-V140 HydrophobicContact CG-CB 3.54Å; W47-V140 HydrophobicContact CG-CG1 4.37Å; W47-V140 HydrophobicContact CG-CG2 4.19Å; W47-V140 HydrophobicContact CZ2-CG2 4.34Å; W47-W226 HydrophobicContact CH2-CB 3.42Å; W47-W226 VanDerWaalsContact CH2-CB 3.42Å; W47-W226 AromaticContact CH2-CD1 3.66Å; W47-W226 AromaticContact CH2-CG 3.64Å; W47-W226 HydrophobicContact CH2-CG 3.64Å; W47-W226 HydrophobicContact CZ2-CB 3.54Å; W47-W226 AromaticContact CZ2-CG 3.84Å; W47-W226 HydrophobicContact CZ2-CG 3.84Å; W47-W226 HydrophobicContact CZ3-CB 4.41Å
48	Q	98.8	Very high	96.4	Very high	5 Å²	5	34.6 Å²	34.6	2%	0.023	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	128.4	179	177.3	67.7	58.6	0	0	109.5	W45 T158 W160 L174 P217	W45-Q48 HydrophobicContact CB-CB 4.25Å; W45-Q48 VanDerWaalsContact O-CB 3.23Å; W45-Q48 WeakPolarHBondContact O-CB 3.3Å; W45-Q48 PolarHBondContact O-N 3.11Å; Q48-T158 PolarHBondContact OE1-O 2.94Å; Q48-T158 PolarHBondContact OE1-OG1 3.48Å; Q48-W160 HydrophobicContact CG-CH2 3.49Å; Q48-W160 VanDerWaalsContact CG-CH2 3.49Å; Q48-W160 HydrophobicContact CG-CZ3 3.46Å; Q48-W160 VanDerWaalsContact CG-CZ3 3.46Å; Q48-L174 HydrophobicContact CB-CD2 4.37Å; Q48-L174 HydrophobicContact CG-CD1 3.91Å; Q48-L174 HydrophobicContact CG-CD2 4.11Å; Q48-P217 VanDerWaalsContact OE1-CD 3.25Å
49	V	98.8	Very high	96.9	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	139.7	174.5	169.8	0	0	0	0	109.1	W47 L51 G61 G62 L64 V70 V85 L87	W47-V49 PolarHBondContact O-N 3.47Å; V49-L51 HydrophobicContact CG1-CD2 3.77Å; V49-L51 HydrophobicContact CG1-CG 4.15Å; V49-G61 WeakPolarHBondContact O-CA 3.35Å; V49-G62 PolarHBondContact N-O 2.97Å; V49-G62 PolarHBondContact O-N 3.25Å; V49-G62 VanDerWaalsContact O-N 3.16Å; V49-L64 HydrophobicContact CG2-CB 4.5Å; V49-V70 HydrophobicContact CB-CG1 4.33Å; V49-V70 HydrophobicContact CG1-CG1 4.31Å; V49-V70 HydrophobicContact CG2-CG1 3.91Å; V49-V70 HydrophobicContact CG2-CG2 3.84Å; V49-V85 HydrophobicContact CG1-CB 4.36Å; V49-V85 HydrophobicContact CG1-CG1 3.82Å; V49-V85 HydrophobicContact CG1-CG2 4.3Å; V49-V85 HydrophobicContact CG2-CG1 4.21Å; V49-L87 HydrophobicContact CG2-CD2 3.49Å; V49-L87 VanDerWaalsContact CG2-CD2 3.49Å; V49-L87 HydrophobicContact CG2-CG 4.42Å
50	S	98.7	Very high	97.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	120.7	160.9	178.3	0	0	0	0	108.1	Q52 H58 V86	S50-Q52 PolarHBondContact OG-NE2 3.41Å; S50-H58 PolarHBondContact OG-ND1 3.23Å; S50-V86 PolarHBondContact N-O 2.87Å; S50-V86 PolarHBondContact O-N 2.96Å
51	L	98.8	Very high	97.3	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	121.3	171.6	-61.5	174.9	0	0	0	108.4	V49 H58 F59 C60 G61 T72 V78 F84 V85 L125	V49-L51 HydrophobicContact CG1-CD2 3.77Å; V49-L51 HydrophobicContact CG1-CG 4.15Å; L51-H58 WeakPolarHBondContact O-CA 3.41Å; L51-F59 HydrophobicContact CB-CE1 3.92Å; L51-F59 HydrophobicContact CB-CE2 4.24Å; L51-F59 HydrophobicContact CB-CZ 3.74Å; L51-F59 VanDerWaalsContact O-CD1 3.25Å; L51-F59 WeakPolarHBondContact O-CD1 3.35Å; L51-F59 WeakPolarHBondContact O-CE1 3.42Å; L51-F59 PolarHBondContact O-N 3.25Å; L51-C60 WeakPolarHBondContact CA-O 3.26Å; L51-C60 HydrophobicContact CB-CB 4.23Å; L51-C60 VanDerWaalsContact CB-O 3.3Å; L51-C60 WeakPolarHBondContact CB-O 3.5Å; L51-C60 HydrophobicContact CD1-CB 3.83Å; L51-C60 PolarHBondContact N-O 3.16Å; L51-G61 VanDerWaalsContact CD1-O 3.29Å; L51-G61 WeakPolarHBondContact CD1-O 3.3Å; L51-T72 HydrophobicContact CD1-CG2 4.1Å; L51-T72 WeakPolarHBondContact CD1-OG1 3.27Å; L51-V78 HydrophobicContact CD1-CG2 3.69Å; L51-F84 WeakPolarHBondContact CA-O 3.45Å; L51-V85 HydrophobicContact CD2-CG2 3.79Å; L51-L125 HydrophobicContact CD1-CD1 4.39Å; L51-L125 HydrophobicContact CD2-CD1 3.65Å
52	Q	98.1	Very high	97.4	Very high	26 Å²	26	28.2 Å²	28.2	12%	0.121	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	149	-174.8	-61.6	-177.5	10.7	0	0	111.5	S50 G56 F57 H58 H83 F84 V86	S50-Q52 PolarHBondContact OG-NE2 3.41Å; Q52-G56 PolarHBondContact OE1-O 3.25Å; Q52-F57 VanDerWaalsContact CA-O 3.22Å; Q52-F57 WeakPolarHBondContact CA-O 3.49Å; Q52-H58 HydrophobicContact CG-CB 4.45Å; Q52-H83 CarbonylContact O-C 3.52Å; Q52-H83 VanDerWaalsContact O-CA 3.24Å; Q52-H83 WeakPolarHBondContact O-CA 3.25Å; Q52-F84 PolarHBondContact N-O 3.15Å; Q52-F84 PolarHBondContact O-N 2.87Å; Q52-V86 HydrophobicContact CB-CG2 4.3Å; Q52-V86 HydrophobicContact CG-CG2 3.94Å
53	D	97.6	Very high	97.5	Very high	47 Å²	47	25.7 Å²	25.7	25%	0.251	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-178.1	167.5	71.8	18.9	0	0	0	111.9	S55 G56 F57	D53-S55 PolarHBondContact O-N 3.11Å; D53-S55 VanDerWaalsContact O-N 3.14Å; D53-S55 WeakPolarHBondContact OD1-CA 3.49Å; D53-S55 WeakPolarHBondContact OD1-CB 3.47Å; D53-S55 PolarHBondContact OD1-N 3.09Å; D53-S55 PolarHBondContact OD1-OG 2.97Å; D53-G56 PolarHBondContact O-N 3.13Å; D53-G56 PolarHBondContact OD1-N 2.87Å; D53-F57 PolarHBondContact N-O 2.89Å; D53-F57 VanDerWaalsContact N-O 3.1Å; D53-F57 WeakPolarHBondContact OD1-CB 3.43Å; D53-F57 PolarHBondContact OD1-N 3.01Å; D53-F57 VanDerWaalsContact OD1-N 3.13Å
54	S	95.9	Very high	97.6	Very high	106 Å²	106	25.2 Å²	25.2	74%	0.741	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-13.7	-179.9	58.5	0	0	0	0	115	G56 R82	S54-G56 VanDerWaalsContact C-N 3.34Å; S54-R82 PolarHBondContact N-O 2.97Å
55	S	95.8	Very high	97.6	Very high	96 Å²	96	26 Å²	26	67%	0.671	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-4.1	173.9	75.4	0	0	0	0	113	D53 F57	D53-S55 PolarHBondContact O-N 3.11Å; D53-S55 VanDerWaalsContact O-N 3.14Å; D53-S55 WeakPolarHBondContact OD1-CA 3.49Å; D53-S55 WeakPolarHBondContact OD1-CB 3.47Å; D53-S55 PolarHBondContact OD1-N 3.09Å; D53-S55 PolarHBondContact OD1-OG 2.97Å; S55-F57 VanDerWaalsContact C-N 3.32Å; S55-F57 WeakPolarHBondContact OG-CB 3.28Å
56	G	94.6	Very high	97.6	Very high	40 Å²	40	27.4 Å²	27.4	41%	0.412	17%	0.166	S	C	.	.			trans	81.7	10.5	-171.4	0	0	0	0	0	113.2	Q52 D53 S54 H58	Q52-G56 PolarHBondContact OE1-O 3.25Å; D53-G56 PolarHBondContact O-N 3.13Å; D53-G56 PolarHBondContact OD1-N 2.87Å; S54-G56 VanDerWaalsContact C-N 3.34Å; G56-H58 PolarHBondContact O-N 3.21Å
57	F	94.6	Very high	97.6	Very high	123 Å²	123	31.5 Å²	31.5	54%	0.539	19%	0.185	S	C	.	.			trans	-76	118.8	179.9	175.4	-100.3	0	0	0	110.8	Q52 D53 S55 F59	Q52-F57 VanDerWaalsContact CA-O 3.22Å; Q52-F57 WeakPolarHBondContact CA-O 3.49Å; D53-F57 PolarHBondContact N-O 2.89Å; D53-F57 VanDerWaalsContact N-O 3.1Å; D53-F57 WeakPolarHBondContact OD1-CB 3.43Å; D53-F57 PolarHBondContact OD1-N 3.01Å; D53-F57 VanDerWaalsContact OD1-N 3.13Å; S55-F57 VanDerWaalsContact C-N 3.32Å; S55-F57 WeakPolarHBondContact OG-CB 3.28Å; F57-F59 HydrophobicContact CD1-CB 4.15Å; F57-F59 HydrophobicContact CE1-CB 3.92Å; F57-F59 PolarHBondContact O-N 3.43Å
58	H	95.8	Very high	97.6	Very high	22 Å²	22	33.3 Å²	33.3	10%	0.102	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	123.8	172.1	173.5	80.8	0	0	0	111.3	S50 L51 Q52 G56 C60 L92 W160 G212	S50-H58 PolarHBondContact OG-ND1 3.23Å; L51-H58 WeakPolarHBondContact O-CA 3.41Å; Q52-H58 HydrophobicContact CG-CB 4.45Å; G56-H58 PolarHBondContact O-N 3.21Å; H58-C60 VanDerWaalsContact CE1-C 3.41Å; H58-C60 PolarHBondContact CE1-O 3.34Å; H58-C60 PolarHBondContact ND1-O 2.87Å; H58-L92 HydrophobicContact CB-CD1 3.98Å; H58-L92 HydrophobicContact CB-CD2 4.23Å; H58-W160 AromaticContact CE1-CE3 3.85Å; H58-G212 PolarHBondContact NE2-O 2.98Å
59	F	95.3	Very high	97.6	Very high	50 Å²	50	33.5 Å²	33.5	22%	0.219	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	-22.6	179	69.2	-90.8	0	0	0	114.4	L51 F57 C76 V78 H83	L51-F59 HydrophobicContact CB-CE1 3.92Å; L51-F59 HydrophobicContact CB-CE2 4.24Å; L51-F59 HydrophobicContact CB-CZ 3.74Å; L51-F59 VanDerWaalsContact O-CD1 3.25Å; L51-F59 WeakPolarHBondContact O-CD1 3.35Å; L51-F59 WeakPolarHBondContact O-CE1 3.42Å; L51-F59 PolarHBondContact O-N 3.25Å; F57-F59 HydrophobicContact CD1-CB 4.15Å; F57-F59 HydrophobicContact CE1-CB 3.92Å; F57-F59 PolarHBondContact O-N 3.43Å; F59-C76 HydrophobicContact CE2-CB 4.33Å; F59-C76 WeakPolarHBondContact CE2-O 3.16Å; F59-V78 HydrophobicContact CE2-CG2 4.4Å; F59-V78 HydrophobicContact CZ-CG2 4.34Å; F59-H83 HydrophobicContact CE1-CB 4.14Å; F59-H83 AromaticContact CE1-CD2 4Å; F59-H83 AromaticContact CE1-CG 3.8Å; F59-H83 HydrophobicContact CZ-CB 4.14Å; F59-H83 AromaticContact CZ-CE1 3.96Å; F59-H83 AromaticContact CZ-CG 3.74Å; F59-H83 AromaticContact CZ-ND1 3.5Å
60	C	97.8	Very high	97.6	Very high	6 Å²	6	33.5 Å²	33.5	4%	0.041	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	161.6	177.3	-90.2	0	0	0	0	111.6	L51 H58 C76 S214	L51-C60 WeakPolarHBondContact CA-O 3.26Å; L51-C60 HydrophobicContact CB-CB 4.23Å; L51-C60 VanDerWaalsContact CB-O 3.3Å; L51-C60 WeakPolarHBondContact CB-O 3.5Å; L51-C60 HydrophobicContact CD1-CB 3.83Å; L51-C60 PolarHBondContact N-O 3.16Å; H58-C60 VanDerWaalsContact CE1-C 3.41Å; H58-C60 PolarHBondContact CE1-O 3.34Å; H58-C60 PolarHBondContact ND1-O 2.87Å; C60-C76 HydrophobicContact CB-CB 3.76Å; C60-C76 WeakPolarHBondContact CB-SG 3.21Å; C60-C76 WeakPolarHBondContact SG-CB 3.24Å; C60-C76 CovalentContact SG-SG 2.04Å; C60-C76 PolarHBondContact SG-SG 3.13Å; C60-S214 CarbonylContact C-O 3.43Å; C60-S214 WeakPolarHBondContact CB-O 3.44Å
61	G	98.4	Very high	97.6	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	178.1	167	0	0	0	0	0	113.9	V49 L51 T72 S214 G215	V49-G61 WeakPolarHBondContact O-CA 3.35Å; L51-G61 VanDerWaalsContact CD1-O 3.29Å; L51-G61 WeakPolarHBondContact CD1-O 3.3Å; G61-T72 PolarHBondContact O-OG1 3.11Å; G61-S214 PolarHBondContact N-O 3.38Å; G61-G215 CarbonylContact C-O 3.46Å; G61-G215 CarbonylContact O-C 3.59Å
62	G	98.8	Very high	97.6	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	177.4	172.9	0	0	0	0	0	110.7	V49 V71 G215	V49-G62 PolarHBondContact N-O 2.97Å; V49-G62 PolarHBondContact O-N 3.25Å; V49-G62 VanDerWaalsContact O-N 3.16Å; G62-V71 CarbonylContact C-O 3.53Å; G62-V71 WeakPolarHBondContact CA-O 3.41Å; G62-G215 VanDerWaalsContact CA-O 3.26Å; G62-G215 WeakPolarHBondContact CA-O 3.47Å; G62-G215 PolarHBondContact N-O 3.39Å
63	S	98.9	Very high	97.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	126.1	173.9	-56.9	0	0	0	0	111.4	W47 I65 V70 V71 P217	W47-S63 CarbonylContact O-C 3.51Å; W47-S63 WeakPolarHBondContact O-CA 3.45Å; S63-I65 PolarHBondContact O-N 3.02Å; S63-V70 CarbonylContact O-C 3.54Å; S63-V70 VanDerWaalsContact O-CA 3.28Å; S63-V70 WeakPolarHBondContact O-CA 3.11Å; S63-V71 PolarHBondContact N-O 2.84Å; S63-V71 PolarHBondContact O-N 2.94Å; S63-P217 WeakPolarHBondContact OG-CB 3.43Å
64	L	98.9	Very high	97.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	123	168.7	-167.6	68.2	0	0	0	109.3	W47 V49 S66 V70 L87 L127 A131 Y133 I137 P139 V140	W47-L64 HydrophobicContact CB-CB 4.33Å; W47-L64 PolarHBondContact O-N 3.49Å; V49-L64 HydrophobicContact CG2-CB 4.5Å; L64-S66 WeakPolarHBondContact CD1-O 3.48Å; L64-S66 WeakPolarHBondContact CG-O 3.5Å; L64-V70 HydrophobicContact CD1-CG2 3.8Å; L64-L87 HydrophobicContact CB-CD2 4.05Å; L64-L87 HydrophobicContact CD1-CD1 4.07Å; L64-L87 HydrophobicContact CD1-CD2 4.28Å; L64-L87 HydrophobicContact CD2-CD1 4.16Å; L64-L87 HydrophobicContact CD2-CD2 4.04Å; L64-L87 HydrophobicContact CG-CD2 4.37Å; L64-L127 HydrophobicContact CD1-CD1 4.17Å; L64-A131 HydrophobicContact CD1-CB 4.37Å; L64-A131 HydrophobicContact CD2-CB 4.39Å; L64-Y133 HydrophobicContact CD2-CD1 4.46Å; L64-Y133 HydrophobicContact CD2-CE1 3.92Å; L64-I137 HydrophobicContact CD2-CG2 3.87Å; L64-P139 CarbonylContact O-C 3.53Å; L64-P139 WeakPolarHBondContact O-CA 3.48Å; L64-V140 PolarHBondContact O-N 2.95Å
65	I	98.7	Very high	97.8	Very high	17 Å²	17	28.1 Å²	28.1	9%	0.087	16%	0.16	C	C	.	.			trans	-116.5	-16	-177.6	56.6	165	0	0	0	112.6	S63 W69 V71 L124 V140 L142 I257 I261	S63-I65 PolarHBondContact O-N 3.02Å; I65-W69 HydrophobicContact CD1-CB 4.06Å; I65-W69 HydrophobicContact CG1-CB 3.8Å; I65-W69 VanDerWaalsContact CG1-O 3.24Å; I65-W69 WeakPolarHBondContact CG1-O 3.42Å; I65-W69 PolarHBondContact N-O 3.18Å; I65-V71 HydrophobicContact CD1-CB 4.32Å; I65-V71 HydrophobicContact CG2-CB 4.39Å; I65-V71 HydrophobicContact CG2-CG1 3.68Å; I65-L124 HydrophobicContact CD1-CD2 3.69Å; I65-V140 HydrophobicContact CG2-CG1 3.95Å; I65-L142 HydrophobicContact CB-CD1 4.39Å; I65-L142 HydrophobicContact CB-CD2 4.44Å; I65-L142 HydrophobicContact CB-CG 4.38Å; I65-L142 HydrophobicContact CD1-CD1 4.18Å; I65-L142 HydrophobicContact CG2-CD2 3.71Å; I65-L142 HydrophobicContact CG2-CG 4.13Å; I65-I257 HydrophobicContact CD1-CG2 4.06Å; I65-I261 HydrophobicContact CD1-CD1 3.88Å
66	S	98.3	Very high	97.9	Very high	35 Å²	35	24 Å²	24	25%	0.245	13%	0.131	C	C	.	.	S	Bend	trans	-157.7	-178.1	166.5	74	0	0	0	0	109.4	L64 S68 W69 Y133	L64-S66 WeakPolarHBondContact CD1-O 3.48Å; L64-S66 WeakPolarHBondContact CG-O 3.5Å; S66-S68 PolarHBondContact O-N 2.8Å; S66-S68 PolarHBondContact OG-N 3.32Å; S66-W69 PolarHBondContact N-O 3.23Å; S66-W69 WeakPolarHBondContact OG-CB 3.43Å; S66-W69 VanDerWaalsContact OG-CD1 3.28Å; S66-W69 PolarHBondContact OG-N 3.49Å; S66-Y133 WeakPolarHBondContact CA-OH 3.38Å
67	Q	97.9	Very high	98.1	Very high	88 Å²	88	28.4 Å²	28.4	41%	0.411	15%	0.145	S	C	.	.	S	Bend	trans	-61.8	-27.7	178.4	-66.7	-177.3	-71	0	0	112.4	L127 P130 A131 Y133	Q67-L127 WeakPolarHBondContact O-CD1 3.35Å; Q67-P130 HydrophobicContact CB-CB 4.01Å; Q67-P130 CarbonylContact O-C 3.45Å; Q67-P130 WeakPolarHBondContact O-CA 3.28Å; Q67-A131 WeakPolarHBondContact O-CB 3.3Å; Q67-A131 PolarHBondContact O-N 2.81Å; Q67-Y133 HydrophobicContact CB-CE1 4.36Å; Q67-Y133 HydrophobicContact CG-CD1 4.24Å; Q67-Y133 HydrophobicContact CG-CD2 4.2Å; Q67-Y133 HydrophobicContact CG-CE1 3.59Å; Q67-Y133 HydrophobicContact CG-CE2 3.56Å; Q67-Y133 WeakPolarHBondContact CG-OH 3.41Å; Q67-Y133 PolarHBondContact N-OH 2.87Å
68	S	98.6	Very high	98.3	Very high	37 Å²	37	23.2 Å²	23.2	26%	0.259	12%	0.123	S	C	.	.	S	Bend	trans	-113.3	0.2	-173.5	-55.6	0	0	0	0	113.6	S66 K126 L127	S66-S68 PolarHBondContact O-N 2.8Å; S66-S68 PolarHBondContact OG-N 3.32Å; S68-K126 WeakPolarHBondContact O-CA 3.31Å; S68-L127 PolarHBondContact O-N 3.32Å
69	W	98.9	Very high	98.4	Very high	9 Å²	9	24.2 Å²	24.2	3%	0.034	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	131.5	-170	-66.4	97.7	0	0	0	112.8	I65 S66 I108 L124 L125 K126 V260 I261 N264	I65-W69 HydrophobicContact CD1-CB 4.06Å; I65-W69 HydrophobicContact CG1-CB 3.8Å; I65-W69 VanDerWaalsContact CG1-O 3.24Å; I65-W69 WeakPolarHBondContact CG1-O 3.42Å; I65-W69 PolarHBondContact N-O 3.18Å; S66-W69 PolarHBondContact N-O 3.23Å; S66-W69 WeakPolarHBondContact OG-CB 3.43Å; S66-W69 VanDerWaalsContact OG-CD1 3.28Å; S66-W69 PolarHBondContact OG-N 3.49Å; W69-I108 HydrophobicContact CH2-CD1 3.94Å; W69-I108 HydrophobicContact CZ3-CD1 4.16Å; W69-L124 HydrophobicContact CE3-CB 3.98Å; W69-L124 HydrophobicContact CE3-CD1 4.48Å; W69-L124 HydrophobicContact CZ3-CB 3.9Å; W69-L125 WeakPolarHBondContact CA-O 3.21Å; W69-K126 HydrophobicContact CD2-CB 4.5Å; W69-K126 HydrophobicContact CD2-CG 4.49Å; W69-K126 HydrophobicContact CE3-CB 4.05Å; W69-K126 HydrophobicContact CH2-CB 3.76Å; W69-K126 HydrophobicContact CH2-CD 3.99Å; W69-K126 HydrophobicContact CH2-CG 3.98Å; W69-K126 HydrophobicContact CZ2-CB 4.21Å; W69-K126 HydrophobicContact CZ2-CD 3.89Å; W69-K126 HydrophobicContact CZ2-CG 3.92Å; W69-K126 HydrophobicContact CZ3-CB 3.67Å; W69-K126 HydrophobicContact CZ3-CG 4.28Å; W69-V260 HydrophobicContact CH2-CG1 3.81Å; W69-V260 HydrophobicContact CZ3-CG1 3.94Å; W69-I261 HydrophobicContact CD2-CG1 3.91Å; W69-I261 HydrophobicContact CG-CD1 4.35Å; W69-I261 HydrophobicContact CG-CG1 3.93Å; W69-N264 HydrophobicContact CH2-CB 3.8Å; W69-N264 HydrophobicContact CZ2-CB 3.85Å; W69-N264 WeakPolarHBondContact CZ2-OXT 3.46Å
70	V	98.9	Very high	98.5	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	142.5	168.9	170.6	0	0	0	0	108.6	V49 S63 L64 V85 L124 L125 L127	V49-V70 HydrophobicContact CB-CG1 4.33Å; V49-V70 HydrophobicContact CG1-CG1 4.31Å; V49-V70 HydrophobicContact CG2-CG1 3.91Å; V49-V70 HydrophobicContact CG2-CG2 3.84Å; S63-V70 CarbonylContact O-C 3.54Å; S63-V70 VanDerWaalsContact O-CA 3.28Å; S63-V70 WeakPolarHBondContact O-CA 3.11Å; L64-V70 HydrophobicContact CD1-CG2 3.8Å; V70-V85 HydrophobicContact CG2-CG1 3.96Å; V70-V85 HydrophobicContact CG2-CG2 4.26Å; V70-L124 WeakPolarHBondContact O-CA 3.37Å; V70-L125 HydrophobicContact CB-CB 4.2Å; V70-L125 HydrophobicContact CB-CD1 4.42Å; V70-L125 HydrophobicContact CG1-CD1 4.14Å; V70-L125 PolarHBondContact N-O 3.34Å; V70-L125 PolarHBondContact O-N 3.03Å; V70-L127 HydrophobicContact CG2-CD1 4.46Å; V70-L127 HydrophobicContact CG2-CD2 4.14Å
71	V	98.9	Very high	98.5	Very high	1 Å²	1	27.3 Å²	27.3	1%	0.006	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	140	168.1	68.3	0	0	0	0	110	G62 S63 I65 V122 L124 L228 I231	G62-V71 CarbonylContact C-O 3.53Å; G62-V71 WeakPolarHBondContact CA-O 3.41Å; S63-V71 PolarHBondContact N-O 2.84Å; S63-V71 PolarHBondContact O-N 2.94Å; I65-V71 HydrophobicContact CD1-CB 4.32Å; I65-V71 HydrophobicContact CG2-CB 4.39Å; I65-V71 HydrophobicContact CG2-CG1 3.68Å; V71-V122 HydrophobicContact CG2-CG2 3.61Å; V71-L124 HydrophobicContact CB-CD2 3.74Å; V71-L124 HydrophobicContact CG2-CD2 3.86Å; V71-L228 HydrophobicContact CG1-CD2 3.52Å; V71-I231 HydrophobicContact CG2-CD1 3.58Å
72	T	98.9	Very high	98.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	-179.3	177.2	-171.6	0	0	0	0	109.9	L51 G61 V78 V122 T123 L125 G215	L51-T72 HydrophobicContact CD1-CG2 4.1Å; L51-T72 WeakPolarHBondContact CD1-OG1 3.27Å; G61-T72 PolarHBondContact O-OG1 3.11Å; T72-V78 HydrophobicContact CG2-CG2 4.14Å; T72-V122 WeakPolarHBondContact O-CA 3.12Å; T72-T123 PolarHBondContact N-O 2.84Å; T72-T123 PolarHBondContact O-N 3.45Å; T72-L125 HydrophobicContact CG2-CD1 3.94Å; T72-L125 HydrophobicContact CG2-CD2 4.32Å; T72-L125 HydrophobicContact CG2-CG 4.07Å; T72-G215 WeakPolarHBondContact OG1-CA 3.42Å
73	A	98.8	Very high	98.4	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.21	C	C	.	.			trans	-78.8	145.2	175.1	0	0	0	0	0	110.9	C76 I231	A73-C76 WeakPolarHBondContact O-CB 3.5Å; A73-C76 PolarHBondContact O-N 2.98Å; A73-I231 HydrophobicContact CB-CG2 4.18Å
74	A	98.8	Very high	98.4	Very high	5 Å²	5	39.9 Å²	39.9	4%	0.041	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-67.6	-35.9	177.6	0	0	0	0	0	112.6	C76 N77 T109 W113 D121 T123	A74-C76 PolarHBondContact O-N 3.07Å; A74-C76 VanDerWaalsContact O-N 3.15Å; A74-N77 PolarHBondContact O-N 2.79Å; A74-T109 HydrophobicContact CB-CG2 3.64Å; A74-W113 HydrophobicContact CB-CB 4.36Å; A74-W113 HydrophobicContact CB-CD2 3.58Å; A74-W113 HydrophobicContact CB-CE3 4.08Å; A74-W113 HydrophobicContact CB-CG 3.69Å; A74-W113 HydrophobicContact CB-CZ2 4.31Å; A74-D121 VanDerWaalsContact CA-OD1 3.32Å; A74-D121 WeakPolarHBondContact CA-OD1 3.29Å; A74-D121 WeakPolarHBondContact CB-OD1 3.22Å; A74-D121 PolarHBondContact N-OD1 3.29Å; A74-T123 VanDerWaalsContact CA-OG1 3.23Å; A74-T123 WeakPolarHBondContact CA-OG1 3.44Å; A74-T123 WeakPolarHBondContact CB-OG1 3.38Å
75	H	98.4	Very high	98.4	Very high	60 Å²	60	39.9 Å²	39.9	28%	0.278	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-65.8	-15	178.3	80.1	-97.6	0	0	0	113.6	N77 W113 M118 D121 S214 S233	H75-N77 PolarHBondContact O-N 2.92Å; H75-W113 HydrophobicContact CB-CH2 4.01Å; H75-W113 HydrophobicContact CB-CZ2 3.74Å; H75-M118 HydrophobicContact CB-SD 4.44Å; H75-D121 IonicContact CE1-OD2 3.79Å; H75-D121 PolarHBondContact CE1-OD2 2.84Å; H75-D121 IonicContact CG-OD1 3.11Å; H75-D121 IonicContact CG-OD2 3.95Å; H75-D121 PolarHBondContact N-OD1 2.81Å; H75-D121 IonicContact ND1-OD1 3.03Å; H75-D121 PolarHBondContact ND1-OD1 3.33Å; H75-D121 IonicContact ND1-OD2 3.39Å; H75-D121 PolarHBondContact ND1-OD2 3.26Å; H75-S214 PolarHBondContact CE1-OG 3.47Å; H75-S214 WeakPolarHBondContact NE2-CB 3.42Å; H75-S214 PolarHBondContact NE2-OG 2.69Å; H75-S233 PolarHBondContact CE1-O 2.75Å
76	C	98.4	Very high	98.4	Very high	11 Å²	11	39.1 Å²	39.1	7%	0.074	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-65.6	-15	170.6	-70.3	0	0	0	0	112.7	F59 C60 A73 A74 V78	F59-C76 HydrophobicContact CE2-CB 4.33Å; F59-C76 WeakPolarHBondContact CE2-O 3.16Å; C60-C76 HydrophobicContact CB-CB 3.76Å; C60-C76 WeakPolarHBondContact CB-SG 3.21Å; C60-C76 WeakPolarHBondContact SG-CB 3.24Å; C60-C76 CovalentContact SG-SG 2.04Å; C60-C76 PolarHBondContact SG-SG 3.13Å; A73-C76 WeakPolarHBondContact O-CB 3.5Å; A73-C76 PolarHBondContact O-N 2.98Å; A74-C76 PolarHBondContact O-N 3.07Å; A74-C76 VanDerWaalsContact O-N 3.15Å; C76-V78 VanDerWaalsContact C-N 3.33Å; C76-V78 HydrophobicContact CB-CG2 4.09Å; C76-V78 PolarHBondContact O-N 2.88Å
77	N	97.9	Very high	98.4	Very high	132 Å²	132	37.5 Å²	37.5	71%	0.706	21%	0.205	S	C	*	.			trans	49.4	49.9	172.3	-166.1	36.9	0	0	0	113.5	A74 H75 S79	A74-N77 PolarHBondContact O-N 2.79Å; H75-N77 PolarHBondContact O-N 2.92Å; N77-S79 PolarHBondContact O-N 3.5Å
78	V	98.5	Very high	98.4	Very high	13 Å²	13	33.6 Å²	33.6	8%	0.079	19%	0.189	C	C	.	.			trans	-69.1	129	-175.1	-175.8	0	0	0	0	110.9	L51 F59 T72 C76 H83 I104 A107 L125	L51-V78 HydrophobicContact CD1-CG2 3.69Å; F59-V78 HydrophobicContact CE2-CG2 4.4Å; F59-V78 HydrophobicContact CZ-CG2 4.34Å; T72-V78 HydrophobicContact CG2-CG2 4.14Å; C76-V78 VanDerWaalsContact C-N 3.33Å; C76-V78 HydrophobicContact CB-CG2 4.09Å; C76-V78 PolarHBondContact O-N 2.88Å; V78-H83 HydrophobicContact CG1-CB 4.04Å; V78-I104 HydrophobicContact CG1-CD1 3.34Å; V78-A107 WeakPolarHBondContact O-CB 3.43Å; V78-L125 HydrophobicContact CB-CD2 3.78Å; V78-L125 HydrophobicContact CG1-CD1 4.07Å; V78-L125 HydrophobicContact CG1-CD2 3.72Å; V78-L125 HydrophobicContact CG2-CD1 4.34Å; V78-L125 HydrophobicContact CG2-CD2 4.24Å
79	S	98.2	Very high	98.4	Very high	43 Å²	43	32.7 Å²	32.7	30%	0.301	18%	0.181	S	C	.	.			trans	-116.4	116.3	-176.8	-175	0	0	0	0	110.9	N77 R82 H83	N77-S79 PolarHBondContact O-N 3.5Å; S79-R82 PolarHBondContact O-N 2.75Å; S79-R82 VanDerWaalsContact O-N 3.15Å; S79-H83 PolarHBondContact N-ND1 3.39Å; S79-H83 PolarHBondContact O-N 2.03Å
80	P	98	Very high	98.3	Very high	52 Å²	52	33 Å²	33	34%	0.338	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.6	139.1	171.1	-28.8	37.1	0	0	0	112.2	R82 I104 A107	P80-R82 PolarHBondContact O-N 3.24Å; P80-I104 WeakPolarHBondContact CB-O 3.39Å; P80-I104 HydrophobicContact CG-CG2 4.11Å; P80-A107 HydrophobicContact CG-CB 4.05Å
81	G	96.5	Very high	98.2	Very high	69 Å²	69	33.9 Å²	33.9	71%	0.711	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.5	-11.5	-177.5	0	0	0	0	0	115.6
82	R	97.6	Very high	98	Very high	178 Å²	178	36.4 Å²	36.4	67%	0.672	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-112.1	-33	174	-65.9	-176.4	174.9	-175.2	-1.1	113.2	S54 S79 P80	S54-R82 PolarHBondContact N-O 2.97Å; S79-R82 PolarHBondContact O-N 2.75Å; S79-R82 VanDerWaalsContact O-N 3.15Å; P80-R82 PolarHBondContact O-N 3.24Å
83	H	98.7	Very high	97.8	Very high	36 Å²	36	40.8 Å²	40.8	17%	0.167	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	156.6	-177.7	-53.3	154.2	0	0	0	111.6	Q52 F59 V78 S79 I104	Q52-H83 CarbonylContact O-C 3.52Å; Q52-H83 VanDerWaalsContact O-CA 3.24Å; Q52-H83 WeakPolarHBondContact O-CA 3.25Å; F59-H83 HydrophobicContact CE1-CB 4.14Å; F59-H83 AromaticContact CE1-CD2 4Å; F59-H83 AromaticContact CE1-CG 3.8Å; F59-H83 HydrophobicContact CZ-CB 4.14Å; F59-H83 AromaticContact CZ-CE1 3.96Å; F59-H83 AromaticContact CZ-CG 3.74Å; F59-H83 AromaticContact CZ-ND1 3.5Å; V78-H83 HydrophobicContact CG1-CB 4.04Å; S79-H83 PolarHBondContact N-ND1 3.39Å; S79-H83 PolarHBondContact O-N 2.03Å; H83-I104 HydrophobicContact CB-CD1 4.45Å
84	F	98.7	Very high	97.5	Very high	52 Å²	52	42.4 Å²	42.4	23%	0.228	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	148.9	-173.7	-57.8	-91.7	0	0	0	110.6	L51 Q52 V101	L51-F84 WeakPolarHBondContact CA-O 3.45Å; Q52-F84 PolarHBondContact N-O 3.15Å; Q52-F84 PolarHBondContact O-N 2.87Å; F84-V101 HydrophobicContact CB-CG1 4.05Å; F84-V101 HydrophobicContact CD1-CG1 4.3Å; F84-V101 HydrophobicContact CG-CG1 4.36Å
85	V	98.8	Very high	97	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	120.3	170.1	163	0	0	0	0	107.9	V49 L51 V70 L87 L102 I104 L125 L127	V49-V85 HydrophobicContact CG1-CB 4.36Å; V49-V85 HydrophobicContact CG1-CG1 3.82Å; V49-V85 HydrophobicContact CG1-CG2 4.3Å; V49-V85 HydrophobicContact CG2-CG1 4.21Å; L51-V85 HydrophobicContact CD2-CG2 3.79Å; V70-V85 HydrophobicContact CG2-CG1 3.96Å; V70-V85 HydrophobicContact CG2-CG2 4.26Å; V85-L87 HydrophobicContact CG1-CD1 4.23Å; V85-L87 HydrophobicContact CG1-CG 3.95Å; V85-L102 HydrophobicContact CB-CB 4.44Å; V85-L102 PolarHBondContact N-O 2Å; V85-L102 PolarHBondContact O-N 2.83Å; V85-I104 HydrophobicContact CG2-CD1 4.11Å; V85-I104 HydrophobicContact CG2-CG1 3.99Å; V85-L125 HydrophobicContact CG2-CD1 4.12Å; V85-L127 HydrophobicContact CB-CD2 3.8Å; V85-L127 HydrophobicContact CG1-CD2 3.88Å; V85-L127 HydrophobicContact CG2-CD2 3.7Å
86	V	98.7	Very high	96.7	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.006	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	121.8	174.6	-172.5	0	0	0	0	109.5	S50 Q52 E89 L99 Q100 V101	S50-V86 PolarHBondContact N-O 2.87Å; S50-V86 PolarHBondContact O-N 2.96Å; Q52-V86 HydrophobicContact CB-CG2 4.3Å; Q52-V86 HydrophobicContact CG-CG2 3.94Å; V86-E89 HydrophobicContact CG1-CB 4.2Å; V86-L99 HydrophobicContact CG1-CB 4.4Å; V86-L99 HydrophobicContact CG1-CD1 4.11Å; V86-Q100 WeakPolarHBondContact CA-O 3.42Å; V86-V101 HydrophobicContact CG1-CG2 4.29Å; V86-V101 HydrophobicContact CG2-CG1 4.29Å; V86-V101 HydrophobicContact CG2-CG2 4.18Å
87	L	98.8	Very high	96.4	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	147.5	-177.6	-71.5	166.2	0	0	0	111.1	V49 L64 V85 E89 L99 Q100 L102 A131 I137	V49-L87 HydrophobicContact CG2-CD2 3.49Å; V49-L87 VanDerWaalsContact CG2-CD2 3.49Å; V49-L87 HydrophobicContact CG2-CG 4.42Å; L64-L87 HydrophobicContact CB-CD2 4.05Å; L64-L87 HydrophobicContact CD1-CD1 4.07Å; L64-L87 HydrophobicContact CD1-CD2 4.28Å; L64-L87 HydrophobicContact CD2-CD1 4.16Å; L64-L87 HydrophobicContact CD2-CD2 4.04Å; L64-L87 HydrophobicContact CG-CD2 4.37Å; V85-L87 HydrophobicContact CG1-CD1 4.23Å; V85-L87 HydrophobicContact CG1-CG 3.95Å; L87-E89 VanDerWaalsContact C-N 3.25Å; L87-L99 WeakPolarHBondContact O-CA 3.47Å; L87-Q100 HydrophobicContact CB-CB 4.28Å; L87-Q100 PolarHBondContact N-O 2.9Å; L87-Q100 PolarHBondContact O-N 3.4Å; L87-L102 HydrophobicContact CD1-CD1 3.82Å; L87-A131 HydrophobicContact CD1-CB 3.6Å; L87-I137 HydrophobicContact CB-CD1 3.86Å; L87-I137 HydrophobicContact CB-CG1 4.09Å; L87-I137 HydrophobicContact CB-CG2 4.15Å; L87-I137 HydrophobicContact CD1-CG2 4.05Å; L87-I137 HydrophobicContact CD2-CG2 4.5Å; L87-I137 HydrophobicContact CG-CG2 4.48Å
88	G	98	Very high	96.2	Very high	7 Å²	7	51 Å²	51	7%	0.072	31%	0.306	C	S	.	.	S	Bend	trans	80.9	4.5	-179.1	0	0	0	0	0	114.4	L99	G88-L99 VanDerWaalsContact C-CD2 3.48Å; G88-L99 WeakPolarHBondContact O-CD2 3.21Å
89	E	97.8	Very high	96.2	Very high	18 Å²	18	52.8 Å²	52.8	8%	0.084	32%	0.315	C	S	.	.			trans	-69.1	137	179.3	-175.4	61.6	-97.5	0	0	111.8	V86 L87 D91 L92 L99 W160	V86-E89 HydrophobicContact CG1-CB 4.2Å; L87-E89 VanDerWaalsContact C-N 3.25Å; E89-D91 VanDerWaalsContact OE1-C 3.28Å; E89-D91 PolarHBondContact OE1-N 2.87Å; E89-L92 HydrophobicContact CG-CD2 3.74Å; E89-L99 VanDerWaalsContact CA-CD2 3.41Å; E89-L99 HydrophobicContact CB-CD2 4.03Å; E89-L99 WeakPolarHBondContact OE2-CD1 3.4Å; E89-W160 HydrophobicContact CB-CH2 4.15Å; E89-W160 HydrophobicContact CB-CZ2 4.13Å; E89-W160 HydrophobicContact CG-CH2 4.12Å; E89-W160 HydrophobicContact CG-CZ2 3.76Å; E89-W160 WeakPolarHBondContact O-CZ2 3.3Å
90	H	97.3	Very high	96.2	Very high	14 Å²	14	52.4 Å²	52.4	7%	0.065	31%	0.308	C	S	.	.			trans	-130.3	-49	171.4	174.3	70.4	0	0	0	111.3	A40 P42 E97 W160 R173 L174	A40-H90 PolarHBondContact O-CE1 3.04Å; P42-H90 HydrophobicContact CB-CB 4.4Å; H90-E97 WeakPolarHBondContact CA-OE2 3.36Å; H90-E97 WeakPolarHBondContact CB-OE1 2.94Å; H90-E97 WeakPolarHBondContact CB-OE2 3.43Å; H90-E97 PolarHBondContact N-OE2 3Å; H90-W160 PolarHBondContact O-NE1 3.08Å; H90-R173 CarbonylContact O-C 3.55Å; H90-R173 VanDerWaalsContact O-CA 3.28Å; H90-R173 WeakPolarHBondContact O-CA 3.25Å; H90-L174 PolarHBondContact O-N 3.12Å
91	D	96.9	Very high	96.2	Very high	20 Å²	20	54.3 Å²	54.3	11%	0.107	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-116.1	101.1	-178	-166.2	-29.7	0	0	0	110.5	E89 S93 S94 E97 A172 R173	E89-D91 VanDerWaalsContact OE1-C 3.28Å; E89-D91 PolarHBondContact OE1-N 2.87Å; D91-S93 PolarHBondContact O-N 3.46Å; D91-S93 WeakPolarHBondContact OD1-CB 3.03Å; D91-S93 PolarHBondContact OD1-N 2.97Å; D91-S93 VanDerWaalsContact OD1-N 3.08Å; D91-S93 PolarHBondContact OD1-OG 3.3Å; D91-S94 WeakPolarHBondContact O-CB 3.3Å; D91-S94 PolarHBondContact O-N 3.2Å; D91-E97 PolarHBondContact N-OE2 3.16Å; D91-A172 CarbonylContact C-O 3.55Å; D91-A172 WeakPolarHBondContact CA-O 3.47Å; D91-A172 WeakPolarHBondContact OD1-CB 3.36Å; D91-R173 HydrophobicContact CB-CG 4.03Å; D91-R173 VanDerWaalsContact OD2-CG 3.29Å; D91-R173 WeakPolarHBondContact OD2-CG 3.48Å; D91-R173 IonicContact OD2-NE 3.49Å; D91-R173 PolarHBondContact OD2-NE 3.4Å; D91-R173 VanDerWaalsContact OD2-NE 3.11Å
92	L	94.6	Very high	96.3	Very high	54 Å²	54	51.8 Å²	51.8	28%	0.283	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-11.9	-179.5	-64.8	174.6	0	0	0	114	H58 E89 W160 A172	H58-L92 HydrophobicContact CB-CD1 3.98Å; H58-L92 HydrophobicContact CB-CD2 4.23Å; E89-L92 HydrophobicContact CG-CD2 3.74Å; L92-W160 HydrophobicContact CD1-CB 3.65Å; L92-W160 VanDerWaalsContact CD1-CD1 3.5Å; L92-W160 HydrophobicContact CD1-CD2 4.18Å; L92-W160 HydrophobicContact CD1-CG 3.52Å; L92-W160 HydrophobicContact CG-CD2 4.33Å; L92-W160 HydrophobicContact CG-CG 4.01Å; L92-A172 PolarHBondContact N-O 2.92Å
93	S	93.9	Very high	96.4	Very high	91 Å²	91	46.1 Å²	46.1	64%	0.636	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-2.8	175.3	72.6	0	0	0	0	113.9	D91	D91-S93 PolarHBondContact O-N 3.46Å; D91-S93 WeakPolarHBondContact OD1-CB 3.03Å; D91-S93 PolarHBondContact OD1-N 2.97Å; D91-S93 VanDerWaalsContact OD1-N 3.08Å; D91-S93 PolarHBondContact OD1-OG 3.3Å
94	S	92.6	Very high	96.4	Very high	34 Å²	34	44.8 Å²	44.8	24%	0.238	27%	0.271	C	S	.	.			trans	-110.7	131.5	-174.2	178.5	0	0	0	0	112.3	D91 A96	D91-S94 WeakPolarHBondContact O-CB 3.3Å; D91-S94 PolarHBondContact O-N 3.2Å; S94-A96 PolarHBondContact OG-N 3.41Å
95	N	88.8	Confident	96.4	Very high	167 Å²	167	45 Å²	45	89%	0.893	28%	0.278	S	S	*	.	S	Bend	trans	-99.7	8.9	171.2	-64.4	-33.9	0	0	0	113
96	A	91.6	Very high	96.3	Very high	91 Å²	91	48.8 Å²	48.8	75%	0.752	30%	0.296	S	S	*	.			trans	-92.6	-9.7	-173.5	0	0	0	0	0	113.7	S94	S94-A96 PolarHBondContact OG-N 3.41Å
97	E	93.7	Very high	96.4	Very high	32 Å²	32	50.3 Å²	50.3	15%	0.15	31%	0.309	C	S	.	.	S	Bend	trans	-78.7	146.5	-175.7	-61.4	-159.4	90.8	0	0	111.7	H90 D91 L99 R136	H90-E97 WeakPolarHBondContact CA-OE2 3.36Å; H90-E97 WeakPolarHBondContact CB-OE1 2.94Å; H90-E97 WeakPolarHBondContact CB-OE2 3.43Å; H90-E97 PolarHBondContact N-OE2 3Å; D91-E97 PolarHBondContact N-OE2 3.16Å; E97-L99 HydrophobicContact CB-CD2 3.65Å; E97-L99 HydrophobicContact CB-CG 4.03Å; E97-L99 PolarHBondContact O-N 2.82Å; E97-R136 IonicContact OE1-NH1 2.56Å; E97-R136 PolarHBondContact OE1-NH1 3.47Å
98	P	93.8	Very high	96.4	Very high	98 Å²	98	52.2 Å²	52.2	64%	0.636	32%	0.318	S	S	*	.			trans	-77.5	71.7	177.9	32.8	-35.6	0	0	0	110.8
99	L	97.2	Very high	96.4	Very high	52 Å²	52	54.7 Å²	54.7	27%	0.272	33%	0.333	S	S	.	.			trans	-79.2	157.4	-176	-52.6	-179	0	0	0	112.5	V86 L87 G88 E89 E97	V86-L99 HydrophobicContact CG1-CB 4.4Å; V86-L99 HydrophobicContact CG1-CD1 4.11Å; L87-L99 WeakPolarHBondContact O-CA 3.47Å; G88-L99 VanDerWaalsContact C-CD2 3.48Å; G88-L99 WeakPolarHBondContact O-CD2 3.21Å; E89-L99 VanDerWaalsContact CA-CD2 3.41Å; E89-L99 HydrophobicContact CB-CD2 4.03Å; E89-L99 WeakPolarHBondContact OE2-CD1 3.4Å; E97-L99 HydrophobicContact CB-CD2 3.65Å; E97-L99 HydrophobicContact CB-CG 4.03Å; E97-L99 PolarHBondContact O-N 2.82Å
100	Q	98.4	Very high	96.4	Very high	34 Å²	34	55.1 Å²	55.1	16%	0.159	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	117	160.1	-77.6	173.9	55.7	0	0	109.6	V86 L87 L102 Q132 I137	V86-Q100 WeakPolarHBondContact CA-O 3.42Å; L87-Q100 HydrophobicContact CB-CB 4.28Å; L87-Q100 PolarHBondContact N-O 2.9Å; L87-Q100 PolarHBondContact O-N 3.4Å; Q100-L102 HydrophobicContact CB-CD2 4.39Å; Q100-L102 HydrophobicContact CB-CG 4.26Å; Q100-Q132 PolarHBondContact NE2-O 2.77Å; Q100-I137 HydrophobicContact CB-CD1 4.19Å; Q100-I137 HydrophobicContact CG-CD1 4.05Å
101	V	98.3	Very high	96.5	Very high	92 Å²	92	59.7 Å²	59.7	56%	0.558	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	110.7	172.8	-175.9	0	0	0	0	108	F84 V86	F84-V101 HydrophobicContact CB-CG1 4.05Å; F84-V101 HydrophobicContact CD1-CG1 4.3Å; F84-V101 HydrophobicContact CG-CG1 4.36Å; V86-V101 HydrophobicContact CG1-CG2 4.29Å; V86-V101 HydrophobicContact CG2-CG1 4.29Å; V86-V101 HydrophobicContact CG2-CG2 4.18Å
102	L	98.7	Very high	96.6	Very high	16 Å²	16	62.1 Å²	62.1	8%	0.084	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.8	-170.9	-57.6	178.2	0	0	0	110.7	V85 L87 Q100 L127 A131	V85-L102 HydrophobicContact CB-CB 4.44Å; V85-L102 PolarHBondContact N-O 2Å; V85-L102 PolarHBondContact O-N 2.83Å; L87-L102 HydrophobicContact CD1-CD1 3.82Å; Q100-L102 HydrophobicContact CB-CD2 4.39Å; Q100-L102 HydrophobicContact CB-CG 4.26Å; L102-L127 HydrophobicContact CB-CD2 4.4Å; L102-L127 HydrophobicContact CD1-CD1 3.81Å; L102-A131 HydrophobicContact CD1-CB 3.81Å
103	S	98.6	Very high	96.8	Very high	60 Å²	60	62 Å²	62	42%	0.42	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	152.1	170.7	-57.3	0	0	0	0	111.2	A128	S103-A128 WeakPolarHBondContact O-CB 3.47Å; S103-A128 PolarHBondContact O-N 3.02Å
104	I	98.8	Very high	97	Very high	8 Å²	8	60.6 Å²	60.6	4%	0.041	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	126.6	177.4	-56.5	168.2	0	0	0	108	V78 P80 H83 V85 Q106 L125	V78-I104 HydrophobicContact CG1-CD1 3.34Å; P80-I104 WeakPolarHBondContact CB-O 3.39Å; P80-I104 HydrophobicContact CG-CG2 4.11Å; H83-I104 HydrophobicContact CB-CD1 4.45Å; V85-I104 HydrophobicContact CG2-CD1 4.11Å; V85-I104 HydrophobicContact CG2-CG1 3.99Å; I104-Q106 VanDerWaalsContact CG2-O 3.31Å; I104-Q106 WeakPolarHBondContact CG2-O 3.34Å; I104-L125 HydrophobicContact CD1-CD1 4.08Å; I104-L125 HydrophobicContact CG2-CB 4.21Å; I104-L125 HydrophobicContact CG2-CD2 4.48Å
105	S	98.6	Very high	97.2	Very high	56 Å²	56	63 Å²	63	39%	0.392	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-39.1	175.5	61.9	0	0	0	0	111.9	K126	S105-K126 PolarHBondContact N-O 3.04Å; S105-K126 PolarHBondContact OG-O 2.9Å
106	Q	98.6	Very high	97.6	Very high	80 Å²	80	61 Å²	61	37%	0.374	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	141.6	-179.8	-62.9	178.7	-53.8	0	0	110.7	I104 I108 L125 K126	I104-Q106 VanDerWaalsContact CG2-O 3.31Å; I104-Q106 WeakPolarHBondContact CG2-O 3.34Å; Q106-I108 HydrophobicContact CB-CG1 4.31Å; Q106-L125 WeakPolarHBondContact O-CA 3.27Å; Q106-K126 HydrophobicContact CB-CB 4.1Å; Q106-K126 PolarHBondContact N-O 3.21Å; Q106-K126 PolarHBondContact O-N 3.41Å
107	A	98.8	Very high	97.8	Very high	33 Å²	33	59.9 Å²	59.9	27%	0.273	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	116.2	167.1	0	0	0	0	0	108.1	V78 P80 T123 L125	V78-A107 WeakPolarHBondContact O-CB 3.43Å; P80-A107 HydrophobicContact CG-CB 4.05Å; A107-T123 HydrophobicContact CB-CG2 4.27Å; A107-L125 HydrophobicContact CB-CD2 3.77Å
108	I	98.8	Very high	98	Very high	39 Å²	39	61.5 Å²	61.5	20%	0.2	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	95.7	-172.8	-54.7	174.3	0	0	0	107.9	W69 Q106 T123 L124 W256 V260 N264	W69-I108 HydrophobicContact CH2-CD1 3.94Å; W69-I108 HydrophobicContact CZ3-CD1 4.16Å; Q106-I108 HydrophobicContact CB-CG1 4.31Å; I108-T123 WeakPolarHBondContact O-CA 3.32Å; I108-L124 PolarHBondContact N-O 2.96Å; I108-L124 PolarHBondContact O-N 3.34Å; I108-W256 HydrophobicContact CG2-CZ2 4.39Å; I108-V260 HydrophobicContact CB-CG1 4.27Å; I108-V260 HydrophobicContact CD1-CG1 3.58Å; I108-V260 HydrophobicContact CG2-CG1 4.07Å; I108-V260 HydrophobicContact CG2-CG2 4.2Å; I108-N264 HydrophobicContact CD1-CB 4.43Å
109	T	98.8	Very high	98.2	Very high	60 Å²	60	58.4 Å²	58.4	37%	0.368	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	141.2	177.5	-60	0	0	0	0	110.5	A74 W113 T123	A74-T109 HydrophobicContact CB-CG2 3.64Å; T109-W113 HydrophobicContact CG2-CB 3.75Å; T109-W113 HydrophobicContact CG2-CG 3.94Å; T109-T123 WeakPolarHBondContact CA-OG1 3.03Å; T109-T123 WeakPolarHBondContact CB-OG1 3.19Å; T109-T123 PolarHBondContact OG1-OG1 3.4Å
110	H	98.8	Very high	98.2	Very high	27 Å²	27	57 Å²	57	13%	0.125	34%	0.337	C	S	.	.			trans	-55.7	130.5	176.4	-171.6	-84.7	0	0	0	110.5	S112 W113 V122 F253 W256	H110-S112 PolarHBondContact ND1-N 3.23Å; H110-S112 VanDerWaalsContact ND1-N 3.17Å; H110-S112 PolarHBondContact O-N 3.39Å; H110-S112 VanDerWaalsContact O-N 3.11Å; H110-W113 WeakPolarHBondContact O-CB 3.34Å; H110-W113 PolarHBondContact O-N 2.91Å; H110-V122 HydrophobicContact CB-CG1 3.73Å; H110-V122 PolarHBondContact N-O 3.11Å; H110-F253 AromaticContact CD2-CD1 3.57Å; H110-F253 AromaticContact CD2-CE1 3.74Å; H110-F253 AromaticContact NE2-CD1 3.81Å; H110-F253 AromaticContact NE2-CE1 3.78Å; H110-W256 HydrophobicContact CB-CH2 4.21Å; H110-W256 HydrophobicContact CB-CZ2 3.98Å; H110-W256 AromaticContact CD2-CD1 3.78Å; H110-W256 AromaticContact CD2-CD2 3.48Å; H110-W256 VanDerWaalsContact CD2-CD2 3.48Å; H110-W256 AromaticContact CD2-CE2 3.67Å; H110-W256 AromaticContact CD2-CE3 3.96Å; H110-W256 AromaticContact CD2-CG 3.58Å; H110-W256 AromaticContact CD2-NE1 3.82Å
111	P	98.3	Very high	98.3	Very high	110 Å²	110	55.3 Å²	55.3	71%	0.714	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-23	-171.1	24.7	-35.3	0	0	0	113.7
112	S	98.5	Very high	98.3	Very high	70 Å²	70	51 Å²	51	49%	0.49	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	15.6	175.7	-44.6	0	0	0	0	113.8	H110 N114 N120	H110-S112 PolarHBondContact ND1-N 3.23Å; H110-S112 VanDerWaalsContact ND1-N 3.17Å; H110-S112 PolarHBondContact O-N 3.39Å; H110-S112 VanDerWaalsContact O-N 3.11Å; S112-N114 PolarHBondContact O-N 3.49Å; S112-N120 WeakPolarHBondContact CB-ND2 3.36Å; S112-N120 PolarHBondContact O-ND2 3.44Å
113	W	98.6	Very high	98.3	Very high	53 Å²	53	50.3 Å²	50.3	20%	0.201	30%	0.299	C	S	.	.			trans	-55.2	129.2	171.8	165.6	-128.9	0	0	0	110.5	A74 H75 T109 H110 P115 M118 D121	A74-W113 HydrophobicContact CB-CB 4.36Å; A74-W113 HydrophobicContact CB-CD2 3.58Å; A74-W113 HydrophobicContact CB-CE3 4.08Å; A74-W113 HydrophobicContact CB-CG 3.69Å; A74-W113 HydrophobicContact CB-CZ2 4.31Å; H75-W113 HydrophobicContact CB-CH2 4.01Å; H75-W113 HydrophobicContact CB-CZ2 3.74Å; T109-W113 HydrophobicContact CG2-CB 3.75Å; T109-W113 HydrophobicContact CG2-CG 3.94Å; H110-W113 WeakPolarHBondContact O-CB 3.34Å; H110-W113 PolarHBondContact O-N 2.91Å; W113-P115 HydrophobicContact CZ2-CB 4.05Å; W113-M118 HydrophobicContact CH2-CB 4.23Å; W113-M118 HydrophobicContact CH2-SD 3.56Å; W113-M118 VanDerWaalsContact CH2-SD 3.56Å; W113-M118 HydrophobicContact CZ2-SD 4.2Å; W113-M118 VanDerWaalsContact CZ3-CA 3.46Å; W113-M118 HydrophobicContact CZ3-CB 4.37Å; W113-D121 HydrophobicContact CE3-CB 3.9Å; W113-D121 HydrophobicContact CH2-CB 3.84Å; W113-D121 WeakPolarHBondContact CH2-OD1 3.33Å; W113-D121 HydrophobicContact CZ3-CB 3.27Å
114	N	98.4	Very high	98.3	Very high	60 Å²	60	47.5 Å²	47.5	32%	0.321	28%	0.279	S	S	.	.	B	Isolated β-bridge	trans	-120.4	107.7	176.8	-173.7	-39.2	0	0	0	110.6	S112 T116 T117 M118 N119	S112-N114 PolarHBondContact O-N 3.49Å; N114-T116 PolarHBondContact O-N 3.13Å; N114-T116 WeakPolarHBondContact OD1-CA 3.48Å; N114-T116 VanDerWaalsContact OD1-CB 3.3Å; N114-T116 WeakPolarHBondContact OD1-CB 3.49Å; N114-T116 PolarHBondContact OD1-N 3.22Å; N114-T117 WeakPolarHBondContact CB-OG1 3.28Å; N114-T117 VanDerWaalsContact CG-OG1 3.26Å; N114-T117 PolarHBondContact O-N 3.35Å; N114-T117 PolarHBondContact OD1-N 3.45Å; N114-T117 VanDerWaalsContact OD1-N 3.13Å; N114-M118 VanDerWaalsContact O-CA 3.32Å; N114-M118 WeakPolarHBondContact O-CA 3.19Å; N114-M118 PolarHBondContact O-N 3.45Å; N114-N119 HydrophobicContact CB-CB 4.46Å; N114-N119 PolarHBondContact N-O 2.66Å; N114-N119 PolarHBondContact O-N 2.86Å
115	P	97.3	Very high	98.3	Very high	84 Å²	84	47.1 Å²	47.1	55%	0.545	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-12.8	-177.7	30.2	-36.3	0	0	0	114.1	W113 M118	W113-P115 HydrophobicContact CZ2-CB 4.05Å; P115-M118 WeakPolarHBondContact O-CE 3.23Å
116	T	96.4	Very high	98.3	Very high	126 Å²	126	46.9 Å²	46.9	77%	0.773	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-44.9	176.3	-54.5	0	0	0	0	111.4	N114	N114-T116 PolarHBondContact O-N 3.13Å; N114-T116 WeakPolarHBondContact OD1-CA 3.48Å; N114-T116 VanDerWaalsContact OD1-CB 3.3Å; N114-T116 WeakPolarHBondContact OD1-CB 3.49Å; N114-T116 PolarHBondContact OD1-N 3.22Å
117	T	96.7	Very high	98.3	Very high	68 Å²	68	43.3 Å²	43.3	42%	0.417	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-4.6	-177.1	60.2	0	0	0	0	113.4	N114 N119 M199	N114-T117 WeakPolarHBondContact CB-OG1 3.28Å; N114-T117 VanDerWaalsContact CG-OG1 3.26Å; N114-T117 PolarHBondContact O-N 3.35Å; N114-T117 PolarHBondContact OD1-N 3.45Å; N114-T117 VanDerWaalsContact OD1-N 3.13Å; T117-N119 PolarHBondContact O-N 2.88Å; T117-N119 VanDerWaalsContact O-N 3.12Å; T117-N119 VanDerWaalsContact OG1-CB 3.28Å; T117-N119 WeakPolarHBondContact OG1-CB 3.44Å; T117-N119 PolarHBondContact OG1-N 2.84Å; T117-M199 WeakPolarHBondContact O-CE 3.23Å
118	M	97.4	Very high	98.3	Very high	65 Å²	65	44.8 Å²	44.8	32%	0.32	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	22.3	-169.1	-53.2	-64	166.4	0	0	113	H75 W113 N114 P115 M199 W234	H75-M118 HydrophobicContact CB-SD 4.44Å; W113-M118 HydrophobicContact CH2-CB 4.23Å; W113-M118 HydrophobicContact CH2-SD 3.56Å; W113-M118 VanDerWaalsContact CH2-SD 3.56Å; W113-M118 HydrophobicContact CZ2-SD 4.2Å; W113-M118 VanDerWaalsContact CZ3-CA 3.46Å; W113-M118 HydrophobicContact CZ3-CB 4.37Å; N114-M118 VanDerWaalsContact O-CA 3.32Å; N114-M118 WeakPolarHBondContact O-CA 3.19Å; N114-M118 PolarHBondContact O-N 3.45Å; P115-M118 WeakPolarHBondContact O-CE 3.23Å; M118-M199 WeakPolarHBondContact O-CE 3.48Å; M118-W234 VanDerWaalsContact CB-CD1 3.47Å; M118-W234 HydrophobicContact CB-CG 4.25Å; M118-W234 HydrophobicContact CG-CG 4.32Å
119	N	98.2	Very high	98.3	Very high	33 Å²	33	45.6 Å²	45.6	18%	0.176	27%	0.274	C	S	.	.	B	Isolated β-bridge	trans	-81.9	140.1	179.7	-166.6	33.6	0	0	0	111.6	N114 T117 T196 S198 M199	N114-N119 HydrophobicContact CB-CB 4.46Å; N114-N119 PolarHBondContact N-O 2.66Å; N114-N119 PolarHBondContact O-N 2.86Å; T117-N119 PolarHBondContact O-N 2.88Å; T117-N119 VanDerWaalsContact O-N 3.12Å; T117-N119 VanDerWaalsContact OG1-CB 3.28Å; T117-N119 WeakPolarHBondContact OG1-CB 3.44Å; T117-N119 PolarHBondContact OG1-N 2.84Å; N119-T196 HydrophobicContact CB-CG2 4.27Å; N119-T196 WeakPolarHBondContact OD1-CB 3.34Å; N119-T196 PolarHBondContact OD1-OG1 3.01Å; N119-S198 WeakPolarHBondContact OD1-CB 3.34Å; N119-M199 HydrophobicContact CB-CE 4.18Å
120	N	98.5	Very high	98.3	Very high	22 Å²	22	45.8 Å²	45.8	12%	0.118	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	60	41.6	-175.6	-46.5	-48.8	0	0	0	113.5	S112 V122 S198 F253	S112-N120 WeakPolarHBondContact CB-ND2 3.36Å; S112-N120 PolarHBondContact O-ND2 3.44Å; N120-V122 VanDerWaalsContact C-N 3.31Å; N120-V122 PolarHBondContact O-N 3.17Å; N120-S198 WeakPolarHBondContact OD1-CB 3.22Å; N120-S198 PolarHBondContact OD1-OG 2.83Å; N120-F253 HydrophobicContact CB-CE1 3.87Å; N120-F253 HydrophobicContact CB-CZ 3.87Å; N120-F253 WeakPolarHBondContact OD1-CZ 3.22Å
121	D	98.8	Very high	98.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	27%	0.271	C	S	.	.			trans	-74.9	74	-177.6	-167.3	15.5	0	0	0	112.5	A74 H75 W113 S233 T248	A74-D121 VanDerWaalsContact CA-OD1 3.32Å; A74-D121 WeakPolarHBondContact CA-OD1 3.29Å; A74-D121 WeakPolarHBondContact CB-OD1 3.22Å; A74-D121 PolarHBondContact N-OD1 3.29Å; H75-D121 IonicContact CE1-OD2 3.79Å; H75-D121 PolarHBondContact CE1-OD2 2.84Å; H75-D121 IonicContact CG-OD1 3.11Å; H75-D121 IonicContact CG-OD2 3.95Å; H75-D121 PolarHBondContact N-OD1 2.81Å; H75-D121 IonicContact ND1-OD1 3.03Å; H75-D121 PolarHBondContact ND1-OD1 3.33Å; H75-D121 IonicContact ND1-OD2 3.39Å; H75-D121 PolarHBondContact ND1-OD2 3.26Å; W113-D121 HydrophobicContact CE3-CB 3.9Å; W113-D121 HydrophobicContact CH2-CB 3.84Å; W113-D121 WeakPolarHBondContact CH2-OD1 3.33Å; W113-D121 HydrophobicContact CZ3-CB 3.27Å; D121-S233 WeakPolarHBondContact CB-OG 3.38Å; D121-S233 WeakPolarHBondContact OD2-CB 3.3Å; D121-S233 PolarHBondContact OD2-OG 3Å; D121-T248 WeakPolarHBondContact CB-OG1 3.41Å; D121-T248 PolarHBondContact O-OG1 2.81Å
122	V	98.9	Very high	98.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	26%	0.262	C	S	.	.			trans	-147	137.9	179.4	63	0	0	0	0	112.4	V71 T72 H110 N120 I231 T248 F253 W256	V71-V122 HydrophobicContact CG2-CG2 3.61Å; T72-V122 WeakPolarHBondContact O-CA 3.12Å; H110-V122 HydrophobicContact CB-CG1 3.73Å; H110-V122 PolarHBondContact N-O 3.11Å; N120-V122 VanDerWaalsContact C-N 3.31Å; N120-V122 PolarHBondContact O-N 3.17Å; V122-I231 HydrophobicContact CB-CD1 4.27Å; V122-I231 HydrophobicContact CG2-CD1 3.67Å; V122-T248 HydrophobicContact CB-CG2 4.21Å; V122-F253 HydrophobicContact CG1-CD1 3.68Å; V122-F253 HydrophobicContact CG1-CD2 4.4Å; V122-F253 HydrophobicContact CG1-CE1 3.99Å; V122-F253 HydrophobicContact CG1-CG 3.92Å; V122-F253 HydrophobicContact CG1-CZ 4.5Å; V122-W256 HydrophobicContact CB-CZ3 4.42Å; V122-W256 HydrophobicContact CG1-CE3 4.24Å; V122-W256 HydrophobicContact CG1-CH2 4.25Å; V122-W256 HydrophobicContact CG1-CZ3 3.74Å; V122-W256 HydrophobicContact CG2-CH2 4.46Å; V122-W256 HydrophobicContact CG2-CZ3 3.84Å
123	T	98.9	Very high	98.3	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.018	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	137.7	174.2	-67.5	0	0	0	0	109.7	T72 A74 A107 I108 T109 L125	T72-T123 PolarHBondContact N-O 2.84Å; T72-T123 PolarHBondContact O-N 3.45Å; A74-T123 VanDerWaalsContact CA-OG1 3.23Å; A74-T123 WeakPolarHBondContact CA-OG1 3.44Å; A74-T123 WeakPolarHBondContact CB-OG1 3.38Å; A107-T123 HydrophobicContact CB-CG2 4.27Å; I108-T123 WeakPolarHBondContact O-CA 3.32Å; T109-T123 WeakPolarHBondContact CA-OG1 3.03Å; T109-T123 WeakPolarHBondContact CB-OG1 3.19Å; T109-T123 PolarHBondContact OG1-OG1 3.4Å; T123-L125 HydrophobicContact CG2-CD2 3.83Å
124	L	98.9	Very high	98.2	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	136	168.5	-73.4	178.8	0	0	0	110.6	I65 W69 V70 V71 I108 W256 I257 V260 I261	I65-L124 HydrophobicContact CD1-CD2 3.69Å; W69-L124 HydrophobicContact CE3-CB 3.98Å; W69-L124 HydrophobicContact CE3-CD1 4.48Å; W69-L124 HydrophobicContact CZ3-CB 3.9Å; V70-L124 WeakPolarHBondContact O-CA 3.37Å; V71-L124 HydrophobicContact CB-CD2 3.74Å; V71-L124 HydrophobicContact CG2-CD2 3.86Å; I108-L124 PolarHBondContact N-O 2.96Å; I108-L124 PolarHBondContact O-N 3.34Å; L124-W256 HydrophobicContact CB-CH2 4.43Å; L124-W256 HydrophobicContact CD1-CH2 4.26Å; L124-W256 HydrophobicContact CD1-CZ3 4.17Å; L124-W256 HydrophobicContact CG-CH2 3.95Å; L124-W256 HydrophobicContact CG-CZ3 3.96Å; L124-I257 HydrophobicContact CD1-CB 4.32Å; L124-I257 HydrophobicContact CD1-CG1 4.33Å; L124-I257 HydrophobicContact CD1-CG2 4.12Å; L124-I257 HydrophobicContact CD2-CG1 4.49Å; L124-I257 HydrophobicContact CD2-CG2 4.34Å; L124-V260 HydrophobicContact CB-CG1 4.39Å; L124-V260 HydrophobicContact CD1-CB 3.7Å; L124-V260 HydrophobicContact CD1-CG1 3.59Å; L124-V260 HydrophobicContact CD1-CG2 4.42Å; L124-I261 HydrophobicContact CD1-CG1 4.42Å
125	L	98.9	Very high	98.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	118.8	176	-48.6	176.6	0	0	0	108.3	L51 W69 V70 T72 V78 V85 I104 Q106 A107 T123	L51-L125 HydrophobicContact CD1-CD1 4.39Å; L51-L125 HydrophobicContact CD2-CD1 3.65Å; W69-L125 WeakPolarHBondContact CA-O 3.21Å; V70-L125 HydrophobicContact CB-CB 4.2Å; V70-L125 HydrophobicContact CB-CD1 4.42Å; V70-L125 HydrophobicContact CG1-CD1 4.14Å; V70-L125 PolarHBondContact N-O 3.34Å; V70-L125 PolarHBondContact O-N 3.03Å; T72-L125 HydrophobicContact CG2-CD1 3.94Å; T72-L125 HydrophobicContact CG2-CD2 4.32Å; T72-L125 HydrophobicContact CG2-CG 4.07Å; V78-L125 HydrophobicContact CB-CD2 3.78Å; V78-L125 HydrophobicContact CG1-CD1 4.07Å; V78-L125 HydrophobicContact CG1-CD2 3.72Å; V78-L125 HydrophobicContact CG2-CD1 4.34Å; V78-L125 HydrophobicContact CG2-CD2 4.24Å; V85-L125 HydrophobicContact CG2-CD1 4.12Å; I104-L125 HydrophobicContact CD1-CD1 4.08Å; I104-L125 HydrophobicContact CG2-CB 4.21Å; I104-L125 HydrophobicContact CG2-CD2 4.48Å; Q106-L125 WeakPolarHBondContact O-CA 3.27Å; A107-L125 HydrophobicContact CB-CD2 3.77Å; T123-L125 HydrophobicContact CG2-CD2 3.83Å
126	K	98.9	Very high	98.1	Very high	51 Å²	51	43.6 Å²	43.6	22%	0.222	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	119	170.8	-166.9	177.9	179.4	-179.5	0	109	S68 W69 S105 Q106 N264	S68-K126 WeakPolarHBondContact O-CA 3.31Å; W69-K126 HydrophobicContact CD2-CB 4.5Å; W69-K126 HydrophobicContact CD2-CG 4.49Å; W69-K126 HydrophobicContact CE3-CB 4.05Å; W69-K126 HydrophobicContact CH2-CB 3.76Å; W69-K126 HydrophobicContact CH2-CD 3.99Å; W69-K126 HydrophobicContact CH2-CG 3.98Å; W69-K126 HydrophobicContact CZ2-CB 4.21Å; W69-K126 HydrophobicContact CZ2-CD 3.89Å; W69-K126 HydrophobicContact CZ2-CG 3.92Å; W69-K126 HydrophobicContact CZ3-CB 3.67Å; W69-K126 HydrophobicContact CZ3-CG 4.28Å; S105-K126 PolarHBondContact N-O 3.04Å; S105-K126 PolarHBondContact OG-O 2.9Å; Q106-K126 HydrophobicContact CB-CB 4.1Å; Q106-K126 PolarHBondContact N-O 3.21Å; Q106-K126 PolarHBondContact O-N 3.41Å; K126-N264 PolarHBondContact NZ-O 2.59Å; K126-N264 PolarHBondContact NZ-OXT 3.14Å
127	L	98.8	Very high	98.2	Very high	6 Å²	6	37.7 Å²	37.7	3%	0.031	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	143	177.5	-54.8	177.9	0	0	0	110	L64 Q67 S68 V70 V85 L102 S129 A131	L64-L127 HydrophobicContact CD1-CD1 4.17Å; Q67-L127 WeakPolarHBondContact O-CD1 3.35Å; S68-L127 PolarHBondContact O-N 3.32Å; V70-L127 HydrophobicContact CG2-CD1 4.46Å; V70-L127 HydrophobicContact CG2-CD2 4.14Å; V85-L127 HydrophobicContact CB-CD2 3.8Å; V85-L127 HydrophobicContact CG1-CD2 3.88Å; V85-L127 HydrophobicContact CG2-CD2 3.7Å; L102-L127 HydrophobicContact CB-CD2 4.4Å; L102-L127 HydrophobicContact CD1-CD1 3.81Å; L127-S129 VanDerWaalsContact C-N 3.26Å; L127-S129 VanDerWaalsContact CB-O 3.27Å; L127-S129 WeakPolarHBondContact CB-O 3.33Å; L127-A131 HydrophobicContact CD1-CB 4.21Å
128	A	98.5	Very high	98.3	Very high	63 Å²	63	34.7 Å²	34.7	52%	0.521	19%	0.192	S	C	.	.	S	Bend	trans	-70.3	-26.8	177.7	0	0	0	0	0	112.4	S103	S103-A128 WeakPolarHBondContact O-CB 3.47Å; S103-A128 PolarHBondContact O-N 3.02Å
129	S	98.3	Very high	98.4	Very high	57 Å²	57	31.9 Å²	31.9	40%	0.399	18%	0.179	S	C	.	.	S	Bend	trans	-135.4	147.6	170	54.1	0	0	0	0	109.8	L127 A131	L127-S129 VanDerWaalsContact C-N 3.26Å; L127-S129 VanDerWaalsContact CB-O 3.27Å; L127-S129 WeakPolarHBondContact CB-O 3.33Å; S129-A131 PolarHBondContact O-N 3.03Å
130	P	98.4	Very high	98.4	Very high	64 Å²	64	30.4 Å²	30.4	42%	0.416	17%	0.171	S	C	.	.	P	Polyproline II helix	trans	-63.8	133.6	177.3	-20.1	31.8	0	0	0	111.8	Q67 Q132	Q67-P130 HydrophobicContact CB-CB 4.01Å; Q67-P130 CarbonylContact O-C 3.45Å; Q67-P130 WeakPolarHBondContact O-CA 3.28Å; P130-Q132 PolarHBondContact O-NE2 2.9Å; P130-Q132 VanDerWaalsContact O-NE2 3.15Å
131	A	98.6	Very high	98.4	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-59.5	136.2	169.5	0	0	0	0	0	110.8	L64 Q67 L87 L102 L127 S129	L64-A131 HydrophobicContact CD1-CB 4.37Å; L64-A131 HydrophobicContact CD2-CB 4.39Å; Q67-A131 WeakPolarHBondContact O-CB 3.3Å; Q67-A131 PolarHBondContact O-N 2.81Å; L87-A131 HydrophobicContact CD1-CB 3.6Å; L102-A131 HydrophobicContact CD1-CB 3.81Å; L127-A131 HydrophobicContact CD1-CB 4.21Å; S129-A131 PolarHBondContact O-N 3.03Å
132	Q	98.3	Very high	98.3	Very high	116 Å²	116	32.3 Å²	32.3	54%	0.542	18%	0.182	S	C	.	.	P	Polyproline II helix	trans	-85	121.2	173.2	-56.8	-56	-55.5	0	0	108.9	Q100 P130	Q100-Q132 PolarHBondContact NE2-O 2.77Å; P130-Q132 PolarHBondContact O-NE2 2.9Å; P130-Q132 VanDerWaalsContact O-NE2 3.15Å
133	Y	98.1	Very high	98.2	Very high	45 Å²	45	32.4 Å²	32.4	18%	0.176	18%	0.183	C	C	.	.	P	Polyproline II helix	trans	-71.9	138.7	177.9	-64.7	-22.1	0	0	0	111.4	W17 L64 S66 Q67 I137 P139	W17-Y133 HydrophobicContact CB-CD2 3.67Å; W17-Y133 HydrophobicContact CB-CE2 4.17Å; W17-Y133 HydrophobicContact CD2-CD2 4.2Å; W17-Y133 HydrophobicContact CD2-CG 4.47Å; W17-Y133 HydrophobicContact CE3-CD2 4.33Å; W17-Y133 HydrophobicContact CE3-CG 4.27Å; W17-Y133 AromaticContact CG-CD2 3.95Å; W17-Y133 HydrophobicContact CG-CD2 3.95Å; L64-Y133 HydrophobicContact CD2-CD1 4.46Å; L64-Y133 HydrophobicContact CD2-CE1 3.92Å; S66-Y133 WeakPolarHBondContact CA-OH 3.38Å; Q67-Y133 HydrophobicContact CB-CE1 4.36Å; Q67-Y133 HydrophobicContact CG-CD1 4.24Å; Q67-Y133 HydrophobicContact CG-CD2 4.2Å; Q67-Y133 HydrophobicContact CG-CE1 3.59Å; Q67-Y133 HydrophobicContact CG-CE2 3.56Å; Q67-Y133 WeakPolarHBondContact CG-OH 3.41Å; Q67-Y133 PolarHBondContact N-OH 2.87Å; Y133-I137 CarbonylContact C-O 3.49Å; Y133-I137 WeakPolarHBondContact CA-O 3.36Å; Y133-I137 WeakPolarHBondContact CB-O 3.34Å; Y133-I137 HydrophobicContact CD1-CG2 4.49Å; Y133-P139 HydrophobicContact CE1-CG 4.45Å; Y133-P139 HydrophobicContact CE2-CG 4.25Å; Y133-P139 VanDerWaalsContact CZ-CD 3.45Å; Y133-P139 VanDerWaalsContact OH-CG 3.31Å; Y133-P139 WeakPolarHBondContact OH-CG 3.34Å
134	T	97.3	Very high	97.9	Very high	50 Å²	50	34.6 Å²	34.6	31%	0.307	20%	0.198	S	C	.	.	B	Isolated β-bridge	trans	-142.3	173.8	179.8	75.8	0	0	0	0	108.6	W17 R136 I137	W17-T134 VanDerWaalsContact CZ3-C 3.46Å; W17-T134 VanDerWaalsContact CZ3-O 3.23Å; W17-T134 WeakPolarHBondContact CZ3-O 2.82Å; T134-R136 PolarHBondContact O-N 2.95Å; T134-R136 PolarHBondContact OG1-N 3.4Å; T134-R136 VanDerWaalsContact OG1-N 3.14Å; T134-I137 PolarHBondContact N-O 3.23Å; T134-I137 CarbonylContact O-C 3.54Å; T134-I137 PolarHBondContact O-N 3.04Å; T134-I137 PolarHBondContact OG1-N 3.35Å
135	T	96.8	Very high	97.5	Very high	82 Å²	82	39 Å²	39	50%	0.503	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-15.1	174.4	57.2	0	0	0	0	114.1	A23	A23-T135 HydrophobicContact CB-CG2 4.27Å
136	R	97.5	Very high	97	Very high	65 Å²	65	45.3 Å²	45.3	25%	0.245	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	-1.2	178.2	-56.6	-174.1	171.1	-141	0.2	113.6	I24 P46 E97 T134	I24-R136 HydrophobicContact CD1-CG 4.33Å; P46-R136 VanDerWaalsContact CA-O 3.22Å; P46-R136 WeakPolarHBondContact CA-O 3.2Å; P46-R136 WeakPolarHBondContact CB-O 3.37Å; E97-R136 IonicContact OE1-NH1 2.56Å; E97-R136 PolarHBondContact OE1-NH1 3.47Å; T134-R136 PolarHBondContact O-N 2.95Å; T134-R136 PolarHBondContact OG1-N 3.4Å; T134-R136 VanDerWaalsContact OG1-N 3.14Å
137	I	98.6	Very high	96.4	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-136.9	106.3	-175.8	-58.1	175.5	0	0	0	108.4	P46 L64 L87 Q100 Y133 T134	P46-I137 WeakPolarHBondContact O-CA 3.24Å; L64-I137 HydrophobicContact CD2-CG2 3.87Å; L87-I137 HydrophobicContact CB-CD1 3.86Å; L87-I137 HydrophobicContact CB-CG1 4.09Å; L87-I137 HydrophobicContact CB-CG2 4.15Å; L87-I137 HydrophobicContact CD1-CG2 4.05Å; L87-I137 HydrophobicContact CD2-CG2 4.5Å; L87-I137 HydrophobicContact CG-CG2 4.48Å; Q100-I137 HydrophobicContact CB-CD1 4.19Å; Q100-I137 HydrophobicContact CG-CD1 4.05Å; Y133-I137 CarbonylContact C-O 3.49Å; Y133-I137 WeakPolarHBondContact CA-O 3.36Å; Y133-I137 WeakPolarHBondContact CB-O 3.34Å; Y133-I137 HydrophobicContact CD1-CG2 4.49Å; T134-I137 PolarHBondContact N-O 3.23Å; T134-I137 CarbonylContact O-C 3.54Å; T134-I137 PolarHBondContact O-N 3.04Å; T134-I137 PolarHBondContact OG1-N 3.35Å
138	S	98.5	Very high	95.7	Very high	6 Å²	6	46.5 Å²	46.5	4%	0.042	28%	0.281	C	S	.	.			trans	-161.8	152.6	179.1	67	0	0	0	0	109.6	P46 W47	P46-S138 CarbonylContact C-O 3.57Å; P46-S138 VanDerWaalsContact C-O 3.27Å; P46-S138 WeakPolarHBondContact CB-OG 3.3Å; P46-S138 WeakPolarHBondContact CG-OG 3.47Å; P46-S138 PolarHBondContact O-N 2.99Å; W47-S138 VanDerWaalsContact CA-O 3.27Å; W47-S138 WeakPolarHBondContact CA-O 3.43Å; W47-S138 WeakPolarHBondContact CB-O 3.48Å; W47-S138 PolarHBondContact N-O 3.3Å
139	P	98.6	Very high	95	Very high	6 Å²	6	45.7 Å²	45.7	4%	0.039	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-77.8	155.3	-169.9	33.7	-34.5	0	0	0	112.2	C19 G20 L64 Y133	C19-P139 CarbonylContact C-O 3.48Å; C19-P139 WeakPolarHBondContact CA-O 3.34Å; C19-P139 HydrophobicContact CB-CG 4.12Å; G20-P139 PolarHBondContact N-O 3.01Å; L64-P139 CarbonylContact O-C 3.53Å; L64-P139 WeakPolarHBondContact O-CA 3.48Å; Y133-P139 HydrophobicContact CE1-CG 4.45Å; Y133-P139 HydrophobicContact CE2-CG 4.25Å; Y133-P139 VanDerWaalsContact CZ-CD 3.45Å; Y133-P139 VanDerWaalsContact OH-CG 3.31Å; Y133-P139 WeakPolarHBondContact OH-CG 3.34Å
140	V	98.7	Very high	94.3	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.006	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-84.6	150.1	165.9	70.3	0	0	0	0	110.2	W47 L64 I65 V219 L228	W47-V140 HydrophobicContact CB-CB 3.82Å; W47-V140 HydrophobicContact CB-CG1 4.36Å; W47-V140 HydrophobicContact CD2-CB 3.65Å; W47-V140 HydrophobicContact CD2-CG2 3.95Å; W47-V140 HydrophobicContact CE3-CB 4.08Å; W47-V140 HydrophobicContact CE3-CG2 4.41Å; W47-V140 HydrophobicContact CG-CB 3.54Å; W47-V140 HydrophobicContact CG-CG1 4.37Å; W47-V140 HydrophobicContact CG-CG2 4.19Å; W47-V140 HydrophobicContact CZ2-CG2 4.34Å; L64-V140 PolarHBondContact O-N 2.95Å; I65-V140 HydrophobicContact CG2-CG1 3.95Å; V140-V219 HydrophobicContact CG2-CG1 3.7Å; V140-L228 HydrophobicContact CB-CB 4.49Å; V140-L228 HydrophobicContact CG1-CB 3.71Å; V140-L228 HydrophobicContact CG1-CD2 4.17Å; V140-L228 HydrophobicContact CG1-CG 4.35Å; V140-L228 HydrophobicContact CG2-CB 3.94Å
141	C	98	Very high	93.4	Very high	16 Å²	16	49.7 Å²	49.7	11%	0.108	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	144.9	170.2	-64	0	0	0	0	110.5	C19 T225 W226 V227 L228	C19-C141 HydrophobicContact CB-CB 3.98Å; C19-C141 WeakPolarHBondContact CB-SG 3.43Å; C19-C141 PolarHBondContact O-SG 3Å; C19-C141 WeakPolarHBondContact SG-CA 3.14Å; C19-C141 WeakPolarHBondContact SG-CB 3.42Å; C19-C141 CovalentContact SG-SG 2.04Å; C19-C141 PolarHBondContact SG-SG 3.42Å; C141-T225 HydrophobicContact CB-CG2 4.11Å; C141-T225 WeakPolarHBondContact SG-CG2 3.31Å; C141-W226 PolarHBondContact N-O 3.29Å; C141-V227 HydrophobicContact CB-CG2 4.21Å; C141-V227 CarbonylContact O-C 3.5Å; C141-V227 WeakPolarHBondContact O-CA 3.48Å; C141-L228 WeakPolarHBondContact O-CB 3.24Å; C141-L228 PolarHBondContact O-N 3.48Å
142	L	97.2	Very high	92.5	Very high	47 Å²	47	51.8 Å²	51.8	25%	0.246	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	142	174.5	-71.7	171.9	0	0	0	111.2	I65 S144 L228 V250 I257	I65-L142 HydrophobicContact CB-CD1 4.39Å; I65-L142 HydrophobicContact CB-CD2 4.44Å; I65-L142 HydrophobicContact CB-CG 4.38Å; I65-L142 HydrophobicContact CD1-CD1 4.18Å; I65-L142 HydrophobicContact CG2-CD2 3.71Å; I65-L142 HydrophobicContact CG2-CG 4.13Å; L142-S144 PolarHBondContact O-N 2.84Å; L142-L228 HydrophobicContact CD2-CD2 3.96Å; L142-V250 HydrophobicContact CD2-CG1 3.93Å; L142-I257 HydrophobicContact CD1-CG2 3.67Å; L142-I257 HydrophobicContact CD2-CD1 4.44Å
143	A	96.1	Very high	91.9	Very high	2 Å²	2	48.8 Å²	48.8	2%	0.017	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-57.5	137.1	167.6	0	0	0	0	0	111	E147 V227 L228 I229 V250 S254	A143-E147 HydrophobicContact CB-CB 4.02Å; A143-E147 HydrophobicContact CB-CG 3.81Å; A143-V227 HydrophobicContact CB-CG1 4.12Å; A143-L228 VanDerWaalsContact CB-O 3.25Å; A143-L228 WeakPolarHBondContact CB-O 3.37Å; A143-L228 PolarHBondContact N-O 2.87Å; A143-I229 HydrophobicContact CB-CG2 4.45Å; A143-V250 HydrophobicContact CB-CB 4.38Å; A143-V250 HydrophobicContact CB-CG1 4.2Å; A143-S254 PolarHBondContact O-OG 2.91Å
144	S	93.4	Very high	91.5	Very high	49 Å²	49	49.9 Å²	49.9	34%	0.343	30%	0.301	S	S	.	.	P	Polyproline II helix	trans	-71.9	163.1	171.6	62.7	0	0	0	0	111.4	L142 N146 E147 S251	L142-S144 PolarHBondContact O-N 2.84Å; S144-N146 WeakPolarHBondContact CB-OD1 3.31Å; S144-N146 PolarHBondContact O-N 3.15Å; S144-N146 PolarHBondContact OG-OD1 2.88Å; S144-E147 WeakPolarHBondContact O-CB 3.1Å; S144-E147 PolarHBondContact O-N 2.95Å; S144-E147 VanDerWaalsContact O-N 3.15Å; S144-E147 PolarHBondContact OG-N 3.48Å; S144-E147 PolarHBondContact OG-OE2 2.87Å; S144-S251 WeakPolarHBondContact O-CB 3.34Å
145	S	91	Very high	91.3	Very high	92 Å²	92	47.5 Å²	47.5	64%	0.643	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-27.7	178.7	53.8	0	0	0	0	113.3	S251	S145-S251 WeakPolarHBondContact CA-O 3.28Å
146	N	86.8	Confident	91.2	Very high	133 Å²	133	43.7 Å²	43.7	71%	0.711	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	18.2	176.3	64	-39.3	0	0	0	112.9	S144 A148	S144-N146 WeakPolarHBondContact CB-OD1 3.31Å; S144-N146 PolarHBondContact O-N 3.15Å; S144-N146 PolarHBondContact OG-OD1 2.88Å; N146-A148 PolarHBondContact O-N 2.8Å; N146-A148 VanDerWaalsContact O-N 3.1Å
147	E	87.5	Confident	91	Very high	14 Å²	14	40.8 Å²	40.8	7%	0.065	25%	0.253	C	S	.	.			trans	-55.3	115.2	179.5	-179	68	-165.2	0	0	111.4	A143 S144 L149 K222	A143-E147 HydrophobicContact CB-CB 4.02Å; A143-E147 HydrophobicContact CB-CG 3.81Å; S144-E147 WeakPolarHBondContact O-CB 3.1Å; S144-E147 PolarHBondContact O-N 2.95Å; S144-E147 VanDerWaalsContact O-N 3.15Å; S144-E147 PolarHBondContact OG-N 3.48Å; S144-E147 PolarHBondContact OG-OE2 2.87Å; E147-L149 HydrophobicContact CG-CD2 3.84Å; E147-L149 HydrophobicContact CG-CG 4.44Å; E147-L149 PolarHBondContact O-N 3.45Å; E147-K222 WeakPolarHBondContact OE1-CE 3.43Å; E147-K222 IonicContact OE1-NZ 2.76Å; E147-K222 PolarHBondContact OE1-NZ 2.78Å; E147-K222 IonicContact OE2-NZ 3.47Å; E147-K222 PolarHBondContact OE2-NZ 2.96Å
148	A	83.2	Confident	90.9	Very high	68 Å²	68	40.9 Å²	40.9	56%	0.562	25%	0.253	S	S	*	.			trans	-74.5	115.3	174.6	0	0	0	0	0	109.9	N146	N146-A148 PolarHBondContact O-N 2.8Å; N146-A148 VanDerWaalsContact O-N 3.1Å
149	L	83.8	Confident	90.8	Very high	45 Å²	45	40.8 Å²	40.8	24%	0.236	25%	0.253	C	S	.	.			trans	-103.5	94.2	175.8	-59.6	179.5	0	0	0	108.4	E147 L181 I200 I229 R249	E147-L149 HydrophobicContact CG-CD2 3.84Å; E147-L149 HydrophobicContact CG-CG 4.44Å; E147-L149 PolarHBondContact O-N 3.45Å; L149-L181 HydrophobicContact CB-CD1 4.24Å; L149-L181 HydrophobicContact CD2-CD1 4.22Å; L149-I200 HydrophobicContact CD1-CD1 4.41Å; L149-I200 HydrophobicContact CD1-CG2 3.71Å; L149-I229 HydrophobicContact CD2-CB 4.13Å; L149-I229 HydrophobicContact CD2-CD1 4.45Å; L149-I229 HydrophobicContact CD2-CG2 3.92Å; L149-R249 HydrophobicContact CD1-CG 4.39Å
150	T	84	Confident	90.5	Very high	94 Å²	94	40.5 Å²	40.5	58%	0.577	25%	0.251	S	S	*	.			trans	-77	137	178.9	-49.8	0	0	0	0	110.2	L153	T150-L153 WeakPolarHBondContact O-CB 3.48Å; T150-L153 PolarHBondContact O-N 2.92Å
151	E	79.3	Confident	89.9	Confident	111 Å²	111	40.6 Å²	40.6	52%	0.519	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	141.8	171.7	-179.5	177.8	-178.6	0	0	111.1	L153 T183 Q186	E151-L153 PolarHBondContact O-N 3.16Å; E151-L153 VanDerWaalsContact O-N 3.13Å; E151-T183 HydrophobicContact CB-CG2 3.73Å; E151-T183 VanDerWaalsContact CD-CG2 3.41Å; E151-T183 HydrophobicContact CG-CG2 3.67Å; E151-T183 VanDerWaalsContact OE2-CG2 3.25Å; E151-T183 WeakPolarHBondContact OE2-CG2 3.47Å; E151-Q186 PolarHBondContact OE1-NE2 2.73Å; E151-Q186 PolarHBondContact OE1-OE1 2.84Å
152	G	79.1	Confident	89	Confident	44 Å²	44	42.7 Å²	42.7	45%	0.454	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.3	-1.3	178	0	0	0	0	0	114.3	T154 L181	G152-T154 PolarHBondContact O-N 3.11Å; G152-T154 VanDerWaalsContact O-N 3.12Å; G152-L181 PolarHBondContact N-O 2.75Å
153	L	86.9	Confident	87.8	Confident	53 Å²	53	43.7 Å²	43.7	28%	0.277	26%	0.263	S	S	.	.			trans	-56.3	120.8	169.2	-177.5	65.4	0	0	0	108.4	T150 E151 C155 L181 C220	T150-L153 WeakPolarHBondContact O-CB 3.48Å; T150-L153 PolarHBondContact O-N 2.92Å; E151-L153 PolarHBondContact O-N 3.16Å; E151-L153 VanDerWaalsContact O-N 3.13Å; L153-C155 PolarHBondContact O-N 2.83Å; L153-L181 HydrophobicContact CB-CD1 4.15Å; L153-L181 HydrophobicContact CB-CG 4.44Å; L153-L181 HydrophobicContact CD2-CD1 4.18Å; L153-L181 PolarHBondContact O-N 3.07Å; L153-C220 HydrophobicContact CD2-CB 3.83Å; L153-C220 HydrophobicContact CG-CB 4.3Å
154	T	89.1	Confident	86.5	Confident	69 Å²	69	45.6 Å²	45.6	42%	0.423	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	122.5	179.6	-61.3	0	0	0	0	108.7	F30 G152 A178	F30-T154 HydrophobicContact CD1-CG2 4.24Å; F30-T154 HydrophobicContact CE1-CG2 4.16Å; G152-T154 PolarHBondContact O-N 3.11Å; G152-T154 VanDerWaalsContact O-N 3.12Å; T154-A178 HydrophobicContact CG2-CB 3.96Å
155	C	93	Very high	85.1	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	169.4	-179.8	-54.2	0	0	0	0	108.9	L153 A178 L179 L218 V219 C220 I229	L153-C155 PolarHBondContact O-N 2.83Å; C155-A178 CarbonylContact O-C 3.55Å; C155-A178 WeakPolarHBondContact O-CA 3.44Å; C155-L179 PolarHBondContact N-O 2.84Å; C155-L179 PolarHBondContact O-N 2.78Å; C155-L179 VanDerWaalsContact O-O 3.11Å; C155-L218 HydrophobicContact CB-CD1 3.9Å; C155-L218 HydrophobicContact CB-CG 4.29Å; C155-V219 CarbonylContact C-O 3.54Å; C155-V219 VanDerWaalsContact CA-O 3.29Å; C155-V219 WeakPolarHBondContact CA-O 3.36Å; C155-V219 VanDerWaalsContact CB-O 3.27Å; C155-V219 WeakPolarHBondContact CB-O 3.32Å; C155-C220 HydrophobicContact CB-CB 4.06Å; C155-C220 WeakPolarHBondContact CB-SG 3.13Å; C155-C220 WeakPolarHBondContact SG-CB 3.33Å; C155-C220 CovalentContact SG-SG 2.03Å; C155-C220 PolarHBondContact SG-SG 2.93Å; C155-I229 HydrophobicContact CB-CD1 4.45Å
156	V	94.5	Very high	83.6	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.012	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	133.4	-176.4	-176.6	0	0	0	0	108.9	L28 W45 T158 Q176 V177 A178 L218 V219 W226	L28-V156 HydrophobicContact CD1-CG2 3.81Å; L28-V156 HydrophobicContact CD2-CG1 4.07Å; L28-V156 HydrophobicContact CD2-CG2 3.79Å; L28-V156 HydrophobicContact CG-CG2 4.5Å; W45-V156 HydrophobicContact CH2-CB 3.95Å; W45-V156 HydrophobicContact CH2-CG1 3.79Å; W45-V156 HydrophobicContact CH2-CG2 4.15Å; W45-V156 HydrophobicContact CZ2-CB 4.31Å; W45-V156 HydrophobicContact CZ2-CG1 3.65Å; V156-T158 HydrophobicContact CG1-CG2 4.1Å; V156-Q176 HydrophobicContact CG1-CB 4.21Å; V156-V177 VanDerWaalsContact CA-O 3.3Å; V156-V177 WeakPolarHBondContact CA-O 3.47Å; V156-V177 WeakPolarHBondContact CG1-O 3.36Å; V156-A178 HydrophobicContact CG2-CB 4.48Å; V156-L218 WeakPolarHBondContact O-CA 3.5Å; V156-V219 HydrophobicContact CB-CG2 4.26Å; V156-V219 PolarHBondContact N-O 2.58Å; V156-V219 WeakPolarHBondContact O-CG2 3.38Å; V156-V219 PolarHBondContact O-N 2.82Å; V156-W226 HydrophobicContact CB-CZ3 4.19Å; V156-W226 HydrophobicContact CG2-CH2 3.77Å; V156-W226 HydrophobicContact CG2-CZ3 3.75Å
157	T	94.7	Very high	82.5	Confident	4 Å²	4	42.1 Å²	42.1	3%	0.025	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	145.6	165.5	-162.5	0	0	0	0	108.9	Q176 V177 L179 P217	T157-Q176 WeakPolarHBondContact O-CA 3.09Å; T157-V177 HydrophobicContact CG2-CG1 3.44Å; T157-V177 VanDerWaalsContact CG2-CG1 3.44Å; T157-V177 PolarHBondContact N-O 3.13Å; T157-V177 PolarHBondContact O-N 2.94Å; T157-L179 HydrophobicContact CG2-CD2 3.5Å; T157-P217 VanDerWaalsContact CA-O 3.3Å; T157-P217 WeakPolarHBondContact CA-O 3.41Å; T157-P217 PolarHBondContact OG1-O 2.87Å; T157-P217 VanDerWaalsContact OG1-O 3.04Å
158	T	95.9	Very high	81.5	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.012	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	150.7	179.7	55	0	0	0	0	110.7	W45 Q48 V156 Q175 Q176 P217	W45-T158 HydrophobicContact CD2-CG2 3.77Å; W45-T158 HydrophobicContact CE3-CG2 4.49Å; W45-T158 HydrophobicContact CG-CG2 3.74Å; W45-T158 HydrophobicContact CZ2-CG2 4.41Å; Q48-T158 PolarHBondContact OE1-O 2.94Å; Q48-T158 PolarHBondContact OE1-OG1 3.48Å; V156-T158 HydrophobicContact CG1-CG2 4.1Å; T158-Q175 WeakPolarHBondContact CA-O 3.33Å; T158-Q175 WeakPolarHBondContact CB-O 3.3Å; T158-Q176 HydrophobicContact CG2-CB 3.76Å; T158-P217 VanDerWaalsContact OG1-CG 3.24Å; T158-P217 WeakPolarHBondContact OG1-CG 3.39Å
159	G	95.3	Very high	81.1	Confident	4 Å²	4	49.8 Å²	49.8	4%	0.041	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	169.1	-179.9	177.9	0	0	0	0	0	114	Q175 D213	G159-Q175 PolarHBondContact N-O 2.88Å; G159-Q175 VanDerWaalsContact N-O 3.12Å; G159-Q175 WeakPolarHBondContact O-CB 3.39Å; G159-Q175 PolarHBondContact O-N 3.13Å; G159-D213 VanDerWaalsContact CA-OD1 3.31Å; G159-D213 WeakPolarHBondContact CA-OD1 3.34Å
160	W	94	Very high	81	Confident	1 Å²	1	51 Å²	51	0%	0.004	31%	0.314	C	S	.	.	S	Bend	trans	-111.7	20.5	175.3	-61.9	-94.5	0	0	0	111.2	Q48 H58 E89 H90 L92 T170 A172 L174	Q48-W160 HydrophobicContact CG-CH2 3.49Å; Q48-W160 VanDerWaalsContact CG-CH2 3.49Å; Q48-W160 HydrophobicContact CG-CZ3 3.46Å; Q48-W160 VanDerWaalsContact CG-CZ3 3.46Å; H58-W160 AromaticContact CE1-CE3 3.85Å; E89-W160 HydrophobicContact CB-CH2 4.15Å; E89-W160 HydrophobicContact CB-CZ2 4.13Å; E89-W160 HydrophobicContact CG-CH2 4.12Å; E89-W160 HydrophobicContact CG-CZ2 3.76Å; E89-W160 WeakPolarHBondContact O-CZ2 3.3Å; H90-W160 PolarHBondContact O-NE1 3.08Å; L92-W160 HydrophobicContact CD1-CB 3.65Å; L92-W160 VanDerWaalsContact CD1-CD1 3.5Å; L92-W160 HydrophobicContact CD1-CD2 4.18Å; L92-W160 HydrophobicContact CD1-CG 3.52Å; L92-W160 HydrophobicContact CG-CD2 4.33Å; L92-W160 HydrophobicContact CG-CG 4.01Å; W160-T170 WeakPolarHBondContact O-CB 3.45Å; W160-T170 WeakPolarHBondContact O-CG2 3.42Å; W160-A172 VanDerWaalsContact CD1-O 3.22Å; W160-A172 PolarHBondContact NE1-O 3.46Å; W160-L174 HydrophobicContact CD2-CD1 3.86Å; W160-L174 HydrophobicContact CE3-CD1 3.93Å; W160-L174 HydrophobicContact CH2-CD1 3.83Å; W160-L174 HydrophobicContact CZ2-CB 3.74Å; W160-L174 HydrophobicContact CZ2-CD1 3.74Å; W160-L174 HydrophobicContact CZ2-CD2 4.39Å; W160-L174 HydrophobicContact CZ2-CG 4.15Å; W160-L174 HydrophobicContact CZ3-CD1 3.92Å; W160-L174 VanDerWaalsContact NE1-N 3.1Å
161	G	85.1	Confident	81.1	Confident	2 Å²	2	47.4 Å²	47.4	2%	0.021	29%	0.292	C	S	.	.			trans	-64.8	167	173.1	0	0	0	0	0	112.2	L163 P171 Q211 D213	G161-L163 PolarHBondContact O-N 2.93Å; G161-P171 WeakPolarHBondContact O-CD 3.46Å; G161-Q211 CarbonylContact C-O 3.54Å; G161-Q211 WeakPolarHBondContact CA-O 3.48Å; G161-D213 VanDerWaalsContact CA-OD1 3.23Å; G161-D213 WeakPolarHBondContact CA-OD1 3.49Å; G161-D213 PolarHBondContact N-OD1 2.73Å
162	R	80.1	Confident	81.7	Confident	61 Å²	61	44 Å²	44	23%	0.23	28%	0.283	C	S	.	.			trans	-59.3	143	-176.7	-57.8	169.9	-177.9	-155.7	-2.7	110.4	G167 N168 T170 C210 Q211	R162-G167 PolarHBondContact NH1-O 2.94Å; R162-N168 PolarHBondContact NH1-OD1 2.57Å; R162-N168 PolarHBondContact NH2-OD1 3.38Å; R162-T170 HydrophobicContact CG-CG2 3.98Å; R162-C210 HydrophobicContact CB-CB 4.41Å; R162-C210 VanDerWaalsContact CB-SG 3.57Å; R162-C210 WeakPolarHBondContact O-CB 3.27Å; R162-C210 PolarHBondContact O-SG 2.98Å; R162-C210 VanDerWaalsContact O-SG 3.41Å; R162-Q211 PolarHBondContact N-O 2.81Å
163	L	72	Confident	82.4	Confident	68 Å²	68	48 Å²	48	36%	0.356	28%	0.284	S	S	.	.	S	Bend	trans	-74.1	-30.6	178.4	-63.6	-169	0	0	0	112.6	N36 G161 P171 Q175	N36-L163 HydrophobicContact CB-CB 3.91Å; N36-L163 HydrophobicContact CB-CD1 4.46Å; N36-L163 VanDerWaalsContact O-CD2 3.32Å; N36-L163 WeakPolarHBondContact O-CD2 3.48Å; N36-L163 VanDerWaalsContact OD1-C 3.32Å; N36-L163 PolarHBondContact OD1-O 2.95Å; G161-L163 PolarHBondContact O-N 2.93Å; L163-P171 HydrophobicContact CD1-CB 4.31Å; L163-P171 HydrophobicContact CD2-CB 4.16Å; L163-P171 HydrophobicContact CD2-CG 3.73Å; L163-P171 HydrophobicContact CG-CB 4.28Å; L163-P171 HydrophobicContact CG-CG 4.14Å; L163-Q175 HydrophobicContact CD2-CG 3.66Å
164	S	66.8	Low	82.9	Confident	42 Å²	42	45.7 Å²	45.7	29%	0.294	27%	0.272	S	S	.	.	S	Bend	trans	-144.3	161.4	-178.7	86	0	0	0	0	111.7	V166	S164-V166 PolarHBondContact O-N 2.95Å; S164-V166 PolarHBondContact OG-N 3.25Å; S164-V166 VanDerWaalsContact OG-N 3.13Å; S164-V166 PolarHBondContact OG-O 3.43Å; S164-V166 VanDerWaalsContact OG-O 3.06Å
165	G	64.6	Low	83.1	Confident	30 Å²	30	43.3 Å²	43.3	31%	0.309	26%	0.256	S	S	.	.	S	Bend	trans	-73.1	-0.8	170.5	0	0	0	0	0	114.8	N238	G165-N238 VanDerWaalsContact CA-O 3.24Å; G165-N238 WeakPolarHBondContact CA-O 3.04Å
166	V	60.9	Low	83.1	Confident	127 Å²	127	43.4 Å²	43.4	77%	0.77	26%	0.257	S	S	*	.	S	Bend	trans	-101.7	117.6	178.2	-177	0	0	0	0	108.7	S164	S164-V166 PolarHBondContact O-N 2.95Å; S164-V166 PolarHBondContact OG-N 3.25Å; S164-V166 VanDerWaalsContact OG-N 3.13Å; S164-V166 PolarHBondContact OG-O 3.43Å; S164-V166 VanDerWaalsContact OG-O 3.06Å
167	G	62	Low	82.8	Confident	43 Å²	43	44.4 Å²	44.4	44%	0.443	26%	0.263	S	S	.	.	S	Bend	trans	80.5	178.8	-175	0	0	0	0	0	113.7	R162	R162-G167 PolarHBondContact NH1-O 2.94Å
168	N	67.8	Low	82.5	Confident	123 Å²	123	45.6 Å²	45.6	66%	0.658	27%	0.273	S	S	*	.	S	Bend	trans	-114.7	21.9	-177.5	-65.6	-19.9	0	0	0	112.4	R162	R162-N168 PolarHBondContact NH1-OD1 2.57Å; R162-N168 PolarHBondContact NH2-OD1 3.38Å
169	V	73.3	Confident	82.2	Confident	120 Å²	120	45.6 Å²	45.6	73%	0.727	27%	0.273	S	S	*	.	P	Polyproline II helix	trans	-83.2	121.9	-174.6	-175.7	0	0	0	0	110
170	T	81.9	Confident	82	Confident	72 Å²	72	47.1 Å²	47.1	44%	0.442	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-96.7	142.7	168.1	47.7	0	0	0	0	109.7	W160 R162	W160-T170 WeakPolarHBondContact O-CB 3.45Å; W160-T170 WeakPolarHBondContact O-CG2 3.42Å; R162-T170 HydrophobicContact CG-CG2 3.98Å
171	P	86.9	Confident	81.9	Confident	17 Å²	17	47.5 Å²	47.5	11%	0.11	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-69.6	143.2	174.9	32	-35	0	0	0	110	G161 L163 Q175	G161-P171 WeakPolarHBondContact O-CD 3.46Å; L163-P171 HydrophobicContact CD1-CB 4.31Å; L163-P171 HydrophobicContact CD2-CB 4.16Å; L163-P171 HydrophobicContact CD2-CG 3.73Å; L163-P171 HydrophobicContact CG-CB 4.28Å; L163-P171 HydrophobicContact CG-CG 4.14Å; P171-Q175 HydrophobicContact CB-CG 4.08Å; P171-Q175 HydrophobicContact CG-CG 3.58Å
172	A	91.7	Very high	82.2	Confident	40 Å²	40	48.9 Å²	48.9	33%	0.331	29%	0.292	S	S	.	.	S	Bend	trans	-70.9	-38.1	172.4	0	0	0	0	0	111.2	D91 L92 W160	D91-A172 CarbonylContact C-O 3.55Å; D91-A172 WeakPolarHBondContact CA-O 3.47Å; D91-A172 WeakPolarHBondContact OD1-CB 3.36Å; L92-A172 PolarHBondContact N-O 2.92Å; W160-A172 VanDerWaalsContact CD1-O 3.22Å; W160-A172 PolarHBondContact NE1-O 3.46Å
173	R	94.9	Very high	82.6	Confident	127 Å²	127	47.9 Å²	47.9	48%	0.479	29%	0.293	S	S	.	.	B	Isolated β-bridge	trans	-88.7	144.9	-179	-66.2	-178.9	-171.8	170.4	3.7	112.5	H90 D91 Q175	H90-R173 CarbonylContact O-C 3.55Å; H90-R173 VanDerWaalsContact O-CA 3.28Å; H90-R173 WeakPolarHBondContact O-CA 3.25Å; D91-R173 HydrophobicContact CB-CG 4.03Å; D91-R173 VanDerWaalsContact OD2-CG 3.29Å; D91-R173 WeakPolarHBondContact OD2-CG 3.48Å; D91-R173 IonicContact OD2-NE 3.49Å; D91-R173 PolarHBondContact OD2-NE 3.4Å; D91-R173 VanDerWaalsContact OD2-NE 3.11Å; R173-Q175 PolarHBondContact O-N 2.88Å; R173-Q175 PolarHBondContact O-NE2 2.92Å
174	L	95.6	Very high	83.4	Confident	5 Å²	5	46.7 Å²	46.7	3%	0.026	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-58.3	127.4	177.2	-179.8	62	0	0	0	109.8	A40 W45 Q48 H90 W160	A40-L174 HydrophobicContact CB-CB 4.35Å; A40-L174 HydrophobicContact CB-CD2 4.18Å; A40-L174 HydrophobicContact CB-CG 4.07Å; A40-L174 WeakPolarHBondContact CB-O 3.16Å; A40-L174 PolarHBondContact N-O 3.34Å; W45-L174 HydrophobicContact CB-CD2 4.25Å; Q48-L174 HydrophobicContact CB-CD2 4.37Å; Q48-L174 HydrophobicContact CG-CD1 3.91Å; Q48-L174 HydrophobicContact CG-CD2 4.11Å; H90-L174 PolarHBondContact O-N 3.12Å; W160-L174 HydrophobicContact CD2-CD1 3.86Å; W160-L174 HydrophobicContact CE3-CD1 3.93Å; W160-L174 HydrophobicContact CH2-CD1 3.83Å; W160-L174 HydrophobicContact CZ2-CB 3.74Å; W160-L174 HydrophobicContact CZ2-CD1 3.74Å; W160-L174 HydrophobicContact CZ2-CD2 4.39Å; W160-L174 HydrophobicContact CZ2-CG 4.15Å; W160-L174 HydrophobicContact CZ3-CD1 3.92Å; W160-L174 VanDerWaalsContact NE1-N 3.1Å
175	Q	93.9	Very high	84.5	Confident	20 Å²	20	50 Å²	50	9%	0.093	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	155.9	174	-54.7	-60.2	-63.2	0	0	110.8	E38 N39 T158 G159 L163 P171 R173	E38-Q175 VanDerWaalsContact C-OE1 3.28Å; E38-Q175 CarbonylContact O-C 3.4Å; E38-Q175 VanDerWaalsContact O-CA 3.31Å; E38-Q175 WeakPolarHBondContact O-CA 3.48Å; E38-Q175 PolarHBondContact O-OE1 3.14Å; N39-Q175 PolarHBondContact OD1-NE2 3.06Å; T158-Q175 WeakPolarHBondContact CA-O 3.33Å; T158-Q175 WeakPolarHBondContact CB-O 3.3Å; G159-Q175 PolarHBondContact N-O 2.88Å; G159-Q175 VanDerWaalsContact N-O 3.12Å; G159-Q175 WeakPolarHBondContact O-CB 3.39Å; G159-Q175 PolarHBondContact O-N 3.13Å; L163-Q175 HydrophobicContact CD2-CG 3.66Å; P171-Q175 HydrophobicContact CB-CG 4.08Å; P171-Q175 HydrophobicContact CG-CG 3.58Å; R173-Q175 PolarHBondContact O-N 2.88Å; R173-Q175 PolarHBondContact O-NE2 2.92Å
176	Q	92.4	Very high	85.7	Confident	2 Å²	2	52 Å²	52	1%	0.009	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	149.6	167.5	65.7	-176.7	39.7	0	0	109.2	A27 L28 E38 A40 V156 T157 T158	A27-Q176 PolarHBondContact O-NE2 3.49Å; L28-Q176 HydrophobicContact CD2-CG 4.34Å; L28-Q176 VanDerWaalsContact CD2-NE2 3.34Å; E38-Q176 HydrophobicContact CG-CG 3.59Å; E38-Q176 PolarHBondContact N-O 3.36Å; E38-Q176 PolarHBondContact O-N 3Å; E38-Q176 PolarHBondContact OE1-NE2 2.91Å; A40-Q176 HydrophobicContact CB-CB 4.25Å; A40-Q176 HydrophobicContact CB-CG 4.24Å; V156-Q176 HydrophobicContact CG1-CB 4.21Å; T157-Q176 WeakPolarHBondContact O-CA 3.09Å; T158-Q176 HydrophobicContact CG2-CB 3.76Å
177	V	88.6	Confident	87.3	Confident	23 Å²	23	45.9 Å²	45.9	14%	0.139	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	136.4	169.8	64.9	0	0	0	0	110.5	V156 T157 L179 A207	V156-V177 VanDerWaalsContact CA-O 3.3Å; V156-V177 WeakPolarHBondContact CA-O 3.47Å; V156-V177 WeakPolarHBondContact CG1-O 3.36Å; T157-V177 HydrophobicContact CG2-CG1 3.44Å; T157-V177 VanDerWaalsContact CG2-CG1 3.44Å; T157-V177 PolarHBondContact N-O 3.13Å; T157-V177 PolarHBondContact O-N 2.94Å; V177-L179 HydrophobicContact CG1-CD2 3.88Å; V177-L179 WeakPolarHBondContact O-CD2 3.43Å; V177-A207 HydrophobicContact CG2-CB 3.4Å
178	A	89.5	Confident	88.8	Confident	29 Å²	29	48.3 Å²	48.3	24%	0.24	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	132.1	173	0	0	0	0	0	109.8	F30 T154 C155 V156	F30-A178 HydrophobicContact CD1-CB 4.43Å; T154-A178 HydrophobicContact CG2-CB 3.96Å; C155-A178 CarbonylContact O-C 3.55Å; C155-A178 WeakPolarHBondContact O-CA 3.44Å; V156-A178 HydrophobicContact CG2-CB 4.48Å
179	L	88.3	Confident	90.1	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	146	-179.9	55.2	141.8	0	0	0	111.4	C155 T157 V177 A202 L218 Y247	C155-L179 PolarHBondContact N-O 2.84Å; C155-L179 PolarHBondContact O-N 2.78Å; C155-L179 VanDerWaalsContact O-O 3.11Å; T157-L179 HydrophobicContact CG2-CD2 3.5Å; V177-L179 HydrophobicContact CG1-CD2 3.88Å; V177-L179 WeakPolarHBondContact O-CD2 3.43Å; L179-A202 HydrophobicContact CD1-CB 3.25Å; L179-A202 HydrophobicContact CG-CB 4.31Å; L179-L218 HydrophobicContact CD1-CD1 4.17Å; L179-L218 HydrophobicContact CD2-CD1 4.42Å; L179-L218 HydrophobicContact CG-CD1 4.34Å; L179-Y247 HydrophobicContact CD1-CE2 4.48Å; L179-Y247 WeakPolarHBondContact CD1-OH 3.44Å
180	P	90.9	Very high	91	Very high	37 Å²	37	50 Å²	50	24%	0.24	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	144.1	178.1	31.2	-34.6	0	0	0	110.9	A202 G203 A205	P180-A202 CarbonylContact O-C 3.53Å; P180-A202 VanDerWaalsContact O-CA 3.24Å; P180-A202 WeakPolarHBondContact O-CA 3.42Å; P180-G203 PolarHBondContact O-N 2.86Å; P180-A205 HydrophobicContact CG-CB 3.96Å
181	L	92.4	Very high	91.7	Very high	9 Å²	9	48.4 Å²	48.4	5%	0.047	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	137.4	159.9	-71	-173.6	0	0	0	110.4	L149 G152 L153 A202 L218 I229	L149-L181 HydrophobicContact CB-CD1 4.24Å; L149-L181 HydrophobicContact CD2-CD1 4.22Å; G152-L181 PolarHBondContact N-O 2.75Å; L153-L181 HydrophobicContact CB-CD1 4.15Å; L153-L181 HydrophobicContact CB-CG 4.44Å; L153-L181 HydrophobicContact CD2-CD1 4.18Å; L153-L181 PolarHBondContact O-N 3.07Å; L181-A202 HydrophobicContact CD2-CB 3.79Å; L181-L218 HydrophobicContact CD2-CD2 4.02Å; L181-I229 HydrophobicContact CD1-CD1 3.87Å; L181-I229 HydrophobicContact CD2-CD1 3.59Å; L181-I229 HydrophobicContact CG-CD1 4.19Å
182	V	91.4	Very high	92.1	Very high	31 Å²	31	49.3 Å²	49.3	19%	0.188	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	150.2	170.7	-55.5	0	0	0	0	109.8	Q186 C187 C201 G203 P244	V182-Q186 HydrophobicContact CB-CB 4.24Å; V182-C187 HydrophobicContact CG2-CB 4.19Å; V182-C201 HydrophobicContact CG2-CB 3.48Å; V182-C201 VanDerWaalsContact CG2-CB 3.48Å; V182-C201 WeakPolarHBondContact CG2-O 3.47Å; V182-C201 PolarHBondContact N-O 2.95Å; V182-G203 WeakPolarHBondContact CG1-O 3.27Å; V182-P244 HydrophobicContact CG2-CB 3.88Å; V182-P244 HydrophobicContact CG2-CG 4.49Å
183	T	89.3	Confident	92.2	Very high	40 Å²	40	52.9 Å²	52.9	25%	0.245	28%	0.276	C	S	.	.			trans	-65.7	156.4	176.5	62.3	0	0	0	0	111	E151 N185 Q186 C187	E151-T183 HydrophobicContact CB-CG2 3.73Å; E151-T183 VanDerWaalsContact CD-CG2 3.41Å; E151-T183 HydrophobicContact CG-CG2 3.67Å; E151-T183 VanDerWaalsContact OE2-CG2 3.25Å; E151-T183 WeakPolarHBondContact OE2-CG2 3.47Å; T183-N185 PolarHBondContact O-N 2.75Å; T183-Q186 PolarHBondContact O-N 3.18Å; T183-Q186 WeakPolarHBondContact OG1-CB 3.41Å; T183-Q186 VanDerWaalsContact OG1-CD 3.29Å; T183-Q186 VanDerWaalsContact OG1-CG 3.3Å; T183-Q186 WeakPolarHBondContact OG1-CG 3.44Å; T183-Q186 PolarHBondContact OG1-N 2.84Å; T183-Q186 VanDerWaalsContact OG1-N 3.11Å; T183-Q186 PolarHBondContact OG1-OE1 3.15Å; T183-C187 WeakPolarHBondContact O-CB 3.44Å; T183-C187 PolarHBondContact O-N 2.92Å
184	V	88.6	Confident	92.3	Very high	42 Å²	42	51.5 Å²	51.5	26%	0.255	28%	0.278	S	S	.	.	H	α-helix	trans	-55.1	-37.9	172.2	173.9	0	0	0	0	110.9	C187 R188 I195	V184-C187 PolarHBondContact O-N 3.12Å; V184-R188 HydrophobicContact CG1-CG 4.35Å; V184-R188 VanDerWaalsContact CG1-CZ 3.43Å; V184-R188 WeakPolarHBondContact O-CB 3.49Å; V184-R188 VanDerWaalsContact O-CG 3.28Å; V184-R188 WeakPolarHBondContact O-CG 3.21Å; V184-R188 PolarHBondContact O-N 2.96Å; V184-I195 HydrophobicContact CG1-CG2 4.26Å
185	N	88.8	Confident	92.3	Very high	113 Å²	113	51.5 Å²	51.5	60%	0.604	28%	0.278	S	S	*	.	H	α-helix	trans	-66.1	-47	178.8	-70.7	-14.9	0	0	0	112.2	T183 C187 R188 Q189	T183-N185 PolarHBondContact O-N 2.75Å; N185-C187 VanDerWaalsContact C-N 3.29Å; N185-C187 PolarHBondContact O-N 2.93Å; N185-R188 PolarHBondContact O-N 3.44Å; N185-Q189 WeakPolarHBondContact O-CG 3.32Å; N185-Q189 PolarHBondContact O-N 2.93Å
186	Q	90.8	Very high	92.4	Very high	70 Å²	70	52.1 Å²	52.1	33%	0.327	28%	0.283	S	S	.	.	H	α-helix	trans	-61.4	-39.5	173.8	-74.8	159.4	-27.8	0	0	111.6	E151 V182 T183 R188 Q189	E151-Q186 PolarHBondContact OE1-NE2 2.73Å; E151-Q186 PolarHBondContact OE1-OE1 2.84Å; V182-Q186 HydrophobicContact CB-CB 4.24Å; T183-Q186 PolarHBondContact O-N 3.18Å; T183-Q186 WeakPolarHBondContact OG1-CB 3.41Å; T183-Q186 VanDerWaalsContact OG1-CD 3.29Å; T183-Q186 VanDerWaalsContact OG1-CG 3.3Å; T183-Q186 WeakPolarHBondContact OG1-CG 3.44Å; T183-Q186 PolarHBondContact OG1-N 2.84Å; T183-Q186 VanDerWaalsContact OG1-N 3.11Å; T183-Q186 PolarHBondContact OG1-OE1 3.15Å; Q186-R188 PolarHBondContact O-N 3.3Å; Q186-Q189 WeakPolarHBondContact O-CB 3.3Å; Q186-Q189 PolarHBondContact O-N 2.66Å
187	C	93.4	Very high	92.5	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-63.4	-42.9	176.5	-164.4	0	0	0	0	111.9	V182 T183 V184 N185 Q189 Y190 W191 I195 C201	V182-C187 HydrophobicContact CG2-CB 4.19Å; T183-C187 WeakPolarHBondContact O-CB 3.44Å; T183-C187 PolarHBondContact O-N 2.92Å; V184-C187 PolarHBondContact O-N 3.12Å; N185-C187 VanDerWaalsContact C-N 3.29Å; N185-C187 PolarHBondContact O-N 2.93Å; C187-Q189 VanDerWaalsContact C-N 3.29Å; C187-Q189 PolarHBondContact O-N 3.27Å; C187-Y190 PolarHBondContact O-N 3.45Å; C187-Y190 VanDerWaalsContact O-N 3.13Å; C187-W191 PolarHBondContact O-N 2.74Å; C187-I195 HydrophobicContact CB-CG1 4.37Å; C187-I195 HydrophobicContact CB-CG2 4.5Å; C187-I195 WeakPolarHBondContact SG-CD1 3.45Å; C187-C201 HydrophobicContact CB-CB 3.57Å; C187-C201 WeakPolarHBondContact CB-SG 3.32Å; C187-C201 WeakPolarHBondContact SG-CB 3.22Å; C187-C201 CovalentContact SG-SG 2Å; C187-C201 PolarHBondContact SG-SG 2.86Å
188	R	95	Very high	92.9	Very high	94 Å²	94	56.7 Å²	56.7	36%	0.355	31%	0.308	S	S	.	.	H	α-helix	trans	-65.6	-25.9	174.8	-75	178.3	177.2	153.5	4.6	113.6	V184 N185 Q186 Y190 G192 I195 D197	V184-R188 HydrophobicContact CG1-CG 4.35Å; V184-R188 VanDerWaalsContact CG1-CZ 3.43Å; V184-R188 WeakPolarHBondContact O-CB 3.49Å; V184-R188 VanDerWaalsContact O-CG 3.28Å; V184-R188 WeakPolarHBondContact O-CG 3.21Å; V184-R188 PolarHBondContact O-N 2.96Å; N185-R188 PolarHBondContact O-N 3.44Å; Q186-R188 PolarHBondContact O-N 3.3Å; R188-Y190 PolarHBondContact O-N 3.5Å; R188-G192 WeakPolarHBondContact CG-O 3.29Å; R188-G192 WeakPolarHBondContact O-CA 3.46Å; R188-G192 PolarHBondContact O-N 2.75Å; R188-I195 HydrophobicContact CG-CB 3.82Å; R188-I195 HydrophobicContact CG-CG1 4.31Å; R188-I195 HydrophobicContact CG-CG2 4.26Å; R188-I195 PolarHBondContact NE-O 2.96Å; R188-I195 PolarHBondContact NH2-O 2.82Å; R188-D197 IonicContact NH2-OD1 2.69Å; R188-D197 PolarHBondContact NH2-OD1 3Å
189	Q	93.8	Very high	93.3	Very high	167 Å²	167	55.5 Å²	55.5	78%	0.78	30%	0.298	S	S	*	.	H	α-helix	trans	-62.7	-30.5	172.3	-73.3	172.9	-14.8	0	0	112.1	N185 Q186 C187	N185-Q189 WeakPolarHBondContact O-CG 3.32Å; N185-Q189 PolarHBondContact O-N 2.93Å; Q186-Q189 WeakPolarHBondContact O-CB 3.3Å; Q186-Q189 PolarHBondContact O-N 2.66Å; C187-Q189 VanDerWaalsContact C-N 3.29Å; C187-Q189 PolarHBondContact O-N 3.27Å
190	Y	93.8	Very high	93.6	Very high	110 Å²	110	56 Å²	56	43%	0.431	30%	0.301	S	S	.	.	H	α-helix	trans	-93.4	-46.7	177.4	-167.3	-81.4	0	0	0	112.4	C187 R188 T236 A243	C187-Y190 PolarHBondContact O-N 3.45Å; C187-Y190 VanDerWaalsContact O-N 3.13Å; R188-Y190 PolarHBondContact O-N 3.5Å; Y190-T236 HydrophobicContact CE1-CG2 4.25Å; Y190-A243 HydrophobicContact CD1-CB 4.38Å; Y190-A243 HydrophobicContact CD2-CB 4.5Å; Y190-A243 HydrophobicContact CE1-CB 3.74Å; Y190-A243 HydrophobicContact CE2-CB 3.87Å; Y190-A243 VanDerWaalsContact CZ-CB 3.45Å
191	W	95.3	Very high	93.8	Very high	40 Å²	40	54.4 Å²	54.4	15%	0.152	29%	0.29	C	S	.	.	H	α-helix	trans	-100.7	-2.8	-170.5	-63.8	113.2	0	0	0	114.4	C187 D194 I195 W234 T236 A243 P244 V246	C187-W191 PolarHBondContact O-N 2.74Å; W191-D194 WeakPolarHBondContact O-CB 3.35Å; W191-D194 PolarHBondContact O-N 3.16Å; W191-I195 HydrophobicContact CB-CD1 3.61Å; W191-I195 HydrophobicContact CB-CG1 3.53Å; W191-I195 HydrophobicContact CG-CD1 3.93Å; W191-I195 HydrophobicContact CG-CG1 4.31Å; W191-W234 HydrophobicContact CB-CH2 4.22Å; W191-W234 AromaticContact CD2-CH2 3.8Å; W191-W234 HydrophobicContact CD2-CH2 3.8Å; W191-W234 AromaticContact CD2-CZ3 3.64Å; W191-W234 HydrophobicContact CD2-CZ3 3.64Å; W191-W234 AromaticContact CE3-CH2 3.87Å; W191-W234 HydrophobicContact CE3-CH2 3.87Å; W191-W234 AromaticContact CE3-CZ3 3.45Å; W191-W234 HydrophobicContact CE3-CZ3 3.45Å; W191-W234 VanDerWaalsContact CE3-CZ3 3.45Å; W191-W234 HydrophobicContact CG-CH2 4Å; W191-W234 HydrophobicContact CG-CZ3 4.32Å; W191-W234 HydrophobicContact CH2-CE3 4.5Å; W191-W234 AromaticContact CH2-CZ3 4Å; W191-W234 HydrophobicContact CH2-CZ3 4Å; W191-W234 HydrophobicContact CZ2-CZ3 4.2Å; W191-W234 HydrophobicContact CZ3-CE3 4.48Å; W191-W234 AromaticContact CZ3-CZ3 3.65Å; W191-W234 HydrophobicContact CZ3-CZ3 3.65Å; W191-T236 HydrophobicContact CH2-CG2 3.49Å; W191-T236 VanDerWaalsContact CH2-CG2 3.49Å; W191-T236 HydrophobicContact CZ2-CG2 3.91Å; W191-A243 HydrophobicContact CZ2-CB 4.38Å; W191-P244 PolarHBondContact NE1-O 3.41Å; W191-V246 HydrophobicContact CG-CG2 4.5Å
192	G	95.9	Very high	93.8	Very high	35 Å²	35	54 Å²	54	36%	0.361	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	60.7	-138.2	177	0	0	0	0	0	113.5	R188 D194	R188-G192 WeakPolarHBondContact CG-O 3.29Å; R188-G192 WeakPolarHBondContact O-CA 3.46Å; R188-G192 PolarHBondContact O-N 2.75Å; G192-D194 PolarHBondContact O-N 2.83Å
193	S	94.4	Very high	93.7	Very high	116 Å²	116	52.6 Å²	52.6	81%	0.811	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-71.8	-6.7	-177.2	49.3	0	0	0	0	114.6	I195	S193-I195 PolarHBondContact O-N 3.28Å
194	D	95.6	Very high	93.4	Very high	98 Å²	98	52.1 Å²	52.1	52%	0.524	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-72.7	-16.8	-178.3	-61.4	-19.8	0	0	0	112.1	W191 G192 T196 W234	W191-D194 WeakPolarHBondContact O-CB 3.35Å; W191-D194 PolarHBondContact O-N 3.16Å; G192-D194 PolarHBondContact O-N 2.83Å; D194-T196 PolarHBondContact O-N 3.41Å; D194-W234 HydrophobicContact CB-CH2 4.14Å; D194-W234 HydrophobicContact CB-CZ2 4.4Å
195	I	97.3	Very high	93	Very high	4 Å²	4	53.6 Å²	53.6	2%	0.021	30%	0.299	C	S	.	.			trans	-85.5	110.5	179.1	-54.8	-57.9	0	0	0	111.5	V184 C187 R188 W191 S193 M199 W234 V246	V184-I195 HydrophobicContact CG1-CG2 4.26Å; C187-I195 HydrophobicContact CB-CG1 4.37Å; C187-I195 HydrophobicContact CB-CG2 4.5Å; C187-I195 WeakPolarHBondContact SG-CD1 3.45Å; R188-I195 HydrophobicContact CG-CB 3.82Å; R188-I195 HydrophobicContact CG-CG1 4.31Å; R188-I195 HydrophobicContact CG-CG2 4.26Å; R188-I195 PolarHBondContact NE-O 2.96Å; R188-I195 PolarHBondContact NH2-O 2.82Å; W191-I195 HydrophobicContact CB-CD1 3.61Å; W191-I195 HydrophobicContact CB-CG1 3.53Å; W191-I195 HydrophobicContact CG-CD1 3.93Å; W191-I195 HydrophobicContact CG-CG1 4.31Å; S193-I195 PolarHBondContact O-N 3.28Å; I195-M199 HydrophobicContact CD1-SD 4.44Å; I195-W234 HydrophobicContact CD1-CH2 4.09Å; I195-W234 HydrophobicContact CD1-CZ2 3.9Å; I195-V246 HydrophobicContact CD1-CG1 4.22Å; I195-V246 HydrophobicContact CD1-CG2 3.84Å
196	T	95.9	Very high	92.2	Very high	34 Å²	34	49 Å²	49	21%	0.209	28%	0.279	C	S	.	.			trans	-92.8	170.8	176	75.5	0	0	0	0	112.3	N119 D194 S198 M199	N119-T196 HydrophobicContact CB-CG2 4.27Å; N119-T196 WeakPolarHBondContact OD1-CB 3.34Å; N119-T196 PolarHBondContact OD1-OG1 3.01Å; D194-T196 PolarHBondContact O-N 3.41Å; T196-S198 PolarHBondContact O-N 3.06Å; T196-S198 PolarHBondContact OG1-N 2.86Å; T196-M199 HydrophobicContact CG2-CE 4.17Å; T196-M199 PolarHBondContact O-N 2.91Å
197	D	93.6	Very high	91.3	Very high	99 Å²	99	46.2 Å²	46.2	53%	0.529	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-15.5	176.6	-68.5	-8.9	0	0	0	113.7	R188 K252	R188-D197 IonicContact NH2-OD1 2.69Å; R188-D197 PolarHBondContact NH2-OD1 3Å; D197-K252 VanDerWaalsContact O-CE 3.3Å; D197-K252 WeakPolarHBondContact O-CE 3.45Å; D197-K252 WeakPolarHBondContact O-CG 3.36Å
198	S	96.5	Very high	90.2	Very high	22 Å²	22	47.3 Å²	47.3	15%	0.154	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-0.6	174	-62.1	0	0	0	0	112.7	N119 N120 T196 R249	N119-S198 WeakPolarHBondContact OD1-CB 3.34Å; N120-S198 WeakPolarHBondContact OD1-CB 3.22Å; N120-S198 PolarHBondContact OD1-OG 2.83Å; T196-S198 PolarHBondContact O-N 3.06Å; T196-S198 PolarHBondContact OG1-N 2.86Å; S198-R249 VanDerWaalsContact O-CB 3.3Å; S198-R249 WeakPolarHBondContact O-CB 3.29Å; S198-R249 PolarHBondContact O-N 2.85Å
199	M	97.4	Very high	89.2	Confident	3 Å²	3	43.2 Å²	43.2	2%	0.015	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	152.9	-179.5	-63.2	172.9	-172.8	0	0	111.1	T117 M118 N119 I195 T196 W234 V246 Y247	T117-M199 WeakPolarHBondContact O-CE 3.23Å; M118-M199 WeakPolarHBondContact O-CE 3.48Å; N119-M199 HydrophobicContact CB-CE 4.18Å; I195-M199 HydrophobicContact CD1-SD 4.44Å; T196-M199 HydrophobicContact CG2-CE 4.17Å; T196-M199 PolarHBondContact O-N 2.91Å; M199-W234 HydrophobicContact SD-CZ2 4.15Å; M199-V246 HydrophobicContact CB-CG1 3.87Å; M199-V246 HydrophobicContact CG-CG1 3.98Å; M199-V246 HydrophobicContact SD-CG1 3.78Å; M199-Y247 WeakPolarHBondContact CA-O 3.39Å
200	I	96	Very high	88.5	Confident	13 Å²	13	35.9 Å²	35.9	7%	0.067	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	159.7	164.5	54.7	174.8	0	0	0	108.6	L149 L218 I229 Y247 R249	L149-I200 HydrophobicContact CD1-CD1 4.41Å; L149-I200 HydrophobicContact CD1-CG2 3.71Å; I200-L218 HydrophobicContact CD1-CD2 4.19Å; I200-I229 HydrophobicContact CD1-CB 4.46Å; I200-I229 HydrophobicContact CD1-CD1 3.88Å; I200-I229 HydrophobicContact CD1-CG1 4.42Å; I200-I229 VanDerWaalsContact CD1-O 3.25Å; I200-I229 WeakPolarHBondContact CD1-O 3.31Å; I200-Y247 PolarHBondContact N-O 3.24Å; I200-Y247 PolarHBondContact O-N 3.44Å; I200-R249 HydrophobicContact CB-CB 4.5Å; I200-R249 HydrophobicContact CG1-CB 4.33Å; I200-R249 HydrophobicContact CG2-CB 3.77Å; I200-R249 HydrophobicContact CG2-CG 3.5Å
201	C	95.2	Very high	87.5	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.014	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	150.7	-178.2	-44.2	0	0	0	0	110.4	V182 C187 P244 A245	V182-C201 HydrophobicContact CG2-CB 3.48Å; V182-C201 VanDerWaalsContact CG2-CB 3.48Å; V182-C201 WeakPolarHBondContact CG2-O 3.47Å; V182-C201 PolarHBondContact N-O 2.95Å; C187-C201 HydrophobicContact CB-CB 3.57Å; C187-C201 WeakPolarHBondContact CB-SG 3.32Å; C187-C201 WeakPolarHBondContact SG-CB 3.22Å; C187-C201 CovalentContact SG-SG 2Å; C187-C201 PolarHBondContact SG-SG 2.86Å; C201-P244 HydrophobicContact CB-CB 4.14Å; C201-A245 WeakPolarHBondContact CA-O 3.36Å; C201-A245 WeakPolarHBondContact CB-O 2.99Å
202	A	92.9	Very high	86.4	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	149.6	-178.1	0	0	0	0	0	109.5	L179 P180 L181 L218 A245 Y247	L179-A202 HydrophobicContact CD1-CB 3.25Å; L179-A202 HydrophobicContact CG-CB 4.31Å; P180-A202 CarbonylContact O-C 3.53Å; P180-A202 VanDerWaalsContact O-CA 3.24Å; P180-A202 WeakPolarHBondContact O-CA 3.42Å; L181-A202 HydrophobicContact CD2-CB 3.79Å; A202-L218 HydrophobicContact CB-CD1 4.38Å; A202-L218 HydrophobicContact CB-CD2 3.89Å; A202-A245 PolarHBondContact N-O 2.86Å; A202-A245 VanDerWaalsContact N-O 3.08Å; A202-A245 PolarHBondContact O-N 2.89Å; A202-Y247 HydrophobicContact CB-CD2 4.31Å; A202-Y247 HydrophobicContact CB-CE2 3.78Å
203	G	89	Confident	86.1	Confident	3 Å²	3	31.9 Å²	31.9	3%	0.031	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	96.5	-144.1	-177.6	0	0	0	0	0	112.4	P180 V182 A205	P180-G203 PolarHBondContact O-N 2.86Å; V182-G203 WeakPolarHBondContact CG1-O 3.27Å; G203-A205 PolarHBondContact O-N 3.06Å
204	G	82.3	Confident	86.1	Confident	29 Å²	29	27.4 Å²	27.4	30%	0.299	18%	0.18	S	C	.	.			trans	74.4	9.3	-169.8	0	0	0	0	0	114	V241 R242 A243	G204-V241 CarbonylContact C-O 3.59Å; G204-R242 WeakPolarHBondContact CA-O 3.24Å; G204-A243 PolarHBondContact N-O 2.82Å
205	A	79.9	Confident	86.2	Confident	73 Å²	73	22.8 Å²	22.8	60%	0.603	16%	0.155	S	C	*	.	S	Bend	trans	-124.1	33.4	-174.2	0	0	0	0	0	112.8	P180 G203 V241	P180-A205 HydrophobicContact CG-CB 3.96Å; G203-A205 PolarHBondContact O-N 3.06Å; A205-V241 PolarHBondContact N-O 3.46Å
206	G	71.9	Confident	86.3	Confident	18 Å²	18	22.6 Å²	22.6	19%	0.186	15%	0.154	C	C	.	.	S	Bend	trans	99.6	5.6	177.7	0	0	0	0	0	115.2	V241	G206-V241 PolarHBondContact N-O 2.79Å
207	A	71.4	Confident	86.4	Confident	11 Å²	11	21 Å²	21	9%	0.091	14%	0.144	C	C	.	.			trans	-143.8	151.9	170.8	0	0	0	0	0	111.2	V177	V177-A207 HydrophobicContact CG2-CB 3.4Å
208	S	71.1	Confident	86.6	Confident	22 Å²	22	16.2 Å²	16.2	15%	0.154	12%	0.119	C	C	.	.			trans	-151.6	152.6	176.2	-178.2	0	0	0	0	110
209	S	74.1	Confident	86.6	Confident	9 Å²	9	15.2 Å²	15.2	6%	0.063	11%	0.112	C	C	.	.			trans	-69.3	162.5	158.3	61.2	0	0	0	0	110.4	A245	S209-A245 VanDerWaalsContact OG-CB 3.27Å; S209-A245 WeakPolarHBondContact OG-CB 3.31Å
210	C	79.6	Confident	86.5	Confident	12 Å²	12	15.1 Å²	15.1	8%	0.081	11%	0.111	C	C	.	.			trans	-146.4	-179	-174.8	-164.8	0	0	0	0	112.1	R162 G212 D213 C239	R162-C210 HydrophobicContact CB-CB 4.41Å; R162-C210 VanDerWaalsContact CB-SG 3.57Å; R162-C210 WeakPolarHBondContact O-CB 3.27Å; R162-C210 PolarHBondContact O-SG 2.98Å; R162-C210 VanDerWaalsContact O-SG 3.41Å; C210-G212 PolarHBondContact O-N 2.84Å; C210-D213 PolarHBondContact N-OD2 3.35Å; C210-D213 WeakPolarHBondContact O-CB 3.26Å; C210-D213 PolarHBondContact O-N 2.99Å; C210-C239 WeakPolarHBondContact CA-SG 3.26Å; C210-C239 HydrophobicContact CB-CB 3.73Å; C210-C239 WeakPolarHBondContact CB-SG 3.29Å; C210-C239 WeakPolarHBondContact SG-CB 3.45Å; C210-C239 CovalentContact SG-SG 1.99Å; C210-C239 PolarHBondContact SG-SG 2.85Å
211	Q	71.1	Confident	86.3	Confident	68 Å²	68	18.6 Å²	18.6	32%	0.318	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	132.7	-179.7	-64.7	82.3	19.6	0	0	111.2	G161 R162 K237 C239	G161-Q211 CarbonylContact C-O 3.54Å; G161-Q211 WeakPolarHBondContact CA-O 3.48Å; R162-Q211 PolarHBondContact N-O 2.81Å; Q211-K237 PolarHBondContact NE2-O 3.06Å; Q211-C239 PolarHBondContact OE1-SG 1.99Å
212	G	73.8	Confident	86	Confident	17 Å²	17	22.8 Å²	22.8	18%	0.175	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.1	-17.8	-172.9	0	0	0	0	0	113.4	H58 C210 S214	H58-G212 PolarHBondContact NE2-O 2.98Å; C210-G212 PolarHBondContact O-N 2.84Å; G212-S214 VanDerWaalsContact C-N 3.33Å
213	D	88.3	Confident	85.8	Confident	16 Å²	16	25.9 Å²	25.9	9%	0.086	18%	0.177	C	C	.	.			trans	-82.8	-11.7	173	-61.6	-44	0	0	0	113	G159 G161 C210 G215 G216 V232	G159-D213 VanDerWaalsContact CA-OD1 3.31Å; G159-D213 WeakPolarHBondContact CA-OD1 3.34Å; G161-D213 VanDerWaalsContact CA-OD1 3.23Å; G161-D213 WeakPolarHBondContact CA-OD1 3.49Å; G161-D213 PolarHBondContact N-OD1 2.73Å; C210-D213 PolarHBondContact N-OD2 3.35Å; C210-D213 WeakPolarHBondContact O-CB 3.26Å; C210-D213 PolarHBondContact O-N 2.99Å; D213-G215 PolarHBondContact O-N 3.15Å; D213-G216 WeakPolarHBondContact O-CA 3.38Å; D213-G216 PolarHBondContact O-N 3.03Å; D213-V232 HydrophobicContact CB-CG1 4.08Å; D213-V232 HydrophobicContact CB-CG2 4.31Å; D213-V232 VanDerWaalsContact O-CB 3.26Å; D213-V232 WeakPolarHBondContact O-CB 3.49Å; D213-V232 WeakPolarHBondContact O-CG2 3.34Å
214	S	95.2	Very high	85.8	Confident	23 Å²	23	31.6 Å²	31.6	16%	0.161	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.2	131.2	-179.3	-75.6	0	0	0	0	112.9	C60 G61 H75 G212 G216	C60-S214 CarbonylContact C-O 3.43Å; C60-S214 WeakPolarHBondContact CB-O 3.44Å; G61-S214 PolarHBondContact N-O 3.38Å; H75-S214 PolarHBondContact CE1-OG 3.47Å; H75-S214 WeakPolarHBondContact NE2-CB 3.42Å; H75-S214 PolarHBondContact NE2-OG 2.69Å; G212-S214 VanDerWaalsContact C-N 3.33Å; S214-G216 PolarHBondContact O-N 3.11Å
215	G	98.3	Very high	86.4	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.2	-12.4	-175.2	0	0	0	0	0	115.1	G61 G62 T72 D213 V232	G61-G215 CarbonylContact C-O 3.46Å; G61-G215 CarbonylContact O-C 3.59Å; G62-G215 VanDerWaalsContact CA-O 3.26Å; G62-G215 WeakPolarHBondContact CA-O 3.47Å; G62-G215 PolarHBondContact N-O 3.39Å; T72-G215 WeakPolarHBondContact OG1-CA 3.42Å; D213-G215 PolarHBondContact O-N 3.15Å; G215-V232 PolarHBondContact N-O 2.82Å
216	G	98.1	Very high	87.3	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.179	C	C	.	.			trans	-66	164.5	175.8	0	0	0	0	0	113.7	D213 S214 I231 V232	D213-G216 WeakPolarHBondContact O-CA 3.38Å; D213-G216 PolarHBondContact O-N 3.03Å; S214-G216 PolarHBondContact O-N 3.11Å; G216-I231 WeakPolarHBondContact O-CA 3.08Å; G216-V232 WeakPolarHBondContact O-CG2 3.33Å; G216-V232 PolarHBondContact O-N 3.06Å
217	P	98.4	Very high	88.5	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	143.4	-175.2	27.8	-32.3	0	0	0	113.4	Q48 S63 T157 T158 V219 L228	Q48-P217 VanDerWaalsContact OE1-CD 3.25Å; S63-P217 WeakPolarHBondContact OG-CB 3.43Å; T157-P217 VanDerWaalsContact CA-O 3.3Å; T157-P217 WeakPolarHBondContact CA-O 3.41Å; T157-P217 PolarHBondContact OG1-O 2.87Å; T157-P217 VanDerWaalsContact OG1-O 3.04Å; T158-P217 VanDerWaalsContact OG1-CG 3.24Å; T158-P217 WeakPolarHBondContact OG1-CG 3.39Å; P217-V219 HydrophobicContact CB-CG1 4.04Å; P217-L228 HydrophobicContact CB-CD1 3.51Å
218	L	97.6	Very high	89.8	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	115.4	149.4	-179.7	70.3	0	0	0	108.2	C155 V156 L179 L181 I200 A202 I229 G230 Y247	C155-L218 HydrophobicContact CB-CD1 3.9Å; C155-L218 HydrophobicContact CB-CG 4.29Å; V156-L218 WeakPolarHBondContact O-CA 3.5Å; L179-L218 HydrophobicContact CD1-CD1 4.17Å; L179-L218 HydrophobicContact CD2-CD1 4.42Å; L179-L218 HydrophobicContact CG-CD1 4.34Å; L181-L218 HydrophobicContact CD2-CD2 4.02Å; I200-L218 HydrophobicContact CD1-CD2 4.19Å; A202-L218 HydrophobicContact CB-CD1 4.38Å; A202-L218 HydrophobicContact CB-CD2 3.89Å; L218-I229 HydrophobicContact CB-CG1 4.46Å; L218-I229 HydrophobicContact CD2-CD1 3.6Å; L218-I229 HydrophobicContact CD2-CG1 4.13Å; L218-I229 HydrophobicContact CG-CD1 3.85Å; L218-I229 HydrophobicContact CG-CG1 3.98Å; L218-I229 WeakPolarHBondContact O-CG1 3.23Å; L218-I229 PolarHBondContact O-N 3.2Å; L218-G230 PolarHBondContact N-O 2.91Å; L218-G230 PolarHBondContact O-N 2.99Å; L218-G230 VanDerWaalsContact O-N 3.15Å; L218-Y247 HydrophobicContact CB-CD1 3.61Å; L218-Y247 HydrophobicContact CB-CE1 3.71Å; L218-Y247 HydrophobicContact CB-CG 4.34Å; L218-Y247 HydrophobicContact CD1-CE1 4.15Å; L218-Y247 HydrophobicContact CD2-CD1 3.94Å; L218-Y247 HydrophobicContact CD2-CD2 3.96Å; L218-Y247 HydrophobicContact CD2-CE1 4.11Å; L218-Y247 HydrophobicContact CD2-CE2 4.16Å; L218-Y247 HydrophobicContact CD2-CG 3.88Å; L218-Y247 HydrophobicContact CG-CD1 4.29Å; L218-Y247 HydrophobicContact CG-CE1 4.21Å
219	V	97.5	Very high	91	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	139.5	-176	-70.2	0	0	0	0	112	W45 V140 C155 V156 P217 W226 V227 L228	W45-V219 HydrophobicContact CE3-CG2 4.36Å; W45-V219 HydrophobicContact CH2-CG2 4.4Å; W45-V219 HydrophobicContact CZ3-CG2 3.73Å; V140-V219 HydrophobicContact CG2-CG1 3.7Å; C155-V219 CarbonylContact C-O 3.54Å; C155-V219 VanDerWaalsContact CA-O 3.29Å; C155-V219 WeakPolarHBondContact CA-O 3.36Å; C155-V219 VanDerWaalsContact CB-O 3.27Å; C155-V219 WeakPolarHBondContact CB-O 3.32Å; V156-V219 HydrophobicContact CB-CG2 4.26Å; V156-V219 PolarHBondContact N-O 2.58Å; V156-V219 WeakPolarHBondContact O-CG2 3.38Å; V156-V219 PolarHBondContact O-N 2.82Å; P217-V219 HydrophobicContact CB-CG1 4.04Å; V219-W226 HydrophobicContact CB-CB 4.46Å; V219-W226 HydrophobicContact CB-CE3 3.97Å; V219-W226 HydrophobicContact CG2-CD2 4.42Å; V219-W226 HydrophobicContact CG2-CE3 3.63Å; V219-W226 HydrophobicContact CG2-CZ3 4.14Å; V219-V227 CarbonylContact C-O 3.57Å; V219-V227 WeakPolarHBondContact CA-O 3.32Å; V219-L228 HydrophobicContact CG1-CB 4.37Å; V219-L228 HydrophobicContact CG1-CD1 4Å
220	C	94.9	Very high	92.2	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.007	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	145.7	170.7	-43.8	0	0	0	0	109.9	L153 C155 V227 I229	L153-C220 HydrophobicContact CD2-CB 3.83Å; L153-C220 HydrophobicContact CG-CB 4.3Å; C155-C220 HydrophobicContact CB-CB 4.06Å; C155-C220 WeakPolarHBondContact CB-SG 3.13Å; C155-C220 WeakPolarHBondContact SG-CB 3.33Å; C155-C220 CovalentContact SG-SG 2.03Å; C155-C220 PolarHBondContact SG-SG 2.93Å; C220-V227 PolarHBondContact N-O 2.82Å; C220-V227 PolarHBondContact O-N 3.31Å; C220-I229 HydrophobicContact CB-CG2 4.46Å; C220-I229 WeakPolarHBondContact SG-CD1 3.49Å; C220-I229 WeakPolarHBondContact SG-CG1 3.45Å
221	Q	92.3	Very high	93.1	Very high	86 Å²	86	26.6 Å²	26.6	40%	0.402	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	130	179	-167.5	173.8	-1.6	0	0	110.8	G223 W226	Q221-G223 VanDerWaalsContact CG-O 3.29Å; Q221-G223 WeakPolarHBondContact CG-O 3.47Å; Q221-G223 PolarHBondContact NE2-O 3.42Å; Q221-W226 HydrophobicContact CB-CD2 4.11Å; Q221-W226 HydrophobicContact CB-CE3 3.94Å; Q221-W226 HydrophobicContact CB-CH2 3.89Å; Q221-W226 HydrophobicContact CB-CZ2 4.05Å; Q221-W226 HydrophobicContact CB-CZ3 3.84Å; Q221-W226 HydrophobicContact CG-CD2 4.39Å; Q221-W226 HydrophobicContact CG-CZ2 4.27Å
222	K	89.2	Confident	94.3	Very high	90 Å²	90	23.6 Å²	23.6	39%	0.391	14%	0.142	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	104.5	171.4	-70.7	-168.2	172	-172.3	0	109.6	E147 N224 T225 V227	E147-K222 WeakPolarHBondContact OE1-CE 3.43Å; E147-K222 IonicContact OE1-NZ 2.76Å; E147-K222 PolarHBondContact OE1-NZ 2.78Å; E147-K222 IonicContact OE2-NZ 3.47Å; E147-K222 PolarHBondContact OE2-NZ 2.96Å; K222-N224 PolarHBondContact O-N 2.91Å; K222-N224 VanDerWaalsContact O-N 3.1Å; K222-T225 PolarHBondContact N-O 2.99Å; K222-T225 PolarHBondContact O-N 2.98Å; K222-V227 HydrophobicContact CB-CG2 4.49Å; K222-V227 HydrophobicContact CD-CG2 4.18Å; K222-V227 HydrophobicContact CG-CG2 4.38Å
223	G	88.2	Confident	95.5	Very high	65 Å²	65	23 Å²	23	67%	0.67	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.7	-116.1	-168.7	0	0	0	0	0	110	Q221	Q221-G223 VanDerWaalsContact CG-O 3.29Å; Q221-G223 WeakPolarHBondContact CG-O 3.47Å; Q221-G223 PolarHBondContact NE2-O 3.42Å
224	N	89.4	Confident	95.8	Very high	124 Å²	124	24.8 Å²	24.8	66%	0.663	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.1	3.4	179.4	-69.8	-22	0	0	0	114.3	K222	K222-N224 PolarHBondContact O-N 2.91Å; K222-N224 VanDerWaalsContact O-N 3.1Å
225	T	94.8	Very high	95.6	Very high	44 Å²	44	25 Å²	25	27%	0.27	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	128.6	-170.7	-56.8	0	0	0	0	111	C141 K222 V227	C141-T225 HydrophobicContact CB-CG2 4.11Å; C141-T225 WeakPolarHBondContact SG-CG2 3.31Å; K222-T225 PolarHBondContact N-O 2.99Å; K222-T225 PolarHBondContact O-N 2.98Å; T225-V227 HydrophobicContact CG2-CG2 4.4Å
226	W	97.2	Very high	95	Very high	10 Å²	10	25.9 Å²	25.9	4%	0.038	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	128.8	170.7	-67.1	91.7	0	0	0	110.6	G20 P26 L28 W45 W47 C141 V156 V219 Q221	G20-W226 VanDerWaalsContact CA-O 3.28Å; G20-W226 WeakPolarHBondContact CA-O 3.09Å; G20-W226 PolarHBondContact O-N 2.93Å; P26-W226 HydrophobicContact CG-CZ2 4.06Å; L28-W226 HydrophobicContact CD1-CH2 3.67Å; L28-W226 HydrophobicContact CD1-CZ2 3.97Å; W45-W226 HydrophobicContact CH2-CD2 4.16Å; W45-W226 AromaticContact CH2-CE2 3.94Å; W45-W226 HydrophobicContact CH2-CE3 4.15Å; W45-W226 AromaticContact CH2-CH2 3.74Å; W45-W226 HydrophobicContact CH2-CH2 3.74Å; W45-W226 AromaticContact CH2-CZ2 3.74Å; W45-W226 HydrophobicContact CH2-CZ2 3.74Å; W45-W226 AromaticContact CH2-CZ3 3.94Å; W45-W226 HydrophobicContact CH2-CZ3 3.94Å; W45-W226 AromaticContact CZ3-CD2 3.8Å; W45-W226 HydrophobicContact CZ3-CD2 3.8Å; W45-W226 AromaticContact CZ3-CE2 3.92Å; W45-W226 AromaticContact CZ3-CE3 3.96Å; W45-W226 HydrophobicContact CZ3-CE3 3.96Å; W45-W226 HydrophobicContact CZ3-CG 4.29Å; W45-W226 HydrophobicContact CZ3-CH2 4.35Å; W45-W226 HydrophobicContact CZ3-CZ2 4.21Å; W45-W226 HydrophobicContact CZ3-CZ3 4.22Å; W47-W226 HydrophobicContact CH2-CB 3.42Å; W47-W226 VanDerWaalsContact CH2-CB 3.42Å; W47-W226 AromaticContact CH2-CD1 3.66Å; W47-W226 AromaticContact CH2-CG 3.64Å; W47-W226 HydrophobicContact CH2-CG 3.64Å; W47-W226 HydrophobicContact CZ2-CB 3.54Å; W47-W226 AromaticContact CZ2-CG 3.84Å; W47-W226 HydrophobicContact CZ2-CG 3.84Å; W47-W226 HydrophobicContact CZ3-CB 4.41Å; C141-W226 PolarHBondContact N-O 3.29Å; V156-W226 HydrophobicContact CB-CZ3 4.19Å; V156-W226 HydrophobicContact CG2-CH2 3.77Å; V156-W226 HydrophobicContact CG2-CZ3 3.75Å; V219-W226 HydrophobicContact CB-CB 4.46Å; V219-W226 HydrophobicContact CB-CE3 3.97Å; V219-W226 HydrophobicContact CG2-CD2 4.42Å; V219-W226 HydrophobicContact CG2-CE3 3.63Å; V219-W226 HydrophobicContact CG2-CZ3 4.14Å; Q221-W226 HydrophobicContact CB-CD2 4.11Å; Q221-W226 HydrophobicContact CB-CE3 3.94Å; Q221-W226 HydrophobicContact CB-CH2 3.89Å; Q221-W226 HydrophobicContact CB-CZ2 4.05Å; Q221-W226 HydrophobicContact CB-CZ3 3.84Å; Q221-W226 HydrophobicContact CG-CD2 4.39Å; Q221-W226 HydrophobicContact CG-CZ2 4.27Å
227	V	97.7	Very high	94.2	Very high	13 Å²	13	35 Å²	35	8%	0.079	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	127.6	-177.9	-176.3	0	0	0	0	109	C141 A143 V219 C220 K222 T225 I229	C141-V227 HydrophobicContact CB-CG2 4.21Å; C141-V227 CarbonylContact O-C 3.5Å; C141-V227 WeakPolarHBondContact O-CA 3.48Å; A143-V227 HydrophobicContact CB-CG1 4.12Å; V219-V227 CarbonylContact C-O 3.57Å; V219-V227 WeakPolarHBondContact CA-O 3.32Å; C220-V227 PolarHBondContact N-O 2.82Å; C220-V227 PolarHBondContact O-N 3.31Å; K222-V227 HydrophobicContact CB-CG2 4.49Å; K222-V227 HydrophobicContact CD-CG2 4.18Å; K222-V227 HydrophobicContact CG-CG2 4.38Å; T225-V227 HydrophobicContact CG2-CG2 4.4Å; V227-I229 HydrophobicContact CG1-CG2 4.49Å; V227-I229 PolarHBondContact O-N 3.41Å
228	L	98.4	Very high	93.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	107.7	173.4	-171.8	75	0	0	0	109.2	V71 V140 C141 L142 A143 P217 V219 G230 V250	V71-L228 HydrophobicContact CG1-CD2 3.52Å; V140-L228 HydrophobicContact CB-CB 4.49Å; V140-L228 HydrophobicContact CG1-CB 3.71Å; V140-L228 HydrophobicContact CG1-CD2 4.17Å; V140-L228 HydrophobicContact CG1-CG 4.35Å; V140-L228 HydrophobicContact CG2-CB 3.94Å; C141-L228 WeakPolarHBondContact O-CB 3.24Å; C141-L228 PolarHBondContact O-N 3.48Å; L142-L228 HydrophobicContact CD2-CD2 3.96Å; A143-L228 VanDerWaalsContact CB-O 3.25Å; A143-L228 WeakPolarHBondContact CB-O 3.37Å; A143-L228 PolarHBondContact N-O 2.87Å; P217-L228 HydrophobicContact CB-CD1 3.51Å; V219-L228 HydrophobicContact CG1-CB 4.37Å; V219-L228 HydrophobicContact CG1-CD1 4Å; L228-G230 VanDerWaalsContact CD1-O 3.31Å; L228-G230 WeakPolarHBondContact CD1-O 3.39Å; L228-V250 HydrophobicContact CD2-CG2 4.12Å; L228-V250 HydrophobicContact CG-CG2 4.07Å; L228-V250 WeakPolarHBondContact O-CG1 3.35Å
229	I	97.6	Very high	92.7	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-23.9	179.6	57.7	140.5	0	0	0	112.1	A143 L149 C155 L181 I200 L218 C220 V227 V250	A143-I229 HydrophobicContact CB-CG2 4.45Å; L149-I229 HydrophobicContact CD2-CB 4.13Å; L149-I229 HydrophobicContact CD2-CD1 4.45Å; L149-I229 HydrophobicContact CD2-CG2 3.92Å; C155-I229 HydrophobicContact CB-CD1 4.45Å; L181-I229 HydrophobicContact CD1-CD1 3.87Å; L181-I229 HydrophobicContact CD2-CD1 3.59Å; L181-I229 HydrophobicContact CG-CD1 4.19Å; I200-I229 HydrophobicContact CD1-CB 4.46Å; I200-I229 HydrophobicContact CD1-CD1 3.88Å; I200-I229 HydrophobicContact CD1-CG1 4.42Å; I200-I229 VanDerWaalsContact CD1-O 3.25Å; I200-I229 WeakPolarHBondContact CD1-O 3.31Å; L218-I229 HydrophobicContact CB-CG1 4.46Å; L218-I229 HydrophobicContact CD2-CD1 3.6Å; L218-I229 HydrophobicContact CD2-CG1 4.13Å; L218-I229 HydrophobicContact CG-CD1 3.85Å; L218-I229 HydrophobicContact CG-CG1 3.98Å; L218-I229 WeakPolarHBondContact O-CG1 3.23Å; L218-I229 PolarHBondContact O-N 3.2Å; C220-I229 HydrophobicContact CB-CG2 4.46Å; C220-I229 WeakPolarHBondContact SG-CD1 3.49Å; C220-I229 WeakPolarHBondContact SG-CG1 3.45Å; V227-I229 HydrophobicContact CG1-CG2 4.49Å; V227-I229 PolarHBondContact O-N 3.41Å; I229-V250 PolarHBondContact O-N 2.74Å
230	G	97.9	Very high	92.1	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	156.8	-174.4	0	0	0	0	0	112.8	L218 L228 T248	L218-G230 PolarHBondContact N-O 2.91Å; L218-G230 PolarHBondContact O-N 2.99Å; L218-G230 VanDerWaalsContact O-N 3.15Å; L228-G230 VanDerWaalsContact CD1-O 3.31Å; L228-G230 WeakPolarHBondContact CD1-O 3.39Å; G230-T248 WeakPolarHBondContact CA-O 3.23Å
231	I	98.8	Very high	91.6	Very high	1 Å²	1	44 Å²	44	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	126.3	172.2	-58.7	159.5	0	0	0	106.8	V71 A73 V122 G216 S233 Y247 T248 V250	V71-I231 HydrophobicContact CG2-CD1 3.58Å; A73-I231 HydrophobicContact CB-CG2 4.18Å; V122-I231 HydrophobicContact CB-CD1 4.27Å; V122-I231 HydrophobicContact CG2-CD1 3.67Å; G216-I231 WeakPolarHBondContact O-CA 3.08Å; I231-S233 PolarHBondContact O-N 2.86Å; I231-S233 VanDerWaalsContact O-N 3.16Å; I231-Y247 CarbonylContact O-C 3.27Å; I231-Y247 WeakPolarHBondContact O-CA 3.03Å; I231-Y247 VanDerWaalsContact O-CB 3.3Å; I231-Y247 WeakPolarHBondContact O-CB 3.48Å; I231-T248 PolarHBondContact N-O 2.81Å; I231-T248 VanDerWaalsContact N-O 3.15Å; I231-T248 PolarHBondContact O-N 3.11Å; I231-V250 HydrophobicContact CD1-CG2 3.97Å; I231-V250 HydrophobicContact CG1-CG2 3.81Å
232	V	97.9	Very high	91.3	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.024	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	122.4	-179.4	179.1	0	0	0	0	109.3	D213 G215 G216 Y247	D213-V232 HydrophobicContact CB-CG1 4.08Å; D213-V232 HydrophobicContact CB-CG2 4.31Å; D213-V232 VanDerWaalsContact O-CB 3.26Å; D213-V232 WeakPolarHBondContact O-CB 3.49Å; D213-V232 WeakPolarHBondContact O-CG2 3.34Å; G215-V232 PolarHBondContact N-O 2.82Å; G216-V232 WeakPolarHBondContact O-CG2 3.33Å; G216-V232 PolarHBondContact O-N 3.06Å; V232-Y247 HydrophobicContact CB-CD1 4.3Å; V232-Y247 HydrophobicContact CB-CE1 4.32Å; V232-Y247 HydrophobicContact CG2-CD1 3.91Å; V232-Y247 HydrophobicContact CG2-CE1 3.56Å
233	S	97.1	Very high	91.3	Very high	6 Å²	6	45.4 Å²	45.4	4%	0.042	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	-66.8	-175.5	-177.9	0	0	0	0	111	H75 D121 I231 V246	H75-S233 PolarHBondContact CE1-O 2.75Å; D121-S233 WeakPolarHBondContact CB-OG 3.38Å; D121-S233 WeakPolarHBondContact OD2-CB 3.3Å; D121-S233 PolarHBondContact OD2-OG 3Å; I231-S233 PolarHBondContact O-N 2.86Å; I231-S233 VanDerWaalsContact O-N 3.16Å; S233-V246 PolarHBondContact N-O 3.09Å; S233-V246 VanDerWaalsContact N-O 3.11Å
234	W	94.4	Very high	91.5	Very high	53 Å²	53	42.9 Å²	42.9	20%	0.201	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	170.7	-177.1	63.1	-88	0	0	0	112.6	M118 W191 D194 I195 M199 V246	M118-W234 VanDerWaalsContact CB-CD1 3.47Å; M118-W234 HydrophobicContact CB-CG 4.25Å; M118-W234 HydrophobicContact CG-CG 4.32Å; W191-W234 HydrophobicContact CB-CH2 4.22Å; W191-W234 AromaticContact CD2-CH2 3.8Å; W191-W234 HydrophobicContact CD2-CH2 3.8Å; W191-W234 AromaticContact CD2-CZ3 3.64Å; W191-W234 HydrophobicContact CD2-CZ3 3.64Å; W191-W234 AromaticContact CE3-CH2 3.87Å; W191-W234 HydrophobicContact CE3-CH2 3.87Å; W191-W234 AromaticContact CE3-CZ3 3.45Å; W191-W234 HydrophobicContact CE3-CZ3 3.45Å; W191-W234 VanDerWaalsContact CE3-CZ3 3.45Å; W191-W234 HydrophobicContact CG-CH2 4Å; W191-W234 HydrophobicContact CG-CZ3 4.32Å; W191-W234 HydrophobicContact CH2-CE3 4.5Å; W191-W234 AromaticContact CH2-CZ3 4Å; W191-W234 HydrophobicContact CH2-CZ3 4Å; W191-W234 HydrophobicContact CZ2-CZ3 4.2Å; W191-W234 HydrophobicContact CZ3-CE3 4.48Å; W191-W234 AromaticContact CZ3-CZ3 3.65Å; W191-W234 HydrophobicContact CZ3-CZ3 3.65Å; D194-W234 HydrophobicContact CB-CH2 4.14Å; D194-W234 HydrophobicContact CB-CZ2 4.4Å; I195-W234 HydrophobicContact CD1-CH2 4.09Å; I195-W234 HydrophobicContact CD1-CZ2 3.9Å; M199-W234 HydrophobicContact SD-CZ2 4.15Å; W234-V246 HydrophobicContact CD2-CB 3.85Å; W234-V246 HydrophobicContact CD2-CG1 4.36Å; W234-V246 HydrophobicContact CD2-CG2 3.98Å; W234-V246 HydrophobicContact CE3-CB 4.45Å; W234-V246 HydrophobicContact CE3-CG2 4.13Å; W234-V246 HydrophobicContact CG-CB 4.14Å; W234-V246 HydrophobicContact CH2-CG2 3.85Å; W234-V246 HydrophobicContact CZ2-CB 4.03Å; W234-V246 HydrophobicContact CZ2-CG1 3.92Å; W234-V246 HydrophobicContact CZ2-CG2 3.68Å; W234-V246 HydrophobicContact CZ3-CG2 4.07Å; W234-V246 PolarHBondContact N-O 3.23Å; W234-V246 VanDerWaalsContact N-O 3.07Å; W234-V246 WeakPolarHBondContact O-CA 3.02Å; W234-V246 WeakPolarHBondContact O-CB 3.37Å; W234-V246 PolarHBondContact O-N 3.44Å; W234-V246 VanDerWaalsContact O-O 3.11Å
235	G	91.4	Very high	91.7	Very high	28 Å²	28	37 Å²	37	29%	0.289	18%	0.182	S	C	.	.			trans	-177.8	-160.8	178.7	0	0	0	0	0	110.8
236	T	86.8	Confident	91.8	Very high	18 Å²	18	34.9 Å²	34.9	11%	0.11	17%	0.169	C	C	.	.			trans	-67.1	139.7	178.4	57.3	0	0	0	0	111.5	Y190 W191 N238 C239 N240 A243	Y190-T236 HydrophobicContact CE1-CG2 4.25Å; W191-T236 HydrophobicContact CH2-CG2 3.49Å; W191-T236 VanDerWaalsContact CH2-CG2 3.49Å; W191-T236 HydrophobicContact CZ2-CG2 3.91Å; T236-N238 WeakPolarHBondContact CB-OD1 3.06Å; T236-N238 PolarHBondContact O-N 3.38Å; T236-N238 PolarHBondContact OG1-OD1 3.24Å; T236-C239 PolarHBondContact O-N 2.83Å; T236-C239 VanDerWaalsContact O-N 3.11Å; T236-C239 PolarHBondContact OG1-N 3.35Å; T236-N240 HydrophobicContact CG2-CB 4.04Å; T236-N240 PolarHBondContact OG1-N 3.15Å; T236-A243 HydrophobicContact CG2-CB 3.46Å; T236-A243 VanDerWaalsContact CG2-CB 3.46Å
237	K	81	Confident	91.8	Very high	191 Å²	191	34.4 Å²	34.4	83%	0.83	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-27.2	178	-65.4	-175.4	-179.7	-180	0	113.7	Q211	Q211-K237 PolarHBondContact NE2-O 3.06Å
238	N	82.2	Confident	91.8	Very high	98 Å²	98	34 Å²	34	52%	0.524	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	14.6	179.4	68.3	-24.2	0	0	0	113.5	G165 T236 N240	G165-N238 VanDerWaalsContact CA-O 3.24Å; G165-N238 WeakPolarHBondContact CA-O 3.04Å; T236-N238 WeakPolarHBondContact CB-OD1 3.06Å; T236-N238 PolarHBondContact O-N 3.38Å; T236-N238 PolarHBondContact OG1-OD1 3.24Å; N238-N240 PolarHBondContact O-N 3.15Å; N238-N240 VanDerWaalsContact O-N 3.15Å
239	C	82.8	Confident	91.8	Very high	12 Å²	12	36.6 Å²	36.6	8%	0.081	17%	0.174	C	C	.	.			trans	49.5	46	177.3	-52.6	0	0	0	0	112.8	C210 Q211 T236 V241	C210-C239 WeakPolarHBondContact CA-SG 3.26Å; C210-C239 HydrophobicContact CB-CB 3.73Å; C210-C239 WeakPolarHBondContact CB-SG 3.29Å; C210-C239 WeakPolarHBondContact SG-CB 3.45Å; C210-C239 CovalentContact SG-SG 1.99Å; C210-C239 PolarHBondContact SG-SG 2.85Å; Q211-C239 PolarHBondContact OE1-SG 1.99Å; T236-C239 PolarHBondContact O-N 2.83Å; T236-C239 VanDerWaalsContact O-N 3.11Å; T236-C239 PolarHBondContact OG1-N 3.35Å; C239-V241 PolarHBondContact O-N 2.87Å
240	N	85	Confident	91.8	Very high	49 Å²	49	36.6 Å²	36.6	26%	0.262	17%	0.174	S	C	.	.			trans	-63.8	108	179.4	178.1	6.8	0	0	0	109.7	T236 N238 R242 A243	T236-N240 HydrophobicContact CG2-CB 4.04Å; T236-N240 PolarHBondContact OG1-N 3.15Å; N238-N240 PolarHBondContact O-N 3.15Å; N238-N240 VanDerWaalsContact O-N 3.15Å; N240-R242 PolarHBondContact O-N 3.35Å; N240-R242 WeakPolarHBondContact OD1-CB 3Å; N240-R242 PolarHBondContact OD1-N 3.11Å; N240-A243 HydrophobicContact CB-CB 4.17Å; N240-A243 WeakPolarHBondContact O-CB 3.38Å; N240-A243 PolarHBondContact O-N 2.04Å
241	V	83.4	Confident	91.8	Very high	32 Å²	32	36.9 Å²	36.9	19%	0.194	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-8.2	179.7	-61.7	0	0	0	0	115.1	V35 G204 A205 G206 C239	V35-V241 HydrophobicContact CG1-CG1 4.12Å; V35-V241 HydrophobicContact CG2-CG2 4.42Å; G204-V241 CarbonylContact C-O 3.59Å; A205-V241 PolarHBondContact N-O 3.46Å; G206-V241 PolarHBondContact N-O 2.79Å; C239-V241 PolarHBondContact O-N 2.87Å
242	R	86.5	Confident	91.7	Very high	203 Å²	203	42 Å²	42	77%	0.766	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-8.1	173.2	-58.6	-176.2	-179.2	171.8	0.8	113.2	G204 N240	G204-R242 WeakPolarHBondContact CA-O 3.24Å; N240-R242 PolarHBondContact O-N 3.35Å; N240-R242 WeakPolarHBondContact OD1-CB 3Å; N240-R242 PolarHBondContact OD1-N 3.11Å
243	A	89.1	Confident	91.7	Very high	1 Å²	1	42.2 Å²	42.2	1%	0.008	20%	0.199	C	C	.	.	S	Bend	trans	-95	136.5	172	0	0	0	0	0	109.3	Y190 W191 G204 T236 N240 A245	Y190-A243 HydrophobicContact CD1-CB 4.38Å; Y190-A243 HydrophobicContact CD2-CB 4.5Å; Y190-A243 HydrophobicContact CE1-CB 3.74Å; Y190-A243 HydrophobicContact CE2-CB 3.87Å; Y190-A243 VanDerWaalsContact CZ-CB 3.45Å; W191-A243 HydrophobicContact CZ2-CB 4.38Å; G204-A243 PolarHBondContact N-O 2.82Å; T236-A243 HydrophobicContact CG2-CB 3.46Å; T236-A243 VanDerWaalsContact CG2-CB 3.46Å; N240-A243 HydrophobicContact CB-CB 4.17Å; N240-A243 WeakPolarHBondContact O-CB 3.38Å; N240-A243 PolarHBondContact O-N 2.04Å; A243-A245 PolarHBondContact O-N 3.21Å
244	P	92.8	Very high	91.7	Very high	12 Å²	12	42.2 Å²	42.2	8%	0.078	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	132.4	171.7	28.8	-31.8	0	0	0	109.5	V182 W191 C201	V182-P244 HydrophobicContact CG2-CB 3.88Å; V182-P244 HydrophobicContact CG2-CG 4.49Å; W191-P244 PolarHBondContact NE1-O 3.41Å; C201-P244 HydrophobicContact CB-CB 4.14Å
245	A	92.9	Very high	91.8	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.008	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	152.4	171.2	0	0	0	0	0	110.2	C201 A202 S209 A243 Y247	C201-A245 WeakPolarHBondContact CA-O 3.36Å; C201-A245 WeakPolarHBondContact CB-O 2.99Å; A202-A245 PolarHBondContact N-O 2.86Å; A202-A245 VanDerWaalsContact N-O 3.08Å; A202-A245 PolarHBondContact O-N 2.89Å; S209-A245 VanDerWaalsContact OG-CB 3.27Å; S209-A245 WeakPolarHBondContact OG-CB 3.31Å; A243-A245 PolarHBondContact O-N 3.21Å; A245-Y247 HydrophobicContact CB-CE2 3.72Å; A245-Y247 WeakPolarHBondContact O-CD2 3.13Å; A245-Y247 WeakPolarHBondContact O-CE2 3.46Å
246	V	96.6	Very high	92.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	133.5	-176.6	-171.7	0	0	0	0	110	W191 I195 M199 S233 W234	W191-V246 HydrophobicContact CG-CG2 4.5Å; I195-V246 HydrophobicContact CD1-CG1 4.22Å; I195-V246 HydrophobicContact CD1-CG2 3.84Å; M199-V246 HydrophobicContact CB-CG1 3.87Å; M199-V246 HydrophobicContact CG-CG1 3.98Å; M199-V246 HydrophobicContact SD-CG1 3.78Å; S233-V246 PolarHBondContact N-O 3.09Å; S233-V246 VanDerWaalsContact N-O 3.11Å; W234-V246 HydrophobicContact CD2-CB 3.85Å; W234-V246 HydrophobicContact CD2-CG1 4.36Å; W234-V246 HydrophobicContact CD2-CG2 3.98Å; W234-V246 HydrophobicContact CE3-CB 4.45Å; W234-V246 HydrophobicContact CE3-CG2 4.13Å; W234-V246 HydrophobicContact CG-CB 4.14Å; W234-V246 HydrophobicContact CH2-CG2 3.85Å; W234-V246 HydrophobicContact CZ2-CB 4.03Å; W234-V246 HydrophobicContact CZ2-CG1 3.92Å; W234-V246 HydrophobicContact CZ2-CG2 3.68Å; W234-V246 HydrophobicContact CZ3-CG2 4.07Å; W234-V246 PolarHBondContact N-O 3.23Å; W234-V246 VanDerWaalsContact N-O 3.07Å; W234-V246 WeakPolarHBondContact O-CA 3.02Å; W234-V246 WeakPolarHBondContact O-CB 3.37Å; W234-V246 PolarHBondContact O-N 3.44Å; W234-V246 VanDerWaalsContact O-O 3.11Å
247	Y	97.8	Very high	92.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	148.3	-176.4	-55.2	-107.3	0	0	0	109.3	L179 M199 I200 A202 L218 I231 V232 A245 R249	L179-Y247 HydrophobicContact CD1-CE2 4.48Å; L179-Y247 WeakPolarHBondContact CD1-OH 3.44Å; M199-Y247 WeakPolarHBondContact CA-O 3.39Å; I200-Y247 PolarHBondContact N-O 3.24Å; I200-Y247 PolarHBondContact O-N 3.44Å; A202-Y247 HydrophobicContact CB-CD2 4.31Å; A202-Y247 HydrophobicContact CB-CE2 3.78Å; L218-Y247 HydrophobicContact CB-CD1 3.61Å; L218-Y247 HydrophobicContact CB-CE1 3.71Å; L218-Y247 HydrophobicContact CB-CG 4.34Å; L218-Y247 HydrophobicContact CD1-CE1 4.15Å; L218-Y247 HydrophobicContact CD2-CD1 3.94Å; L218-Y247 HydrophobicContact CD2-CD2 3.96Å; L218-Y247 HydrophobicContact CD2-CE1 4.11Å; L218-Y247 HydrophobicContact CD2-CE2 4.16Å; L218-Y247 HydrophobicContact CD2-CG 3.88Å; L218-Y247 HydrophobicContact CG-CD1 4.29Å; L218-Y247 HydrophobicContact CG-CE1 4.21Å; I231-Y247 CarbonylContact O-C 3.27Å; I231-Y247 WeakPolarHBondContact O-CA 3.03Å; I231-Y247 VanDerWaalsContact O-CB 3.3Å; I231-Y247 WeakPolarHBondContact O-CB 3.48Å; V232-Y247 HydrophobicContact CB-CD1 4.3Å; V232-Y247 HydrophobicContact CB-CE1 4.32Å; V232-Y247 HydrophobicContact CG2-CD1 3.91Å; V232-Y247 HydrophobicContact CG2-CE1 3.56Å; A245-Y247 HydrophobicContact CB-CE2 3.72Å; A245-Y247 WeakPolarHBondContact O-CD2 3.13Å; A245-Y247 WeakPolarHBondContact O-CE2 3.46Å; Y247-R249 PolarHBondContact O-N 2.86Å
248	T	98.4	Very high	93.5	Very high	3 Å²	3	38 Å²	38	2%	0.018	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	127.3	168	-58.5	0	0	0	0	109.5	D121 V122 G230 I231 V250 F253	D121-T248 WeakPolarHBondContact CB-OG1 3.41Å; D121-T248 PolarHBondContact O-OG1 2.81Å; V122-T248 HydrophobicContact CB-CG2 4.21Å; G230-T248 WeakPolarHBondContact CA-O 3.23Å; I231-T248 PolarHBondContact N-O 2.81Å; I231-T248 VanDerWaalsContact N-O 3.15Å; I231-T248 PolarHBondContact O-N 3.11Å; T248-V250 PolarHBondContact O-N 3.3Å; T248-V250 VanDerWaalsContact O-N 3.16Å; T248-F253 HydrophobicContact CG2-CD2 3.63Å; T248-F253 HydrophobicContact CG2-CE2 3.31Å; T248-F253 HydrophobicContact CG2-CZ 4.12Å
249	R	97.5	Very high	94.2	Very high	55 Å²	55	38.8 Å²	38.8	21%	0.208	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	98.2	-179.4	-173.7	175.7	176.6	171.6	5.5	111.2	L149 S198 I200 Y247 S251 K252 F253	L149-R249 HydrophobicContact CD1-CG 4.39Å; S198-R249 VanDerWaalsContact O-CB 3.3Å; S198-R249 WeakPolarHBondContact O-CB 3.29Å; S198-R249 PolarHBondContact O-N 2.85Å; I200-R249 HydrophobicContact CB-CB 4.5Å; I200-R249 HydrophobicContact CG1-CB 4.33Å; I200-R249 HydrophobicContact CG2-CB 3.77Å; I200-R249 HydrophobicContact CG2-CG 3.5Å; Y247-R249 PolarHBondContact O-N 2.86Å; R249-S251 WeakPolarHBondContact CG-OG 3.28Å; R249-S251 PolarHBondContact NE-OG 2.83Å; R249-S251 PolarHBondContact O-N 3.3Å; R249-S251 VanDerWaalsContact O-N 3.13Å; R249-K252 HydrophobicContact CB-CG 4.17Å; R249-K252 HydrophobicContact CG-CG 3.97Å; R249-K252 WeakPolarHBondContact O-CB 3.22Å; R249-K252 PolarHBondContact O-N 2.89Å; R249-F253 VanDerWaalsContact O-CD2 3.25Å; R249-F253 WeakPolarHBondContact O-CD2 3.41Å
250	V	98.2	Very high	95	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.006	19%	0.19	C	C	.	.	H	α-helix	trans	-55.9	-37.6	-173.7	173.7	0	0	0	0	112.9	L142 A143 L228 I229 I231 T248 K252 F253 S254 I257	L142-V250 HydrophobicContact CD2-CG1 3.93Å; A143-V250 HydrophobicContact CB-CB 4.38Å; A143-V250 HydrophobicContact CB-CG1 4.2Å; L228-V250 HydrophobicContact CD2-CG2 4.12Å; L228-V250 HydrophobicContact CG-CG2 4.07Å; L228-V250 WeakPolarHBondContact O-CG1 3.35Å; I229-V250 PolarHBondContact O-N 2.74Å; I231-V250 HydrophobicContact CD1-CG2 3.97Å; I231-V250 HydrophobicContact CG1-CG2 3.81Å; T248-V250 PolarHBondContact O-N 3.3Å; T248-V250 VanDerWaalsContact O-N 3.16Å; V250-K252 PolarHBondContact O-N 3.02Å; V250-K252 VanDerWaalsContact O-N 3.09Å; V250-F253 CarbonylContact O-C 3.43Å; V250-F253 WeakPolarHBondContact O-CA 3.38Å; V250-F253 PolarHBondContact O-N 2.82Å; V250-S254 PolarHBondContact O-N 3.13Å; V250-S254 VanDerWaalsContact O-N 3.11Å; V250-S254 PolarHBondContact O-OG 3.06Å; V250-I257 HydrophobicContact CG1-CD1 4.37Å
251	S	97	Very high	95.5	Very high	7 Å²	7	38.9 Å²	38.9	5%	0.049	19%	0.19	C	C	.	.	H	α-helix	trans	-57.5	-27.1	178.5	73.2	0	0	0	0	113.8	S144 S145 R249 F253 S254	S144-S251 WeakPolarHBondContact O-CB 3.34Å; S145-S251 WeakPolarHBondContact CA-O 3.28Å; R249-S251 WeakPolarHBondContact CG-OG 3.28Å; R249-S251 PolarHBondContact NE-OG 2.83Å; R249-S251 PolarHBondContact O-N 3.3Å; R249-S251 VanDerWaalsContact O-N 3.13Å; S251-F253 VanDerWaalsContact C-N 3.28Å; S251-S254 WeakPolarHBondContact CA-OG 3.5Å; S251-S254 PolarHBondContact O-OG 3.22Å
252	K	97.4	Very high	96.2	Very high	109 Å²	109	41 Å²	41	47%	0.474	21%	0.211	S	C	.	.	H	α-helix	trans	-76.8	-17.8	176.8	-68.3	-71.4	-171.4	173.1	0	112.8	D197 R249 V250	D197-K252 VanDerWaalsContact O-CE 3.3Å; D197-K252 WeakPolarHBondContact O-CE 3.45Å; D197-K252 WeakPolarHBondContact O-CG 3.36Å; R249-K252 HydrophobicContact CB-CG 4.17Å; R249-K252 HydrophobicContact CG-CG 3.97Å; R249-K252 WeakPolarHBondContact O-CB 3.22Å; R249-K252 PolarHBondContact O-N 2.89Å; V250-K252 PolarHBondContact O-N 3.02Å; V250-K252 VanDerWaalsContact O-N 3.09Å
253	F	98.2	Very high	96.6	Very high	7 Å²	7	40 Å²	40	3%	0.031	21%	0.209	C	C	.	.	H	α-helix	trans	-110.3	-4	-176.7	-61	-80	0	0	0	113.2	H110 N120 V122 T248 R249 V250 S251 A255 W256 I257	H110-F253 AromaticContact CD2-CD1 3.57Å; H110-F253 AromaticContact CD2-CE1 3.74Å; H110-F253 AromaticContact NE2-CD1 3.81Å; H110-F253 AromaticContact NE2-CE1 3.78Å; N120-F253 HydrophobicContact CB-CE1 3.87Å; N120-F253 HydrophobicContact CB-CZ 3.87Å; N120-F253 WeakPolarHBondContact OD1-CZ 3.22Å; V122-F253 HydrophobicContact CG1-CD1 3.68Å; V122-F253 HydrophobicContact CG1-CD2 4.4Å; V122-F253 HydrophobicContact CG1-CE1 3.99Å; V122-F253 HydrophobicContact CG1-CG 3.92Å; V122-F253 HydrophobicContact CG1-CZ 4.5Å; T248-F253 HydrophobicContact CG2-CD2 3.63Å; T248-F253 HydrophobicContact CG2-CE2 3.31Å; T248-F253 HydrophobicContact CG2-CZ 4.12Å; R249-F253 VanDerWaalsContact O-CD2 3.25Å; R249-F253 WeakPolarHBondContact O-CD2 3.41Å; V250-F253 CarbonylContact O-C 3.43Å; V250-F253 WeakPolarHBondContact O-CA 3.38Å; V250-F253 PolarHBondContact O-N 2.82Å; S251-F253 VanDerWaalsContact C-N 3.28Å; F253-A255 VanDerWaalsContact C-N 3.25Å; F253-A255 PolarHBondContact O-N 3.48Å; F253-A255 VanDerWaalsContact O-N 3.16Å; F253-W256 HydrophobicContact CB-CE3 4.32Å; F253-W256 PolarHBondContact O-N 3.06Å; F253-I257 HydrophobicContact CB-CD1 4.18Å; F253-I257 HydrophobicContact CB-CG1 4.35Å; F253-I257 WeakPolarHBondContact O-CG1 3.25Å; F253-I257 PolarHBondContact O-N 3.25Å
254	S	96.1	Very high	96.7	Very high	7 Å²	7	44.1 Å²	44.1	5%	0.049	23%	0.231	C	C	.	.	H	α-helix	trans	-53.9	-40.2	-176.8	-44.4	0	0	0	0	113.1	A143 V250 S251 N258	A143-S254 PolarHBondContact O-OG 2.91Å; V250-S254 PolarHBondContact O-N 3.13Å; V250-S254 VanDerWaalsContact O-N 3.11Å; V250-S254 PolarHBondContact O-OG 3.06Å; S251-S254 WeakPolarHBondContact CA-OG 3.5Å; S251-S254 PolarHBondContact O-OG 3.22Å; S254-N258 WeakPolarHBondContact O-CB 3.48Å; S254-N258 PolarHBondContact O-N 3.28Å; S254-N258 PolarHBondContact O-ND2 3.37Å
255	A	97	Very high	96.9	Very high	73 Å²	73	45.8 Å²	45.8	60%	0.603	24%	0.238	S	C	*	.	H	α-helix	trans	-65.2	-46.2	176.9	0	0	0	0	0	112.1	F253 N258 Q259	F253-A255 VanDerWaalsContact C-N 3.25Å; F253-A255 PolarHBondContact O-N 3.48Å; F253-A255 VanDerWaalsContact O-N 3.16Å; A255-N258 PolarHBondContact O-N 3.06Å; A255-Q259 WeakPolarHBondContact O-CB 3.46Å; A255-Q259 PolarHBondContact O-N 2.82Å
256	W	98.3	Very high	97.1	Very high	32 Å²	32	48.1 Å²	48.1	12%	0.121	25%	0.25	C	S	.	.	H	α-helix	trans	-63.9	-43.3	176.1	170.2	81	0	0	0	111.8	I108 H110 V122 L124 F253 N258 Q259 V260	I108-W256 HydrophobicContact CG2-CZ2 4.39Å; H110-W256 HydrophobicContact CB-CH2 4.21Å; H110-W256 HydrophobicContact CB-CZ2 3.98Å; H110-W256 AromaticContact CD2-CD1 3.78Å; H110-W256 AromaticContact CD2-CD2 3.48Å; H110-W256 VanDerWaalsContact CD2-CD2 3.48Å; H110-W256 AromaticContact CD2-CE2 3.67Å; H110-W256 AromaticContact CD2-CE3 3.96Å; H110-W256 AromaticContact CD2-CG 3.58Å; H110-W256 AromaticContact CD2-NE1 3.82Å; V122-W256 HydrophobicContact CB-CZ3 4.42Å; V122-W256 HydrophobicContact CG1-CE3 4.24Å; V122-W256 HydrophobicContact CG1-CH2 4.25Å; V122-W256 HydrophobicContact CG1-CZ3 3.74Å; V122-W256 HydrophobicContact CG2-CH2 4.46Å; V122-W256 HydrophobicContact CG2-CZ3 3.84Å; L124-W256 HydrophobicContact CB-CH2 4.43Å; L124-W256 HydrophobicContact CD1-CH2 4.26Å; L124-W256 HydrophobicContact CD1-CZ3 4.17Å; L124-W256 HydrophobicContact CG-CH2 3.95Å; L124-W256 HydrophobicContact CG-CZ3 3.96Å; F253-W256 HydrophobicContact CB-CE3 4.32Å; F253-W256 PolarHBondContact O-N 3.06Å; W256-N258 PolarHBondContact O-N 2.74Å; W256-Q259 WeakPolarHBondContact O-CB 3.34Å; W256-Q259 PolarHBondContact O-N 3.26Å; W256-V260 HydrophobicContact CD2-CG2 4.22Å; W256-V260 HydrophobicContact CG-CG2 4.49Å; W256-V260 HydrophobicContact CZ2-CG2 3.99Å; W256-V260 WeakPolarHBondContact O-CG2 3.48Å; W256-V260 PolarHBondContact O-N 2.6Å
257	I	98.5	Very high	97.2	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-58.4	-50.9	177.1	-69.3	169.8	0	0	0	110.1	I65 L124 L142 V250 F253 Q259 V260 I261	I65-I257 HydrophobicContact CD1-CG2 4.06Å; L124-I257 HydrophobicContact CD1-CB 4.32Å; L124-I257 HydrophobicContact CD1-CG1 4.33Å; L124-I257 HydrophobicContact CD1-CG2 4.12Å; L124-I257 HydrophobicContact CD2-CG1 4.49Å; L124-I257 HydrophobicContact CD2-CG2 4.34Å; L142-I257 HydrophobicContact CD1-CG2 3.67Å; L142-I257 HydrophobicContact CD2-CD1 4.44Å; V250-I257 HydrophobicContact CG1-CD1 4.37Å; F253-I257 HydrophobicContact CB-CD1 4.18Å; F253-I257 HydrophobicContact CB-CG1 4.35Å; F253-I257 WeakPolarHBondContact O-CG1 3.25Å; F253-I257 PolarHBondContact O-N 3.25Å; I257-Q259 VanDerWaalsContact C-N 3.31Å; I257-Q259 PolarHBondContact O-N 2.82Å; I257-V260 PolarHBondContact O-N 3.35Å; I257-I261 HydrophobicContact CG2-CD1 3.7Å; I257-I261 HydrophobicContact CG2-CG1 4.48Å; I257-I261 VanDerWaalsContact O-CG1 3.3Å; I257-I261 WeakPolarHBondContact O-CG1 3.37Å; I257-I261 PolarHBondContact O-N 3.1Å
258	N	97.3	Very high	97.1	Very high	96 Å²	96	53.8 Å²	53.8	51%	0.513	28%	0.28	S	S	.	.	H	α-helix	trans	-62.2	-39.8	179.4	-70.9	-20.6	0	0	0	111.9	S254 A255 W256 I261 A262	S254-N258 WeakPolarHBondContact O-CB 3.48Å; S254-N258 PolarHBondContact O-N 3.28Å; S254-N258 PolarHBondContact O-ND2 3.37Å; A255-N258 PolarHBondContact O-N 3.06Å; W256-N258 PolarHBondContact O-N 2.74Å; N258-I261 PolarHBondContact O-N 2.82Å; N258-A262 VanDerWaalsContact O-CB 3.26Å; N258-A262 WeakPolarHBondContact O-CB 3.24Å; N258-A262 PolarHBondContact O-N 3.04Å
259	Q	98.1	Very high	97	Very high	115 Å²	115	56.9 Å²	56.9	54%	0.537	30%	0.296	S	S	.	.	H	α-helix	trans	-61.6	-50.7	175.7	-175.1	179.4	15.5	0	0	111	A255 W256 I257 I261 A262 Y263	A255-Q259 WeakPolarHBondContact O-CB 3.46Å; A255-Q259 PolarHBondContact O-N 2.82Å; W256-Q259 WeakPolarHBondContact O-CB 3.34Å; W256-Q259 PolarHBondContact O-N 3.26Å; I257-Q259 VanDerWaalsContact C-N 3.31Å; I257-Q259 PolarHBondContact O-N 2.82Å; Q259-I261 VanDerWaalsContact C-N 3.32Å; Q259-I261 PolarHBondContact O-N 3.15Å; Q259-A262 PolarHBondContact O-N 3.08Å; Q259-Y263 HydrophobicContact CG-CD2 3.66Å; Q259-Y263 HydrophobicContact CG-CE2 3.85Å; Q259-Y263 WeakPolarHBondContact O-CD2 3.34Å; Q259-Y263 PolarHBondContact O-N 3.25Å; Q259-Y263 VanDerWaalsContact O-N 3.11Å
260	V	98.4	Very high	97	Very high	12 Å²	12	57.1 Å²	57.1	7%	0.073	30%	0.302	C	S	.	.	H	α-helix	trans	-58.7	-45.4	179.2	170.5	0	0	0	0	111	W69 I108 L124 W256 I257 A262 Y263 N264	W69-V260 HydrophobicContact CH2-CG1 3.81Å; W69-V260 HydrophobicContact CZ3-CG1 3.94Å; I108-V260 HydrophobicContact CB-CG1 4.27Å; I108-V260 HydrophobicContact CD1-CG1 3.58Å; I108-V260 HydrophobicContact CG2-CG1 4.07Å; I108-V260 HydrophobicContact CG2-CG2 4.2Å; L124-V260 HydrophobicContact CB-CG1 4.39Å; L124-V260 HydrophobicContact CD1-CB 3.7Å; L124-V260 HydrophobicContact CD1-CG1 3.59Å; L124-V260 HydrophobicContact CD1-CG2 4.42Å; W256-V260 HydrophobicContact CD2-CG2 4.22Å; W256-V260 HydrophobicContact CG-CG2 4.49Å; W256-V260 HydrophobicContact CZ2-CG2 3.99Å; W256-V260 WeakPolarHBondContact O-CG2 3.48Å; W256-V260 PolarHBondContact O-N 2.6Å; I257-V260 PolarHBondContact O-N 3.35Å; V260-A262 VanDerWaalsContact C-N 3.34Å; V260-A262 PolarHBondContact O-N 3.13Å; V260-Y263 PolarHBondContact O-N 3.39Å; V260-N264 WeakPolarHBondContact O-CB 3.48Å; V260-N264 PolarHBondContact O-N 3Å; V260-N264 PolarHBondContact O-ND2 2.81Å
261	I	97.4	Very high	96.9	Very high	51 Å²	51	61.1 Å²	61.1	26%	0.262	32%	0.323	S	S	.	.	H	α-helix	trans	-62.7	-39.9	178.2	-68.7	171.7	0	0	0	111.9	I65 W69 L124 I257 N258 Q259	I65-I261 HydrophobicContact CD1-CD1 3.88Å; W69-I261 HydrophobicContact CD2-CG1 3.91Å; W69-I261 HydrophobicContact CG-CD1 4.35Å; W69-I261 HydrophobicContact CG-CG1 3.93Å; L124-I261 HydrophobicContact CD1-CG1 4.42Å; I257-I261 HydrophobicContact CG2-CD1 3.7Å; I257-I261 HydrophobicContact CG2-CG1 4.48Å; I257-I261 VanDerWaalsContact O-CG1 3.3Å; I257-I261 WeakPolarHBondContact O-CG1 3.37Å; I257-I261 PolarHBondContact O-N 3.1Å; N258-I261 PolarHBondContact O-N 2.82Å; Q259-I261 VanDerWaalsContact C-N 3.32Å; Q259-I261 PolarHBondContact O-N 3.15Å
262	A	96.3	Very high	96.9	Very high	76 Å²	76	65.2 Å²	65.2	63%	0.628	34%	0.344	S	S	*	.	H	α-helix	trans	-72.2	-29.8	-176.9	0	0	0	0	0	113.4	N258 Q259 V260	N258-A262 VanDerWaalsContact O-CB 3.26Å; N258-A262 WeakPolarHBondContact O-CB 3.24Å; N258-A262 PolarHBondContact O-N 3.04Å; Q259-A262 PolarHBondContact O-N 3.08Å; V260-A262 VanDerWaalsContact C-N 3.34Å; V260-A262 PolarHBondContact O-N 3.13Å
263	Y	95.1	Very high	96.9	Very high	183 Å²	183	61.6 Å²	61.6	72%	0.718	33%	0.333	S	S	*	.	H	α-helix	trans	-106.6	6.6	-173.3	-67.1	-69.9	0	0	0	114.5	Q259 V260	Q259-Y263 HydrophobicContact CG-CD2 3.66Å; Q259-Y263 HydrophobicContact CG-CE2 3.85Å; Q259-Y263 WeakPolarHBondContact O-CD2 3.34Å; Q259-Y263 PolarHBondContact O-N 3.25Å; Q259-Y263 VanDerWaalsContact O-N 3.11Å; V260-Y263 PolarHBondContact O-N 3.39Å
264	N	92.1	Very high	96.8	Very high	87 Å²	87	66.5 Å²	66.5	47%	0.465	36%	0.361	S	S	.	.			trans	-130.2	0	176.8	-65.9	-93.6	0	0	0	111.5	W69 I108 K126 V260	W69-N264 HydrophobicContact CH2-CB 3.8Å; W69-N264 HydrophobicContact CZ2-CB 3.85Å; W69-N264 WeakPolarHBondContact CZ2-OXT 3.46Å; I108-N264 HydrophobicContact CD1-CB 4.43Å; K126-N264 PolarHBondContact NZ-O 2.59Å; K126-N264 PolarHBondContact NZ-OXT 3.14Å; V260-N264 WeakPolarHBondContact O-CB 3.48Å; V260-N264 PolarHBondContact O-N 3Å; V260-N264 PolarHBondContact O-ND2 2.81Å

Retrieved 264 of 264 residues in 123.6 ms (Link to these results)

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