A0A087X3B0_POEFO Loading...

Methionine aminopeptidase

Cotranslationally removes the N-terminal methionine from nascent proteins. The N-terminal methionine is often cleaved when the second residue in the primary sequence is small and uncharged (Met-Ala-, Cys, Gly, Pro, Ser, Thr, or Val).

AlphaFold DB , UniProt , Accession A0A087X3B0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 393 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	A	37.4	Very low	42.3	Very low	149 Å²	149	141.9 Å²	141.9	100%	1.231	85%	0.847	S	S	*	*				0	109.3	0	0	0	0	0	0	105.7
2	D	37.5	Very low	45.6	Very low	170 Å²	170	140.3 Å²	140.3	91%	0.909	82%	0.815	S	S	*	*			trans	-84.4	112.7	-178.8	-159.1	10.9	0	0	0	106.1
3	E	34.6	Very low	48.7	Very low	184 Å²	184	140.2 Å²	140.2	86%	0.86	80%	0.803	S	S	*	*			trans	-120.4	102.5	174.4	-78.2	-168.6	170	0	0	108.7
4	G	32.8	Very low	51.3	Low	75 Å²	75	131 Å²	131	77%	0.773	75%	0.751	S	S	*	*			trans	-67.4	128.7	177.3	0	0	0	0	0	112.1	A6	G4-A6 PolarHBondContact O-N 3.06Å; G4-A6 VanDerWaalsContact O-N 3.11Å
5	M	36	Very low	53.5	Low	195 Å²	195	127 Å²	127	96%	0.961	72%	0.723	S	S	*	*			trans	-67.8	100.8	161.4	-85.5	167	67	0	0	109.1	S7	M5-S7 PolarHBondContact O-N 3.23Å
6	A	36	Very low	55.4	Low	97 Å²	97	120.6 Å²	120.6	80%	0.802	69%	0.687	S	S	*	*			trans	-67.7	116.2	165.6	0	0	0	0	0	109.3	G4 T8	G4-A6 PolarHBondContact O-N 3.06Å; G4-A6 VanDerWaalsContact O-N 3.11Å; A6-T8 PolarHBondContact O-N 3.19Å
7	S	37.6	Very low	56.9	Low	101 Å²	101	124.8 Å²	124.8	71%	0.706	70%	0.699	S	S	*	*			trans	-66.8	121.2	170.6	58.6	0	0	0	0	109.9	M5 E9	M5-S7 PolarHBondContact O-N 3.23Å; S7-E9 PolarHBondContact O-N 2.78Å
8	T	40.1	Very low	58.1	Low	142 Å²	142	122.7 Å²	122.7	87%	0.871	71%	0.71	S	S	*	*			trans	-71.1	95.5	168.1	40.3	0	0	0	0	109.3	A6 A10	A6-T8 PolarHBondContact O-N 3.19Å; T8-A10 PolarHBondContact O-N 3.28Å
9	E	50.8	Low	59.3	Low	169 Å²	169	117.3 Å²	117.3	79%	0.79	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-59.8	123.4	168.7	-75	-175	148.9	0	0	109.2	S7 R11	S7-E9 PolarHBondContact O-N 2.78Å; E9-R11 PolarHBondContact O-N 2.93Å
10	A	58.8	Low	60.4	Low	81 Å²	81	116.5 Å²	116.5	67%	0.669	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-55.1	123.2	174.2	0	0	0	0	0	109.5	T8 R12	T8-A10 PolarHBondContact O-N 3.28Å; A10-R12 WeakPolarHBondContact O-CG 3.32Å; A10-R12 PolarHBondContact O-N 3.44Å
11	R	63.3	Low	61.6	Low	198 Å²	198	117.6 Å²	117.6	75%	0.747	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-65	124.9	-178.5	-154.1	171.9	178.9	-166.3	-13.4	109.5	E9 D22	E9-R11 PolarHBondContact O-N 2.93Å; R11-D22 WeakPolarHBondContact CG-OD2 3.28Å; R11-D22 IonicContact CZ-OD1 3.39Å; R11-D22 IonicContact CZ-OD2 2.89Å; R11-D22 VanDerWaalsContact NE-CG 3.31Å; R11-D22 IonicContact NE-OD1 3.65Å; R11-D22 PolarHBondContact NE-OD1 3.43Å; R11-D22 IonicContact NE-OD2 3.34Å; R11-D22 PolarHBondContact NE-OD2 3.46Å; R11-D22 IonicContact NH2-OD1 3.59Å; R11-D22 PolarHBondContact NH2-OD1 3Å; R11-D22 IonicContact NH2-OD2 3.88Å
12	R	82.2	Confident	64	Low	123 Å²	123	114.1 Å²	114.1	46%	0.464	64%	0.635	S	S	.	*			trans	-111.6	127	-176.6	-61	173.6	-179.3	173.4	0.4	109.2	A10 D22 A23 Y39	A10-R12 WeakPolarHBondContact O-CG 3.32Å; A10-R12 PolarHBondContact O-N 3.44Å; R12-D22 CarbonylContact O-C 3.59Å; R12-D22 WeakPolarHBondContact O-CA 3.25Å; R12-A23 PolarHBondContact O-N 2.92Å; R12-Y39 HydrophobicContact CB-CD1 4.49Å; R12-Y39 HydrophobicContact CB-CD2 4.24Å; R12-Y39 HydrophobicContact CB-CG 4.17Å; R12-Y39 VanDerWaalsContact CD-CZ 3.4Å; R12-Y39 HydrophobicContact CG-CD2 4.44Å; R12-Y39 HydrophobicContact CG-CE2 4.36Å; R12-Y39 PolarHBondContact NH1-OH 3.18Å; R12-Y39 VanDerWaalsContact NH1-OH 3.09Å
13	E	85.4	Confident	66.3	Low	139 Å²	139	106.3 Å²	106.3	65%	0.65	59%	0.594	S	S	*	*	B	Isolated β-bridge	trans	-91.3	154.1	-179.1	-66.9	-173.8	171.4	0	0	111.9
14	C	85.1	Confident	68.6	Low	11 Å²	11	106.4 Å²	106.4	7%	0.074	59%	0.591	C	S	.	*			trans	-71.6	132.7	178	-170.5	0	0	0	0	111.2	T16 C19 R21 A23 C41	C14-T16 PolarHBondContact O-N 3.12Å; C14-C19 HydrophobicContact CB-CB 4.16Å; C14-R21 WeakPolarHBondContact CB-O 3.41Å; C14-R21 PolarHBondContact N-O 3.06Å; C14-R21 VanDerWaalsContact N-O 3.12Å; C14-A23 HydrophobicContact CB-CB 4.22Å; C14-C41 HydrophobicContact CB-CB 4.18Å; C14-C41 PolarHBondContact SG-N 3.39Å; C14-C41 VanDerWaalsContact SG-N 3.44Å; C14-C41 VanDerWaalsContact SG-SG 3.65Å
15	E	84.3	Confident	71	Confident	71 Å²	71	106.4 Å²	106.4	33%	0.332	57%	0.573	S	S	.	*			trans	-76	-8.5	-179.6	-159.7	-175.7	154.2	0	0	113.2	E17 S38 Y39 F40 H53 L56	E15-E17 PolarHBondContact O-N 3.34Å; E15-S38 VanDerWaalsContact OE2-CA 3.24Å; E15-S38 WeakPolarHBondContact OE2-CA 3.41Å; E15-S38 VanDerWaalsContact OE2-CB 3.23Å; E15-S38 WeakPolarHBondContact OE2-CB 3.31Å; E15-S38 PolarHBondContact OE2-OG 3.45Å; E15-Y39 PolarHBondContact N-O 3.17Å; E15-F40 HydrophobicContact CB-CD1 4.45Å; E15-F40 HydrophobicContact CB-CE1 3.89Å; E15-F40 HydrophobicContact CB-CZ 4.21Å; E15-H53 IonicContact OE1-ND1 2.82Å; E15-H53 PolarHBondContact OE1-ND1 3.19Å; E15-H53 IonicContact OE2-CE1 3.59Å; E15-H53 IonicContact OE2-ND1 2.78Å; E15-L56 WeakPolarHBondContact OE1-CD1 3.32Å
16	T	84.8	Confident	73.3	Confident	24 Å²	24	101.1 Å²	101.1	15%	0.147	55%	0.546	C	S	.	.	S	Bend	trans	-70.5	123.9	177.8	-53.2	0	0	0	0	110.5	C14 G18 C19 C45	C14-T16 PolarHBondContact O-N 3.12Å; T16-G18 PolarHBondContact O-N 3.05Å; T16-C19 HydrophobicContact CG2-CB 4.49Å; T16-C19 VanDerWaalsContact O-CB 3.31Å; T16-C19 WeakPolarHBondContact O-CB 3.41Å; T16-C19 PolarHBondContact O-N 3.25Å; T16-C45 HydrophobicContact CG2-CB 4.43Å; T16-C45 WeakPolarHBondContact OG1-CA 3.44Å; T16-C45 WeakPolarHBondContact OG1-CB 3.46Å; T16-C45 PolarHBondContact OG1-O 3.09Å
17	E	80.1	Confident	75.6	Confident	192 Å²	192	96.7 Å²	96.7	90%	0.897	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	126	177.7	-165.5	173.8	-172.5	0	0	111.1	E15	E15-E17 PolarHBondContact O-N 3.34Å
18	G	78.9	Confident	77.8	Confident	87 Å²	87	95.9 Å²	95.9	90%	0.897	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.5	6.6	-175.7	0	0	0	0	0	115.8	T16	T16-G18 PolarHBondContact O-N 3.05Å
19	C	81.6	Confident	79.8	Confident	21 Å²	21	91.6 Å²	91.6	14%	0.142	48%	0.475	C	S	.	.			trans	-114	108.6	177.3	-165.2	0	0	0	0	112.6	C14 T16	C14-C19 HydrophobicContact CB-CB 4.16Å; T16-C19 HydrophobicContact CG2-CB 4.49Å; T16-C19 VanDerWaalsContact O-CB 3.31Å; T16-C19 WeakPolarHBondContact O-CB 3.41Å; T16-C19 PolarHBondContact O-N 3.25Å
20	S	80.3	Confident	81.3	Confident	100 Å²	100	83.7 Å²	83.7	70%	0.699	44%	0.439	S	S	*	.			trans	-99.9	26.7	177.9	-50.4	0	0	0	0	113.5
21	R	85.4	Confident	82.4	Confident	140 Å²	140	84.7 Å²	84.7	53%	0.528	43%	0.432	S	S	.	.	S	Bend	trans	-84.1	145.7	179.4	-69.4	-173.1	-70.7	-177.2	-3.1	110.9	C14 A23 C41	C14-R21 WeakPolarHBondContact CB-O 3.41Å; C14-R21 PolarHBondContact N-O 3.06Å; C14-R21 VanDerWaalsContact N-O 3.12Å; R21-A23 PolarHBondContact O-N 3.3Å; R21-C41 HydrophobicContact CB-CB 3.86Å; R21-C41 PolarHBondContact NE-SG 3.19Å; R21-C41 VanDerWaalsContact NE-SG 3.42Å
22	D	87.9	Confident	83.2	Confident	76 Å²	76	83.4 Å²	83.4	41%	0.406	43%	0.432	S	S	.	.	B	Isolated β-bridge	trans	-56.2	132.6	171.9	-71.5	32.8	0	0	0	111	R11 R12 C41	R11-D22 WeakPolarHBondContact CG-OD2 3.28Å; R11-D22 IonicContact CZ-OD1 3.39Å; R11-D22 IonicContact CZ-OD2 2.89Å; R11-D22 VanDerWaalsContact NE-CG 3.31Å; R11-D22 IonicContact NE-OD1 3.65Å; R11-D22 PolarHBondContact NE-OD1 3.43Å; R11-D22 IonicContact NE-OD2 3.34Å; R11-D22 PolarHBondContact NE-OD2 3.46Å; R11-D22 IonicContact NH2-OD1 3.59Å; R11-D22 PolarHBondContact NH2-OD1 3Å; R11-D22 IonicContact NH2-OD2 3.88Å; R12-D22 CarbonylContact O-C 3.59Å; R12-D22 WeakPolarHBondContact O-CA 3.25Å; D22-C41 VanDerWaalsContact O-CB 3.28Å; D22-C41 WeakPolarHBondContact O-CB 3.48Å
23	A	86.3	Confident	83.1	Confident	6 Å²	6	79.5 Å²	79.5	5%	0.05	42%	0.42	C	S	.	.			trans	-116.2	128.3	-170.3	0	0	0	0	0	111.9	R12 C14 R21 F40	R12-A23 PolarHBondContact O-N 2.92Å; C14-A23 HydrophobicContact CB-CB 4.22Å; R21-A23 PolarHBondContact O-N 3.3Å; A23-F40 VanDerWaalsContact CB-C 3.47Å
24	K	82.3	Confident	82.7	Confident	186 Å²	186	75.8 Å²	75.8	81%	0.809	42%	0.418	S	S	*	.			trans	-120.4	-14.4	-178.6	-63.7	-171.9	178.6	-171.6	0	113.5	F40	K24-F40 PolarHBondContact N-O 2.71Å
25	L	83.9	Confident	82.4	Confident	75 Å²	75	77.3 Å²	77.3	39%	0.393	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	134.6	-179.1	-56.7	173.9	0	0	0	109.8	Y39 F40	L25-Y39 CarbonylContact O-C 3.52Å; L25-Y39 VanDerWaalsContact O-CA 3.32Å; L25-Y39 WeakPolarHBondContact O-CA 3.4Å; L25-F40 WeakPolarHBondContact CB-O 3.48Å; L25-F40 PolarHBondContact N-O 3.5Å; L25-F40 PolarHBondContact O-N 2.96Å
26	Q	85.1	Confident	82	Confident	85 Å²	85	83 Å²	83	40%	0.397	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	149.5	174	-76.9	-177.6	-25.7	0	0	110.7	P28 I31 Y39	Q26-P28 WeakPolarHBondContact O-CD 3.39Å; Q26-I31 HydrophobicContact CB-CD1 3.93Å; Q26-I31 HydrophobicContact CB-CG1 4.29Å; Q26-Y39 HydrophobicContact CG-CD1 3.51Å; Q26-Y39 HydrophobicContact CG-CE1 3.3Å; Q26-Y39 PolarHBondContact NE2-OH 3.46Å
27	C	84.6	Confident	81.5	Confident	3 Å²	3	84.4 Å²	84.4	2%	0.02	47%	0.471	C	S	.	.			trans	-69.3	123.5	171.8	-176	0	0	0	0	110.6	T29 C30 I31 F40 F46 H57	C27-T29 PolarHBondContact O-N 3.47Å; C27-T29 VanDerWaalsContact O-N 3.16Å; C27-C30 HydrophobicContact CB-CB 3.98Å; C27-C30 WeakPolarHBondContact O-CB 3.36Å; C27-C30 PolarHBondContact O-N 2.79Å; C27-C30 VanDerWaalsContact O-N 3.14Å; C27-I31 PolarHBondContact O-N 2.73Å; C27-I31 VanDerWaalsContact O-N 3.17Å; C27-F40 HydrophobicContact CB-CE2 4.42Å; C27-F46 HydrophobicContact CB-CE2 4.03Å; C27-H57 VanDerWaalsContact SG-CE1 3.6Å
28	P	82.2	Confident	81.6	Confident	84 Å²	84	75.5 Å²	75.5	55%	0.545	43%	0.43	S	S	.	.	H	α-helix	trans	-59.8	-28.8	178.3	-24.8	34.4	0	0	0	113.7	Q26 K32	Q26-P28 WeakPolarHBondContact O-CD 3.39Å; P28-K32 WeakPolarHBondContact O-CG 3.5Å; P28-K32 PolarHBondContact O-N 3.14Å; P28-K32 VanDerWaalsContact O-N 3.16Å
29	T	82.1	Confident	82	Confident	52 Å²	52	73 Å²	73	32%	0.319	39%	0.394	S	S	.	.	H	α-helix	trans	-75.3	-38.9	178.1	-54.9	0	0	0	0	111.5	C27 I31 K32 L33 H57	C27-T29 PolarHBondContact O-N 3.47Å; C27-T29 VanDerWaalsContact O-N 3.16Å; T29-I31 VanDerWaalsContact C-N 3.32Å; T29-I31 PolarHBondContact O-N 2.95Å; T29-K32 PolarHBondContact O-N 3.31Å; T29-L33 HydrophobicContact CG2-CD1 3.82Å; T29-L33 HydrophobicContact CG2-CG 4.31Å; T29-L33 WeakPolarHBondContact O-CB 3.5Å; T29-L33 VanDerWaalsContact O-CG 3.32Å; T29-L33 WeakPolarHBondContact O-CG 3.49Å; T29-L33 PolarHBondContact O-N 3.01Å; T29-H57 HydrophobicContact CG2-CB 4.44Å
30	C	83.4	Confident	82.4	Confident	4 Å²	4	72 Å²	72	3%	0.027	39%	0.387	C	S	.	.	H	α-helix	trans	-59.5	-43.1	171.6	-72.4	0	0	0	0	111.7	C27 K32 L33 G34 I35 H53 H57	C27-C30 HydrophobicContact CB-CB 3.98Å; C27-C30 WeakPolarHBondContact O-CB 3.36Å; C27-C30 PolarHBondContact O-N 2.79Å; C27-C30 VanDerWaalsContact O-N 3.14Å; C30-K32 VanDerWaalsContact C-N 3.34Å; C30-K32 PolarHBondContact O-N 2.89Å; C30-L33 CarbonylContact O-C 3.48Å; C30-L33 PolarHBondContact O-N 2.65Å; C30-G34 PolarHBondContact O-N 3.38Å; C30-I35 HydrophobicContact CB-CB 4Å; C30-I35 PolarHBondContact O-N 2.99Å; C30-H53 PolarHBondContact SG-CE1 2.89Å; C30-H57 PolarHBondContact SG-NE2 3.45Å
31	I	81.1	Confident	82.8	Confident	101 Å²	101	68.8 Å²	68.8	52%	0.518	36%	0.364	S	S	.	.	H	α-helix	trans	-58.5	-47.5	175.5	-62.4	171.1	0	0	0	110.3	Q26 C27 T29 L33 G34	Q26-I31 HydrophobicContact CB-CD1 3.93Å; Q26-I31 HydrophobicContact CB-CG1 4.29Å; C27-I31 PolarHBondContact O-N 2.73Å; C27-I31 VanDerWaalsContact O-N 3.17Å; T29-I31 VanDerWaalsContact C-N 3.32Å; T29-I31 PolarHBondContact O-N 2.95Å; I31-L33 VanDerWaalsContact C-N 3.29Å; I31-L33 PolarHBondContact O-N 3.2Å; I31-G34 PolarHBondContact O-N 3.09Å
32	K	81.3	Confident	82.9	Confident	172 Å²	172	63.2 Å²	63.2	75%	0.748	35%	0.347	S	S	*	.	H	α-helix	trans	-65	-30.1	177.8	-73.3	177.6	-179.2	-176.1	0	113.7	P28 T29 C30	P28-K32 WeakPolarHBondContact O-CG 3.5Å; P28-K32 PolarHBondContact O-N 3.14Å; P28-K32 VanDerWaalsContact O-N 3.16Å; T29-K32 PolarHBondContact O-N 3.31Å; C30-K32 VanDerWaalsContact C-N 3.34Å; C30-K32 PolarHBondContact O-N 2.89Å
33	L	78.8	Confident	82.7	Confident	41 Å²	41	65.2 Å²	65.2	22%	0.215	35%	0.353	C	S	.	.	H	α-helix	trans	-92.9	-0.7	179.8	-66.5	176.7	0	0	0	113.2	T29 C30 I31 I35 H57 A60 K61	T29-L33 HydrophobicContact CG2-CD1 3.82Å; T29-L33 HydrophobicContact CG2-CG 4.31Å; T29-L33 WeakPolarHBondContact O-CB 3.5Å; T29-L33 VanDerWaalsContact O-CG 3.32Å; T29-L33 WeakPolarHBondContact O-CG 3.49Å; T29-L33 PolarHBondContact O-N 3.01Å; C30-L33 CarbonylContact O-C 3.48Å; C30-L33 PolarHBondContact O-N 2.65Å; I31-L33 VanDerWaalsContact C-N 3.29Å; I31-L33 PolarHBondContact O-N 3.2Å; L33-I35 HydrophobicContact CB-CD1 3.89Å; L33-I35 HydrophobicContact CB-CG1 3.87Å; L33-I35 HydrophobicContact CD1-CD1 4.09Å; L33-I35 PolarHBondContact O-N 3.15Å; L33-H57 HydrophobicContact CD1-CB 4.07Å; L33-A60 HydrophobicContact CD1-CB 4.23Å; L33-K61 HydrophobicContact CD1-CG 4.35Å; L33-K61 HydrophobicContact CD2-CG 4.18Å
34	G	77.9	Confident	82.6	Confident	60 Å²	60	72.2 Å²	72.2	62%	0.619	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.6	18	-178	0	0	0	0	0	114.4	C30 I31 Q36	C30-G34 PolarHBondContact O-N 3.38Å; I31-G34 PolarHBondContact O-N 3.09Å; G34-Q36 PolarHBondContact O-N 2.92Å
35	I	78.7	Confident	82.8	Confident	44 Å²	44	64 Å²	64	23%	0.226	35%	0.351	C	S	.	.			trans	-77.6	113.8	-179	-56.1	170.9	0	0	0	108.4	C30 L33 A60	C30-I35 HydrophobicContact CB-CB 4Å; C30-I35 PolarHBondContact O-N 2.99Å; L33-I35 HydrophobicContact CB-CD1 3.89Å; L33-I35 HydrophobicContact CB-CG1 3.87Å; L33-I35 HydrophobicContact CD1-CD1 4.09Å; L33-I35 PolarHBondContact O-N 3.15Å; I35-A60 HydrophobicContact CD1-CB 3.54Å; I35-A60 HydrophobicContact CG1-CB 3.96Å
36	Q	76.5	Confident	82.9	Confident	190 Å²	190	62.5 Å²	62.5	89%	0.888	34%	0.341	S	S	*	.			trans	-83.4	145.9	177.5	-63.3	-168.8	-7.5	0	0	111.4	G34	G34-Q36 PolarHBondContact O-N 2.92Å
37	G	74.1	Confident	82.9	Confident	53 Å²	53	65.7 Å²	65.7	55%	0.546	35%	0.354	S	S	.	.			trans	100.7	-0.8	168.6	0	0	0	0	0	116.9	Y39	G37-Y39 WeakPolarHBondContact O-CD2 3.37Å
38	S	81.4	Confident	82.8	Confident	6 Å²	6	68.4 Å²	68.4	4%	0.042	38%	0.383	C	S	.	.			trans	-91.7	109.8	-179.3	-173.8	0	0	0	0	113.6	E15 F40 H53	E15-S38 VanDerWaalsContact OE2-CA 3.24Å; E15-S38 WeakPolarHBondContact OE2-CA 3.41Å; E15-S38 VanDerWaalsContact OE2-CB 3.23Å; E15-S38 WeakPolarHBondContact OE2-CB 3.31Å; E15-S38 PolarHBondContact OE2-OG 3.45Å; S38-F40 VanDerWaalsContact OG-CE2 3.22Å; S38-F40 WeakPolarHBondContact OG-CE2 3.34Å; S38-H53 PolarHBondContact OG-CE1 3.3Å
39	Y	87.9	Confident	82.8	Confident	33 Å²	33	64.9 Å²	64.9	13%	0.129	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	141.9	-176.8	-61.5	-83.7	0	0	0	112.4	R12 E15 L25 Q26 G37	R12-Y39 HydrophobicContact CB-CD1 4.49Å; R12-Y39 HydrophobicContact CB-CD2 4.24Å; R12-Y39 HydrophobicContact CB-CG 4.17Å; R12-Y39 VanDerWaalsContact CD-CZ 3.4Å; R12-Y39 HydrophobicContact CG-CD2 4.44Å; R12-Y39 HydrophobicContact CG-CE2 4.36Å; R12-Y39 PolarHBondContact NH1-OH 3.18Å; R12-Y39 VanDerWaalsContact NH1-OH 3.09Å; E15-Y39 PolarHBondContact N-O 3.17Å; L25-Y39 CarbonylContact O-C 3.52Å; L25-Y39 VanDerWaalsContact O-CA 3.32Å; L25-Y39 WeakPolarHBondContact O-CA 3.4Å; Q26-Y39 HydrophobicContact CG-CD1 3.51Å; Q26-Y39 HydrophobicContact CG-CE1 3.3Å; Q26-Y39 PolarHBondContact NE2-OH 3.46Å; G37-Y39 WeakPolarHBondContact O-CD2 3.37Å
40	F	89.2	Confident	82.9	Confident	2 Å²	2	67 Å²	67	1%	0.009	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	143.9	178.4	-55.6	-83.5	0	0	0	111.5	E15 A23 K24 L25 C27 S38 F46 H53	E15-F40 HydrophobicContact CB-CD1 4.45Å; E15-F40 HydrophobicContact CB-CE1 3.89Å; E15-F40 HydrophobicContact CB-CZ 4.21Å; A23-F40 VanDerWaalsContact CB-C 3.47Å; K24-F40 PolarHBondContact N-O 2.71Å; L25-F40 WeakPolarHBondContact CB-O 3.48Å; L25-F40 PolarHBondContact N-O 3.5Å; L25-F40 PolarHBondContact O-N 2.96Å; C27-F40 HydrophobicContact CB-CE2 4.42Å; S38-F40 VanDerWaalsContact OG-CE2 3.22Å; S38-F40 WeakPolarHBondContact OG-CE2 3.34Å; F40-F46 HydrophobicContact CB-CB 4.25Å; F40-F46 HydrophobicContact CD1-CB 4.24Å; F40-F46 HydrophobicContact CD1-CD2 4.44Å; F40-F46 HydrophobicContact CD2-CB 4.32Å; F40-F46 AromaticContact CD2-CD2 3.66Å; F40-F46 HydrophobicContact CD2-CD2 3.66Å; F40-F46 HydrophobicContact CD2-CG 4.44Å; F40-F46 HydrophobicContact CE1-CD2 4.34Å; F40-F46 AromaticContact CE2-CD2 3.55Å; F40-F46 HydrophobicContact CE2-CD2 3.55Å; F40-F46 HydrophobicContact CE2-CE2 4.09Å; F40-F46 HydrophobicContact CG-CB 3.99Å; F40-F46 HydrophobicContact CG-CD2 4.12Å; F40-F46 AromaticContact CZ-CD2 3.91Å; F40-F46 HydrophobicContact CZ-CD2 3.91Å; F40-F46 HydrophobicContact CZ-CE2 4.49Å; F40-H53 AromaticContact CZ-CE1 3.99Å; F40-H53 AromaticContact CZ-CG 3.91Å; F40-H53 AromaticContact CZ-ND1 3.75Å
41	C	88.5	Confident	82.8	Confident	31 Å²	31	71.7 Å²	71.7	21%	0.209	39%	0.39	C	S	.	.	S	Bend	trans	-83.4	-22	178	68.5	0	0	0	0	113.2	C14 R21 D22	C14-C41 HydrophobicContact CB-CB 4.18Å; C14-C41 PolarHBondContact SG-N 3.39Å; C14-C41 VanDerWaalsContact SG-N 3.44Å; C14-C41 VanDerWaalsContact SG-SG 3.65Å; R21-C41 HydrophobicContact CB-CB 3.86Å; R21-C41 PolarHBondContact NE-SG 3.19Å; R21-C41 VanDerWaalsContact NE-SG 3.42Å; D22-C41 VanDerWaalsContact O-CB 3.28Å; D22-C41 WeakPolarHBondContact O-CB 3.48Å
42	S	87.3	Confident	82.8	Confident	24 Å²	24	70.3 Å²	70.3	17%	0.168	39%	0.39	C	S	.	.	S	Bend	trans	-154	166	177	78.5	0	0	0	0	112.4	E44 C45 F46	S42-E44 PolarHBondContact O-N 3.03Å; S42-E44 PolarHBondContact OG-N 3.21Å; S42-C45 PolarHBondContact O-N 3.2Å; S42-C45 PolarHBondContact OG-N 3.32Å; S42-F46 PolarHBondContact O-N 3.12Å; S42-F46 VanDerWaalsContact O-N 3.08Å
43	Q	83.6	Confident	82.9	Confident	117 Å²	117	62.2 Å²	62.2	55%	0.547	36%	0.355	S	S	.	.	H	α-helix	trans	-63.4	-29.8	173.3	-73.2	-68.6	-16.8	0	0	112.8	K47	Q43-K47 WeakPolarHBondContact O-CG 3.34Å; Q43-K47 PolarHBondContact O-N 2.74Å
44	E	85.8	Confident	83.3	Confident	153 Å²	153	64.6 Å²	64.6	72%	0.715	36%	0.363	S	S	*	.	H	α-helix	trans	-69.7	-43.9	176.6	-66.4	158.6	170.1	0	0	110.9	S42 F46 K47 G48	S42-E44 PolarHBondContact O-N 3.03Å; S42-E44 PolarHBondContact OG-N 3.21Å; E44-F46 VanDerWaalsContact C-N 3.33Å; E44-F46 PolarHBondContact O-N 3.27Å; E44-K47 PolarHBondContact O-N 2.88Å; E44-G48 PolarHBondContact O-N 3.38Å
45	C	85.8	Confident	83.6	Confident	14 Å²	14	66.8 Å²	66.8	10%	0.095	36%	0.36	C	S	.	.	H	α-helix	trans	-61	-41.8	174.1	-83.3	0	0	0	0	111.8	T16 S42 G48 S49	T16-C45 HydrophobicContact CG2-CB 4.43Å; T16-C45 WeakPolarHBondContact OG1-CA 3.44Å; T16-C45 WeakPolarHBondContact OG1-CB 3.46Å; T16-C45 PolarHBondContact OG1-O 3.09Å; S42-C45 PolarHBondContact O-N 3.2Å; S42-C45 PolarHBondContact OG-N 3.32Å; C45-G48 PolarHBondContact O-N 3.48Å; C45-S49 WeakPolarHBondContact O-CB 3.39Å; C45-S49 PolarHBondContact O-N 3.5Å
46	F	86.1	Confident	83.7	Confident	43 Å²	43	68 Å²	68	19%	0.189	37%	0.367	C	S	.	.	H	α-helix	trans	-60.4	-47.6	173.3	176.5	-109.6	0	0	0	112.4	C27 F40 S42 E44 G48 S49 W50	C27-F46 HydrophobicContact CB-CE2 4.03Å; F40-F46 HydrophobicContact CB-CB 4.25Å; F40-F46 HydrophobicContact CD1-CB 4.24Å; F40-F46 HydrophobicContact CD1-CD2 4.44Å; F40-F46 HydrophobicContact CD2-CB 4.32Å; F40-F46 AromaticContact CD2-CD2 3.66Å; F40-F46 HydrophobicContact CD2-CD2 3.66Å; F40-F46 HydrophobicContact CD2-CG 4.44Å; F40-F46 HydrophobicContact CE1-CD2 4.34Å; F40-F46 AromaticContact CE2-CD2 3.55Å; F40-F46 HydrophobicContact CE2-CD2 3.55Å; F40-F46 HydrophobicContact CE2-CE2 4.09Å; F40-F46 HydrophobicContact CG-CB 3.99Å; F40-F46 HydrophobicContact CG-CD2 4.12Å; F40-F46 AromaticContact CZ-CD2 3.91Å; F40-F46 HydrophobicContact CZ-CD2 3.91Å; F40-F46 HydrophobicContact CZ-CE2 4.49Å; S42-F46 PolarHBondContact O-N 3.12Å; S42-F46 VanDerWaalsContact O-N 3.08Å; E44-F46 VanDerWaalsContact C-N 3.33Å; E44-F46 PolarHBondContact O-N 3.27Å; F46-G48 PolarHBondContact O-N 3.3Å; F46-S49 PolarHBondContact O-N 3.44Å; F46-W50 HydrophobicContact CE1-CE3 4.28Å; F46-W50 HydrophobicContact CE2-CE3 4.01Å; F46-W50 HydrophobicContact CE2-CZ3 4.13Å; F46-W50 AromaticContact CZ-CE3 3.62Å; F46-W50 HydrophobicContact CZ-CE3 3.62Å; F46-W50 AromaticContact CZ-CZ3 3.63Å; F46-W50 HydrophobicContact CZ-CZ3 3.63Å; F46-W50 PolarHBondContact O-N 2.96Å; F46-W50 VanDerWaalsContact O-N 3.07Å
47	K	84.7	Confident	84.1	Confident	153 Å²	153	59.6 Å²	59.6	67%	0.665	33%	0.328	S	S	*	.	H	α-helix	trans	-63.3	-41.5	177.9	-74.5	175.9	-177.5	-179.9	0	112.2	Q43 E44 S49 W50	Q43-K47 WeakPolarHBondContact O-CG 3.34Å; Q43-K47 PolarHBondContact O-N 2.74Å; E44-K47 PolarHBondContact O-N 2.88Å; K47-S49 VanDerWaalsContact C-N 3.33Å; K47-S49 PolarHBondContact O-N 3.24Å; K47-W50 VanDerWaalsContact O-CB 3.32Å; K47-W50 WeakPolarHBondContact O-CB 3.13Å; K47-W50 PolarHBondContact O-N 3.41Å
48	G	81.7	Confident	84.5	Confident	60 Å²	60	63 Å²	63	62%	0.619	33%	0.327	S	S	*	.	H	α-helix	trans	-64.1	-36	177.9	0	0	0	0	0	113.2	E44 C45 F46	E44-G48 PolarHBondContact O-N 3.38Å; C45-G48 PolarHBondContact O-N 3.48Å; F46-G48 PolarHBondContact O-N 3.3Å
49	S	83.4	Confident	84.5	Confident	9 Å²	9	68.9 Å²	68.9	6%	0.063	35%	0.352	C	S	.	.	H	α-helix	trans	-85.8	-5.6	177.5	-161.3	0	0	0	0	113.5	C45 F46 K47 T51 S52 H53	C45-S49 WeakPolarHBondContact O-CB 3.39Å; C45-S49 PolarHBondContact O-N 3.5Å; F46-S49 PolarHBondContact O-N 3.44Å; K47-S49 VanDerWaalsContact C-N 3.33Å; K47-S49 PolarHBondContact O-N 3.24Å; S49-T51 VanDerWaalsContact C-N 3.26Å; S49-T51 PolarHBondContact O-N 3.14Å; S49-T51 VanDerWaalsContact O-N 3.11Å; S49-S52 PolarHBondContact O-N 3.19Å; S49-S52 PolarHBondContact O-OG 3.42Å; S49-H53 WeakPolarHBondContact O-CB 3.23Å; S49-H53 PolarHBondContact O-N 2.93Å
50	W	83.3	Confident	84	Confident	98 Å²	98	68.3 Å²	68.3	37%	0.371	35%	0.354	S	S	.	.	H	α-helix	trans	-58.5	-34.6	-170.4	-178.2	-118.7	0	0	0	114.2	F46 K47 S52 K54 H57	F46-W50 HydrophobicContact CE1-CE3 4.28Å; F46-W50 HydrophobicContact CE2-CE3 4.01Å; F46-W50 HydrophobicContact CE2-CZ3 4.13Å; F46-W50 AromaticContact CZ-CE3 3.62Å; F46-W50 HydrophobicContact CZ-CE3 3.62Å; F46-W50 AromaticContact CZ-CZ3 3.63Å; F46-W50 HydrophobicContact CZ-CZ3 3.63Å; F46-W50 PolarHBondContact O-N 2.96Å; F46-W50 VanDerWaalsContact O-N 3.07Å; K47-W50 VanDerWaalsContact O-CB 3.32Å; K47-W50 WeakPolarHBondContact O-CB 3.13Å; K47-W50 PolarHBondContact O-N 3.41Å; W50-S52 PolarHBondContact O-N 3.01Å; W50-K54 HydrophobicContact CD2-CB 4.26Å; W50-K54 HydrophobicContact CE3-CB 4.47Å; W50-K54 HydrophobicContact CH2-CB 4.23Å; W50-K54 HydrophobicContact CZ2-CB 4Å; W50-K54 HydrophobicContact CZ3-CB 4.46Å; W50-K54 WeakPolarHBondContact O-CB 3.03Å; W50-K54 VanDerWaalsContact O-CG 3.26Å; W50-K54 WeakPolarHBondContact O-CG 3.38Å; W50-K54 PolarHBondContact O-N 2.92Å; W50-H57 AromaticContact CH2-CE1 4Å; W50-H57 AromaticContact CH2-ND1 3.9Å; W50-H57 AromaticContact CZ3-CE1 3.78Å
51	T	82.6	Confident	83.5	Confident	101 Å²	101	73.7 Å²	73.7	62%	0.62	38%	0.378	S	S	*	.	H	α-helix	trans	-63.8	-42	-177.3	-58.1	0	0	0	0	112.6	S49 K54	S49-T51 VanDerWaalsContact C-N 3.26Å; S49-T51 PolarHBondContact O-N 3.14Å; S49-T51 VanDerWaalsContact O-N 3.11Å; T51-K54 WeakPolarHBondContact O-CE 3.4Å
52	S	81.2	Confident	82.9	Confident	73 Å²	73	76.8 Å²	76.8	51%	0.51	39%	0.389	S	S	.	.	H	α-helix	trans	-82.3	-43.6	175.3	48.7	0	0	0	0	111	S49 W50 K54 L55	S49-S52 PolarHBondContact O-N 3.19Å; S49-S52 PolarHBondContact O-OG 3.42Å; W50-S52 PolarHBondContact O-N 3.01Å; S52-K54 PolarHBondContact O-N 2.94Å; S52-L55 VanDerWaalsContact O-CB 3.28Å; S52-L55 WeakPolarHBondContact O-CB 3.35Å; S52-L55 PolarHBondContact O-N 3.26Å; S52-L55 VanDerWaalsContact O-N 3.07Å
53	H	83.6	Confident	82	Confident	1 Å²	1	79.3 Å²	79.3	1%	0.005	40%	0.401	C	S	.	.	H	α-helix	trans	-62.5	-36.9	-175.2	-176.4	69.2	0	0	0	113.2	E15 C30 S38 F40 S49 L55 L56 H57	E15-H53 IonicContact OE1-ND1 2.82Å; E15-H53 PolarHBondContact OE1-ND1 3.19Å; E15-H53 IonicContact OE2-CE1 3.59Å; E15-H53 IonicContact OE2-ND1 2.78Å; C30-H53 PolarHBondContact SG-CE1 2.89Å; S38-H53 PolarHBondContact OG-CE1 3.3Å; F40-H53 AromaticContact CZ-CE1 3.99Å; F40-H53 AromaticContact CZ-CG 3.91Å; F40-H53 AromaticContact CZ-ND1 3.75Å; S49-H53 WeakPolarHBondContact O-CB 3.23Å; S49-H53 PolarHBondContact O-N 2.93Å; H53-L55 PolarHBondContact O-N 2.98Å; H53-L55 VanDerWaalsContact O-N 3.15Å; H53-L56 VanDerWaalsContact O-CB 3.32Å; H53-L56 WeakPolarHBondContact O-CB 3.47Å; H53-L56 PolarHBondContact O-N 3.32Å; H53-L56 VanDerWaalsContact O-N 3.07Å; H53-H57 AromaticContact CD2-CE1 3.88Å; H53-H57 AromaticContact NE2-CE1 3.66Å; H53-H57 AromaticContact NE2-NE2 3.54Å
54	K	85.6	Confident	81.1	Confident	91 Å²	91	78.8 Å²	78.8	40%	0.396	40%	0.396	S	S	.	.	H	α-helix	trans	-63.7	-20.3	176.6	73.9	-172.6	174.6	-179	0	114	W50 T51 S52 L56 H57 K58	W50-K54 HydrophobicContact CD2-CB 4.26Å; W50-K54 HydrophobicContact CE3-CB 4.47Å; W50-K54 HydrophobicContact CH2-CB 4.23Å; W50-K54 HydrophobicContact CZ2-CB 4Å; W50-K54 HydrophobicContact CZ3-CB 4.46Å; W50-K54 WeakPolarHBondContact O-CB 3.03Å; W50-K54 VanDerWaalsContact O-CG 3.26Å; W50-K54 WeakPolarHBondContact O-CG 3.38Å; W50-K54 PolarHBondContact O-N 2.92Å; T51-K54 WeakPolarHBondContact O-CE 3.4Å; S52-K54 PolarHBondContact O-N 2.94Å; K54-L56 VanDerWaalsContact C-N 3.3Å; K54-H57 WeakPolarHBondContact O-CB 3.43Å; K54-H57 PolarHBondContact O-N 3.03Å; K54-K58 PolarHBondContact O-N 3.31Å
55	L	84.7	Confident	79.7	Confident	106 Å²	106	77.7 Å²	77.7	56%	0.555	39%	0.391	S	S	*	.	H	α-helix	trans	-68.9	-31.3	175.6	-61.9	171.9	0	0	0	111.3	S52 H53 H57 K58 K59	S52-L55 VanDerWaalsContact O-CB 3.28Å; S52-L55 WeakPolarHBondContact O-CB 3.35Å; S52-L55 PolarHBondContact O-N 3.26Å; S52-L55 VanDerWaalsContact O-N 3.07Å; H53-L55 PolarHBondContact O-N 2.98Å; H53-L55 VanDerWaalsContact O-N 3.15Å; L55-H57 VanDerWaalsContact C-N 3.28Å; L55-H57 PolarHBondContact O-N 3.13Å; L55-K58 PolarHBondContact O-N 2.96Å; L55-K59 WeakPolarHBondContact O-CB 3.38Å; L55-K59 PolarHBondContact O-N 3.21Å
56	L	81.2	Confident	78.3	Confident	70 Å²	70	83.1 Å²	83.1	37%	0.366	42%	0.415	S	S	.	.	H	α-helix	trans	-62.1	-38.5	172.6	-60.5	172.6	0	0	0	111.1	E15 H53 K54 A60	E15-L56 WeakPolarHBondContact OE1-CD1 3.32Å; H53-L56 VanDerWaalsContact O-CB 3.32Å; H53-L56 WeakPolarHBondContact O-CB 3.47Å; H53-L56 PolarHBondContact O-N 3.32Å; H53-L56 VanDerWaalsContact O-N 3.07Å; K54-L56 VanDerWaalsContact C-N 3.3Å; L56-A60 VanDerWaalsContact O-CB 3.24Å; L56-A60 WeakPolarHBondContact O-CB 3.31Å; L56-A60 PolarHBondContact O-N 2.93Å
57	H	85	Confident	76.6	Confident	13 Å²	13	84.7 Å²	84.7	6%	0.06	43%	0.429	C	S	.	.	H	α-helix	trans	-66.7	-39.9	174.4	-58.2	153.8	0	0	0	112.6	C27 T29 C30 L33 W50 H53 K54 L55 K61	C27-H57 VanDerWaalsContact SG-CE1 3.6Å; T29-H57 HydrophobicContact CG2-CB 4.44Å; C30-H57 PolarHBondContact SG-NE2 3.45Å; L33-H57 HydrophobicContact CD1-CB 4.07Å; W50-H57 AromaticContact CH2-CE1 4Å; W50-H57 AromaticContact CH2-ND1 3.9Å; W50-H57 AromaticContact CZ3-CE1 3.78Å; H53-H57 AromaticContact CD2-CE1 3.88Å; H53-H57 AromaticContact NE2-CE1 3.66Å; H53-H57 AromaticContact NE2-NE2 3.54Å; K54-H57 WeakPolarHBondContact O-CB 3.43Å; K54-H57 PolarHBondContact O-N 3.03Å; L55-H57 VanDerWaalsContact C-N 3.28Å; L55-H57 PolarHBondContact O-N 3.13Å; H57-K61 WeakPolarHBondContact O-CB 3.46Å; H57-K61 VanDerWaalsContact O-CG 3.29Å; H57-K61 WeakPolarHBondContact O-CG 3.26Å; H57-K61 PolarHBondContact O-N 3.15Å
58	K	82.1	Confident	74.9	Confident	125 Å²	125	82.1 Å²	82.1	54%	0.543	42%	0.419	S	S	.	.	H	α-helix	trans	-62.9	-49.1	177.4	-174.7	178.9	172.5	-176	0	110.2	K54 L55 K61 E62	K54-K58 PolarHBondContact O-N 3.31Å; L55-K58 PolarHBondContact O-N 2.96Å; K58-K61 PolarHBondContact O-N 3.1Å; K58-E62 WeakPolarHBondContact CE-OE1 3.22Å; K58-E62 WeakPolarHBondContact O-CG 3.29Å; K58-E62 PolarHBondContact O-N 3.26Å
59	K	81.2	Confident	73	Confident	129 Å²	129	81.6 Å²	81.6	56%	0.561	41%	0.409	S	S	*	.	H	α-helix	trans	-61	-46.6	177	-171	174.8	179.6	-179.5	0	112.1	L55 K61 E62 D63	L55-K59 WeakPolarHBondContact O-CB 3.38Å; L55-K59 PolarHBondContact O-N 3.21Å; K59-K61 VanDerWaalsContact C-N 3.29Å; K59-K61 PolarHBondContact O-N 2.67Å; K59-E62 PolarHBondContact O-N 2.96Å; K59-E62 VanDerWaalsContact O-N 3.15Å; K59-D63 WeakPolarHBondContact O-CB 3.41Å; K59-D63 VanDerWaalsContact O-CG 3.26Å; K59-D63 PolarHBondContact O-N 2.87Å
60	A	78.3	Confident	71.1	Confident	21 Å²	21	88.7 Å²	88.7	17%	0.174	44%	0.439	C	S	.	.	H	α-helix	trans	-63.5	-32.9	177.8	0	0	0	0	0	113.2	L33 I35 L56 K64	L33-A60 HydrophobicContact CD1-CB 4.23Å; I35-A60 HydrophobicContact CD1-CB 3.54Å; I35-A60 HydrophobicContact CG1-CB 3.96Å; L56-A60 VanDerWaalsContact O-CB 3.24Å; L56-A60 WeakPolarHBondContact O-CB 3.31Å; L56-A60 PolarHBondContact O-N 2.93Å; A60-K64 WeakPolarHBondContact O-CB 3.36Å; A60-K64 PolarHBondContact O-N 2.77Å
61	K	78.8	Confident	69.2	Low	116 Å²	116	89.3 Å²	89.3	50%	0.504	45%	0.449	S	S	.	.	H	α-helix	trans	-72.8	-38.1	173	-74.6	-179.4	-178.4	-172.4	0	112.4	L33 H57 K58 K59 K64 H65	L33-K61 HydrophobicContact CD1-CG 4.35Å; L33-K61 HydrophobicContact CD2-CG 4.18Å; H57-K61 WeakPolarHBondContact O-CB 3.46Å; H57-K61 VanDerWaalsContact O-CG 3.29Å; H57-K61 WeakPolarHBondContact O-CG 3.26Å; H57-K61 PolarHBondContact O-N 3.15Å; K58-K61 PolarHBondContact O-N 3.1Å; K59-K61 VanDerWaalsContact C-N 3.29Å; K59-K61 PolarHBondContact O-N 2.67Å; K61-K64 PolarHBondContact O-N 2.79Å; K61-H65 WeakPolarHBondContact O-CB 3.46Å; K61-H65 PolarHBondContact O-CD2 2.83Å; K61-H65 VanDerWaalsContact O-CD2 3.31Å; K61-H65 PolarHBondContact O-N 2.92Å
62	E	75.2	Confident	67.1	Low	96 Å²	96	89.3 Å²	89.3	45%	0.449	45%	0.452	S	S	.	.	H	α-helix	trans	-65.7	-42.2	174.1	-73.2	168.7	177.4	0	0	111.3	K58 K59 K64 H65 Q66	K58-E62 WeakPolarHBondContact CE-OE1 3.22Å; K58-E62 WeakPolarHBondContact O-CG 3.29Å; K58-E62 PolarHBondContact O-N 3.26Å; K59-E62 PolarHBondContact O-N 2.96Å; K59-E62 VanDerWaalsContact O-N 3.15Å; E62-K64 VanDerWaalsContact C-N 3.34Å; E62-K64 PolarHBondContact O-N 2.72Å; E62-H65 PolarHBondContact O-N 3.47Å; E62-Q66 WeakPolarHBondContact O-CG 3.33Å; E62-Q66 PolarHBondContact O-N 3.14Å
63	D	68.6	Low	65	Low	76 Å²	76	93.6 Å²	93.6	41%	0.406	47%	0.466	S	S	.	.	H	α-helix	trans	-63.4	-40	173.6	-67.5	-20.7	0	0	0	110.6	K59 Q66 T67	K59-D63 WeakPolarHBondContact O-CB 3.41Å; K59-D63 VanDerWaalsContact O-CG 3.26Å; K59-D63 PolarHBondContact O-N 2.87Å; D63-Q66 PolarHBondContact O-N 3.46Å; D63-T67 WeakPolarHBondContact O-CB 3.48Å; D63-T67 PolarHBondContact O-N 2.78Å; D63-T67 PolarHBondContact O-OG1 3Å
64	K	64.2	Low	62.9	Low	106 Å²	106	101.3 Å²	101.3	46%	0.461	50%	0.502	S	S	.	.	H	α-helix	trans	-65.1	-42.1	174.5	-133.8	179.7	-176.5	-174.3	0	111.9	A60 K61 E62 T67 E68	A60-K64 WeakPolarHBondContact O-CB 3.36Å; A60-K64 PolarHBondContact O-N 2.77Å; K61-K64 PolarHBondContact O-N 2.79Å; E62-K64 VanDerWaalsContact C-N 3.34Å; E62-K64 PolarHBondContact O-N 2.72Å; K64-T67 PolarHBondContact O-N 3.34Å; K64-E68 VanDerWaalsContact O-CB 3.32Å; K64-E68 WeakPolarHBondContact O-CB 3.38Å; K64-E68 VanDerWaalsContact O-CG 3.3Å; K64-E68 WeakPolarHBondContact O-CG 3.38Å; K64-E68 PolarHBondContact O-N 3.17Å
65	H	57.3	Low	60.8	Low	131 Å²	131	104.8 Å²	104.8	61%	0.606	52%	0.517	S	S	*	.	H	α-helix	trans	-67.3	-34.3	175.1	-91.6	-72	0	0	0	112.9	K61 E62 A69	K61-H65 WeakPolarHBondContact O-CB 3.46Å; K61-H65 PolarHBondContact O-CD2 2.83Å; K61-H65 VanDerWaalsContact O-CD2 3.31Å; K61-H65 PolarHBondContact O-N 2.92Å; E62-H65 PolarHBondContact O-N 3.47Å; H65-A69 WeakPolarHBondContact O-CB 3.28Å; H65-A69 PolarHBondContact O-N 2.93Å
66	Q	54.8	Low	59.1	Low	127 Å²	127	104.9 Å²	104.9	59%	0.593	52%	0.518	S	S	*	.	H	α-helix	trans	-71.4	-34.2	171.5	-75.9	-176.5	12.9	0	0	112.3	E62 D63 K70	E62-Q66 WeakPolarHBondContact O-CG 3.33Å; E62-Q66 PolarHBondContact O-N 3.14Å; D63-Q66 PolarHBondContact O-N 3.46Å; Q66-K70 WeakPolarHBondContact O-CB 3.47Å; Q66-K70 WeakPolarHBondContact O-CG 3.39Å; Q66-K70 PolarHBondContact O-N 3.28Å
67	T	52.2	Low	58	Low	77 Å²	77	105.8 Å²	105.8	47%	0.472	53%	0.527	S	S	.	.	H	α-helix	trans	-71.1	-40.7	174.6	-48.4	0	0	0	0	111	D63 K64 K70 N71	D63-T67 WeakPolarHBondContact O-CB 3.48Å; D63-T67 PolarHBondContact O-N 2.78Å; D63-T67 PolarHBondContact O-OG1 3Å; K64-T67 PolarHBondContact O-N 3.34Å; T67-K70 PolarHBondContact O-N 3.34Å; T67-N71 WeakPolarHBondContact O-CB 3.17Å; T67-N71 VanDerWaalsContact O-CG 3.28Å; T67-N71 PolarHBondContact O-N 3.01Å
68	E	47.5	Very low	57	Low	98 Å²	98	108.7 Å²	108.7	46%	0.458	54%	0.543	S	S	.	.	H	α-helix	trans	-70.4	-33.8	173.8	-73.4	172.3	-174	0	0	111.8	K64 N71 C72	K64-E68 VanDerWaalsContact O-CB 3.32Å; K64-E68 WeakPolarHBondContact O-CB 3.38Å; K64-E68 VanDerWaalsContact O-CG 3.3Å; K64-E68 WeakPolarHBondContact O-CG 3.38Å; K64-E68 PolarHBondContact O-N 3.17Å; E68-N71 PolarHBondContact O-N 2.92Å; E68-C72 VanDerWaalsContact O-CB 3.26Å; E68-C72 WeakPolarHBondContact O-CB 3.45Å; E68-C72 PolarHBondContact O-N 2.83Å; E68-C72 PolarHBondContact O-SG 3.12Å
69	A	43.4	Very low	56.9	Low	50 Å²	50	106.1 Å²	106.1	41%	0.413	54%	0.538	S	S	.	.	H	α-helix	trans	-71.6	-35.4	172.1	0	0	0	0	0	112.5	H65 C72 M73	H65-A69 WeakPolarHBondContact O-CB 3.28Å; H65-A69 PolarHBondContact O-N 2.93Å; A69-C72 PolarHBondContact O-N 2.9Å; A69-M73 WeakPolarHBondContact O-CB 3.46Å; A69-M73 VanDerWaalsContact O-CG 3.31Å; A69-M73 WeakPolarHBondContact O-CG 3.48Å; A69-M73 PolarHBondContact O-N 3.41Å
70	K	42.5	Very low	57.2	Low	158 Å²	158	101.8 Å²	101.8	69%	0.687	52%	0.521	S	S	*	.	H	α-helix	trans	-65.9	-42.9	169.5	-85.2	-179.8	173.4	178.8	0	111.6	Q66 T67 C72 M73 E74	Q66-K70 WeakPolarHBondContact O-CB 3.47Å; Q66-K70 WeakPolarHBondContact O-CG 3.39Å; Q66-K70 PolarHBondContact O-N 3.28Å; T67-K70 PolarHBondContact O-N 3.34Å; K70-C72 VanDerWaalsContact C-N 3.31Å; K70-C72 PolarHBondContact O-N 3.12Å; K70-M73 PolarHBondContact O-N 3.33Å; K70-E74 PolarHBondContact O-N 3.37Å; K70-E74 VanDerWaalsContact O-N 3.14Å
71	N	43.3	Very low	57.7	Low	110 Å²	110	103.8 Å²	103.8	59%	0.588	53%	0.532	S	S	*	.	H	α-helix	trans	-68.8	-26.3	175.7	-73.5	-5.4	0	0	0	113.2	T67 E68	T67-N71 WeakPolarHBondContact O-CB 3.17Å; T67-N71 VanDerWaalsContact O-CG 3.28Å; T67-N71 PolarHBondContact O-N 3.01Å; E68-N71 PolarHBondContact O-N 2.92Å
72	C	38.4	Very low	58.4	Low	101 Å²	101	101 Å²	101	68%	0.682	52%	0.518	S	S	*	.	H	α-helix	trans	-88.3	-11.7	173.5	-80.1	0	0	0	0	114	E68 A69 K70	E68-C72 VanDerWaalsContact O-CB 3.26Å; E68-C72 WeakPolarHBondContact O-CB 3.45Å; E68-C72 PolarHBondContact O-N 2.83Å; E68-C72 PolarHBondContact O-SG 3.12Å; A69-C72 PolarHBondContact O-N 2.9Å; K70-C72 VanDerWaalsContact C-N 3.31Å; K70-C72 PolarHBondContact O-N 3.12Å
73	M	37.9	Very low	58.7	Low	164 Å²	164	104.3 Å²	104.3	81%	0.808	54%	0.538	S	S	*	.	H	α-helix	trans	-96.7	-11.8	173.2	-75.2	-170.4	85.2	0	0	113.6	A69 K70 K75	A69-M73 WeakPolarHBondContact O-CB 3.46Å; A69-M73 VanDerWaalsContact O-CG 3.31Å; A69-M73 WeakPolarHBondContact O-CG 3.48Å; A69-M73 PolarHBondContact O-N 3.41Å; K70-M73 PolarHBondContact O-N 3.33Å; M73-K75 PolarHBondContact O-N 2.82Å
74	E	38.8	Very low	59.6	Low	162 Å²	162	104.6 Å²	104.6	76%	0.757	56%	0.559	S	S	*	*			trans	-75.6	57.7	153.3	-76.4	-174.6	169.9	0	0	109.7	K70 D76	K70-E74 PolarHBondContact O-N 3.37Å; K70-E74 VanDerWaalsContact O-N 3.14Å; E74-D76 PolarHBondContact O-N 3.27Å
75	K	42.4	Very low	61.1	Low	165 Å²	165	102.3 Å²	102.3	72%	0.717	55%	0.548	S	S	*	.			trans	-64.9	118.6	148.4	-83.5	-175.1	177.7	-179.9	0	105	M73 T77	M73-K75 PolarHBondContact O-N 2.82Å; K75-T77 PolarHBondContact O-N 3.42Å
76	D	49.1	Very low	63	Low	108 Å²	108	106.7 Å²	106.7	58%	0.578	56%	0.559	S	S	*	*			trans	-52	74.5	168.2	-153.2	-13.7	0	0	0	109.3	E74 N78 R213	E74-D76 PolarHBondContact O-N 3.27Å; D76-N78 PolarHBondContact O-N 3.4Å; D76-R213 IonicContact OD1-CZ 3.75Å; D76-R213 IonicContact OD1-NE 3.36Å; D76-R213 PolarHBondContact OD1-NE 3.18Å; D76-R213 IonicContact OD1-NH2 2.92Å; D76-R213 PolarHBondContact OD1-NH2 3.11Å; D76-R213 IonicContact OD2-CZ 2.92Å; D76-R213 IonicContact OD2-NH2 3.77Å; D76-R213 PolarHBondContact OD2-NH2 2.95Å
77	T	56.3	Low	65.1	Low	88 Å²	88	101.7 Å²	101.7	54%	0.54	54%	0.535	S	S	.	.			trans	-78	80	172.9	56.3	0	0	0	0	105	K75 T79	K75-T77 PolarHBondContact O-N 3.42Å; T77-T79 VanDerWaalsContact C-N 3.34Å; T77-T79 PolarHBondContact O-N 3.03Å
78	N	64.4	Low	67.2	Low	74 Å²	74	99.6 Å²	99.6	40%	0.396	52%	0.522	S	S	.	.			trans	-55	105.3	157.3	176.6	16.8	0	0	0	107.1	D76 H94 Y95	D76-N78 PolarHBondContact O-N 3.4Å; N78-H94 PolarHBondContact ND2-CD2 3.14Å; N78-H94 PolarHBondContact ND2-NE2 3.11Å; N78-H94 WeakPolarHBondContact OD1-CA 3.43Å; N78-H94 WeakPolarHBondContact OD1-CB 3.45Å; N78-Y95 VanDerWaalsContact CA-O 3.27Å; N78-Y95 WeakPolarHBondContact CA-O 3.24Å
79	T	80.7	Confident	69.6	Low	72 Å²	72	95.8 Å²	95.8	44%	0.442	51%	0.509	S	S	.	.	B	Isolated β-bridge	trans	-117.8	123.6	-179.1	51	0	0	0	0	109.9	T77 P81 Y95	T77-T79 VanDerWaalsContact C-N 3.34Å; T77-T79 PolarHBondContact O-N 3.03Å; T79-P81 VanDerWaalsContact O-CD 3.24Å; T79-P81 WeakPolarHBondContact O-CD 3.29Å; T79-Y95 PolarHBondContact N-O 3.31Å; T79-Y95 WeakPolarHBondContact O-CB 3.49Å
80	D	86.6	Confident	72.1	Confident	38 Å²	38	103.1 Å²	103.1	20%	0.203	53%	0.531	C	S	.	.			trans	-65.8	114.7	161	178.6	-9.2	0	0	0	108	W82 Y87	D80-W82 PolarHBondContact O-N 3.42Å; D80-W82 PolarHBondContact OD1-N 2.89Å; D80-Y87 PolarHBondContact OD1-OH 3.13Å; D80-Y87 WeakPolarHBondContact OD2-CE2 3.27Å; D80-Y87 PolarHBondContact OD2-OH 3.35Å
81	P	89	Confident	74.7	Confident	63 Å²	63	96.3 Å²	96.3	41%	0.409	50%	0.503	S	S	.	.	S	Bend	trans	-75.6	-9.7	-176.2	31.4	-34.6	0	0	0	112.5	T79 Y95	T79-P81 VanDerWaalsContact O-CD 3.24Å; T79-P81 WeakPolarHBondContact O-CD 3.29Å; P81-Y95 HydrophobicContact CG-CD2 3.49Å; P81-Y95 VanDerWaalsContact CG-CD2 3.49Å; P81-Y95 HydrophobicContact CG-CE2 3.46Å; P81-Y95 VanDerWaalsContact CG-CE2 3.46Å; P81-Y95 HydrophobicContact CG-CG 4.16Å
82	W	93.2	Very high	77.3	Confident	56 Å²	56	95.5 Å²	95.5	21%	0.212	49%	0.491	C	S	.	.			trans	-119.5	62.1	-173.3	-50.2	-58.2	0	0	0	111.8	D80 G84 Y85 P93 Y95 W346 P347 D348	D80-W82 PolarHBondContact O-N 3.42Å; D80-W82 PolarHBondContact OD1-N 2.89Å; W82-G84 PolarHBondContact O-N 3.2Å; W82-Y85 PolarHBondContact O-N 3.49Å; W82-P93 HydrophobicContact CE3-CG 3.97Å; W82-P93 HydrophobicContact CZ3-CB 4.04Å; W82-P93 HydrophobicContact CZ3-CG 3.6Å; W82-Y95 AromaticContact CH2-CE2 3.66Å; W82-Y95 HydrophobicContact CH2-CE2 3.66Å; W82-Y95 AromaticContact CH2-CZ 3.82Å; W82-Y95 WeakPolarHBondContact CH2-OH 3.24Å; W82-Y95 HydrophobicContact CZ2-CE2 4.24Å; W82-Y95 HydrophobicContact CZ3-CE2 4.1Å; W82-W346 HydrophobicContact CZ3-CE3 4.34Å; W82-P347 HydrophobicContact CB-CG 4.16Å; W82-P347 HydrophobicContact CD2-CB 3.71Å; W82-P347 HydrophobicContact CD2-CG 3.82Å; W82-P347 HydrophobicContact CE3-CB 4.33Å; W82-P347 HydrophobicContact CE3-CG 4.14Å; W82-P347 HydrophobicContact CG-CB 3.79Å; W82-P347 HydrophobicContact CG-CG 3.8Å; W82-P347 HydrophobicContact CZ2-CB 4.37Å; W82-D348 HydrophobicContact CH2-CB 3.57Å; W82-D348 HydrophobicContact CZ2-CB 3.88Å
83	L	81.3	Confident	80.1	Confident	167 Å²	167	90.9 Å²	90.9	87%	0.874	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	4.9	-177.9	-70.1	170.6	0	0	0	116.9
84	G	88.4	Confident	82.9	Confident	81 Å²	81	85 Å²	85	84%	0.835	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.2	-1.4	173.6	0	0	0	0	0	114.7	W82	W82-G84 PolarHBondContact O-N 3.2Å
85	Y	95.9	Very high	85.5	Confident	59 Å²	59	79.2 Å²	79.2	23%	0.231	40%	0.402	C	S	.	.			trans	-76.7	135.4	175.1	177.7	-107.6	0	0	0	110	W82 Y87 E344 W346 P347	W82-Y85 PolarHBondContact O-N 3.49Å; Y85-Y87 AromaticContact CD1-CD1 3.84Å; Y85-Y87 HydrophobicContact CD1-CD1 3.84Å; Y85-Y87 HydrophobicContact CD1-CD2 4.07Å; Y85-Y87 AromaticContact CD1-CE1 3.76Å; Y85-Y87 HydrophobicContact CD1-CE1 3.76Å; Y85-Y87 HydrophobicContact CD1-CE2 4Å; Y85-Y87 HydrophobicContact CD1-CG 4.01Å; Y85-Y87 AromaticContact CD1-CZ 3.87Å; Y85-Y87 AromaticContact CE1-CD1 3.81Å; Y85-Y87 HydrophobicContact CE1-CD1 3.81Å; Y85-Y87 HydrophobicContact CE1-CE1 4.02Å; Y85-Y87 HydrophobicContact CE1-CG 4.18Å; Y85-Y87 PolarHBondContact O-N 3.25Å; Y85-E344 PolarHBondContact OH-OE1 3.47Å; Y85-W346 AromaticContact CE1-CD1 3.58Å; Y85-W346 HydrophobicContact CE1-CG 4.16Å; Y85-W346 AromaticContact CZ-CD1 3.93Å; Y85-P347 HydrophobicContact CD1-CG 4.11Å; Y85-P347 HydrophobicContact CD2-CG 3.7Å; Y85-P347 HydrophobicContact CE2-CG 4.3Å; Y85-P347 HydrophobicContact CG-CG 3.62Å
86	R	97.6	Very high	88	Confident	222 Å²	222	74.9 Å²	74.9	84%	0.838	39%	0.391	S	S	*	.			trans	-92.6	93.4	179.8	-174.8	-178.2	179.9	174.4	0.3	109.6
87	Y	98	Very high	90.1	Very high	22 Å²	22	71.7 Å²	71.7	9%	0.086	37%	0.373	C	S	.	.			trans	-58.1	144.2	172.8	-63.1	-87	0	0	0	112.3	D80 Y85 R92 P93 W346	D80-Y87 PolarHBondContact OD1-OH 3.13Å; D80-Y87 WeakPolarHBondContact OD2-CE2 3.27Å; D80-Y87 PolarHBondContact OD2-OH 3.35Å; Y85-Y87 AromaticContact CD1-CD1 3.84Å; Y85-Y87 HydrophobicContact CD1-CD1 3.84Å; Y85-Y87 HydrophobicContact CD1-CD2 4.07Å; Y85-Y87 AromaticContact CD1-CE1 3.76Å; Y85-Y87 HydrophobicContact CD1-CE1 3.76Å; Y85-Y87 HydrophobicContact CD1-CE2 4Å; Y85-Y87 HydrophobicContact CD1-CG 4.01Å; Y85-Y87 AromaticContact CD1-CZ 3.87Å; Y85-Y87 AromaticContact CE1-CD1 3.81Å; Y85-Y87 HydrophobicContact CE1-CD1 3.81Å; Y85-Y87 HydrophobicContact CE1-CE1 4.02Å; Y85-Y87 HydrophobicContact CE1-CG 4.18Å; Y85-Y87 PolarHBondContact O-N 3.25Å; Y87-R92 VanDerWaalsContact CB-NH1 3.34Å; Y87-R92 VanDerWaalsContact CD2-CD 3.46Å; Y87-R92 VanDerWaalsContact CD2-NE 3.32Å; Y87-P93 HydrophobicContact CE1-CG 4.45Å; Y87-P93 WeakPolarHBondContact OH-CD 3.47Å; Y87-P93 WeakPolarHBondContact OH-CG 3.39Å; Y87-W346 HydrophobicContact CD1-CD2 4.31Å; Y87-W346 AromaticContact CD1-CE2 3.63Å; Y87-W346 HydrophobicContact CD1-CH2 4.4Å; Y87-W346 AromaticContact CD1-CZ2 3.69Å; Y87-W346 HydrophobicContact CD1-CZ2 3.69Å; Y87-W346 AromaticContact CD1-NE1 3.77Å; Y87-W346 AromaticContact CE1-CD2 3.98Å; Y87-W346 HydrophobicContact CE1-CD2 3.98Å; Y87-W346 AromaticContact CE1-CE2 3.76Å; Y87-W346 HydrophobicContact CE1-CE3 4.3Å; Y87-W346 HydrophobicContact CE1-CH2 4.24Å; Y87-W346 AromaticContact CE1-CZ2 3.9Å; Y87-W346 HydrophobicContact CE1-CZ2 3.9Å; Y87-W346 HydrophobicContact CE1-CZ3 4.42Å
88	T	97.5	Very high	91.6	Very high	33 Å²	33	70.3 Å²	70.3	20%	0.202	36%	0.363	C	S	.	.	S	Bend	trans	-78.8	-34	-177.2	61.2	0	0	0	0	112.3	E344 V353 T354 G357	T88-E344 HydrophobicContact CG2-CG 3.85Å; T88-E344 WeakPolarHBondContact CG2-OE1 3.35Å; T88-V353 HydrophobicContact CG2-CG2 3.97Å; T88-T354 WeakPolarHBondContact CB-O 3.26Å; T88-T354 WeakPolarHBondContact CG2-O 3.3Å; T88-T354 PolarHBondContact OG1-O 3.03Å; T88-G357 WeakPolarHBondContact O-CA 3.35Å
89	G	96.4	Very high	92.3	Very high	18 Å²	18	73 Å²	73	19%	0.186	38%	0.382	C	S	.	.	S	Bend	trans	-127.4	-154.5	-179.3	0	0	0	0	0	114.7	R92 E204	G89-R92 PolarHBondContact O-NH1 3.38Å; G89-E204 WeakPolarHBondContact CA-OE1 3.49Å
90	K	97	Very high	91.8	Very high	204 Å²	204	74.3 Å²	74.3	89%	0.887	38%	0.382	S	S	*	.	S	Bend	trans	-84.3	-24.4	-176.1	-67.6	179.9	-177.7	173.6	0	112.4	R92 E204	K90-R92 PolarHBondContact O-NH1 2.97Å; K90-E204 PolarHBondContact N-OE1 2.91Å
91	L	97.4	Very high	91	Very high	16 Å²	16	74.8 Å²	74.8	8%	0.084	39%	0.386	C	S	.	.			trans	-66.2	144	-176.1	-155.7	73	0	0	0	111.1	V202 E204 V205 R214 W346	L91-V202 HydrophobicContact CD1-CB 4.31Å; L91-V202 HydrophobicContact CD1-CG1 4.15Å; L91-V202 HydrophobicContact CD2-CB 4.24Å; L91-E204 HydrophobicContact CB-CG 4.49Å; L91-E204 WeakPolarHBondContact CB-OE1 3.24Å; L91-E204 PolarHBondContact N-OE1 3.26Å; L91-V205 HydrophobicContact CD2-CG2 3.33Å; L91-R214 VanDerWaalsContact CD1-CD 3.44Å; L91-W346 HydrophobicContact CB-CH2 4.3Å; L91-W346 HydrophobicContact CB-CZ2 4.4Å; L91-W346 HydrophobicContact CD2-CH2 4.03Å; L91-W346 HydrophobicContact CG-CH2 4.18Å
92	R	97.3	Very high	90.1	Very high	93 Å²	93	82.5 Å²	82.5	35%	0.351	41%	0.407	S	S	.	.			trans	-134.4	148.5	173.5	-64.4	-64.1	179	-82.6	0.7	108.2	Y87 G89 K90 H94	Y87-R92 VanDerWaalsContact CB-NH1 3.34Å; Y87-R92 VanDerWaalsContact CD2-CD 3.46Å; Y87-R92 VanDerWaalsContact CD2-NE 3.32Å; G89-R92 PolarHBondContact O-NH1 3.38Å; K90-R92 PolarHBondContact O-NH1 2.97Å; R92-H94 PolarHBondContact O-CE1 3.06Å; R92-H94 VanDerWaalsContact O-CE1 3.24Å; R92-H94 PolarHBondContact O-ND1 3.25Å
93	P	96.9	Very high	89.2	Confident	4 Å²	4	81.2 Å²	81.2	3%	0.026	40%	0.404	C	S	.	.			trans	-69.1	147.7	170.8	34.7	-39.8	0	0	0	110.4	W82 Y87 Y95 D212 W346	W82-P93 HydrophobicContact CE3-CG 3.97Å; W82-P93 HydrophobicContact CZ3-CB 4.04Å; W82-P93 HydrophobicContact CZ3-CG 3.6Å; Y87-P93 HydrophobicContact CE1-CG 4.45Å; Y87-P93 WeakPolarHBondContact OH-CD 3.47Å; Y87-P93 WeakPolarHBondContact OH-CG 3.39Å; P93-Y95 HydrophobicContact CB-CD2 3.74Å; P93-Y95 HydrophobicContact CB-CE2 3.44Å; P93-Y95 VanDerWaalsContact CB-CE2 3.44Å; P93-Y95 HydrophobicContact CG-CD2 4.16Å; P93-Y95 HydrophobicContact CG-CE2 3.97Å; P93-D212 WeakPolarHBondContact CA-OD2 3.3Å; P93-W346 HydrophobicContact CB-CE3 4.43Å; P93-W346 HydrophobicContact CB-CZ3 3.93Å; P93-W346 HydrophobicContact CG-CZ3 4.32Å
94	H	96.4	Very high	88.4	Confident	39 Å²	39	79.7 Å²	79.7	18%	0.181	39%	0.392	C	S	.	.			trans	-117.9	88.1	-178.2	-69	51.5	0	0	0	112.2	N78 R92 D212 R213 R214	N78-H94 PolarHBondContact ND2-CD2 3.14Å; N78-H94 PolarHBondContact ND2-NE2 3.11Å; N78-H94 WeakPolarHBondContact OD1-CA 3.43Å; N78-H94 WeakPolarHBondContact OD1-CB 3.45Å; R92-H94 PolarHBondContact O-CE1 3.06Å; R92-H94 VanDerWaalsContact O-CE1 3.24Å; R92-H94 PolarHBondContact O-ND1 3.25Å; H94-D212 HydrophobicContact CB-CB 4.44Å; H94-D212 PolarHBondContact N-OD2 2.81Å; H94-R213 HydrophobicContact CB-CB 3.94Å; H94-R213 WeakPolarHBondContact O-CB 3.47Å; H94-R213 PolarHBondContact O-N 2.89Å; H94-R213 VanDerWaalsContact O-N 3.09Å; H94-R214 HydrophobicContact CB-CB 4.1Å
95	Y	94	Very high	87.1	Confident	42 Å²	42	85.4 Å²	85.4	17%	0.165	39%	0.394	C	S	.	.	B	Isolated β-bridge	trans	-95.9	163.6	-177.3	-75.6	-91.2	0	0	0	113.1	N78 T79 P81 W82 P93 L97	N78-Y95 VanDerWaalsContact CA-O 3.27Å; N78-Y95 WeakPolarHBondContact CA-O 3.24Å; T79-Y95 PolarHBondContact N-O 3.31Å; T79-Y95 WeakPolarHBondContact O-CB 3.49Å; P81-Y95 HydrophobicContact CG-CD2 3.49Å; P81-Y95 VanDerWaalsContact CG-CD2 3.49Å; P81-Y95 HydrophobicContact CG-CE2 3.46Å; P81-Y95 VanDerWaalsContact CG-CE2 3.46Å; P81-Y95 HydrophobicContact CG-CG 4.16Å; W82-Y95 AromaticContact CH2-CE2 3.66Å; W82-Y95 HydrophobicContact CH2-CE2 3.66Å; W82-Y95 AromaticContact CH2-CZ 3.82Å; W82-Y95 WeakPolarHBondContact CH2-OH 3.24Å; W82-Y95 HydrophobicContact CZ2-CE2 4.24Å; W82-Y95 HydrophobicContact CZ3-CE2 4.1Å; P93-Y95 HydrophobicContact CB-CD2 3.74Å; P93-Y95 HydrophobicContact CB-CE2 3.44Å; P93-Y95 VanDerWaalsContact CB-CE2 3.44Å; P93-Y95 HydrophobicContact CG-CD2 4.16Å; P93-Y95 HydrophobicContact CG-CE2 3.97Å; Y95-L97 HydrophobicContact CD1-CD1 4.48Å; Y95-L97 HydrophobicContact CD1-CD2 4.15Å; Y95-L97 HydrophobicContact CD1-CG 3.72Å; Y95-L97 HydrophobicContact CE1-CD1 3.79Å; Y95-L97 HydrophobicContact CE1-CD2 4.04Å; Y95-L97 HydrophobicContact CE1-CG 3.51Å
96	P	94.2	Very high	86	Confident	74 Å²	74	90.7 Å²	90.7	48%	0.481	42%	0.421	S	S	.	.	S	Bend	cis	-74.3	147.6	-0.8	31.2	-35.1	0	0	0	112.7	R213	P96-R213 WeakPolarHBondContact O-CD 3.23Å
97	L	93.5	Very high	85.1	Confident	41 Å²	41	80.8 Å²	80.8	22%	0.215	39%	0.385	C	S	.	.	P	Polyproline II helix	trans	-69.1	146	167.9	-54.1	-179.1	0	0	0	109.4	Y95 P195 I210 D212	Y95-L97 HydrophobicContact CD1-CD1 4.48Å; Y95-L97 HydrophobicContact CD1-CD2 4.15Å; Y95-L97 HydrophobicContact CD1-CG 3.72Å; Y95-L97 HydrophobicContact CE1-CD1 3.79Å; Y95-L97 HydrophobicContact CE1-CD2 4.04Å; Y95-L97 HydrophobicContact CE1-CG 3.51Å; L97-P195 HydrophobicContact CD1-CG 4.25Å; L97-I210 HydrophobicContact CD1-CG2 3.78Å; L97-I210 HydrophobicContact CD2-CG2 4.44Å; L97-D212 HydrophobicContact CD2-CB 3.62Å
98	N	87.9	Confident	84.5	Confident	58 Å²	58	83.2 Å²	83.2	31%	0.31	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-60.4	157.3	169.5	74.4	16.4	0	0	0	111.7	E169 K196	N98-E169 HydrophobicContact CB-CG 4.46Å; N98-E169 VanDerWaalsContact CB-OE1 3.27Å; N98-E169 WeakPolarHBondContact CB-OE1 3.41Å; N98-E169 PolarHBondContact N-OE1 3.11Å; N98-E169 WeakPolarHBondContact ND2-CG 3.46Å; N98-E169 PolarHBondContact ND2-OE1 3.18Å; N98-E169 PolarHBondContact OD1-OE1 3.01Å; N98-K196 VanDerWaalsContact CG-NZ 3.33Å; N98-K196 PolarHBondContact OD1-NZ 3.23Å
99	T	78.4	Confident	84.2	Confident	130 Å²	130	84.7 Å²	84.7	80%	0.798	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-67.3	140.4	176.7	51.8	0	0	0	0	110.8	T101	T99-T101 PolarHBondContact O-N 3.08Å; T99-T101 VanDerWaalsContact O-N 3.15Å
100	K	71.5	Confident	84	Confident	101 Å²	101	84 Å²	84	44%	0.439	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-46.7	120.4	175.7	-66	-173	177.6	-173.8	0	111.4	R102 N190	K100-R102 PolarHBondContact O-N 2.96Å; K100-N190 PolarHBondContact NZ-OD1 2.97Å; K100-N190 VanDerWaalsContact NZ-OD1 3.1Å
101	T	68.8	Low	83.6	Confident	47 Å²	47	76.8 Å²	76.8	29%	0.288	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-64.6	125.6	174.9	-48.6	0	0	0	0	109.4	T99 L103 H176	T99-T101 PolarHBondContact O-N 3.08Å; T99-T101 VanDerWaalsContact O-N 3.15Å; T101-L103 PolarHBondContact O-N 3.47Å; T101-H176 VanDerWaalsContact CG2-NE2 3.32Å; T101-H176 WeakPolarHBondContact CG2-NE2 3.41Å
102	R	71.2	Confident	83.3	Confident	225 Å²	225	76 Å²	76	85%	0.849	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-75.1	126.3	179.7	-69.1	-173.7	177.8	-152.4	0	109.8	K100	K100-R102 PolarHBondContact O-N 2.96Å
103	L	73.4	Confident	82.8	Confident	29 Å²	29	72.8 Å²	72.8	15%	0.152	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-77.2	140.6	170.7	-68.9	167.2	0	0	0	110.6	T101 F109 H176 V180 Y185 L189	T101-L103 PolarHBondContact O-N 3.47Å; L103-F109 HydrophobicContact CB-CE1 3.87Å; L103-F109 HydrophobicContact CB-CZ 3.77Å; L103-F109 HydrophobicContact CD1-CE1 3.75Å; L103-F109 HydrophobicContact CD1-CZ 4.37Å; L103-F109 HydrophobicContact CG-CE1 4.49Å; L103-H176 WeakPolarHBondContact CD2-CE1 3.08Å; L103-H176 WeakPolarHBondContact CD2-NE2 3.26Å; L103-V180 HydrophobicContact CD2-CG2 3.36Å; L103-Y185 HydrophobicContact CD1-CD2 3.3Å; L103-Y185 HydrophobicContact CD1-CE2 3.21Å; L103-Y185 HydrophobicContact CD1-CG 4.32Å; L103-L189 HydrophobicContact CD1-CD2 3.89Å; L103-L189 HydrophobicContact CG-CD2 4.36Å
104	H	64.9	Low	81.5	Confident	136 Å²	136	77.6 Å²	77.6	63%	0.63	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-84.6	153.7	176.8	-66.9	-78.8	0	0	0	112	H106	H104-H106 PolarHBondContact O-N 2.95Å
105	F	61.6	Low	79.8	Confident	201 Å²	201	80.5 Å²	80.5	88%	0.882	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	12.1	-170.5	-69.4	-79.8	0	0	0	117.5
106	H	71.6	Confident	78.5	Confident	170 Å²	170	80.5 Å²	80.5	79%	0.787	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	6.7	-176.3	-67.6	-107.2	0	0	0	113.7	H104	H104-H106 PolarHBondContact O-N 2.95Å
107	V	78.4	Confident	77.8	Confident	14 Å²	14	82.4 Å²	82.4	9%	0.085	43%	0.429	C	S	.	.	S	Bend	trans	-109.1	141.3	178.6	-177.7	0	0	0	0	109.3	F109 Y185	V107-F109 HydrophobicContact CB-CE2 4.47Å; V107-F109 WeakPolarHBondContact O-CD2 3.46Å; V107-F109 WeakPolarHBondContact O-CE2 3.28Å; V107-Y185 VanDerWaalsContact CG1-N 3.35Å
108	T	86.1	Confident	77.5	Confident	73 Å²	73	83 Å²	83	45%	0.448	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-75.4	127.9	169.5	-49.7	0	0	0	0	109.2	Y229	T108-Y229 HydrophobicContact CG2-CE1 4.04Å; T108-Y229 WeakPolarHBondContact O-CD1 3.36Å; T108-Y229 WeakPolarHBondContact O-CE1 3.45Å
109	F	91.2	Very high	77.7	Confident	63 Å²	63	80.2 Å²	80.2	28%	0.276	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-96.9	144.3	-178.8	-68.2	-102.9	0	0	0	111.1	L103 V107 A113 V114 Y185	L103-F109 HydrophobicContact CB-CE1 3.87Å; L103-F109 HydrophobicContact CB-CZ 3.77Å; L103-F109 HydrophobicContact CD1-CE1 3.75Å; L103-F109 HydrophobicContact CD1-CZ 4.37Å; L103-F109 HydrophobicContact CG-CE1 4.49Å; V107-F109 HydrophobicContact CB-CE2 4.47Å; V107-F109 WeakPolarHBondContact O-CD2 3.46Å; V107-F109 WeakPolarHBondContact O-CE2 3.28Å; F109-A113 HydrophobicContact CB-CB 4.22Å; F109-A113 HydrophobicContact CD1-CB 3.94Å; F109-V114 HydrophobicContact CB-CG2 3.38Å; F109-V114 HydrophobicContact CD1-CG2 4.08Å; F109-V114 HydrophobicContact CD2-CG2 4.45Å; F109-V114 HydrophobicContact CG-CG2 3.74Å; F109-Y185 AromaticContact CD1-CD2 3.41Å; F109-Y185 HydrophobicContact CD1-CD2 3.41Å; F109-Y185 VanDerWaalsContact CD1-CD2 3.41Å; F109-Y185 AromaticContact CD1-CE2 3.38Å; F109-Y185 HydrophobicContact CD1-CE2 3.38Å; F109-Y185 AromaticContact CE1-CD2 3.76Å; F109-Y185 HydrophobicContact CE1-CD2 3.76Å; F109-Y185 AromaticContact CE1-CE2 3.72Å; F109-Y185 HydrophobicContact CE1-CE2 3.72Å; F109-Y185 HydrophobicContact CG-CD2 4.13Å; F109-Y185 HydrophobicContact CG-CE2 4.42Å
110	P	92.3	Very high	78.5	Confident	4 Å²	4	77.1 Å²	77.1	3%	0.026	40%	0.396	C	S	.	.	P	Polyproline II helix	trans	-71.7	159.4	166	31.4	-33.4	0	0	0	110.3	Y112 A113 Y185 Y229	P110-Y112 VanDerWaalsContact C-N 3.29Å; P110-Y112 HydrophobicContact CB-CD1 4.01Å; P110-Y112 HydrophobicContact CB-CE1 3.56Å; P110-Y112 HydrophobicContact CB-CE2 4.3Å; P110-Y112 HydrophobicContact CG-CD1 4.28Å; P110-Y112 HydrophobicContact CG-CD2 4.16Å; P110-Y112 HydrophobicContact CG-CE1 3.72Å; P110-Y112 HydrophobicContact CG-CE2 3.55Å; P110-Y112 HydrophobicContact CG-CG 4.48Å; P110-Y112 WeakPolarHBondContact CG-OH 3.49Å; P110-Y112 PolarHBondContact O-N 3.49Å; P110-A113 HydrophobicContact CG-CB 3.99Å; P110-A113 WeakPolarHBondContact O-CB 3.38Å; P110-A113 PolarHBondContact O-N 3.47Å; P110-Y185 VanDerWaalsContact CD-CD1 3.44Å; P110-Y185 VanDerWaalsContact CD-CG 3.48Å; P110-Y185 HydrophobicContact CG-CD1 3.63Å; P110-Y185 HydrophobicContact CG-CE1 3.69Å; P110-Y185 HydrophobicContact CG-CG 4.2Å; P110-Y229 HydrophobicContact CB-CD1 4.31Å; P110-Y229 HydrophobicContact CB-CD2 4.45Å; P110-Y229 HydrophobicContact CB-CE1 4.22Å; P110-Y229 HydrophobicContact CB-CE2 4.36Å; P110-Y229 HydrophobicContact CB-CG 4.38Å; P110-Y229 HydrophobicContact CG-CD1 4.41Å
111	A	87.9	Confident	79.6	Confident	52 Å²	52	72.5 Å²	72.5	43%	0.43	38%	0.377	S	S	.	.	H	α-helix	trans	-56.9	-39.8	-173.1	0	0	0	0	0	113.4	A113 V114 V115	A111-A113 PolarHBondContact O-N 2.99Å; A111-V114 PolarHBondContact O-N 3.07Å; A111-V115 PolarHBondContact O-N 3.3Å
112	Y	92.2	Very high	80.7	Confident	1 Å²	1	75.7 Å²	75.7	0%	0.004	39%	0.388	C	S	.	.	H	α-helix	trans	-67	-18.1	-179.9	58.8	-104.3	0	0	0	114.3	P110 G119 M120 Y185 S187 N190 Y191 H234	P110-Y112 VanDerWaalsContact C-N 3.29Å; P110-Y112 HydrophobicContact CB-CD1 4.01Å; P110-Y112 HydrophobicContact CB-CE1 3.56Å; P110-Y112 HydrophobicContact CB-CE2 4.3Å; P110-Y112 HydrophobicContact CG-CD1 4.28Å; P110-Y112 HydrophobicContact CG-CD2 4.16Å; P110-Y112 HydrophobicContact CG-CE1 3.72Å; P110-Y112 HydrophobicContact CG-CE2 3.55Å; P110-Y112 HydrophobicContact CG-CG 4.48Å; P110-Y112 WeakPolarHBondContact CG-OH 3.49Å; P110-Y112 PolarHBondContact O-N 3.49Å; Y112-G119 WeakPolarHBondContact CB-O 3.4Å; Y112-M120 WeakPolarHBondContact CB-O 3.41Å; Y112-Y185 AromaticContact CE2-CE1 3.99Å; Y112-Y185 HydrophobicContact CE2-CE1 3.99Å; Y112-S187 WeakPolarHBondContact CE2-O 3.14Å; Y112-S187 VanDerWaalsContact OH-CA 3.26Å; Y112-S187 WeakPolarHBondContact OH-CA 3.2Å; Y112-S187 WeakPolarHBondContact OH-CB 3.24Å; Y112-S187 PolarHBondContact OH-O 3.4Å; Y112-N190 PolarHBondContact O-ND2 3.33Å; Y112-Y191 AromaticContact CD1-CD2 3.88Å; Y112-Y191 HydrophobicContact CD1-CD2 3.88Å; Y112-Y191 HydrophobicContact CD1-CE2 4.46Å; Y112-Y191 HydrophobicContact CD2-CD2 4.32Å; Y112-Y191 AromaticContact CE1-CD2 3.78Å; Y112-Y191 HydrophobicContact CE1-CD2 3.78Å; Y112-Y191 HydrophobicContact CE1-CE2 4.42Å; Y112-Y191 HydrophobicContact CE2-CD2 4.27Å; Y112-Y191 HydrophobicContact CG-CD2 4.16Å; Y112-Y191 AromaticContact CZ-CD2 4Å; Y112-H234 PolarHBondContact OH-CE1 2.94Å
113	A	86.6	Confident	81.7	Confident	25 Å²	25	67.6 Å²	67.6	21%	0.207	37%	0.366	C	S	.	.	H	α-helix	trans	-82	-28.5	-177.6	0	0	0	0	0	113.4	F109 P110 A111 Y185	F109-A113 HydrophobicContact CB-CB 4.22Å; F109-A113 HydrophobicContact CD1-CB 3.94Å; P110-A113 HydrophobicContact CG-CB 3.99Å; P110-A113 WeakPolarHBondContact O-CB 3.38Å; P110-A113 PolarHBondContact O-N 3.47Å; A111-A113 PolarHBondContact O-N 2.99Å; A113-Y185 HydrophobicContact CB-CD2 4.45Å; A113-Y185 HydrophobicContact CB-CE1 4.19Å; A113-Y185 HydrophobicContact CB-CE2 3.56Å; A113-Y185 VanDerWaalsContact CB-CZ 3.42Å; A113-Y185 VanDerWaalsContact CB-OH 3.24Å; A113-Y185 WeakPolarHBondContact CB-OH 3.38Å
114	V	70.6	Confident	82.8	Confident	105 Å²	105	67 Å²	67	64%	0.636	36%	0.362	S	S	*	.	H	α-helix	trans	-109.4	-34.8	-171.9	-174.6	0	0	0	0	112.2	F109 A111	F109-V114 HydrophobicContact CB-CG2 3.38Å; F109-V114 HydrophobicContact CD1-CG2 4.08Å; F109-V114 HydrophobicContact CD2-CG2 4.45Å; F109-V114 HydrophobicContact CG-CG2 3.74Å; A111-V114 PolarHBondContact O-N 3.07Å
115	V	60.6	Low	84.3	Confident	99 Å²	99	64.3 Å²	64.3	60%	0.6	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.9	-30.8	-164	-174.5	0	0	0	0	112.5	A111	A111-V115 PolarHBondContact O-N 3.3Å
116	H	65.6	Low	85.8	Confident	42 Å²	42	63.2 Å²	63.2	19%	0.194	35%	0.345	C	S	.	.			trans	-106.2	119.6	-163.6	-150	-78.9	0	0	0	113.4	T118 G119 M120	H116-T118 PolarHBondContact CE1-OG1 3.49Å; H116-T118 PolarHBondContact ND1-N 3.43Å; H116-T118 PolarHBondContact ND1-OG1 2.95Å; H116-T118 PolarHBondContact O-N 3.17Å; H116-G119 PolarHBondContact O-N 3.48Å; H116-M120 WeakPolarHBondContact CB-O 3.5Å; H116-M120 PolarHBondContact ND1-N 3.25Å
117	P	80.1	Confident	86.9	Confident	115 Å²	115	58.6 Å²	58.6	75%	0.747	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-16.8	-180	26.5	-35.1	0	0	0	113.5
118	T	87.1	Confident	87.6	Confident	53 Å²	53	66.6 Å²	66.6	33%	0.325	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114	9.7	175.7	68.3	0	0	0	0	114.1	H116 M120 Y192 N193	H116-T118 PolarHBondContact CE1-OG1 3.49Å; H116-T118 PolarHBondContact ND1-N 3.43Å; H116-T118 PolarHBondContact ND1-OG1 2.95Å; H116-T118 PolarHBondContact O-N 3.17Å; T118-M120 VanDerWaalsContact C-N 3.27Å; T118-M120 PolarHBondContact O-N 2.99Å; T118-M120 WeakPolarHBondContact OG1-CG 3.43Å; T118-Y192 CarbonylContact O-C 3.4Å; T118-Y192 WeakPolarHBondContact O-CA 3.41Å; T118-N193 WeakPolarHBondContact CA-ND2 3.42Å; T118-N193 WeakPolarHBondContact CA-OD1 3.44Å; T118-N193 PolarHBondContact O-N 3.44Å; T118-N193 PolarHBondContact O-OD1 3.39Å
119	G	92.4	Very high	87.9	Confident	0 Å²	0	67 Å²	67	0%	0	38%	0.379	C	S	.	.			trans	70.3	17.4	177.7	0	0	0	0	0	115.4	Y112 H116 N190 Y192 N193	Y112-G119 WeakPolarHBondContact CB-O 3.4Å; H116-G119 PolarHBondContact O-N 3.48Å; G119-N190 WeakPolarHBondContact CA-O 3.43Å; G119-Y192 WeakPolarHBondContact O-CA 3.36Å; G119-Y192 PolarHBondContact O-N 3.32Å; G119-N193 PolarHBondContact N-OD1 2.97Å
120	M	93.7	Very high	88.1	Confident	65 Å²	65	66.7 Å²	66.7	32%	0.32	38%	0.382	S	S	.	.			trans	-76.2	141	179.4	-65.5	175.1	178.2	0	0	111.3	Y112 H116 T118 Q125 Y192	Y112-M120 WeakPolarHBondContact CB-O 3.41Å; H116-M120 WeakPolarHBondContact CB-O 3.5Å; H116-M120 PolarHBondContact ND1-N 3.25Å; T118-M120 VanDerWaalsContact C-N 3.27Å; T118-M120 PolarHBondContact O-N 2.99Å; T118-M120 WeakPolarHBondContact OG1-CG 3.43Å; M120-Q125 PolarHBondContact SD-NE2 3.34Å; M120-Y192 HydrophobicContact CB-CE1 4.33Å; M120-Y192 HydrophobicContact CG-CD1 3.94Å; M120-Y192 HydrophobicContact CG-CE1 3.73Å
121	S	94.6	Very high	88.3	Confident	3 Å²	3	70 Å²	70	2%	0.021	41%	0.406	C	S	.	.			trans	-91.5	101.8	175.1	-174	0	0	0	0	110.8	S123 E124 Q125	S121-S123 VanDerWaalsContact C-N 3.27Å; S121-S123 PolarHBondContact O-N 3Å; S121-S123 PolarHBondContact OG-OG 2.94Å; S121-E124 WeakPolarHBondContact CB-OE2 3.43Å; S121-E124 PolarHBondContact O-N 3.32Å; S121-E124 WeakPolarHBondContact OG-CG 3.35Å; S121-Q125 WeakPolarHBondContact O-CG 3.23Å; S121-Q125 PolarHBondContact O-N 3.08Å
122	E	92.3	Very high	88.7	Confident	115 Å²	115	75.1 Å²	75.1	54%	0.537	42%	0.42	S	S	.	.	H	α-helix	trans	-59.6	-37.1	-179.6	-67	-176.4	173.9	0	0	112.6	E124 Q125 F126	E122-E124 VanDerWaalsContact C-N 3.33Å; E122-E124 PolarHBondContact O-N 3.14Å; E122-Q125 PolarHBondContact O-N 3.05Å; E122-F126 WeakPolarHBondContact O-CB 3.25Å; E122-F126 PolarHBondContact O-N 2.99Å
123	S	93.3	Very high	89	Confident	54 Å²	54	76.3 Å²	76.3	38%	0.378	43%	0.427	S	S	.	.	H	α-helix	trans	-66.2	-34	179	52.1	0	0	0	0	112.7	S121 L304	S121-S123 VanDerWaalsContact C-N 3.27Å; S121-S123 PolarHBondContact O-N 3Å; S121-S123 PolarHBondContact OG-OG 2.94Å; S123-L304 VanDerWaalsContact OG-CD2 3.28Å; S123-L304 WeakPolarHBondContact OG-CD2 3.37Å
124	E	96.4	Very high	89.6	Confident	17 Å²	17	78.8 Å²	78.8	8%	0.079	43%	0.433	C	S	.	.	H	α-helix	trans	-74	-42.4	172	-68.4	174.3	-179.1	0	0	111.3	S121 E122 F126 L127 K128 Y191 L304 F305 H306	S121-E124 WeakPolarHBondContact CB-OE2 3.43Å; S121-E124 PolarHBondContact O-N 3.32Å; S121-E124 WeakPolarHBondContact OG-CG 3.35Å; E122-E124 VanDerWaalsContact C-N 3.33Å; E122-E124 PolarHBondContact O-N 3.14Å; E124-F126 VanDerWaalsContact C-N 3.27Å; E124-F126 PolarHBondContact O-N 2.92Å; E124-L127 CarbonylContact O-C 3.51Å; E124-L127 PolarHBondContact O-N 3.02Å; E124-K128 PolarHBondContact O-N 3.42Å; E124-Y191 WeakPolarHBondContact OE2-CE2 3.32Å; E124-Y191 PolarHBondContact OE2-OH 3.42Å; E124-Y191 VanDerWaalsContact OE2-OH 3.07Å; E124-L304 HydrophobicContact CG-CB 3.97Å; E124-L304 HydrophobicContact CG-CD1 4.12Å; E124-L304 HydrophobicContact CG-CD2 3.97Å; E124-L304 HydrophobicContact CG-CG 4.23Å; E124-F305 WeakPolarHBondContact OE1-CA 3.24Å; E124-F305 VanDerWaalsContact OE1-CB 3.28Å; E124-F305 WeakPolarHBondContact OE1-CB 3.41Å; E124-F305 PolarHBondContact OE1-N 3.18Å; E124-H306 PolarHBondContact OE1-N 2.67Å
125	Q	95.1	Very high	90.9	Very high	79 Å²	79	78.4 Å²	78.4	37%	0.369	43%	0.426	S	S	.	.	H	α-helix	trans	-59.2	-39.4	177.1	-73.1	-177.2	-7.3	0	0	112.3	M120 S121 E122 L127 K128	M120-Q125 PolarHBondContact SD-NE2 3.34Å; S121-Q125 WeakPolarHBondContact O-CG 3.23Å; S121-Q125 PolarHBondContact O-N 3.08Å; E122-Q125 PolarHBondContact O-N 3.05Å; Q125-L127 PolarHBondContact O-N 3.1Å; Q125-K128 VanDerWaalsContact O-CB 3.23Å; Q125-K128 WeakPolarHBondContact O-CB 3.21Å; Q125-K128 PolarHBondContact O-N 3.33Å; Q125-K128 VanDerWaalsContact O-N 3.13Å
126	F	94.9	Very high	92.7	Very high	179 Å²	179	74.2 Å²	74.2	79%	0.785	40%	0.4	S	S	*	.	H	α-helix	trans	-60.6	-32	176.6	-176.2	-97.6	0	0	0	112.8	E122 E124	E122-F126 WeakPolarHBondContact O-CB 3.25Å; E122-F126 PolarHBondContact O-N 2.99Å; E124-F126 VanDerWaalsContact C-N 3.27Å; E124-F126 PolarHBondContact O-N 2.92Å
127	L	94.6	Very high	94.3	Very high	73 Å²	73	74.3 Å²	74.3	38%	0.382	41%	0.406	S	S	.	.	H	α-helix	trans	-97.4	2	178.7	-67.6	-178.6	0	0	0	113.2	E124 Q125 G129 T130 L304	E124-L127 CarbonylContact O-C 3.51Å; E124-L127 PolarHBondContact O-N 3.02Å; Q125-L127 PolarHBondContact O-N 3.1Å; L127-G129 PolarHBondContact O-N 2.94Å; L127-T130 HydrophobicContact CB-CG2 4.05Å; L127-T130 WeakPolarHBondContact O-CB 3.4Å; L127-T130 WeakPolarHBondContact O-CG2 3.27Å; L127-T130 PolarHBondContact O-N 2.81Å; L127-L304 HydrophobicContact CD1-CD1 3.79Å
128	K	92.5	Very high	95.2	Very high	181 Å²	181	74 Å²	74	79%	0.787	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	128.6	-178.6	-173	175.9	-179.1	176.3	0	111.1	E124 Q125 T130	E124-K128 PolarHBondContact O-N 3.42Å; Q125-K128 VanDerWaalsContact O-CB 3.23Å; Q125-K128 WeakPolarHBondContact O-CB 3.21Å; Q125-K128 PolarHBondContact O-N 3.33Å; Q125-K128 VanDerWaalsContact O-N 3.13Å; K128-T130 VanDerWaalsContact C-N 3.32Å
129	G	91.8	Very high	95.7	Very high	83 Å²	83	78.8 Å²	78.8	86%	0.856	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.8	-5.2	-179.8	0	0	0	0	0	114.7	L127	L127-G129 PolarHBondContact O-N 2.94Å
130	T	96	Very high	96	Very high	55 Å²	55	79.1 Å²	79.1	34%	0.337	42%	0.424	S	S	.	.			trans	-70.9	147.6	168	-163.9	0	0	0	0	111.1	L127 K128 Q132	L127-T130 HydrophobicContact CB-CG2 4.05Å; L127-T130 WeakPolarHBondContact O-CB 3.4Å; L127-T130 WeakPolarHBondContact O-CG2 3.27Å; L127-T130 PolarHBondContact O-N 2.81Å; K128-T130 VanDerWaalsContact C-N 3.32Å; T130-Q132 WeakPolarHBondContact OG1-CB 3.47Å; T130-Q132 PolarHBondContact OG1-N 3.44Å
131	S	95.6	Very high	96.3	Very high	75 Å²	75	77.4 Å²	77.4	52%	0.524	42%	0.416	S	S	.	.			trans	-111.1	7.5	167.1	56	0	0	0	0	112	I133	S131-I133 PolarHBondContact O-N 3.3Å
132	Q	97.3	Very high	96.5	Very high	158 Å²	158	82 Å²	82	74%	0.738	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-72.6	119.3	176.7	-174	175.1	3.7	0	0	109.7	T130	T130-Q132 WeakPolarHBondContact OG1-CB 3.47Å; T130-Q132 PolarHBondContact OG1-N 3.44Å
133	I	98.7	Very high	96.8	Very high	26 Å²	26	77.3 Å²	77.3	13%	0.133	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-94.6	132.2	179.1	-52.5	168.9	0	0	0	108.3	S131 Y274 A308 P309 H327	S131-I133 PolarHBondContact O-N 3.3Å; I133-Y274 HydrophobicContact CD1-CD2 4.06Å; I133-Y274 HydrophobicContact CD1-CE2 3.38Å; I133-A308 HydrophobicContact CG1-CB 4.37Å; I133-P309 HydrophobicContact CD1-CB 3.76Å; I133-P309 HydrophobicContact CD1-CG 3.98Å; I133-P309 HydrophobicContact CG1-CB 4.14Å; I133-P309 HydrophobicContact CG1-CG 4.39Å; I133-H327 HydrophobicContact CG2-CB 4.31Å
134	K	98.4	Very high	97.1	Very high	77 Å²	77	74.8 Å²	74.8	34%	0.335	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-72	132.3	177.5	-176.7	173.6	156.7	64.3	0	110.1	L136 D140	K134-L136 HydrophobicContact CB-CD1 4.42Å; K134-L136 HydrophobicContact CD-CD1 4.35Å; K134-L136 HydrophobicContact CG-CD1 4.1Å; K134-D140 WeakPolarHBondContact CE-OD2 3.25Å; K134-D140 IonicContact NZ-OD2 3.11Å; K134-D140 PolarHBondContact NZ-OD2 3.17Å
135	I	98.8	Very high	97.2	Very high	98 Å²	98	78.1 Å²	78.1	50%	0.503	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-90.8	116.3	162.5	-61.5	173.3	0	0	0	106	K324	I135-K324 HydrophobicContact CD1-CD 4.36Å
136	L	98.8	Very high	97.3	Very high	10 Å²	10	77.6 Å²	77.6	5%	0.052	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-71.7	145.6	-178.3	-85.4	66.3	0	0	0	110.9	K134 D140 I141 M144 H302 G326 V328	K134-L136 HydrophobicContact CB-CD1 4.42Å; K134-L136 HydrophobicContact CD-CD1 4.35Å; K134-L136 HydrophobicContact CG-CD1 4.1Å; L136-D140 HydrophobicContact CB-CB 3.79Å; L136-D140 HydrophobicContact CD2-CB 3.88Å; L136-D140 HydrophobicContact CG-CB 3.7Å; L136-I141 HydrophobicContact CB-CD1 4.5Å; L136-I141 HydrophobicContact CB-CG1 3.85Å; L136-I141 HydrophobicContact CD2-CG1 4.42Å; L136-M144 HydrophobicContact CD2-CG 3.56Å; L136-H302 HydrophobicContact CD1-CB 4.36Å; L136-H302 HydrophobicContact CD2-CB 4.39Å; L136-G326 WeakPolarHBondContact CD1-O 3.27Å; L136-G326 PolarHBondContact N-O 3.16Å; L136-V328 HydrophobicContact CD1-CB 4.46Å; L136-V328 HydrophobicContact CD1-CG2 4.28Å; L136-V328 HydrophobicContact CD2-CB 4.32Å; L136-V328 HydrophobicContact CD2-CG2 3.66Å
137	S	98.8	Very high	97.5	Very high	44 Å²	44	69 Å²	69	31%	0.308	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-73.5	164.9	167.6	68.4	0	0	0	0	110.4	E139 D140 I141	S137-E139 PolarHBondContact O-N 3.36Å; S137-D140 PolarHBondContact O-N 3.15Å; S137-D140 VanDerWaalsContact O-N 3.14Å; S137-D140 PolarHBondContact OG-N 3.08Å; S137-D140 VanDerWaalsContact OG-N 3.11Å; S137-I141 WeakPolarHBondContact O-CG1 3.22Å; S137-I141 PolarHBondContact O-N 3.36Å
138	P	98.5	Very high	97.7	Very high	110 Å²	110	65.6 Å²	65.6	71%	0.714	36%	0.361	S	S	*	.	H	α-helix	trans	-54.4	-37.8	172.5	-27.7	36.2	0	0	0	113.5	I141 E142	P138-I141 PolarHBondContact O-N 3.42Å; P138-E142 PolarHBondContact O-N 3.22Å; P138-E142 VanDerWaalsContact O-N 3.13Å
139	E	98.4	Very high	98	Very high	152 Å²	152	61.9 Å²	61.9	71%	0.71	34%	0.344	S	S	*	.	H	α-helix	trans	-66.3	-45.1	175.6	-178.3	-175.3	-171.8	0	0	112.2	S137 I141 E142 G143	S137-E139 PolarHBondContact O-N 3.36Å; E139-I141 PolarHBondContact O-N 2.98Å; E139-E142 PolarHBondContact O-N 3.26Å; E139-G143 PolarHBondContact O-N 3.32Å
140	D	98.7	Very high	98.4	Very high	8 Å²	8	59.2 Å²	59.2	4%	0.043	31%	0.31	C	S	.	.	H	α-helix	trans	-61.1	-37.1	176.5	-73.2	-27.7	0	0	0	110.6	K134 L136 S137 G143 M144 F233 R303	K134-D140 WeakPolarHBondContact CE-OD2 3.25Å; K134-D140 IonicContact NZ-OD2 3.11Å; K134-D140 PolarHBondContact NZ-OD2 3.17Å; L136-D140 HydrophobicContact CB-CB 3.79Å; L136-D140 HydrophobicContact CD2-CB 3.88Å; L136-D140 HydrophobicContact CG-CB 3.7Å; S137-D140 PolarHBondContact O-N 3.15Å; S137-D140 VanDerWaalsContact O-N 3.14Å; S137-D140 PolarHBondContact OG-N 3.08Å; S137-D140 VanDerWaalsContact OG-N 3.11Å; D140-G143 PolarHBondContact O-N 3.42Å; D140-M144 WeakPolarHBondContact O-CG 3.37Å; D140-M144 PolarHBondContact O-N 3.13Å; D140-F233 HydrophobicContact CB-CE1 3.8Å; D140-F233 HydrophobicContact CB-CZ 4.01Å; D140-F233 VanDerWaalsContact OD1-CZ 3.26Å; D140-F233 WeakPolarHBondContact OD1-CZ 3.2Å; D140-R303 IonicContact OD1-CZ 2.75Å; D140-R303 IonicContact OD1-NE 3.46Å; D140-R303 PolarHBondContact OD1-NE 3.27Å; D140-R303 IonicContact OD1-NH2 3.62Å; D140-R303 PolarHBondContact OD1-NH2 3.21Å
141	I	98.9	Very high	98.5	Very high	28 Å²	28	56.6 Å²	56.6	14%	0.144	29%	0.294	C	S	.	.	H	α-helix	trans	-63.9	-43.9	177	-71.5	167.4	0	0	0	111.6	L136 S137 P138 E139 G143 M144 R145 L368	L136-I141 HydrophobicContact CB-CD1 4.5Å; L136-I141 HydrophobicContact CB-CG1 3.85Å; L136-I141 HydrophobicContact CD2-CG1 4.42Å; S137-I141 WeakPolarHBondContact O-CG1 3.22Å; S137-I141 PolarHBondContact O-N 3.36Å; P138-I141 PolarHBondContact O-N 3.42Å; E139-I141 PolarHBondContact O-N 2.98Å; I141-G143 VanDerWaalsContact C-N 3.32Å; I141-G143 PolarHBondContact O-N 3.29Å; I141-M144 WeakPolarHBondContact O-CB 3.39Å; I141-M144 PolarHBondContact O-N 3.37Å; I141-R145 WeakPolarHBondContact O-CG 3.37Å; I141-R145 PolarHBondContact O-N 3.36Å; I141-L368 HydrophobicContact CD1-CD1 4.21Å; I141-L368 HydrophobicContact CD1-CD2 4.38Å; I141-L368 HydrophobicContact CG1-CD1 4.12Å; I141-L368 HydrophobicContact CG1-CD2 4.26Å; I141-L368 HydrophobicContact CG2-CD2 3.61Å
142	E	98.8	Very high	98.7	Very high	99 Å²	99	53.3 Å²	53.3	46%	0.463	27%	0.27	S	S	.	.	H	α-helix	trans	-63.2	-40.3	175.7	-69.3	-52.2	134.9	0	0	111.7	P138 E139 M144 R145 V146	P138-E142 PolarHBondContact O-N 3.22Å; P138-E142 VanDerWaalsContact O-N 3.13Å; E139-E142 PolarHBondContact O-N 3.26Å; E142-M144 VanDerWaalsContact C-N 3.31Å; E142-M144 PolarHBondContact O-N 3.29Å; E142-R145 PolarHBondContact O-N 3.41Å; E142-R145 IonicContact OE1-CZ 3.38Å; E142-R145 IonicContact OE1-NH1 2.73Å; E142-R145 PolarHBondContact OE1-NH1 2.93Å; E142-V146 WeakPolarHBondContact O-CG2 3.38Å; E142-V146 PolarHBondContact O-N 3.09Å
143	G	98.8	Very high	98.7	Very high	18 Å²	18	48.5 Å²	48.5	19%	0.186	25%	0.248	C	C	.	.	H	α-helix	trans	-56.3	-45.8	171.8	0	0	0	0	0	112.2	E139 D140 I141 V146 V147	E139-G143 PolarHBondContact O-N 3.32Å; D140-G143 PolarHBondContact O-N 3.42Å; I141-G143 VanDerWaalsContact C-N 3.32Å; I141-G143 PolarHBondContact O-N 3.29Å; G143-V146 PolarHBondContact O-N 2.91Å; G143-V147 WeakPolarHBondContact O-CG1 3.38Å; G143-V147 PolarHBondContact O-N 2.96Å
144	M	98.9	Very high	98.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.4	-44.4	176.5	-72	-54.4	-72.6	0	0	113.1	L136 D140 I141 E142 V146 V147 C148 F233 H234 I301 H302 V328 T366 L377	L136-M144 HydrophobicContact CD2-CG 3.56Å; D140-M144 WeakPolarHBondContact O-CG 3.37Å; D140-M144 PolarHBondContact O-N 3.13Å; I141-M144 WeakPolarHBondContact O-CB 3.39Å; I141-M144 PolarHBondContact O-N 3.37Å; E142-M144 VanDerWaalsContact C-N 3.31Å; E142-M144 PolarHBondContact O-N 3.29Å; M144-V146 VanDerWaalsContact C-N 3.32Å; M144-V146 PolarHBondContact O-N 3.14Å; M144-V147 WeakPolarHBondContact O-CG1 3.38Å; M144-V147 PolarHBondContact O-N 3.1Å; M144-V147 HydrophobicContact SD-CG1 4.26Å; M144-C148 WeakPolarHBondContact O-CB 3.47Å; M144-C148 PolarHBondContact O-N 3.34Å; M144-C148 PolarHBondContact O-SG 2.79Å; M144-F233 HydrophobicContact CG-CD1 4.05Å; M144-F233 HydrophobicContact SD-CB 3.86Å; M144-F233 HydrophobicContact SD-CD1 3.68Å; M144-F233 HydrophobicContact SD-CG 4.15Å; M144-H234 VanDerWaalsContact CE-O 3.22Å; M144-H234 WeakPolarHBondContact CE-O 3.29Å; M144-I301 HydrophobicContact CE-CG2 4.23Å; M144-H302 HydrophobicContact SD-CB 4.17Å; M144-V328 HydrophobicContact CE-CG1 3.54Å; M144-T366 HydrophobicContact CE-CG2 4.01Å; M144-L377 HydrophobicContact CB-CD1 3.99Å
145	R	98.8	Very high	98.7	Very high	87 Å²	87	43.6 Å²	43.6	33%	0.328	23%	0.226	S	C	.	.	H	α-helix	trans	-58.2	-44.7	176.2	-76.5	175.1	173.9	140.9	4.9	111.7	I141 E142 K149 E375 L377	I141-R145 WeakPolarHBondContact O-CG 3.37Å; I141-R145 PolarHBondContact O-N 3.36Å; E142-R145 PolarHBondContact O-N 3.41Å; E142-R145 IonicContact OE1-CZ 3.38Å; E142-R145 IonicContact OE1-NH1 2.73Å; E142-R145 PolarHBondContact OE1-NH1 2.93Å; R145-K149 WeakPolarHBondContact O-CB 3.22Å; R145-K149 PolarHBondContact O-N 3.42Å; R145-K149 VanDerWaalsContact O-N 3.11Å; R145-E375 IonicContact CZ-OE2 2.84Å; R145-E375 IonicContact NE-OE1 3.1Å; R145-E375 PolarHBondContact NE-OE1 3.2Å; R145-E375 IonicContact NE-OE2 3.2Å; R145-E375 PolarHBondContact NE-OE2 3.18Å; R145-E375 VanDerWaalsContact NE-OE2 3.14Å; R145-E375 IonicContact NH2-OE2 3.44Å; R145-E375 PolarHBondContact NH2-OE2 2.92Å; R145-L377 HydrophobicContact CG-CD2 3.69Å
146	V	98.7	Very high	98.7	Very high	68 Å²	68	40.6 Å²	40.6	41%	0.412	21%	0.211	S	C	.	.	H	α-helix	trans	-64.8	-53.8	179.2	172.6	0	0	0	0	111	E142 G143 M144 C148 K149 L150	E142-V146 WeakPolarHBondContact O-CG2 3.38Å; E142-V146 PolarHBondContact O-N 3.09Å; G143-V146 PolarHBondContact O-N 2.91Å; M144-V146 VanDerWaalsContact C-N 3.32Å; M144-V146 PolarHBondContact O-N 3.14Å; V146-C148 VanDerWaalsContact C-N 3.33Å; V146-C148 PolarHBondContact O-N 3.19Å; V146-K149 PolarHBondContact O-N 3.19Å; V146-L150 HydrophobicContact CG1-CD1 4.02Å; V146-L150 WeakPolarHBondContact O-CG 3.47Å; V146-L150 PolarHBondContact O-N 3.07Å
147	V	98.8	Very high	98.7	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-65	-37.3	-176.2	71.1	0	0	0	0	112.2	G143 M144 L150 A151 V228 H230 F233	G143-V147 WeakPolarHBondContact O-CG1 3.38Å; G143-V147 PolarHBondContact O-N 2.96Å; M144-V147 WeakPolarHBondContact O-CG1 3.38Å; M144-V147 PolarHBondContact O-N 3.1Å; M144-V147 HydrophobicContact SD-CG1 4.26Å; V147-L150 PolarHBondContact O-N 2.71Å; V147-A151 PolarHBondContact O-N 3.11Å; V147-V228 HydrophobicContact CG2-CG2 3.58Å; V147-V228 VanDerWaalsContact CG2-O 3.23Å; V147-V228 WeakPolarHBondContact CG2-O 3.25Å; V147-H230 HydrophobicContact CB-CB 4.18Å; V147-H230 HydrophobicContact CG2-CB 3.8Å; V147-F233 HydrophobicContact CB-CB 4.46Å; V147-F233 HydrophobicContact CG1-CB 3.86Å; V147-F233 WeakPolarHBondContact CG2-O 3.36Å
148	C	98.9	Very high	98.7	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-66.7	-38.2	177.2	-71.1	0	0	0	0	112.3	M144 V146 L150 A151 R152 L377 T378	M144-C148 WeakPolarHBondContact O-CB 3.47Å; M144-C148 PolarHBondContact O-N 3.34Å; M144-C148 PolarHBondContact O-SG 2.79Å; V146-C148 VanDerWaalsContact C-N 3.33Å; V146-C148 PolarHBondContact O-N 3.19Å; C148-L150 VanDerWaalsContact C-N 3.35Å; C148-A151 PolarHBondContact O-N 3.44Å; C148-R152 PolarHBondContact O-N 3.31Å; C148-L377 HydrophobicContact CB-CB 3.62Å; C148-L377 WeakPolarHBondContact CB-O 3.31Å; C148-T378 HydrophobicContact CB-CG2 3.52Å
149	K	98.8	Very high	98.7	Very high	103 Å²	103	36.5 Å²	36.5	45%	0.448	18%	0.181	S	C	.	.	H	α-helix	trans	-61.6	-44.4	172	-176.4	-171	172.5	-163.6	0	111.1	R145 V146 R152 E153 L381	R145-K149 WeakPolarHBondContact O-CB 3.22Å; R145-K149 PolarHBondContact O-N 3.42Å; R145-K149 VanDerWaalsContact O-N 3.11Å; V146-K149 PolarHBondContact O-N 3.19Å; K149-R152 WeakPolarHBondContact O-CB 3.32Å; K149-R152 PolarHBondContact O-N 3.02Å; K149-E153 VanDerWaalsContact CE-OE1 3.28Å; K149-E153 WeakPolarHBondContact CE-OE1 3.17Å; K149-E153 IonicContact NZ-OE1 3.34Å; K149-E153 WeakPolarHBondContact O-CG 3.21Å; K149-E153 PolarHBondContact O-N 3.4Å; K149-L381 HydrophobicContact CD-CD1 4.38Å; K149-L381 HydrophobicContact CG-CD1 4.38Å
150	L	98.7	Very high	98.6	Very high	27 Å²	27	35.8 Å²	35.8	14%	0.141	18%	0.182	C	C	.	.	H	α-helix	trans	-64.7	-39.7	178.3	-64.3	171.4	0	0	0	111.8	V146 V147 C148 E153 V154 R182 V228 H230	V146-L150 HydrophobicContact CG1-CD1 4.02Å; V146-L150 WeakPolarHBondContact O-CG 3.47Å; V146-L150 PolarHBondContact O-N 3.07Å; V147-L150 PolarHBondContact O-N 2.71Å; C148-L150 VanDerWaalsContact C-N 3.35Å; L150-E153 PolarHBondContact O-N 2.87Å; L150-V154 WeakPolarHBondContact O-CG2 3.5Å; L150-V154 PolarHBondContact O-N 2.96Å; L150-V154 VanDerWaalsContact O-N 3.11Å; L150-R182 HydrophobicContact CD2-CB 4.23Å; L150-R182 HydrophobicContact CD2-CG 4.18Å; L150-V228 HydrophobicContact CB-CG2 4.31Å; L150-H230 HydrophobicContact CD1-CB 4.32Å
151	A	98.8	Very high	98.6	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.7	-46.6	174.5	0	0	0	0	0	111.2	V147 C148 E153 V154 L155 V228 G235 L237	V147-A151 PolarHBondContact O-N 3.11Å; C148-A151 PolarHBondContact O-N 3.44Å; A151-E153 PolarHBondContact O-N 3.4Å; A151-V154 WeakPolarHBondContact O-CB 3.31Å; A151-V154 PolarHBondContact O-N 3.23Å; A151-V154 VanDerWaalsContact O-N 3.07Å; A151-L155 PolarHBondContact O-N 3.03Å; A151-V228 HydrophobicContact CB-CG1 4.28Å; A151-V228 HydrophobicContact CB-CG2 3.8Å; A151-G235 WeakPolarHBondContact CB-O 3.47Å; A151-L237 HydrophobicContact CB-CD2 3.5Å
152	R	98.8	Very high	98.6	Very high	6 Å²	6	37.2 Å²	37.2	2%	0.023	19%	0.189	C	C	.	.	H	α-helix	trans	-55.2	-50.3	173.9	166.3	52.6	63.5	-174.4	1.2	111.9	C148 K149 V154 L155 D156 L237 E239 T378 R380	C148-R152 PolarHBondContact O-N 3.31Å; K149-R152 WeakPolarHBondContact O-CB 3.32Å; K149-R152 PolarHBondContact O-N 3.02Å; R152-V154 PolarHBondContact O-N 3.13Å; R152-L155 PolarHBondContact O-N 2.82Å; R152-L155 VanDerWaalsContact O-N 3.14Å; R152-D156 VanDerWaalsContact CD-OD1 3.29Å; R152-D156 WeakPolarHBondContact CD-OD1 3.14Å; R152-D156 VanDerWaalsContact CD-OD2 3.24Å; R152-D156 WeakPolarHBondContact CD-OD2 3.35Å; R152-D156 IonicContact CZ-OD1 2.7Å; R152-D156 IonicContact NH1-OD1 3.41Å; R152-D156 PolarHBondContact NH1-OD1 3.34Å; R152-D156 VanDerWaalsContact O-CG 3.31Å; R152-D156 PolarHBondContact O-N 3.02Å; R152-L237 HydrophobicContact CB-CD1 3.96Å; R152-L237 VanDerWaalsContact CZ-CD1 3.42Å; R152-E239 IonicContact CZ-OE1 2.67Å; R152-E239 IonicContact NH1-OE1 3.42Å; R152-E239 PolarHBondContact NH1-OE1 3.32Å; R152-E239 IonicContact NH2-OE1 2.72Å; R152-E239 PolarHBondContact NH2-OE1 3.33Å; R152-T378 PolarHBondContact NE-O 3.32Å; R152-T378 PolarHBondContact NH2-O 3.01Å; R152-T378 VanDerWaalsContact NH2-O 3.17Å; R152-R380 VanDerWaalsContact NH1-CG 3.27Å
153	E	98.6	Very high	98.5	Very high	57 Å²	57	38.4 Å²	38.4	27%	0.266	19%	0.193	S	C	.	.	H	α-helix	trans	-59.3	-30.3	178.1	-68.5	175	-166.2	0	0	113	K149 L150 A151 I157 R182	K149-E153 VanDerWaalsContact CE-OE1 3.28Å; K149-E153 WeakPolarHBondContact CE-OE1 3.17Å; K149-E153 IonicContact NZ-OE1 3.34Å; K149-E153 WeakPolarHBondContact O-CG 3.21Å; K149-E153 PolarHBondContact O-N 3.4Å; L150-E153 PolarHBondContact O-N 2.87Å; A151-E153 PolarHBondContact O-N 3.4Å; E153-I157 WeakPolarHBondContact O-CG1 3.09Å; E153-I157 PolarHBondContact O-N 2.78Å; E153-R182 IonicContact OE2-CZ 2.79Å; E153-R182 IonicContact OE2-NE 2.78Å; E153-R182 PolarHBondContact OE2-NE 2.92Å; E153-R182 IonicContact OE2-NH2 2.72Å
154	V	98.8	Very high	98.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-74.2	-43.3	174.9	173	0	0	0	0	111.6	L150 A151 R152 D156 I157 A158 V175 A178 I226 V228	L150-V154 WeakPolarHBondContact O-CG2 3.5Å; L150-V154 PolarHBondContact O-N 2.96Å; L150-V154 VanDerWaalsContact O-N 3.11Å; A151-V154 WeakPolarHBondContact O-CB 3.31Å; A151-V154 PolarHBondContact O-N 3.23Å; A151-V154 VanDerWaalsContact O-N 3.07Å; R152-V154 PolarHBondContact O-N 3.13Å; V154-D156 VanDerWaalsContact C-N 3.28Å; V154-D156 PolarHBondContact O-N 2.97Å; V154-I157 WeakPolarHBondContact O-CB 3.36Å; V154-I157 PolarHBondContact O-N 2.84Å; V154-I157 VanDerWaalsContact O-N 3.13Å; V154-A158 PolarHBondContact O-N 2.67Å; V154-A158 VanDerWaalsContact O-N 3.1Å; V154-V175 HydrophobicContact CG1-CB 4.32Å; V154-V175 HydrophobicContact CG1-CG1 3.77Å; V154-V175 HydrophobicContact CG1-CG2 4.31Å; V154-A178 HydrophobicContact CG1-CB 4.27Å; V154-A178 HydrophobicContact CG2-CB 4.08Å; V154-I226 HydrophobicContact CB-CG2 3.96Å; V154-I226 HydrophobicContact CG1-CD1 4.18Å; V154-I226 HydrophobicContact CG1-CG2 3.73Å; V154-V228 HydrophobicContact CB-CG1 4.49Å; V154-V228 HydrophobicContact CG2-CG1 4.25Å
155	L	98.8	Very high	98.5	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-60.4	-40.2	174.5	-179.7	63.5	0	0	0	111.5	A151 R152 I157 A158 A159 V224 I226 L237 E239 F241	A151-L155 PolarHBondContact O-N 3.03Å; R152-L155 PolarHBondContact O-N 2.82Å; R152-L155 VanDerWaalsContact O-N 3.14Å; L155-I157 PolarHBondContact O-N 3.2Å; L155-A158 WeakPolarHBondContact O-CB 3.4Å; L155-A158 PolarHBondContact O-N 3.06Å; L155-A158 VanDerWaalsContact O-N 3.09Å; L155-A159 PolarHBondContact O-N 3.48Å; L155-V224 HydrophobicContact CD1-CB 4.15Å; L155-V224 HydrophobicContact CD1-CG1 4.43Å; L155-V224 WeakPolarHBondContact CD1-O 3.23Å; L155-I226 HydrophobicContact CB-CB 4.39Å; L155-I226 HydrophobicContact CB-CG1 3.92Å; L155-I226 HydrophobicContact CD1-CG1 3.8Å; L155-I226 HydrophobicContact CG-CG1 4.45Å; L155-L237 HydrophobicContact CB-CD1 4.18Å; L155-L237 HydrophobicContact CB-CD2 4.36Å; L155-L237 HydrophobicContact CB-CG 4.27Å; L155-L237 HydrophobicContact CD2-CD1 3.72Å; L155-L237 HydrophobicContact CD2-CG 3.75Å; L155-E239 HydrophobicContact CD2-CB 4.07Å; L155-E239 HydrophobicContact CD2-CG 3.81Å; L155-F241 HydrophobicContact CD1-CE2 4.08Å; L155-F241 HydrophobicContact CD1-CZ 3.87Å; L155-F241 HydrophobicContact CG-CZ 4.31Å
156	D	98.5	Very high	98.5	Very high	36 Å²	36	39.7 Å²	39.7	19%	0.193	22%	0.218	C	C	.	.	H	α-helix	trans	-64.4	-29.5	177.9	-66.5	-17.2	0	0	0	111.8	R152 V154 L160 R380 H388	R152-D156 VanDerWaalsContact CD-OD1 3.29Å; R152-D156 WeakPolarHBondContact CD-OD1 3.14Å; R152-D156 VanDerWaalsContact CD-OD2 3.24Å; R152-D156 WeakPolarHBondContact CD-OD2 3.35Å; R152-D156 IonicContact CZ-OD1 2.7Å; R152-D156 IonicContact NH1-OD1 3.41Å; R152-D156 PolarHBondContact NH1-OD1 3.34Å; R152-D156 VanDerWaalsContact O-CG 3.31Å; R152-D156 PolarHBondContact O-N 3.02Å; V154-D156 VanDerWaalsContact C-N 3.28Å; V154-D156 PolarHBondContact O-N 2.97Å; D156-L160 WeakPolarHBondContact O-CG 3.47Å; D156-R380 IonicContact OD1-NE 3.87Å; D156-H388 IonicContact OD1-CD2 3.91Å; D156-H388 IonicContact OD1-CE1 3.39Å; D156-H388 IonicContact OD1-NE2 2.71Å; D156-H388 PolarHBondContact OD1-NE2 3.11Å
157	I	98.3	Very high	98.5	Very high	61 Å²	61	37.7 Å²	37.7	31%	0.313	21%	0.206	S	C	.	.	H	α-helix	trans	-69.8	-43.2	170.4	-67.5	-65.5	0	0	0	111.4	E153 V154 L155 A159 L160 A178	E153-I157 WeakPolarHBondContact O-CG1 3.09Å; E153-I157 PolarHBondContact O-N 2.78Å; V154-I157 WeakPolarHBondContact O-CB 3.36Å; V154-I157 PolarHBondContact O-N 2.84Å; V154-I157 VanDerWaalsContact O-N 3.13Å; L155-I157 PolarHBondContact O-N 3.2Å; I157-A159 VanDerWaalsContact C-N 3.29Å; I157-A159 PolarHBondContact O-N 2.72Å; I157-L160 HydrophobicContact CD1-CD1 4.4Å; I157-L160 PolarHBondContact O-N 3.39Å; I157-A178 HydrophobicContact CG2-CB 4.34Å
158	A	98.4	Very high	98.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.4	-41	176.5	0	0	0	0	0	111.5	V154 L155 L160 M161 I171 V175 V224	V154-A158 PolarHBondContact O-N 2.67Å; V154-A158 VanDerWaalsContact O-N 3.1Å; L155-A158 WeakPolarHBondContact O-CB 3.4Å; L155-A158 PolarHBondContact O-N 3.06Å; L155-A158 VanDerWaalsContact O-N 3.09Å; A158-L160 VanDerWaalsContact C-N 3.27Å; A158-L160 PolarHBondContact O-N 3.11Å; A158-M161 WeakPolarHBondContact O-CB 3.44Å; A158-M161 PolarHBondContact O-N 2.75Å; A158-I171 HydrophobicContact CB-CG2 4.03Å; A158-V175 HydrophobicContact CB-CG2 3.82Å; A158-V224 HydrophobicContact CB-CG1 4.01Å
159	A	98.1	Very high	98.4	Very high	16 Å²	16	38.8 Å²	38.8	13%	0.132	21%	0.212	C	C	.	.	H	α-helix	trans	-55.4	-38.8	178.1	0	0	0	0	0	112.8	L155 I157 M161 V162 F241	L155-A159 PolarHBondContact O-N 3.48Å; I157-A159 VanDerWaalsContact C-N 3.29Å; I157-A159 PolarHBondContact O-N 2.72Å; A159-M161 PolarHBondContact O-N 2.7Å; A159-V162 PolarHBondContact O-N 3.41Å; A159-F241 HydrophobicContact CB-CD1 4.25Å; A159-F241 HydrophobicContact CB-CE1 3.41Å; A159-F241 VanDerWaalsContact CB-CE1 3.41Å; A159-F241 HydrophobicContact CB-CZ 3.78Å
160	L	97.1	Very high	98.4	Very high	138 Å²	138	38.6 Å²	38.6	72%	0.723	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-17.7	178.8	-64.4	173.7	0	0	0	113.8	D156 I157 A158	D156-L160 WeakPolarHBondContact O-CG 3.47Å; I157-L160 HydrophobicContact CD1-CD1 4.4Å; I157-L160 PolarHBondContact O-N 3.39Å; A158-L160 VanDerWaalsContact C-N 3.27Å; A158-L160 PolarHBondContact O-N 3.11Å
161	M	98.3	Very high	98.4	Very high	48 Å²	48	37.3 Å²	37.3	24%	0.236	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-12.3	-178.3	-64.4	-172.6	63.4	0	0	113.4	A158 A159 K163 V166 E170 I171 A174	A158-M161 WeakPolarHBondContact O-CB 3.44Å; A158-M161 PolarHBondContact O-N 2.75Å; A159-M161 PolarHBondContact O-N 2.7Å; M161-K163 PolarHBondContact O-N 2.9Å; M161-V166 HydrophobicContact CE-CG1 4.34Å; M161-E170 HydrophobicContact CE-CB 4.16Å; M161-E170 WeakPolarHBondContact CE-O 3.42Å; M161-I171 HydrophobicContact CB-CG1 4.02Å; M161-I171 HydrophobicContact CE-CG1 4.48Å; M161-A174 HydrophobicContact CE-CB 4.05Å; M161-A174 HydrophobicContact SD-CB 3.15Å; M161-A174 WeakPolarHBondContact SD-CB 3.4Å
162	V	98.3	Very high	98.4	Very high	17 Å²	17	37.5 Å²	37.5	10%	0.103	21%	0.206	C	C	.	.			trans	-71.4	100.4	-176.1	-175.3	0	0	0	0	110.2	A159 L216 L222 F241 V243	A159-V162 PolarHBondContact O-N 3.41Å; V162-L216 HydrophobicContact CG1-CD1 4.45Å; V162-L222 HydrophobicContact CG1-CD2 4.34Å; V162-L222 HydrophobicContact CG2-CD2 4.16Å; V162-F241 HydrophobicContact CB-CB 4.34Å; V162-F241 HydrophobicContact CG1-CB 3.83Å; V162-F241 HydrophobicContact CG2-CB 4.17Å; V162-F241 HydrophobicContact CG2-CD2 4.02Å; V162-F241 HydrophobicContact CG2-CG 4.01Å; V162-V243 HydrophobicContact CG1-CG2 3.83Å
163	K	97.9	Very high	98.3	Very high	124 Å²	124	41.2 Å²	41.2	54%	0.539	22%	0.224	S	C	.	.	S	Bend	trans	-158.8	158.8	174.8	64.7	-172.9	176	-175.1	0	110.9	M161 G165 V166	M161-K163 PolarHBondContact O-N 2.9Å; K163-G165 PolarHBondContact O-N 3.18Å; K163-V166 HydrophobicContact CD-CG2 4.24Å; K163-V166 HydrophobicContact CG-CB 4.49Å; K163-V166 HydrophobicContact CG-CG2 3.58Å; K163-V166 PolarHBondContact O-N 3.15Å
164	P	98.7	Very high	98.3	Very high	63 Å²	63	39.5 Å²	39.5	41%	0.409	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	139.5	176.1	-26	33.7	0	0	0	112.5	V166 L216 D218 V243	P164-V166 VanDerWaalsContact C-N 3.34Å; P164-V166 PolarHBondContact O-N 2.89Å; P164-L216 WeakPolarHBondContact CA-O 3.39Å; P164-D218 HydrophobicContact CG-CB 4.02Å; P164-V243 HydrophobicContact CG-CG1 3.98Å
165	G	98.2	Very high	98.2	Very high	52 Å²	52	39.6 Å²	39.6	54%	0.536	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	-19.2	177.7	0	0	0	0	0	115.6	K163 L216	K163-G165 PolarHBondContact O-N 3.18Å; G165-L216 PolarHBondContact N-O 2.81Å
166	V	98.6	Very high	98.1	Very high	17 Å²	17	39.8 Å²	39.8	10%	0.103	22%	0.221	C	C	.	.			trans	-75.1	136.7	173.8	174.4	0	0	0	0	109.4	M161 K163 P164 E170 I171 L216	M161-V166 HydrophobicContact CE-CG1 4.34Å; K163-V166 HydrophobicContact CD-CG2 4.24Å; K163-V166 HydrophobicContact CG-CB 4.49Å; K163-V166 HydrophobicContact CG-CG2 3.58Å; K163-V166 PolarHBondContact O-N 3.15Å; P164-V166 VanDerWaalsContact C-N 3.34Å; P164-V166 PolarHBondContact O-N 2.89Å; V166-E170 HydrophobicContact CG1-CB 4.15Å; V166-I171 HydrophobicContact CG1-CD1 4.25Å; V166-I171 HydrophobicContact CG1-CG1 3.88Å; V166-L216 WeakPolarHBondContact O-CB 3.46Å; V166-L216 VanDerWaalsContact O-CG 3.25Å; V166-L216 WeakPolarHBondContact O-CG 3.21Å; V166-L216 PolarHBondContact O-N 3.07Å
167	T	98.6	Very high	98	Very high	26 Å²	26	42.3 Å²	42.3	16%	0.16	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-84.5	152.5	175.8	63.2	0	0	0	0	111.8	E169 E170 I171 R213 R214 A215	T167-E169 PolarHBondContact O-N 2.91Å; T167-E170 PolarHBondContact N-OE2 3.16Å; T167-E170 PolarHBondContact O-N 3.36Å; T167-E170 WeakPolarHBondContact OG1-CB 3.34Å; T167-E170 VanDerWaalsContact OG1-CD 3.31Å; T167-E170 WeakPolarHBondContact OG1-CG 3.14Å; T167-E170 PolarHBondContact OG1-N 3.07Å; T167-E170 VanDerWaalsContact OG1-N 3.12Å; T167-E170 PolarHBondContact OG1-OE2 2.94Å; T167-I171 PolarHBondContact O-N 2.96Å; T167-R213 WeakPolarHBondContact CG2-O 3.38Å; T167-R214 VanDerWaalsContact CA-O 3.31Å; T167-R214 WeakPolarHBondContact CA-O 3.25Å; T167-A215 HydrophobicContact CG2-CB 4.4Å
168	T	98.6	Very high	97.9	Very high	4 Å²	4	39.9 Å²	39.9	3%	0.025	22%	0.223	C	C	.	.	H	α-helix	trans	-64.5	-31.1	174	49.2	0	0	0	0	111.7	I171 D172 T200 V202 D212 R214 L216 L222	T168-I171 WeakPolarHBondContact O-CB 3.19Å; T168-I171 PolarHBondContact O-N 2.65Å; T168-D172 PolarHBondContact O-N 3.33Å; T168-T200 VanDerWaalsContact CB-OG1 3.28Å; T168-T200 WeakPolarHBondContact CB-OG1 3.36Å; T168-T200 HydrophobicContact CG2-CG2 4.09Å; T168-V202 HydrophobicContact CG2-CG2 4.3Å; T168-D212 PolarHBondContact OG1-N 3.32Å; T168-D212 PolarHBondContact OG1-O 2.66Å; T168-D212 VanDerWaalsContact OG1-O 3.12Å; T168-D212 PolarHBondContact OG1-OD1 2.96Å; T168-R214 PolarHBondContact N-O 3Å; T168-L216 HydrophobicContact CG2-CD2 4.13Å; T168-L222 HydrophobicContact CG2-CD1 4.3Å
169	E	97.7	Very high	97.9	Very high	20 Å²	20	39.9 Å²	39.9	9%	0.093	22%	0.223	C	C	.	.	H	α-helix	trans	-65.2	-34.1	172.3	-175.5	165.8	-102.7	0	0	113.7	N98 T167 H173 K196 D212	N98-E169 HydrophobicContact CB-CG 4.46Å; N98-E169 VanDerWaalsContact CB-OE1 3.27Å; N98-E169 WeakPolarHBondContact CB-OE1 3.41Å; N98-E169 PolarHBondContact N-OE1 3.11Å; N98-E169 WeakPolarHBondContact ND2-CG 3.46Å; N98-E169 PolarHBondContact ND2-OE1 3.18Å; N98-E169 PolarHBondContact OD1-OE1 3.01Å; T167-E169 PolarHBondContact O-N 2.91Å; E169-H173 WeakPolarHBondContact O-CB 3.36Å; E169-H173 PolarHBondContact O-N 2.94Å; E169-K196 IonicContact OE1-NZ 2.84Å; E169-K196 PolarHBondContact OE1-NZ 3.01Å; E169-D212 WeakPolarHBondContact CB-O 3.49Å; E169-D212 PolarHBondContact N-O 3.05Å
170	E	98.2	Very high	97.7	Very high	99 Å²	99	41.1 Å²	41.1	46%	0.463	23%	0.228	S	C	.	.	H	α-helix	trans	-66.6	-39	171.4	-77.2	164.5	138.9	0	0	111.9	M161 V166 T167 H173 A174	M161-E170 HydrophobicContact CE-CB 4.16Å; M161-E170 WeakPolarHBondContact CE-O 3.42Å; V166-E170 HydrophobicContact CG1-CB 4.15Å; T167-E170 PolarHBondContact N-OE2 3.16Å; T167-E170 PolarHBondContact O-N 3.36Å; T167-E170 WeakPolarHBondContact OG1-CB 3.34Å; T167-E170 VanDerWaalsContact OG1-CD 3.31Å; T167-E170 WeakPolarHBondContact OG1-CG 3.14Å; T167-E170 PolarHBondContact OG1-N 3.07Å; T167-E170 VanDerWaalsContact OG1-N 3.12Å; T167-E170 PolarHBondContact OG1-OE2 2.94Å; E170-H173 PolarHBondContact O-N 2.78Å; E170-A174 PolarHBondContact O-N 2.89Å; E170-A174 VanDerWaalsContact O-N 3.12Å
171	I	98.6	Very high	97.6	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.7	-49.2	174.6	-65.3	170.2	0	0	0	110.1	A158 M161 V166 T167 T168 H173 A174 V175 L216 L222 V224	A158-I171 HydrophobicContact CB-CG2 4.03Å; M161-I171 HydrophobicContact CB-CG1 4.02Å; M161-I171 HydrophobicContact CE-CG1 4.48Å; V166-I171 HydrophobicContact CG1-CD1 4.25Å; V166-I171 HydrophobicContact CG1-CG1 3.88Å; T167-I171 PolarHBondContact O-N 2.96Å; T168-I171 WeakPolarHBondContact O-CB 3.19Å; T168-I171 PolarHBondContact O-N 2.65Å; I171-H173 VanDerWaalsContact C-N 3.3Å; I171-H173 PolarHBondContact O-N 2.99Å; I171-A174 PolarHBondContact O-N 3.4Å; I171-V175 HydrophobicContact CG2-CG2 4.41Å; I171-V175 WeakPolarHBondContact O-CG2 3.22Å; I171-V175 PolarHBondContact O-N 3.03Å; I171-L216 HydrophobicContact CD1-CD1 3.87Å; I171-L222 HydrophobicContact CD1-CD2 3.78Å; I171-V224 HydrophobicContact CG2-CG1 4.41Å; I171-V224 HydrophobicContact CG2-CG2 4.42Å
172	D	98.6	Very high	97.5	Very high	3 Å²	3	39 Å²	39	2%	0.016	23%	0.226	C	C	.	.	H	α-helix	trans	-57.8	-41.3	176.8	176.6	74.6	0	0	0	112.6	T168 A174 V175 H176 K196 S197 C198 P211	T168-D172 PolarHBondContact O-N 3.33Å; D172-A174 PolarHBondContact O-N 3.26Å; D172-V175 PolarHBondContact O-N 3.21Å; D172-H176 WeakPolarHBondContact O-CB 3.46Å; D172-H176 PolarHBondContact O-N 3.11Å; D172-K196 WeakPolarHBondContact OD2-CD 3.16Å; D172-S197 VanDerWaalsContact OD1-CA 3.27Å; D172-S197 WeakPolarHBondContact OD1-CA 3.47Å; D172-S197 VanDerWaalsContact OD1-CB 3.27Å; D172-S197 WeakPolarHBondContact OD1-CB 3.39Å; D172-S197 PolarHBondContact OD1-N 2.86Å; D172-C198 PolarHBondContact OD1-N 3.43Å; D172-C198 PolarHBondContact OD1-SG 2.88Å; D172-P211 HydrophobicContact CB-CB 3.51Å; D172-P211 HydrophobicContact CB-CG 3.67Å
173	H	97.4	Very high	97.4	Very high	85 Å²	85	45.2 Å²	45.2	39%	0.394	25%	0.251	S	S	.	.	H	α-helix	trans	-62.9	-43.3	177.6	179.5	-131.5	0	0	0	111.9	E169 E170 I171 H176 L177	E169-H173 WeakPolarHBondContact O-CB 3.36Å; E169-H173 PolarHBondContact O-N 2.94Å; E170-H173 PolarHBondContact O-N 2.78Å; I171-H173 VanDerWaalsContact C-N 3.3Å; I171-H173 PolarHBondContact O-N 2.99Å; H173-H176 WeakPolarHBondContact O-CB 3.36Å; H173-H176 PolarHBondContact O-N 3.26Å; H173-L177 WeakPolarHBondContact O-CG 3.45Å; H173-L177 PolarHBondContact O-N 3.43Å
174	A	97.8	Very high	97.3	Very high	21 Å²	21	39.3 Å²	39.3	17%	0.174	23%	0.226	C	C	.	.	H	α-helix	trans	-66.5	-40.3	175.8	0	0	0	0	0	112.4	M161 E170 I171 D172 H176 L177 A178	M161-A174 HydrophobicContact CE-CB 4.05Å; M161-A174 HydrophobicContact SD-CB 3.15Å; M161-A174 WeakPolarHBondContact SD-CB 3.4Å; E170-A174 PolarHBondContact O-N 2.89Å; E170-A174 VanDerWaalsContact O-N 3.12Å; I171-A174 PolarHBondContact O-N 3.4Å; D172-A174 PolarHBondContact O-N 3.26Å; A174-H176 VanDerWaalsContact C-N 3.35Å; A174-L177 PolarHBondContact O-N 3.32Å; A174-A178 VanDerWaalsContact O-CB 3.24Å; A174-A178 WeakPolarHBondContact O-CB 3.39Å; A174-A178 PolarHBondContact O-N 3.44Å
175	V	98.3	Very high	97.3	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-58.3	-47.5	172.9	164.3	0	0	0	0	110.8	V154 A158 I171 D172 L177 A178 C179 C198 I226	V154-V175 HydrophobicContact CG1-CB 4.32Å; V154-V175 HydrophobicContact CG1-CG1 3.77Å; V154-V175 HydrophobicContact CG1-CG2 4.31Å; A158-V175 HydrophobicContact CB-CG2 3.82Å; I171-V175 HydrophobicContact CG2-CG2 4.41Å; I171-V175 WeakPolarHBondContact O-CG2 3.22Å; I171-V175 PolarHBondContact O-N 3.03Å; D172-V175 PolarHBondContact O-N 3.21Å; V175-L177 PolarHBondContact O-N 2.95Å; V175-A178 WeakPolarHBondContact O-CB 3.47Å; V175-A178 PolarHBondContact O-N 3.47Å; V175-C179 PolarHBondContact O-N 2.99Å; V175-C179 PolarHBondContact O-SG 3.03Å; V175-C179 VanDerWaalsContact O-SG 3.33Å; V175-C198 HydrophobicContact CG1-CB 3.97Å; V175-I226 HydrophobicContact CB-CD1 4.32Å; V175-I226 HydrophobicContact CG1-CD1 3.63Å; V175-I226 HydrophobicContact CG2-CD1 3.68Å
176	H	96.9	Very high	97.2	Very high	4 Å²	4	34.1 Å²	34.1	2%	0.019	18%	0.182	C	C	.	.	H	α-helix	trans	-56.5	-50.4	177.4	-176	92.8	0	0	0	111.5	T101 L103 D172 H173 A174 A178 C179 V180 S197	T101-H176 VanDerWaalsContact CG2-NE2 3.32Å; T101-H176 WeakPolarHBondContact CG2-NE2 3.41Å; L103-H176 WeakPolarHBondContact CD2-CE1 3.08Å; L103-H176 WeakPolarHBondContact CD2-NE2 3.26Å; D172-H176 WeakPolarHBondContact O-CB 3.46Å; D172-H176 PolarHBondContact O-N 3.11Å; H173-H176 WeakPolarHBondContact O-CB 3.36Å; H173-H176 PolarHBondContact O-N 3.26Å; A174-H176 VanDerWaalsContact C-N 3.35Å; H176-A178 VanDerWaalsContact C-N 3.32Å; H176-A178 PolarHBondContact O-N 3.47Å; H176-C179 WeakPolarHBondContact O-CB 3.39Å; H176-C179 PolarHBondContact O-N 3.46Å; H176-V180 WeakPolarHBondContact O-CG2 3.38Å; H176-V180 PolarHBondContact O-N 3Å; H176-S197 PolarHBondContact ND1-OG 3.06Å
177	L	95.8	Very high	97.2	Very high	90 Å²	90	33.3 Å²	33.3	47%	0.471	18%	0.177	S	C	.	.	H	α-helix	trans	-63	-38.7	177.8	-67.5	176.9	0	0	0	111.9	H173 A174 V175 V180 A181	H173-L177 WeakPolarHBondContact O-CG 3.45Å; H173-L177 PolarHBondContact O-N 3.43Å; A174-L177 PolarHBondContact O-N 3.32Å; V175-L177 PolarHBondContact O-N 2.95Å; L177-V180 PolarHBondContact O-N 2.98Å; L177-A181 WeakPolarHBondContact O-CB 3.25Å; L177-A181 PolarHBondContact O-N 2.8Å
178	A	97	Very high	97.2	Very high	9 Å²	9	32.4 Å²	32.4	7%	0.074	17%	0.172	C	C	.	.	H	α-helix	trans	-65.1	-37.8	177.9	0	0	0	0	0	112.4	V154 I157 A174 V175 H176 R182	V154-A178 HydrophobicContact CG1-CB 4.27Å; V154-A178 HydrophobicContact CG2-CB 4.08Å; I157-A178 HydrophobicContact CG2-CB 4.34Å; A174-A178 VanDerWaalsContact O-CB 3.24Å; A174-A178 WeakPolarHBondContact O-CB 3.39Å; A174-A178 PolarHBondContact O-N 3.44Å; V175-A178 WeakPolarHBondContact O-CB 3.47Å; V175-A178 PolarHBondContact O-N 3.47Å; H176-A178 VanDerWaalsContact C-N 3.32Å; H176-A178 PolarHBondContact O-N 3.47Å; A178-R182 WeakPolarHBondContact O-CG 3.32Å; A178-R182 PolarHBondContact O-N 2.84Å; A178-R182 PolarHBondContact O-NH1 3.15Å
179	C	96.8	Very high	97	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.007	17%	0.174	C	C	.	.	H	α-helix	trans	-62.8	-50.5	171.2	-70.8	0	0	0	0	111.1	V175 H176 A181 R182 K183 C184 P186 V228	V175-C179 PolarHBondContact O-N 2.99Å; V175-C179 PolarHBondContact O-SG 3.03Å; V175-C179 VanDerWaalsContact O-SG 3.33Å; H176-C179 WeakPolarHBondContact O-CB 3.39Å; H176-C179 PolarHBondContact O-N 3.46Å; C179-A181 PolarHBondContact O-N 3.15Å; C179-R182 CarbonylContact O-C 3.55Å; C179-R182 WeakPolarHBondContact O-CA 3.12Å; C179-R182 PolarHBondContact O-N 3.33Å; C179-K183 PolarHBondContact O-N 2.93Å; C179-C184 CarbonylContact C-O 3.59Å; C179-C184 HydrophobicContact CB-CB 4.39Å; C179-C184 WeakPolarHBondContact O-CB 3.46Å; C179-C184 PolarHBondContact O-N 2.78Å; C179-P186 HydrophobicContact CB-CB 4.39Å; C179-V228 VanDerWaalsContact SG-CG1 3.57Å
180	V	94.4	Very high	96.9	Very high	41 Å²	41	33.3 Å²	33.3	25%	0.248	18%	0.177	C	C	.	.	H	α-helix	trans	-60.9	-44.4	-179.6	173.5	0	0	0	0	111.5	L103 H176 L177 R182 K183	L103-V180 HydrophobicContact CD2-CG2 3.36Å; H176-V180 WeakPolarHBondContact O-CG2 3.38Å; H176-V180 PolarHBondContact O-N 3Å; L177-V180 PolarHBondContact O-N 2.98Å; V180-R182 PolarHBondContact O-N 3.1Å; V180-K183 PolarHBondContact O-N 3.42Å
181	A	95.3	Very high	96.9	Very high	82 Å²	82	30 Å²	30	68%	0.678	16%	0.161	S	C	*	.	H	α-helix	trans	-59	-29.3	177.1	0	0	0	0	0	112.4	L177 C179 K183	L177-A181 WeakPolarHBondContact O-CB 3.25Å; L177-A181 PolarHBondContact O-N 2.8Å; C179-A181 PolarHBondContact O-N 3.15Å; A181-K183 VanDerWaalsContact C-N 3.34Å
182	R	96	Very high	96.8	Very high	61 Å²	61	34.3 Å²	34.3	23%	0.23	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	9.5	176.4	-71.5	173.9	179.4	80	-3.6	113.7	L150 E153 A178 C179 V180 C184	L150-R182 HydrophobicContact CD2-CB 4.23Å; L150-R182 HydrophobicContact CD2-CG 4.18Å; E153-R182 IonicContact OE2-CZ 2.79Å; E153-R182 IonicContact OE2-NE 2.78Å; E153-R182 PolarHBondContact OE2-NE 2.92Å; E153-R182 IonicContact OE2-NH2 2.72Å; A178-R182 WeakPolarHBondContact O-CG 3.32Å; A178-R182 PolarHBondContact O-N 2.84Å; A178-R182 PolarHBondContact O-NH1 3.15Å; C179-R182 CarbonylContact O-C 3.55Å; C179-R182 WeakPolarHBondContact O-CA 3.12Å; C179-R182 PolarHBondContact O-N 3.33Å; V180-R182 PolarHBondContact O-N 3.1Å; R182-C184 PolarHBondContact O-N 3.46Å; R182-C184 PolarHBondContact O-SG 3.26Å; R182-C184 VanDerWaalsContact O-SG 3.34Å
183	K	96.1	Very high	96.6	Very high	146 Å²	146	37.5 Å²	37.5	64%	0.635	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.3	37.7	-175.9	-53.4	176.2	-178.7	176.1	0	111.9	C179 V180 A181 H230	C179-K183 PolarHBondContact O-N 2.93Å; V180-K183 PolarHBondContact O-N 3.42Å; A181-K183 VanDerWaalsContact C-N 3.34Å; K183-H230 PolarHBondContact O-ND1 2.6Å
184	C	96.4	Very high	96.6	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.176	C	C	.	.			trans	-111.9	148.6	177.2	-62.9	0	0	0	0	110.4	C179 R182 V228 Y229	C179-C184 CarbonylContact C-O 3.59Å; C179-C184 HydrophobicContact CB-CB 4.39Å; C179-C184 WeakPolarHBondContact O-CB 3.46Å; C179-C184 PolarHBondContact O-N 2.78Å; R182-C184 PolarHBondContact O-N 3.46Å; R182-C184 PolarHBondContact O-SG 3.26Å; R182-C184 VanDerWaalsContact O-SG 3.34Å; C184-V228 HydrophobicContact CB-CB 3.99Å; C184-V228 HydrophobicContact CB-CG2 4.35Å; C184-Y229 CarbonylContact C-O 3.58Å; C184-Y229 VanDerWaalsContact CA-O 3.3Å; C184-Y229 WeakPolarHBondContact CA-O 3.41Å
185	Y	97.2	Very high	96.5	Very high	6 Å²	6	34 Å²	34	2%	0.024	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	131.1	167.7	179	-82.9	0	0	0	108.8	L103 V107 F109 P110 Y112 A113 S187 L189 V228 Y229	L103-Y185 HydrophobicContact CD1-CD2 3.3Å; L103-Y185 HydrophobicContact CD1-CE2 3.21Å; L103-Y185 HydrophobicContact CD1-CG 4.32Å; V107-Y185 VanDerWaalsContact CG1-N 3.35Å; F109-Y185 AromaticContact CD1-CD2 3.41Å; F109-Y185 HydrophobicContact CD1-CD2 3.41Å; F109-Y185 VanDerWaalsContact CD1-CD2 3.41Å; F109-Y185 AromaticContact CD1-CE2 3.38Å; F109-Y185 HydrophobicContact CD1-CE2 3.38Å; F109-Y185 AromaticContact CE1-CD2 3.76Å; F109-Y185 HydrophobicContact CE1-CD2 3.76Å; F109-Y185 AromaticContact CE1-CE2 3.72Å; F109-Y185 HydrophobicContact CE1-CE2 3.72Å; F109-Y185 HydrophobicContact CG-CD2 4.13Å; F109-Y185 HydrophobicContact CG-CE2 4.42Å; P110-Y185 VanDerWaalsContact CD-CD1 3.44Å; P110-Y185 VanDerWaalsContact CD-CG 3.48Å; P110-Y185 HydrophobicContact CG-CD1 3.63Å; P110-Y185 HydrophobicContact CG-CE1 3.69Å; P110-Y185 HydrophobicContact CG-CG 4.2Å; Y112-Y185 AromaticContact CE2-CE1 3.99Å; Y112-Y185 HydrophobicContact CE2-CE1 3.99Å; A113-Y185 HydrophobicContact CB-CD2 4.45Å; A113-Y185 HydrophobicContact CB-CE1 4.19Å; A113-Y185 HydrophobicContact CB-CE2 3.56Å; A113-Y185 VanDerWaalsContact CB-CZ 3.42Å; A113-Y185 VanDerWaalsContact CB-OH 3.24Å; A113-Y185 WeakPolarHBondContact CB-OH 3.38Å; Y185-S187 PolarHBondContact O-N 3.35Å; Y185-S187 VanDerWaalsContact O-N 3.13Å; Y185-L189 HydrophobicContact CE1-CB 4.31Å; Y185-L189 PolarHBondContact OH-O 3.17Å; Y185-V228 CarbonylContact O-C 3.54Å; Y185-Y229 PolarHBondContact N-O 2.94Å; Y185-Y229 PolarHBondContact O-N 3.47Å
186	P	97.4	Very high	96.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	104.3	172.7	27.9	-31.5	0	0	0	109.7	C179 P188 L189	C179-P186 HydrophobicContact CB-CB 4.39Å; P186-P188 VanDerWaalsContact C-N 3.34Å; P186-L189 HydrophobicContact CG-CB 4.01Å; P186-L189 HydrophobicContact CG-CD2 4.11Å; P186-L189 VanDerWaalsContact O-CB 3.28Å; P186-L189 WeakPolarHBondContact O-CB 3.42Å; P186-L189 PolarHBondContact O-N 3.46Å
187	S	98.3	Very high	96.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-38	-169.1	-43.4	0	0	0	0	114.4	Y112 Y185 L189 T227 V228 Y229 H234 F305	Y112-S187 WeakPolarHBondContact CE2-O 3.14Å; Y112-S187 VanDerWaalsContact OH-CA 3.26Å; Y112-S187 WeakPolarHBondContact OH-CA 3.2Å; Y112-S187 WeakPolarHBondContact OH-CB 3.24Å; Y112-S187 PolarHBondContact OH-O 3.4Å; Y185-S187 PolarHBondContact O-N 3.35Å; Y185-S187 VanDerWaalsContact O-N 3.13Å; S187-L189 PolarHBondContact O-N 3.35Å; S187-L189 VanDerWaalsContact O-N 3.14Å; S187-T227 PolarHBondContact N-O 3.26Å; S187-T227 WeakPolarHBondContact OG-CG2 3.39Å; S187-T227 PolarHBondContact OG-O 3.43Å; S187-V228 VanDerWaalsContact OG-C 3.25Å; S187-Y229 PolarHBondContact OG-N 3.09Å; S187-H234 WeakPolarHBondContact CB-ND1 3.25Å; S187-H234 PolarHBondContact OG-ND1 2.94Å; S187-F305 VanDerWaalsContact CB-CE1 3.47Å
188	P	97.9	Very high	96.7	Very high	8 Å²	8	29.9 Å²	29.9	5%	0.052	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-29	177.5	-27.2	37.6	0	0	0	113.1	P186 N190 Y191 F194 K196 S197 T227 F305	P186-P188 VanDerWaalsContact C-N 3.34Å; P188-N190 PolarHBondContact O-N 2.83Å; P188-N190 VanDerWaalsContact O-N 3.14Å; P188-Y191 WeakPolarHBondContact O-CB 3.43Å; P188-Y191 PolarHBondContact O-N 3.03Å; P188-F194 HydrophobicContact CB-CD1 3.77Å; P188-F194 HydrophobicContact CB-CE1 3.96Å; P188-F194 WeakPolarHBondContact O-CB 3.45Å; P188-F194 WeakPolarHBondContact O-CD1 3.33Å; P188-K196 CarbonylContact C-O 3.57Å; P188-S197 WeakPolarHBondContact CD-O 3.36Å; P188-T227 WeakPolarHBondContact CD-O 3.42Å; P188-F305 HydrophobicContact CG-CZ 4.42Å
189	L	95.8	Very high	96.7	Very high	13 Å²	13	29.8 Å²	29.8	7%	0.068	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	122.8	-175.2	-173.4	64.2	0	0	0	110.8	L103 Y185 P186 S187 Y191 K196	L103-L189 HydrophobicContact CD1-CD2 3.89Å; L103-L189 HydrophobicContact CG-CD2 4.36Å; Y185-L189 HydrophobicContact CE1-CB 4.31Å; Y185-L189 PolarHBondContact OH-O 3.17Å; P186-L189 HydrophobicContact CG-CB 4.01Å; P186-L189 HydrophobicContact CG-CD2 4.11Å; P186-L189 VanDerWaalsContact O-CB 3.28Å; P186-L189 WeakPolarHBondContact O-CB 3.42Å; P186-L189 PolarHBondContact O-N 3.46Å; S187-L189 PolarHBondContact O-N 3.35Å; S187-L189 VanDerWaalsContact O-N 3.14Å; L189-Y191 PolarHBondContact O-N 2.93Å; L189-Y191 VanDerWaalsContact O-N 3.09Å; L189-K196 WeakPolarHBondContact CA-O 3.44Å; L189-K196 PolarHBondContact N-O 2.89Å
190	N	95.3	Very high	96.8	Very high	30 Å²	30	30.1 Å²	30.1	16%	0.16	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	5.1	-178	-151.4	64.5	0	0	0	115.5	K100 Y112 G119 P188 Y192 N193 F194	K100-N190 PolarHBondContact NZ-OD1 2.97Å; K100-N190 VanDerWaalsContact NZ-OD1 3.1Å; Y112-N190 PolarHBondContact O-ND2 3.33Å; G119-N190 WeakPolarHBondContact CA-O 3.43Å; P188-N190 PolarHBondContact O-N 2.83Å; P188-N190 VanDerWaalsContact O-N 3.14Å; N190-Y192 PolarHBondContact O-N 3.31Å; N190-N193 PolarHBondContact O-N 3.32Å; N190-N193 VanDerWaalsContact O-N 3.14Å; N190-F194 WeakPolarHBondContact CA-O 3.46Å; N190-F194 PolarHBondContact N-O 3.34Å
191	Y	97.2	Very high	97.1	Very high	30 Å²	30	28.3 Å²	28.3	12%	0.118	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-67.8	114.9	173	-178.8	-109.3	0	0	0	109.1	Y112 E124 P188 L189 N193 F194 F305 H306 W350	Y112-Y191 AromaticContact CD1-CD2 3.88Å; Y112-Y191 HydrophobicContact CD1-CD2 3.88Å; Y112-Y191 HydrophobicContact CD1-CE2 4.46Å; Y112-Y191 HydrophobicContact CD2-CD2 4.32Å; Y112-Y191 AromaticContact CE1-CD2 3.78Å; Y112-Y191 HydrophobicContact CE1-CD2 3.78Å; Y112-Y191 HydrophobicContact CE1-CE2 4.42Å; Y112-Y191 HydrophobicContact CE2-CD2 4.27Å; Y112-Y191 HydrophobicContact CG-CD2 4.16Å; Y112-Y191 AromaticContact CZ-CD2 4Å; E124-Y191 WeakPolarHBondContact OE2-CE2 3.32Å; E124-Y191 PolarHBondContact OE2-OH 3.42Å; E124-Y191 VanDerWaalsContact OE2-OH 3.07Å; P188-Y191 WeakPolarHBondContact O-CB 3.43Å; P188-Y191 PolarHBondContact O-N 3.03Å; L189-Y191 PolarHBondContact O-N 2.93Å; L189-Y191 VanDerWaalsContact O-N 3.09Å; Y191-N193 PolarHBondContact O-N 3.02Å; Y191-N193 VanDerWaalsContact O-N 3.1Å; Y191-F194 VanDerWaalsContact O-CB 3.3Å; Y191-F194 WeakPolarHBondContact O-CB 3.28Å; Y191-F194 PolarHBondContact O-N 2.87Å; Y191-F305 HydrophobicContact CD1-CD1 4.27Å; Y191-F305 HydrophobicContact CD1-CE1 4.22Å; Y191-F305 AromaticContact CD2-CD1 3.96Å; Y191-F305 HydrophobicContact CD2-CD1 3.96Å; Y191-F305 HydrophobicContact CE1-CD1 4.41Å; Y191-F305 HydrophobicContact CE2-CB 4.41Å; Y191-F305 HydrophobicContact CE2-CD1 4.12Å; Y191-F305 HydrophobicContact CG-CD1 4.03Å; Y191-F305 HydrophobicContact CG-CE1 4.19Å; Y191-H306 AromaticContact CE1-CE1 3.71Å; Y191-H306 AromaticContact CE1-ND1 3.69Å; Y191-H306 AromaticContact CZ-CE1 3.92Å; Y191-H306 AromaticContact CZ-ND1 3.41Å; Y191-H306 PolarHBondContact OH-ND1 3.22Å; Y191-W350 HydrophobicContact CD1-CH2 4.5Å; Y191-W350 WeakPolarHBondContact O-CH2 3.27Å; Y191-W350 WeakPolarHBondContact O-CZ2 3.37Å
192	Y	96.6	Very high	97.2	Very high	89 Å²	89	24.7 Å²	24.7	35%	0.349	12%	0.115	S	C	.	.	G	3₁₀ helix	trans	47.7	34.2	-167.2	-71.8	-93.4	0	0	0	114.1	T118 G119 M120 N190 F194 W350	T118-Y192 CarbonylContact O-C 3.4Å; T118-Y192 WeakPolarHBondContact O-CA 3.41Å; G119-Y192 WeakPolarHBondContact O-CA 3.36Å; G119-Y192 PolarHBondContact O-N 3.32Å; M120-Y192 HydrophobicContact CB-CE1 4.33Å; M120-Y192 HydrophobicContact CG-CD1 3.94Å; M120-Y192 HydrophobicContact CG-CE1 3.73Å; N190-Y192 PolarHBondContact O-N 3.31Å; Y192-F194 VanDerWaalsContact C-N 3.35Å; Y192-W350 WeakPolarHBondContact O-CZ2 3.24Å
193	N	95.3	Very high	97.4	Very high	70 Å²	70	22.9 Å²	22.9	37%	0.374	11%	0.11	S	C	.	.	G	3₁₀ helix	trans	69.3	15.2	-173.5	-68.5	-24.5	0	0	0	116.5	T118 G119 N190 Y191	T118-N193 WeakPolarHBondContact CA-ND2 3.42Å; T118-N193 WeakPolarHBondContact CA-OD1 3.44Å; T118-N193 PolarHBondContact O-N 3.44Å; T118-N193 PolarHBondContact O-OD1 3.39Å; G119-N193 PolarHBondContact N-OD1 2.97Å; N190-N193 PolarHBondContact O-N 3.32Å; N190-N193 VanDerWaalsContact O-N 3.14Å; Y191-N193 PolarHBondContact O-N 3.02Å; Y191-N193 VanDerWaalsContact O-N 3.1Å
194	F	96.9	Very high	97.5	Very high	4 Å²	4	16.4 Å²	16.4	2%	0.018	8%	0.082	C	C	.	.			trans	-52.9	131.5	169.9	-175.2	-97.9	0	0	0	110.3	P188 N190 Y191 Y192 K196 C198 I210 W350	P188-F194 HydrophobicContact CB-CD1 3.77Å; P188-F194 HydrophobicContact CB-CE1 3.96Å; P188-F194 WeakPolarHBondContact O-CB 3.45Å; P188-F194 WeakPolarHBondContact O-CD1 3.33Å; N190-F194 WeakPolarHBondContact CA-O 3.46Å; N190-F194 PolarHBondContact N-O 3.34Å; Y191-F194 VanDerWaalsContact O-CB 3.3Å; Y191-F194 WeakPolarHBondContact O-CB 3.28Å; Y191-F194 PolarHBondContact O-N 2.87Å; Y192-F194 VanDerWaalsContact C-N 3.35Å; F194-K196 HydrophobicContact CD1-CB 4.43Å; F194-K196 VanDerWaalsContact CD1-O 3.27Å; F194-K196 WeakPolarHBondContact CD1-O 3.44Å; F194-K196 HydrophobicContact CE1-CB 3.73Å; F194-K196 WeakPolarHBondContact CE1-O 3.33Å; F194-K196 HydrophobicContact CZ-CB 4.29Å; F194-C198 WeakPolarHBondContact CE1-O 3.34Å; F194-I210 HydrophobicContact CD2-CG1 4.42Å; F194-I210 HydrophobicContact CE2-CG1 3.72Å; F194-I210 HydrophobicContact CZ-CG1 4.29Å; F194-W350 HydrophobicContact CB-CD2 4.37Å; F194-W350 HydrophobicContact CB-CH2 3.89Å; F194-W350 HydrophobicContact CB-CZ2 3.63Å; F194-W350 HydrophobicContact CB-CZ3 4.38Å; F194-W350 HydrophobicContact CD2-CB 4.37Å; F194-W350 AromaticContact CD2-CD2 3.57Å; F194-W350 HydrophobicContact CD2-CD2 3.57Å; F194-W350 AromaticContact CD2-CE2 3.91Å; F194-W350 AromaticContact CD2-CE3 3.77Å; F194-W350 HydrophobicContact CD2-CE3 3.77Å; F194-W350 AromaticContact CD2-CG 3.83Å; F194-W350 HydrophobicContact CD2-CG 3.83Å; F194-W350 HydrophobicContact CD2-CZ2 4.38Å; F194-W350 HydrophobicContact CD2-CZ3 4.25Å; F194-W350 HydrophobicContact CE2-CB 4.45Å; F194-W350 HydrophobicContact CE2-CD2 4.4Å; F194-W350 HydrophobicContact CE2-CE3 4.49Å; F194-W350 HydrophobicContact CE2-CG 4.38Å; F194-W350 HydrophobicContact CG-CD2 4.46Å
195	P	95.6	Very high	97.6	Very high	30 Å²	30	16.5 Å²	16.5	20%	0.195	8%	0.083	C	C	.	.			trans	-88.1	-9.4	-161.7	31.3	-34	0	0	0	114.9	L97 I210	L97-P195 HydrophobicContact CD1-CG 4.25Å; P195-I210 HydrophobicContact CG-CD1 3.98Å; P195-I210 HydrophobicContact CG-CG1 4.33Å; P195-I210 HydrophobicContact CG-CG2 3.71Å
196	K	97.6	Very high	97.7	Very high	3 Å²	3	16.3 Å²	16.3	1%	0.013	8%	0.082	C	C	.	.	S	Bend	trans	-126.2	174.2	-169	-63.9	-67.5	-176.3	158	0	112.1	N98 E169 D172 P188 L189 F194 I210 P211	N98-K196 VanDerWaalsContact CG-NZ 3.33Å; N98-K196 PolarHBondContact OD1-NZ 3.23Å; E169-K196 IonicContact OE1-NZ 2.84Å; E169-K196 PolarHBondContact OE1-NZ 3.01Å; D172-K196 WeakPolarHBondContact OD2-CD 3.16Å; P188-K196 CarbonylContact C-O 3.57Å; L189-K196 WeakPolarHBondContact CA-O 3.44Å; L189-K196 PolarHBondContact N-O 2.89Å; F194-K196 HydrophobicContact CD1-CB 4.43Å; F194-K196 VanDerWaalsContact CD1-O 3.27Å; F194-K196 WeakPolarHBondContact CD1-O 3.44Å; F194-K196 HydrophobicContact CE1-CB 3.73Å; F194-K196 WeakPolarHBondContact CE1-O 3.33Å; F194-K196 HydrophobicContact CZ-CB 4.29Å; K196-I210 HydrophobicContact CG-CG2 3.79Å; K196-P211 HydrophobicContact CB-CB 4.37Å; K196-P211 HydrophobicContact CB-CG 3.87Å; K196-P211 HydrophobicContact CD-CB 4.26Å; K196-P211 WeakPolarHBondContact CE-O 3.27Å; K196-P211 HydrophobicContact CG-CB 4.04Å; K196-P211 HydrophobicContact CG-CG 4.05Å
197	S	97.9	Very high	97.8	Very high	4 Å²	4	16.4 Å²	16.4	3%	0.028	8%	0.083	C	C	.	.	S	Bend	trans	-94	-18.5	-173	-52.4	0	0	0	0	113.5	D172 H176 P188	D172-S197 VanDerWaalsContact OD1-CA 3.27Å; D172-S197 WeakPolarHBondContact OD1-CA 3.47Å; D172-S197 VanDerWaalsContact OD1-CB 3.27Å; D172-S197 WeakPolarHBondContact OD1-CB 3.39Å; D172-S197 PolarHBondContact OD1-N 2.86Å; H176-S197 PolarHBondContact ND1-OG 3.06Å; P188-S197 WeakPolarHBondContact CD-O 3.36Å
198	C	98.8	Very high	97.8	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.093	C	C	.	.	S	Bend	trans	-142.5	172.8	170.1	59	0	0	0	0	111.3	D172 V175 F194 P211 D225 I226	D172-C198 PolarHBondContact OD1-N 3.43Å; D172-C198 PolarHBondContact OD1-SG 2.88Å; V175-C198 HydrophobicContact CG1-CB 3.97Å; F194-C198 WeakPolarHBondContact CE1-O 3.34Å; C198-P211 VanDerWaalsContact O-CD 3.26Å; C198-P211 WeakPolarHBondContact O-CD 3.33Å; C198-P211 VanDerWaalsContact O-CG 3.27Å; C198-P211 WeakPolarHBondContact O-CG 3.46Å; C198-D225 WeakPolarHBondContact CB-O 3.27Å; C198-I226 HydrophobicContact CB-CD1 3.71Å
199	C	98.9	Very high	97.8	Very high	8 Å²	8	18.3 Å²	18.3	5%	0.054	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	142.9	167.4	-48.1	0	0	0	0	110.1	G209 V224 D225	C199-G209 WeakPolarHBondContact CA-O 3.23Å; C199-V224 WeakPolarHBondContact O-CA 3.44Å; C199-D225 HydrophobicContact CB-CB 3.97Å; C199-D225 PolarHBondContact N-O 3.18Å; C199-D225 PolarHBondContact O-N 3.36Å
200	T	98.9	Very high	98	Very high	7 Å²	7	18.4 Å²	18.4	4%	0.043	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	103.8	176.1	51.4	0	0	0	0	109.4	T168 G209 P211 L222 N223 V224	T168-T200 VanDerWaalsContact CB-OG1 3.28Å; T168-T200 WeakPolarHBondContact CB-OG1 3.36Å; T168-T200 HydrophobicContact CG2-CG2 4.09Å; T200-G209 PolarHBondContact N-O 2.88Å; T200-G209 WeakPolarHBondContact O-CA 3.47Å; T200-P211 HydrophobicContact CG2-CG 4.03Å; T200-P211 WeakPolarHBondContact OG1-CA 3.23Å; T200-L222 HydrophobicContact CG2-CD1 4.42Å; T200-N223 CarbonylContact C-O 3.35Å; T200-N223 WeakPolarHBondContact CA-O 3.15Å; T200-V224 HydrophobicContact CG2-CG2 4.45Å
201	S	98.9	Very high	98.1	Very high	4 Å²	4	17 Å²	17	3%	0.028	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	101.8	-169.6	-55.4	0	0	0	0	109.8	C207 G209 N223	S201-C207 WeakPolarHBondContact OG-CA 3.47Å; S201-G209 PolarHBondContact OG-N 2.84Å; S201-N223 PolarHBondContact N-O 2.77Å; S201-N223 PolarHBondContact O-N 3.38Å
202	V	98.9	Very high	98.2	Very high	5 Å²	5	16.3 Å²	16.3	3%	0.03	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	133.9	-177.1	179.8	0	0	0	0	110.8	L91 T168 E204 V205 L216 D220 I221 L222	L91-V202 HydrophobicContact CD1-CB 4.31Å; L91-V202 HydrophobicContact CD1-CG1 4.15Å; L91-V202 HydrophobicContact CD2-CB 4.24Å; T168-V202 HydrophobicContact CG2-CG2 4.3Å; V202-E204 PolarHBondContact O-N 3.02Å; V202-E204 VanDerWaalsContact O-N 3.07Å; V202-V205 WeakPolarHBondContact O-CB 3.44Å; V202-V205 WeakPolarHBondContact O-CG2 3.37Å; V202-V205 PolarHBondContact O-N 3.24Å; V202-L216 HydrophobicContact CG2-CD2 3.91Å; V202-D220 HydrophobicContact CG1-CB 4.2Å; V202-I221 WeakPolarHBondContact CA-O 3.3Å; V202-L222 HydrophobicContact CG2-CB 4.48Å; V202-L222 HydrophobicContact CG2-CD1 3.54Å
203	N	98.7	Very high	98.2	Very high	23 Å²	23	16.4 Å²	16.4	12%	0.123	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	51	-106.4	170.1	-62.2	-30.5	0	0	0	114.4	V205 D220 I221 R359 S360	N203-V205 PolarHBondContact O-N 3.45Å; N203-D220 PolarHBondContact ND2-OD1 3.46Å; N203-I221 PolarHBondContact N-O 3.19Å; N203-I221 PolarHBondContact OD1-N 2.86Å; N203-R359 HydrophobicContact CB-CG 4.16Å; N203-R359 CarbonylContact O-C 3.49Å; N203-R359 VanDerWaalsContact O-CA 3.3Å; N203-R359 WeakPolarHBondContact O-CA 3.24Å; N203-S360 PolarHBondContact O-N 2.87Å
204	E	98.8	Very high	98.3	Very high	10 Å²	10	13.9 Å²	13.9	5%	0.047	7%	0.068	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-7.8	-178.1	67.4	-94.6	-136.4	0	0	114.7	G89 K90 L91 V202 I206 V353 T354 K358	G89-E204 WeakPolarHBondContact CA-OE1 3.49Å; K90-E204 PolarHBondContact N-OE1 2.91Å; L91-E204 HydrophobicContact CB-CG 4.49Å; L91-E204 WeakPolarHBondContact CB-OE1 3.24Å; L91-E204 PolarHBondContact N-OE1 3.26Å; V202-E204 PolarHBondContact O-N 3.02Å; V202-E204 VanDerWaalsContact O-N 3.07Å; E204-I206 PolarHBondContact O-N 3.01Å; E204-V353 WeakPolarHBondContact O-CA 3.44Å; E204-T354 PolarHBondContact O-N 3.18Å; E204-K358 VanDerWaalsContact CA-O 3.3Å; E204-K358 WeakPolarHBondContact CA-O 3.36Å; E204-K358 WeakPolarHBondContact CB-O 3.32Å
205	V	98.9	Very high	98.4	Very high	3 Å²	3	15.6 Å²	15.6	2%	0.018	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	117.9	172.7	-175.8	0	0	0	0	108.8	L91 V202 N203 T351 A352 V353	L91-V205 HydrophobicContact CD2-CG2 3.33Å; V202-V205 WeakPolarHBondContact O-CB 3.44Å; V202-V205 WeakPolarHBondContact O-CG2 3.37Å; V202-V205 PolarHBondContact O-N 3.24Å; N203-V205 PolarHBondContact O-N 3.45Å; V205-T351 HydrophobicContact CB-CG2 4.47Å; V205-T351 HydrophobicContact CG1-CG2 3.72Å; V205-T351 HydrophobicContact CG2-CG2 3.89Å; V205-A352 CarbonylContact C-O 3.59Å; V205-A352 WeakPolarHBondContact CA-O 3.37Å; V205-V353 HydrophobicContact CG2-CG1 3.98Å
206	I	98.9	Very high	98.5	Very high	2 Å²	2	14.3 Å²	14.3	1%	0.01	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	-53	179.9	-69	169.6	0	0	0	110.3	E204 V293 M334 D343 A352 T354	E204-I206 PolarHBondContact O-N 3.01Å; I206-V293 HydrophobicContact CD1-CG2 4.01Å; I206-V293 HydrophobicContact CG1-CG2 4.32Å; I206-V293 HydrophobicContact CG2-CB 4.48Å; I206-V293 HydrophobicContact CG2-CG1 4.15Å; I206-V293 HydrophobicContact CG2-CG2 3.82Å; I206-M334 HydrophobicContact CG2-CB 3.9Å; I206-M334 HydrophobicContact CG2-CG 3.9Å; I206-M334 HydrophobicContact CG2-SD 3.59Å; I206-M334 VanDerWaalsContact CG2-SD 3.59Å; I206-D343 HydrophobicContact CD1-CB 3.53Å; I206-A352 HydrophobicContact CB-CB 4.35Å; I206-A352 PolarHBondContact N-O 3.04Å; I206-T354 HydrophobicContact CD1-CG2 3.9Å; I206-T354 HydrophobicContact CG1-CG2 3.72Å
207	C	98.9	Very high	98.6	Very high	2 Å²	2	19.8 Å²	19.8	1%	0.014	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	170.7	-179.8	63	0	0	0	0	110.5	S201 G209 M334 A352	S201-C207 WeakPolarHBondContact OG-CA 3.47Å; C207-G209 PolarHBondContact O-N 3.11Å; C207-G209 VanDerWaalsContact O-N 3.11Å; C207-M334 HydrophobicContact CB-SD 3.96Å; C207-A352 PolarHBondContact O-N 3.16Å; C207-A352 VanDerWaalsContact O-N 3.16Å
208	H	98.8	Very high	98.6	Very high	44 Å²	44	24.6 Å²	24.6	20%	0.204	13%	0.126	C	C	.	.			trans	56.7	25.4	174.7	-51.2	154.1	0	0	0	115.4	I210 Y296 W350	H208-I210 PolarHBondContact O-N 2.63Å; H208-Y296 AromaticContact CE1-CD1 3.87Å; H208-Y296 AromaticContact CE1-CE1 3.62Å; H208-Y296 AromaticContact ND1-CE1 3.76Å; H208-W350 HydrophobicContact CB-CE3 4.45Å; H208-W350 WeakPolarHBondContact CB-O 3.08Å
209	G	98.8	Very high	98.6	Very high	3 Å²	3	25.8 Å²	25.8	3%	0.031	14%	0.138	C	C	.	.	P	Polyproline II helix	trans	-59.3	127.7	171.2	0	0	0	0	0	110.5	C199 T200 S201 C207 P211	C199-G209 WeakPolarHBondContact CA-O 3.23Å; T200-G209 PolarHBondContact N-O 2.88Å; T200-G209 WeakPolarHBondContact O-CA 3.47Å; S201-G209 PolarHBondContact OG-N 2.84Å; C207-G209 PolarHBondContact O-N 3.11Å; C207-G209 VanDerWaalsContact O-N 3.11Å; G209-P211 WeakPolarHBondContact O-CD 3.29Å
210	I	98.8	Very high	98.6	Very high	16 Å²	16	25.8 Å²	25.8	8%	0.082	14%	0.138	C	C	.	.	P	Polyproline II helix	trans	-79.9	122.7	-179.9	-62	173.6	0	0	0	109.3	L97 F194 P195 K196 H208 D212 D348 W350	L97-I210 HydrophobicContact CD1-CG2 3.78Å; L97-I210 HydrophobicContact CD2-CG2 4.44Å; F194-I210 HydrophobicContact CD2-CG1 4.42Å; F194-I210 HydrophobicContact CE2-CG1 3.72Å; F194-I210 HydrophobicContact CZ-CG1 4.29Å; P195-I210 HydrophobicContact CG-CD1 3.98Å; P195-I210 HydrophobicContact CG-CG1 4.33Å; P195-I210 HydrophobicContact CG-CG2 3.71Å; K196-I210 HydrophobicContact CG-CG2 3.79Å; H208-I210 PolarHBondContact O-N 2.63Å; I210-D212 PolarHBondContact O-N 3.35Å; I210-D348 HydrophobicContact CD1-CB 3.84Å; I210-W350 HydrophobicContact CD1-CB 4.04Å; I210-W350 HydrophobicContact CD1-CG 4.38Å; I210-W350 HydrophobicContact CG1-CB 4.19Å
211	P	98.6	Very high	98.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.136	C	C	.	.	P	Polyproline II helix	trans	-51.2	127.7	171.5	-29.4	32.9	0	0	0	113.5	D172 K196 C198 T200 G209	D172-P211 HydrophobicContact CB-CB 3.51Å; D172-P211 HydrophobicContact CB-CG 3.67Å; K196-P211 HydrophobicContact CB-CB 4.37Å; K196-P211 HydrophobicContact CB-CG 3.87Å; K196-P211 HydrophobicContact CD-CB 4.26Å; K196-P211 WeakPolarHBondContact CE-O 3.27Å; K196-P211 HydrophobicContact CG-CB 4.04Å; K196-P211 HydrophobicContact CG-CG 4.05Å; C198-P211 VanDerWaalsContact O-CD 3.26Å; C198-P211 WeakPolarHBondContact O-CD 3.33Å; C198-P211 VanDerWaalsContact O-CG 3.27Å; C198-P211 WeakPolarHBondContact O-CG 3.46Å; T200-P211 HydrophobicContact CG2-CG 4.03Å; T200-P211 WeakPolarHBondContact OG1-CA 3.23Å; G209-P211 WeakPolarHBondContact O-CD 3.29Å
212	D	98	Very high	98.6	Very high	16 Å²	16	25.3 Å²	25.3	9%	0.086	13%	0.134	C	C	.	.			trans	-145.1	-173.6	-171.9	75.2	8.1	0	0	0	112.5	P93 H94 L97 T168 E169 I210 R214	P93-D212 WeakPolarHBondContact CA-OD2 3.3Å; H94-D212 HydrophobicContact CB-CB 4.44Å; H94-D212 PolarHBondContact N-OD2 2.81Å; L97-D212 HydrophobicContact CD2-CB 3.62Å; T168-D212 PolarHBondContact OG1-N 3.32Å; T168-D212 PolarHBondContact OG1-O 2.66Å; T168-D212 VanDerWaalsContact OG1-O 3.12Å; T168-D212 PolarHBondContact OG1-OD1 2.96Å; E169-D212 WeakPolarHBondContact CB-O 3.49Å; E169-D212 PolarHBondContact N-O 3.05Å; I210-D212 PolarHBondContact O-N 3.35Å; D212-R214 PolarHBondContact O-N 2.74Å; D212-R214 WeakPolarHBondContact OD1-CB 3.48Å; D212-R214 PolarHBondContact OD1-N 2.76Å
213	R	97.2	Very high	98.6	Very high	91 Å²	91	25.3 Å²	25.3	34%	0.343	13%	0.134	S	C	.	.	S	Bend	trans	-76.8	6.9	-176.3	-56.9	174.7	74.3	91.9	0.8	113.6	D76 H94 P96 T167 A215	D76-R213 IonicContact OD1-CZ 3.75Å; D76-R213 IonicContact OD1-NE 3.36Å; D76-R213 PolarHBondContact OD1-NE 3.18Å; D76-R213 IonicContact OD1-NH2 2.92Å; D76-R213 PolarHBondContact OD1-NH2 3.11Å; D76-R213 IonicContact OD2-CZ 2.92Å; D76-R213 IonicContact OD2-NH2 3.77Å; D76-R213 PolarHBondContact OD2-NH2 2.95Å; H94-R213 HydrophobicContact CB-CB 3.94Å; H94-R213 WeakPolarHBondContact O-CB 3.47Å; H94-R213 PolarHBondContact O-N 2.89Å; H94-R213 VanDerWaalsContact O-N 3.09Å; P96-R213 WeakPolarHBondContact O-CD 3.23Å; T167-R213 WeakPolarHBondContact CG2-O 3.38Å; R213-A215 PolarHBondContact O-N 3.04Å
214	R	97.5	Very high	98.6	Very high	16 Å²	16	24.2 Å²	24.2	6%	0.06	13%	0.128	C	C	.	.	P	Polyproline II helix	trans	-72.1	116.6	-179.7	-174.9	-174.7	172.7	-88.7	8.5	109.8	L91 H94 T167 T168 D212 D220	L91-R214 VanDerWaalsContact CD1-CD 3.44Å; H94-R214 HydrophobicContact CB-CB 4.1Å; T167-R214 VanDerWaalsContact CA-O 3.31Å; T167-R214 WeakPolarHBondContact CA-O 3.25Å; T168-R214 PolarHBondContact N-O 3Å; D212-R214 PolarHBondContact O-N 2.74Å; D212-R214 WeakPolarHBondContact OD1-CB 3.48Å; D212-R214 PolarHBondContact OD1-N 2.76Å; R214-D220 IonicContact CZ-OD2 3.99Å; R214-D220 VanDerWaalsContact CZ-OD2 3.24Å; R214-D220 IonicContact NH1-OD2 2.65Å; R214-D220 PolarHBondContact NH1-OD2 3.47Å; R214-D220 IonicContact NH2-OD1 2.87Å; R214-D220 PolarHBondContact NH2-OD1 2.86Å; R214-D220 IonicContact NH2-OD2 3.1Å; R214-D220 PolarHBondContact NH2-OD2 3.35Å
215	A	98.3	Very high	98.6	Very high	41 Å²	41	24.4 Å²	24.4	34%	0.339	13%	0.13	S	C	.	.	B	Isolated β-bridge	trans	-67.3	131.8	166.7	0	0	0	0	0	110.7	T167 R213	T167-A215 HydrophobicContact CG2-CB 4.4Å; R213-A215 PolarHBondContact O-N 3.04Å
216	L	98.8	Very high	98.6	Very high	3 Å²	3	24.4 Å²	24.4	2%	0.016	13%	0.129	C	C	.	.	P	Polyproline II helix	trans	-61.1	140.6	172.6	-63.6	172.8	0	0	0	110.5	V162 P164 G165 V166 T168 I171 V202 L222 V243	V162-L216 HydrophobicContact CG1-CD1 4.45Å; P164-L216 WeakPolarHBondContact CA-O 3.39Å; G165-L216 PolarHBondContact N-O 2.81Å; V166-L216 WeakPolarHBondContact O-CB 3.46Å; V166-L216 VanDerWaalsContact O-CG 3.25Å; V166-L216 WeakPolarHBondContact O-CG 3.21Å; V166-L216 PolarHBondContact O-N 3.07Å; T168-L216 HydrophobicContact CG2-CD2 4.13Å; I171-L216 HydrophobicContact CD1-CD1 3.87Å; V202-L216 HydrophobicContact CG2-CD2 3.91Å; L216-L222 HydrophobicContact CD1-CD2 3.75Å; L216-L222 HydrophobicContact CD2-CB 4.37Å; L216-L222 HydrophobicContact CD2-CD1 4.42Å; L216-L222 HydrophobicContact CD2-CD2 3.95Å; L216-L222 HydrophobicContact CD2-CG 4.48Å; L216-L222 HydrophobicContact CG-CD2 4.49Å; L216-V243 HydrophobicContact CB-CG1 3.82Å; L216-V243 HydrophobicContact CB-CG2 4.3Å; L216-V243 HydrophobicContact CD1-CG2 4.19Å; L216-V243 HydrophobicContact CD2-CG2 4.37Å
217	Q	98.8	Very high	98.6	Very high	117 Å²	117	24.5 Å²	24.5	55%	0.547	13%	0.13	S	C	.	.			trans	-108.1	146.5	-178.7	-61.2	-178.5	3.6	0	0	110.2	G219 D220 V243	Q217-G219 PolarHBondContact O-N 2.75Å; Q217-D220 PolarHBondContact N-OD2 3.41Å; Q217-D220 VanDerWaalsContact O-CB 3.27Å; Q217-D220 WeakPolarHBondContact O-CB 3.37Å; Q217-D220 PolarHBondContact O-N 3.37Å; Q217-V243 WeakPolarHBondContact O-CB 3.28Å; Q217-V243 VanDerWaalsContact O-CG1 3.23Å; Q217-V243 WeakPolarHBondContact O-CG1 2.97Å
218	D	98.6	Very high	98.6	Very high	105 Å²	105	24.4 Å²	24.4	56%	0.561	13%	0.13	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	130.7	170.3	-172.5	66.3	0	0	0	109.8	P164 G244 E245	P164-D218 HydrophobicContact CG-CB 4.02Å; D218-G244 WeakPolarHBondContact OD1-CA 3.44Å; D218-E245 PolarHBondContact OD1-N 2.98Å
219	G	98.4	Very high	98.6	Very high	25 Å²	25	23.7 Å²	23.7	26%	0.258	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.6	-4.1	-174.3	0	0	0	0	0	115.7	Q217 V243 E245	Q217-G219 PolarHBondContact O-N 2.75Å; G219-V243 PolarHBondContact N-O 3.13Å; G219-E245 VanDerWaalsContact CA-O 3.25Å; G219-E245 WeakPolarHBondContact CA-O 3.36Å; G219-E245 PolarHBondContact N-O 3.44Å
220	D	98.8	Very high	98.5	Very high	9 Å²	9	24.9 Å²	24.9	5%	0.048	13%	0.13	C	C	.	.			trans	-67.2	151.5	169.3	-76.4	-20.6	0	0	0	111	V202 N203 R214 Q217 V243 V246	V202-D220 HydrophobicContact CG1-CB 4.2Å; N203-D220 PolarHBondContact ND2-OD1 3.46Å; R214-D220 IonicContact CZ-OD2 3.99Å; R214-D220 VanDerWaalsContact CZ-OD2 3.24Å; R214-D220 IonicContact NH1-OD2 2.65Å; R214-D220 PolarHBondContact NH1-OD2 3.47Å; R214-D220 IonicContact NH2-OD1 2.87Å; R214-D220 PolarHBondContact NH2-OD1 2.86Å; R214-D220 IonicContact NH2-OD2 3.1Å; R214-D220 PolarHBondContact NH2-OD2 3.35Å; Q217-D220 PolarHBondContact N-OD2 3.41Å; Q217-D220 VanDerWaalsContact O-CB 3.27Å; Q217-D220 WeakPolarHBondContact O-CB 3.37Å; Q217-D220 PolarHBondContact O-N 3.37Å; D220-V243 HydrophobicContact CB-CB 3.93Å; D220-V243 HydrophobicContact CB-CG2 3.78Å; D220-V243 WeakPolarHBondContact O-CB 3.45Å; D220-V243 PolarHBondContact O-N 3.36Å; D220-V246 WeakPolarHBondContact O-CG1 3.26Å
221	I	98.9	Very high	98.4	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	139.7	154.2	65.2	176.5	0	0	0	109.2	V202 N203 T240 F241 F242 V246 A250 L253 V254 R359 S360 A361	V202-I221 WeakPolarHBondContact CA-O 3.3Å; N203-I221 PolarHBondContact N-O 3.19Å; N203-I221 PolarHBondContact OD1-N 2.86Å; I221-T240 HydrophobicContact CB-CG2 3.99Å; I221-T240 HydrophobicContact CD1-CG2 4.36Å; I221-T240 HydrophobicContact CG1-CG2 4.46Å; I221-F241 WeakPolarHBondContact CA-O 3.41Å; I221-F242 HydrophobicContact CG2-CD1 4.02Å; I221-F242 HydrophobicContact CG2-CE1 4.42Å; I221-V246 HydrophobicContact CG2-CG1 4.29Å; I221-A250 HydrophobicContact CG2-CB 3.73Å; I221-L253 HydrophobicContact CD1-CD2 3.83Å; I221-V254 HydrophobicContact CD1-CG2 4.22Å; I221-V254 HydrophobicContact CG2-CG2 4.18Å; I221-R359 HydrophobicContact CD1-CB 4.07Å; I221-R359 HydrophobicContact CD1-CG 4.46Å; I221-S360 WeakPolarHBondContact CD1-O 3.37Å; I221-A361 HydrophobicContact CD1-CB 4.35Å
222	L	98.9	Very high	98.3	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	122	-179.4	168	68.8	0	0	0	109.3	V162 T168 I171 T200 V202 L216 V224 T240 F241 V243	V162-L222 HydrophobicContact CG1-CD2 4.34Å; V162-L222 HydrophobicContact CG2-CD2 4.16Å; T168-L222 HydrophobicContact CG2-CD1 4.3Å; I171-L222 HydrophobicContact CD1-CD2 3.78Å; T200-L222 HydrophobicContact CG2-CD1 4.42Å; V202-L222 HydrophobicContact CG2-CB 4.48Å; V202-L222 HydrophobicContact CG2-CD1 3.54Å; L216-L222 HydrophobicContact CD1-CD2 3.75Å; L216-L222 HydrophobicContact CD2-CB 4.37Å; L216-L222 HydrophobicContact CD2-CD1 4.42Å; L216-L222 HydrophobicContact CD2-CD2 3.95Å; L216-L222 HydrophobicContact CD2-CG 4.48Å; L216-L222 HydrophobicContact CG-CD2 4.49Å; L222-V224 HydrophobicContact CD1-CG2 4.43Å; L222-V224 HydrophobicContact CD2-CG2 3.84Å; L222-V224 HydrophobicContact CG-CG2 3.93Å; L222-T240 CarbonylContact O-C 3.58Å; L222-T240 WeakPolarHBondContact O-CA 3.3Å; L222-F241 PolarHBondContact N-O 2.91Å; L222-F241 WeakPolarHBondContact O-CD2 3.49Å; L222-F241 PolarHBondContact O-N 3.36Å; L222-V243 HydrophobicContact CB-CG2 4.22Å
223	N	98.9	Very high	98.4	Very high	5 Å²	5	29.4 Å²	29.4	3%	0.027	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	136.7	161.6	176.1	-82.5	0	0	0	110.4	T200 S201 N238 E239 Q362	T200-N223 CarbonylContact C-O 3.35Å; T200-N223 WeakPolarHBondContact CA-O 3.15Å; S201-N223 PolarHBondContact N-O 2.77Å; S201-N223 PolarHBondContact O-N 3.38Å; N223-N238 PolarHBondContact ND2-OD1 3.25Å; N223-E239 WeakPolarHBondContact CA-O 3.28Å; N223-E239 PolarHBondContact ND2-O 2.87Å; N223-Q362 PolarHBondContact ND2-O 2.99Å
224	V	98.9	Very high	98.4	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	123.2	168.8	-172.7	0	0	0	0	108.9	L155 A158 I171 C199 T200 L222 I226 N238 E239 F241	L155-V224 HydrophobicContact CD1-CB 4.15Å; L155-V224 HydrophobicContact CD1-CG1 4.43Å; L155-V224 WeakPolarHBondContact CD1-O 3.23Å; A158-V224 HydrophobicContact CB-CG1 4.01Å; I171-V224 HydrophobicContact CG2-CG1 4.41Å; I171-V224 HydrophobicContact CG2-CG2 4.42Å; C199-V224 WeakPolarHBondContact O-CA 3.44Å; T200-V224 HydrophobicContact CG2-CG2 4.45Å; L222-V224 HydrophobicContact CD1-CG2 4.43Å; L222-V224 HydrophobicContact CD2-CG2 3.84Å; L222-V224 HydrophobicContact CG-CG2 3.93Å; V224-I226 HydrophobicContact CG1-CD1 3.83Å; V224-I226 HydrophobicContact CG1-CG1 4.22Å; V224-N238 WeakPolarHBondContact O-CA 3.35Å; V224-N238 WeakPolarHBondContact O-CB 3.47Å; V224-E239 PolarHBondContact N-O 3.18Å; V224-E239 VanDerWaalsContact N-O 3.11Å; V224-E239 PolarHBondContact O-N 2.9Å; V224-F241 HydrophobicContact CB-CE2 4.02Å; V224-F241 HydrophobicContact CG2-CD2 4.16Å; V224-F241 HydrophobicContact CG2-CE2 3.94Å
225	D	98.9	Very high	98.5	Very high	14 Å²	14	24.5 Å²	24.5	8%	0.075	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	122.7	-176	-166.3	-9	0	0	0	111.7	C198 C199 N238	C198-D225 WeakPolarHBondContact CB-O 3.27Å; C199-D225 HydrophobicContact CB-CB 3.97Å; C199-D225 PolarHBondContact N-O 3.18Å; C199-D225 PolarHBondContact O-N 3.36Å; D225-N238 HydrophobicContact CB-CB 3.74Å
226	I	98.9	Very high	98.5	Very high	2 Å²	2	22.7 Å²	22.7	1%	0.01	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	113.4	-167.7	-58.2	-62.5	0	0	0	110	V154 L155 V175 C198 V224 V228 L237	V154-I226 HydrophobicContact CB-CG2 3.96Å; V154-I226 HydrophobicContact CG1-CD1 4.18Å; V154-I226 HydrophobicContact CG1-CG2 3.73Å; L155-I226 HydrophobicContact CB-CB 4.39Å; L155-I226 HydrophobicContact CB-CG1 3.92Å; L155-I226 HydrophobicContact CD1-CG1 3.8Å; L155-I226 HydrophobicContact CG-CG1 4.45Å; V175-I226 HydrophobicContact CB-CD1 4.32Å; V175-I226 HydrophobicContact CG1-CD1 3.63Å; V175-I226 HydrophobicContact CG2-CD1 3.68Å; C198-I226 HydrophobicContact CB-CD1 3.71Å; V224-I226 HydrophobicContact CG1-CD1 3.83Å; V224-I226 HydrophobicContact CG1-CG1 4.22Å; I226-V228 HydrophobicContact CG2-CG1 4.01Å; I226-L237 HydrophobicContact CB-CD2 4Å; I226-L237 HydrophobicContact CG2-CD2 4.23Å; I226-L237 PolarHBondContact N-O 2.91Å; I226-L237 WeakPolarHBondContact O-CD2 3.47Å; I226-L237 PolarHBondContact O-N 2.81Å; I226-L237 VanDerWaalsContact O-N 3.15Å
227	T	98.9	Very high	98.5	Very high	5 Å²	5	22.6 Å²	22.6	3%	0.031	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	129.1	164.2	-29.7	0	0	0	0	111	S187 P188 H234 G235 D236 I301 F305	S187-T227 PolarHBondContact N-O 3.26Å; S187-T227 WeakPolarHBondContact OG-CG2 3.39Å; S187-T227 PolarHBondContact OG-O 3.43Å; P188-T227 WeakPolarHBondContact CD-O 3.42Å; T227-H234 HydrophobicContact CG2-CB 4.16Å; T227-G235 VanDerWaalsContact CA-O 3.29Å; T227-G235 WeakPolarHBondContact CA-O 3.45Å; T227-G235 WeakPolarHBondContact CG2-O 3.04Å; T227-D236 WeakPolarHBondContact CB-OD1 3.38Å; T227-D236 HydrophobicContact CG2-CB 4.01Å; T227-D236 PolarHBondContact OG1-OD1 3.05Å; T227-D236 PolarHBondContact OG1-OD2 3.38Å; T227-I301 HydrophobicContact CG2-CD1 4.37Å; T227-F305 HydrophobicContact CG2-CD2 3.89Å; T227-F305 HydrophobicContact CG2-CE2 3.38Å; T227-F305 HydrophobicContact CG2-CZ 3.73Å; T227-F305 VanDerWaalsContact OG1-CE2 3.26Å; T227-F305 WeakPolarHBondContact OG1-CE2 3.43Å; T227-F305 WeakPolarHBondContact OG1-CZ 3.45Å
228	V	98.6	Very high	98.5	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	147.9	174.9	-47	0	0	0	0	111.1	V147 L150 A151 V154 C179 C184 Y185 S187 I226 H234 G235	V147-V228 HydrophobicContact CG2-CG2 3.58Å; V147-V228 VanDerWaalsContact CG2-O 3.23Å; V147-V228 WeakPolarHBondContact CG2-O 3.25Å; L150-V228 HydrophobicContact CB-CG2 4.31Å; A151-V228 HydrophobicContact CB-CG1 4.28Å; A151-V228 HydrophobicContact CB-CG2 3.8Å; V154-V228 HydrophobicContact CB-CG1 4.49Å; V154-V228 HydrophobicContact CG2-CG1 4.25Å; C179-V228 VanDerWaalsContact SG-CG1 3.57Å; C184-V228 HydrophobicContact CB-CB 3.99Å; C184-V228 HydrophobicContact CB-CG2 4.35Å; Y185-V228 CarbonylContact O-C 3.54Å; S187-V228 VanDerWaalsContact OG-C 3.25Å; I226-V228 HydrophobicContact CG2-CG1 4.01Å; V228-H234 CarbonylContact O-C 3.54Å; V228-H234 VanDerWaalsContact O-CA 3.27Å; V228-H234 WeakPolarHBondContact O-CA 3.43Å; V228-G235 PolarHBondContact N-O 3.36Å; V228-G235 PolarHBondContact O-N 3.12Å
229	Y	98.6	Very high	98.6	Very high	28 Å²	28	12.2 Å²	12.2	11%	0.11	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	125.1	176.3	176	-100.2	0	0	0	110.6	T108 P110 C184 Y185 S187 G232 F233 H234	T108-Y229 HydrophobicContact CG2-CE1 4.04Å; T108-Y229 WeakPolarHBondContact O-CD1 3.36Å; T108-Y229 WeakPolarHBondContact O-CE1 3.45Å; P110-Y229 HydrophobicContact CB-CD1 4.31Å; P110-Y229 HydrophobicContact CB-CD2 4.45Å; P110-Y229 HydrophobicContact CB-CE1 4.22Å; P110-Y229 HydrophobicContact CB-CE2 4.36Å; P110-Y229 HydrophobicContact CB-CG 4.38Å; P110-Y229 HydrophobicContact CG-CD1 4.41Å; C184-Y229 CarbonylContact C-O 3.58Å; C184-Y229 VanDerWaalsContact CA-O 3.3Å; C184-Y229 WeakPolarHBondContact CA-O 3.41Å; Y185-Y229 PolarHBondContact N-O 2.94Å; Y185-Y229 PolarHBondContact O-N 3.47Å; S187-Y229 PolarHBondContact OG-N 3.09Å; Y229-G232 WeakPolarHBondContact OH-CA 3.4Å; Y229-F233 CarbonylContact C-O 3.52Å; Y229-F233 VanDerWaalsContact CA-O 3.23Å; Y229-F233 WeakPolarHBondContact CA-O 3.41Å; Y229-F233 VanDerWaalsContact CD2-O 3.25Å; Y229-F233 WeakPolarHBondContact CD2-O 3.48Å; Y229-H234 AromaticContact CD2-CD2 3.67Å; Y229-H234 AromaticContact CD2-CE1 3.32Å; Y229-H234 WeakPolarHBondContact CD2-CE1 3.14Å; Y229-H234 AromaticContact CD2-CG 3.87Å; Y229-H234 AromaticContact CD2-ND1 3.68Å; Y229-H234 AromaticContact CD2-NE2 3.31Å; Y229-H234 VanDerWaalsContact CD2-NE2 3.31Å; Y229-H234 WeakPolarHBondContact CD2-NE2 3.26Å; Y229-H234 AromaticContact CE2-NE2 3.69Å; Y229-H234 AromaticContact CG-CE1 3.83Å
230	H	97.8	Very high	98.6	Very high	29 Å²	29	11.1 Å²	11.1	13%	0.134	6%	0.058	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	130.4	-178.1	-169.5	74.2	0	0	0	110.4	V147 L150 K183 G232 F233	V147-H230 HydrophobicContact CB-CB 4.18Å; V147-H230 HydrophobicContact CG2-CB 3.8Å; L150-H230 HydrophobicContact CD1-CB 4.32Å; K183-H230 PolarHBondContact O-ND1 2.6Å; H230-G232 PolarHBondContact O-N 3.03Å; H230-F233 PolarHBondContact N-O 3.27Å; H230-F233 PolarHBondContact O-N 2.97Å
231	N	95.9	Very high	98.6	Very high	105 Å²	105	10.7 Å²	10.7	56%	0.561	6%	0.056	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.8	37.5	176.8	-64.1	-14.5	0	0	0	115	F233	N231-F233 WeakPolarHBondContact O-CD2 3.42Å
232	G	97.1	Very high	98.6	Very high	10 Å²	10	10.9 Å²	10.9	10%	0.103	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.7	4.8	177.3	0	0	0	0	0	115.8	Y229 H230 R303	Y229-G232 WeakPolarHBondContact OH-CA 3.4Å; H230-G232 PolarHBondContact O-N 3.03Å; G232-R303 WeakPolarHBondContact O-CA 3.32Å; G232-R303 WeakPolarHBondContact O-CG 3.49Å
233	F	98.7	Very high	98.6	Very high	11 Å²	11	10.9 Å²	10.9	5%	0.048	6%	0.057	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	148.8	-179.6	-61.1	-88.4	0	0	0	111.4	D140 M144 V147 Y229 H230 N231 H302 R303	D140-F233 HydrophobicContact CB-CE1 3.8Å; D140-F233 HydrophobicContact CB-CZ 4.01Å; D140-F233 VanDerWaalsContact OD1-CZ 3.26Å; D140-F233 WeakPolarHBondContact OD1-CZ 3.2Å; M144-F233 HydrophobicContact CG-CD1 4.05Å; M144-F233 HydrophobicContact SD-CB 3.86Å; M144-F233 HydrophobicContact SD-CD1 3.68Å; M144-F233 HydrophobicContact SD-CG 4.15Å; V147-F233 HydrophobicContact CB-CB 4.46Å; V147-F233 HydrophobicContact CG1-CB 3.86Å; V147-F233 WeakPolarHBondContact CG2-O 3.36Å; Y229-F233 CarbonylContact C-O 3.52Å; Y229-F233 VanDerWaalsContact CA-O 3.23Å; Y229-F233 WeakPolarHBondContact CA-O 3.41Å; Y229-F233 VanDerWaalsContact CD2-O 3.25Å; Y229-F233 WeakPolarHBondContact CD2-O 3.48Å; H230-F233 PolarHBondContact N-O 3.27Å; H230-F233 PolarHBondContact O-N 2.97Å; N231-F233 WeakPolarHBondContact O-CD2 3.42Å; F233-H302 CarbonylContact C-O 3.55Å; F233-H302 WeakPolarHBondContact CA-O 3.38Å; F233-R303 HydrophobicContact CD1-CG 4.05Å; F233-R303 HydrophobicContact CE1-CG 3.79Å; F233-R303 HydrophobicContact CZ-CG 4.33Å
234	H	98.9	Very high	98.5	Very high	5 Å²	5	12.3 Å²	12.3	2%	0.023	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	144.4	170.4	-62.2	-88.2	0	0	0	110.1	Y112 M144 S187 T227 V228 Y229 I301 H302 F305	Y112-H234 PolarHBondContact OH-CE1 2.94Å; M144-H234 VanDerWaalsContact CE-O 3.22Å; M144-H234 WeakPolarHBondContact CE-O 3.29Å; S187-H234 WeakPolarHBondContact CB-ND1 3.25Å; S187-H234 PolarHBondContact OG-ND1 2.94Å; T227-H234 HydrophobicContact CG2-CB 4.16Å; V228-H234 CarbonylContact O-C 3.54Å; V228-H234 VanDerWaalsContact O-CA 3.27Å; V228-H234 WeakPolarHBondContact O-CA 3.43Å; Y229-H234 AromaticContact CD2-CD2 3.67Å; Y229-H234 AromaticContact CD2-CE1 3.32Å; Y229-H234 WeakPolarHBondContact CD2-CE1 3.14Å; Y229-H234 AromaticContact CD2-CG 3.87Å; Y229-H234 AromaticContact CD2-ND1 3.68Å; Y229-H234 AromaticContact CD2-NE2 3.31Å; Y229-H234 VanDerWaalsContact CD2-NE2 3.31Å; Y229-H234 WeakPolarHBondContact CD2-NE2 3.26Å; Y229-H234 AromaticContact CE2-NE2 3.69Å; Y229-H234 AromaticContact CG-CE1 3.83Å; H234-I301 HydrophobicContact CB-CD1 3.73Å; H234-I301 HydrophobicContact CB-CG1 3.82Å; H234-H302 PolarHBondContact CD2-O 3.48Å; H234-H302 PolarHBondContact N-O 3.03Å; H234-F305 PolarHBondContact CD2-N 3.37Å
235	G	98.9	Very high	98.5	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	134.7	170.6	0	0	0	0	0	110.3	A151 T227 V228	A151-G235 WeakPolarHBondContact CB-O 3.47Å; T227-G235 VanDerWaalsContact CA-O 3.29Å; T227-G235 WeakPolarHBondContact CA-O 3.45Å; T227-G235 WeakPolarHBondContact CG2-O 3.04Å; V228-G235 PolarHBondContact N-O 3.36Å; V228-G235 PolarHBondContact O-N 3.12Å
236	D	98.9	Very high	98.4	Very high	3 Å²	3	19.1 Å²	19.1	2%	0.016	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	136.7	-162.6	-146.1	1.8	0	0	0	114.1	T227 H299 I301 F305 T330 T366 T378	T227-D236 WeakPolarHBondContact CB-OD1 3.38Å; T227-D236 HydrophobicContact CG2-CB 4.01Å; T227-D236 PolarHBondContact OG1-OD1 3.05Å; T227-D236 PolarHBondContact OG1-OD2 3.38Å; D236-H299 IonicContact OD2-CE1 3.85Å; D236-H299 IonicContact OD2-NE2 3.85Å; D236-I301 HydrophobicContact CB-CD1 3.52Å; D236-F305 WeakPolarHBondContact OD2-CE2 3.36Å; D236-T330 HydrophobicContact CB-CG2 4.24Å; D236-T366 PolarHBondContact N-OG1 2.62Å; D236-T366 PolarHBondContact O-N 2.85Å; D236-T366 PolarHBondContact O-OG1 3.49Å; D236-T378 WeakPolarHBondContact O-CG2 3.38Å
237	L	98.9	Very high	98.3	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.1	154.2	177.2	76.7	175.2	0	0	0	111.9	A151 R152 L155 I226 T378	A151-L237 HydrophobicContact CB-CD2 3.5Å; R152-L237 HydrophobicContact CB-CD1 3.96Å; R152-L237 VanDerWaalsContact CZ-CD1 3.42Å; L155-L237 HydrophobicContact CB-CD1 4.18Å; L155-L237 HydrophobicContact CB-CD2 4.36Å; L155-L237 HydrophobicContact CB-CG 4.27Å; L155-L237 HydrophobicContact CD2-CD1 3.72Å; L155-L237 HydrophobicContact CD2-CG 3.75Å; I226-L237 HydrophobicContact CB-CD2 4Å; I226-L237 HydrophobicContact CG2-CD2 4.23Å; I226-L237 PolarHBondContact N-O 2.91Å; I226-L237 WeakPolarHBondContact O-CD2 3.47Å; I226-L237 PolarHBondContact O-N 2.81Å; I226-L237 VanDerWaalsContact O-N 3.15Å; L237-T378 HydrophobicContact CB-CG2 4.04Å; L237-T378 HydrophobicContact CD1-CG2 4.31Å; L237-T378 HydrophobicContact CD2-CG2 4.37Å; L237-T378 HydrophobicContact CG-CG2 4.46Å
238	N	98.9	Very high	98.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	154.8	171.6	71.9	62.8	0	0	0	111.7	N223 V224 D225 Q362 F363 E364	N223-N238 PolarHBondContact ND2-OD1 3.25Å; V224-N238 WeakPolarHBondContact O-CA 3.35Å; V224-N238 WeakPolarHBondContact O-CB 3.47Å; D225-N238 HydrophobicContact CB-CB 3.74Å; N238-Q362 PolarHBondContact ND2-NE2 3.15Å; N238-Q362 WeakPolarHBondContact OD1-CG 3.34Å; N238-Q362 PolarHBondContact OD1-O 2.82Å; N238-F363 VanDerWaalsContact OD1-C 3.29Å; N238-F363 WeakPolarHBondContact OD1-CA 3.32Å; N238-F363 PolarHBondContact OD1-N 3.37Å; N238-E364 HydrophobicContact CB-CB 4.34Å; N238-E364 WeakPolarHBondContact ND2-CB 3.44Å; N238-E364 PolarHBondContact ND2-OE2 3.32Å; N238-E364 PolarHBondContact O-N 3.43Å; N238-E364 PolarHBondContact OD1-N 3Å
239	E	98.9	Very high	98.2	Very high	5 Å²	5	31.4 Å²	31.4	2%	0.023	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	146.8	172.4	-73.6	-174.8	-146	0	0	110.2	R152 L155 N223 V224 F241 F363 A387 H388	R152-E239 IonicContact CZ-OE1 2.67Å; R152-E239 IonicContact NH1-OE1 3.42Å; R152-E239 PolarHBondContact NH1-OE1 3.32Å; R152-E239 IonicContact NH2-OE1 2.72Å; R152-E239 PolarHBondContact NH2-OE1 3.33Å; L155-E239 HydrophobicContact CD2-CB 4.07Å; L155-E239 HydrophobicContact CD2-CG 3.81Å; N223-E239 WeakPolarHBondContact CA-O 3.28Å; N223-E239 PolarHBondContact ND2-O 2.87Å; V224-E239 PolarHBondContact N-O 3.18Å; V224-E239 VanDerWaalsContact N-O 3.11Å; V224-E239 PolarHBondContact O-N 2.9Å; E239-F241 HydrophobicContact CB-CE1 4.27Å; E239-F241 HydrophobicContact CB-CE2 4.14Å; E239-F241 HydrophobicContact CB-CZ 3.84Å; E239-F241 WeakPolarHBondContact O-CD2 3.48Å; E239-F241 VanDerWaalsContact O-CE2 3.28Å; E239-F241 WeakPolarHBondContact O-CE2 3.4Å; E239-F363 HydrophobicContact CB-CD1 4.07Å; E239-F363 HydrophobicContact CB-CE1 3.85Å; E239-F363 HydrophobicContact CG-CD1 3.82Å; E239-F363 HydrophobicContact CG-CE1 3.89Å; E239-A387 WeakPolarHBondContact OE2-CA 3.32Å; E239-H388 IonicContact OE2-CD2 3.2Å; E239-H388 PolarHBondContact OE2-CD2 3.5Å; E239-H388 IonicContact OE2-CG 2.92Å; E239-H388 PolarHBondContact OE2-N 3.07Å
240	T	98.9	Very high	98.2	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	131	167.6	-54.1	0	0	0	0	110.3	I221 L222 V254 A361 Q362	I221-T240 HydrophobicContact CB-CG2 3.99Å; I221-T240 HydrophobicContact CD1-CG2 4.36Å; I221-T240 HydrophobicContact CG1-CG2 4.46Å; L222-T240 CarbonylContact O-C 3.58Å; L222-T240 WeakPolarHBondContact O-CA 3.3Å; T240-V254 HydrophobicContact CG2-CG1 4.44Å; T240-V254 HydrophobicContact CG2-CG2 3.65Å; T240-A361 HydrophobicContact CG2-CB 4.14Å; T240-Q362 PolarHBondContact N-O 2.91Å; T240-Q362 PolarHBondContact OG1-N 3.37Å; T240-Q362 PolarHBondContact OG1-O 2.93Å
241	F	98.8	Very high	98.2	Very high	1 Å²	1	30.2 Å²	30.2	0%	0.004	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	151.8	-178.4	-54.3	-84.1	0	0	0	111.2	L155 A159 V162 I221 L222 V224 E239 H388	L155-F241 HydrophobicContact CD1-CE2 4.08Å; L155-F241 HydrophobicContact CD1-CZ 3.87Å; L155-F241 HydrophobicContact CG-CZ 4.31Å; A159-F241 HydrophobicContact CB-CD1 4.25Å; A159-F241 HydrophobicContact CB-CE1 3.41Å; A159-F241 VanDerWaalsContact CB-CE1 3.41Å; A159-F241 HydrophobicContact CB-CZ 3.78Å; V162-F241 HydrophobicContact CB-CB 4.34Å; V162-F241 HydrophobicContact CG1-CB 3.83Å; V162-F241 HydrophobicContact CG2-CB 4.17Å; V162-F241 HydrophobicContact CG2-CD2 4.02Å; V162-F241 HydrophobicContact CG2-CG 4.01Å; I221-F241 WeakPolarHBondContact CA-O 3.41Å; L222-F241 PolarHBondContact N-O 2.91Å; L222-F241 WeakPolarHBondContact O-CD2 3.49Å; L222-F241 PolarHBondContact O-N 3.36Å; V224-F241 HydrophobicContact CB-CE2 4.02Å; V224-F241 HydrophobicContact CG2-CD2 4.16Å; V224-F241 HydrophobicContact CG2-CE2 3.94Å; E239-F241 HydrophobicContact CB-CE1 4.27Å; E239-F241 HydrophobicContact CB-CE2 4.14Å; E239-F241 HydrophobicContact CB-CZ 3.84Å; E239-F241 WeakPolarHBondContact O-CD2 3.48Å; E239-F241 VanDerWaalsContact O-CE2 3.28Å; E239-F241 WeakPolarHBondContact O-CE2 3.4Å; F241-H388 HydrophobicContact CD1-CB 3.92Å; F241-H388 HydrophobicContact CE1-CB 3.65Å; F241-H388 AromaticContact CE1-CD2 3.81Å; F241-H388 AromaticContact CE1-CG 3.86Å
242	F	98.8	Very high	98.3	Very high	4 Å²	4	31 Å²	31	2%	0.018	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	135.7	166.7	-55.5	-36.6	0	0	0	110.6	I221 V246 K251 V254 F389 Q392 M393	I221-F242 HydrophobicContact CG2-CD1 4.02Å; I221-F242 HydrophobicContact CG2-CE1 4.42Å; F242-V246 HydrophobicContact CB-CG1 3.79Å; F242-V246 HydrophobicContact CB-CG2 4.01Å; F242-V246 HydrophobicContact CD1-CB 4.29Å; F242-V246 HydrophobicContact CD1-CG1 3.99Å; F242-V246 HydrophobicContact CD1-CG2 3.47Å; F242-V246 VanDerWaalsContact CD1-CG2 3.47Å; F242-V246 HydrophobicContact CD2-CG2 3.92Å; F242-V246 HydrophobicContact CE1-CG2 3.82Å; F242-V246 HydrophobicContact CE2-CG2 4.26Å; F242-V246 HydrophobicContact CG-CB 4.47Å; F242-V246 HydrophobicContact CG-CG1 4.1Å; F242-V246 HydrophobicContact CG-CG2 3.52Å; F242-V246 HydrophobicContact CZ-CG2 4.23Å; F242-K251 HydrophobicContact CE2-CG 4.27Å; F242-K251 HydrophobicContact CZ-CB 4.25Å; F242-K251 HydrophobicContact CZ-CG 4Å; F242-V254 HydrophobicContact CD1-CG2 4.4Å; F242-V254 HydrophobicContact CE1-CB 3.69Å; F242-V254 HydrophobicContact CE1-CG1 3.89Å; F242-V254 HydrophobicContact CE1-CG2 3.65Å; F242-V254 HydrophobicContact CZ-CB 4.06Å; F242-V254 HydrophobicContact CZ-CG1 4.08Å; F242-V254 HydrophobicContact CZ-CG2 4.5Å; F242-F389 HydrophobicContact CD2-CB 4.39Å; F242-F389 HydrophobicContact CE2-CB 4.12Å; F242-F389 AromaticContact CE2-CD2 4Å; F242-F389 HydrophobicContact CE2-CD2 4Å; F242-F389 HydrophobicContact CZ-CB 4.36Å; F242-F389 AromaticContact CZ-CD2 3.86Å; F242-F389 HydrophobicContact CZ-CD2 3.86Å; F242-Q392 HydrophobicContact CD2-CB 3.87Å; F242-Q392 PolarHBondContact O-NE2 2.91Å; F242-M393 HydrophobicContact CE2-CG 4.13Å; F242-M393 HydrophobicContact CE2-SD 3.77Å; F242-M393 HydrophobicContact CZ-SD 4.13Å
243	V	98.8	Very high	98.4	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.154	C	C	.	.			trans	-98.3	99.3	171.6	-173.7	0	0	0	0	108.6	V162 P164 L216 Q217 G219 D220 L222	V162-V243 HydrophobicContact CG1-CG2 3.83Å; P164-V243 HydrophobicContact CG-CG1 3.98Å; L216-V243 HydrophobicContact CB-CG1 3.82Å; L216-V243 HydrophobicContact CB-CG2 4.3Å; L216-V243 HydrophobicContact CD1-CG2 4.19Å; L216-V243 HydrophobicContact CD2-CG2 4.37Å; Q217-V243 WeakPolarHBondContact O-CB 3.28Å; Q217-V243 VanDerWaalsContact O-CG1 3.23Å; Q217-V243 WeakPolarHBondContact O-CG1 2.97Å; G219-V243 PolarHBondContact N-O 3.13Å; D220-V243 HydrophobicContact CB-CB 3.93Å; D220-V243 HydrophobicContact CB-CG2 3.78Å; D220-V243 WeakPolarHBondContact O-CB 3.45Å; D220-V243 PolarHBondContact O-N 3.36Å; L222-V243 HydrophobicContact CB-CG2 4.22Å
244	G	97.6	Very high	98.4	Very high	36 Å²	36	30 Å²	30	37%	0.371	15%	0.152	S	C	.	.	S	Bend	trans	65.8	-137.1	-174.9	0	0	0	0	0	111.7	D218	D218-G244 WeakPolarHBondContact OD1-CA 3.44Å
245	E	97.7	Very high	98.4	Very high	145 Å²	145	32 Å²	32	68%	0.678	16%	0.161	S	C	*	.	S	Bend	trans	-91	120.6	-178.4	-68.3	-60.6	140.5	0	0	111.5	D218 G219	D218-E245 PolarHBondContact OD1-N 2.98Å; G219-E245 VanDerWaalsContact CA-O 3.25Å; G219-E245 WeakPolarHBondContact CA-O 3.36Å; G219-E245 PolarHBondContact N-O 3.44Å
246	V	98.1	Very high	98.4	Very high	11 Å²	11	32.1 Å²	32.1	7%	0.067	16%	0.162	C	C	.	.			trans	-107.3	151.1	-179.8	-63.3	0	0	0	0	112	D220 I221 F242 A250 K251	D220-V246 WeakPolarHBondContact O-CG1 3.26Å; I221-V246 HydrophobicContact CG2-CG1 4.29Å; F242-V246 HydrophobicContact CB-CG1 3.79Å; F242-V246 HydrophobicContact CB-CG2 4.01Å; F242-V246 HydrophobicContact CD1-CB 4.29Å; F242-V246 HydrophobicContact CD1-CG1 3.99Å; F242-V246 HydrophobicContact CD1-CG2 3.47Å; F242-V246 VanDerWaalsContact CD1-CG2 3.47Å; F242-V246 HydrophobicContact CD2-CG2 3.92Å; F242-V246 HydrophobicContact CE1-CG2 3.82Å; F242-V246 HydrophobicContact CE2-CG2 4.26Å; F242-V246 HydrophobicContact CG-CB 4.47Å; F242-V246 HydrophobicContact CG-CG1 4.1Å; F242-V246 HydrophobicContact CG-CG2 3.52Å; F242-V246 HydrophobicContact CZ-CG2 4.23Å; V246-A250 HydrophobicContact CB-CB 4.01Å; V246-A250 HydrophobicContact CG2-CB 4.34Å; V246-K251 HydrophobicContact CG2-CD 4.46Å; V246-K251 HydrophobicContact CG2-CG 3.62Å; V246-K251 WeakPolarHBondContact O-CE 3.39Å
247	E	97.3	Very high	98.4	Very high	119 Å²	119	32 Å²	32	56%	0.556	16%	0.161	S	C	*	.			trans	-70.4	158.2	175.8	66.5	177.1	-177.1	0	0	112.9	G249 A250 K251 R359	E247-G249 PolarHBondContact O-N 3.32Å; E247-G249 VanDerWaalsContact O-N 3.08Å; E247-A250 HydrophobicContact CG-CB 4.45Å; E247-A250 WeakPolarHBondContact O-CB 3.28Å; E247-A250 PolarHBondContact O-N 2.75Å; E247-K251 PolarHBondContact O-N 3.03Å; E247-K251 VanDerWaalsContact O-N 3.17Å; E247-R359 IonicContact OE1-CZ 3.15Å; E247-R359 IonicContact OE1-NH1 3.6Å; E247-R359 PolarHBondContact OE1-NH1 2.86Å; E247-R359 IonicContact OE1-NH2 3.59Å; E247-R359 PolarHBondContact OE1-NH2 3.45Å
248	E	97.4	Very high	98.4	Very high	123 Å²	123	33.4 Å²	33.4	58%	0.575	17%	0.167	S	C	*	.	H	α-helix	trans	-58	-28.3	-176.8	-66.7	-57.3	126.3	0	0	113.9	K251 R252	E248-K251 PolarHBondContact O-N 3.06Å; E248-K251 WeakPolarHBondContact OE1-CD 3.42Å; E248-K251 IonicContact OE1-NZ 3.14Å; E248-K251 PolarHBondContact OE1-NZ 3.32Å; E248-R252 WeakPolarHBondContact O-CB 3.28Å; E248-R252 WeakPolarHBondContact O-CG 3.31Å; E248-R252 PolarHBondContact O-N 2.81Å
249	G	97.5	Very high	98.4	Very high	24 Å²	24	36.2 Å²	36.2	25%	0.247	18%	0.179	C	C	.	.	H	α-helix	trans	-61.1	-47.9	173	0	0	0	0	0	112.5	E247 R252 L253	E247-G249 PolarHBondContact O-N 3.32Å; E247-G249 VanDerWaalsContact O-N 3.08Å; G249-R252 PolarHBondContact O-N 3.25Å; G249-L253 PolarHBondContact O-N 3.4Å
250	A	98.1	Very high	98.4	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.2	-43.8	175.8	0	0	0	0	0	111.7	I221 V246 E247 R252 L253 V254	I221-A250 HydrophobicContact CG2-CB 3.73Å; V246-A250 HydrophobicContact CB-CB 4.01Å; V246-A250 HydrophobicContact CG2-CB 4.34Å; E247-A250 HydrophobicContact CG-CB 4.45Å; E247-A250 WeakPolarHBondContact O-CB 3.28Å; E247-A250 PolarHBondContact O-N 2.75Å; A250-R252 PolarHBondContact O-N 3.32Å; A250-L253 PolarHBondContact O-N 3.35Å; A250-V254 WeakPolarHBondContact O-CG2 3.43Å; A250-V254 PolarHBondContact O-N 3.14Å
251	K	98.5	Very high	98.4	Very high	32 Å²	32	36 Å²	36	14%	0.139	18%	0.178	C	C	.	.	H	α-helix	trans	-58.3	-47.2	176.7	-63	-176.2	-174.1	167.9	0	111.7	F242 V246 E247 E248 L253 V254 Q255 M393	F242-K251 HydrophobicContact CE2-CG 4.27Å; F242-K251 HydrophobicContact CZ-CB 4.25Å; F242-K251 HydrophobicContact CZ-CG 4Å; V246-K251 HydrophobicContact CG2-CD 4.46Å; V246-K251 HydrophobicContact CG2-CG 3.62Å; V246-K251 WeakPolarHBondContact O-CE 3.39Å; E247-K251 PolarHBondContact O-N 3.03Å; E247-K251 VanDerWaalsContact O-N 3.17Å; E248-K251 PolarHBondContact O-N 3.06Å; E248-K251 WeakPolarHBondContact OE1-CD 3.42Å; E248-K251 IonicContact OE1-NZ 3.14Å; E248-K251 PolarHBondContact OE1-NZ 3.32Å; K251-L253 PolarHBondContact O-N 2.87Å; K251-V254 PolarHBondContact O-N 2.81Å; K251-Q255 WeakPolarHBondContact O-CB 3.41Å; K251-Q255 PolarHBondContact O-N 3.15Å; K251-M393 HydrophobicContact CB-CE 4.4Å; K251-M393 HydrophobicContact CB-SD 4.05Å; K251-M393 HydrophobicContact CD-SD 3.9Å; K251-M393 HydrophobicContact CG-SD 4.04Å
252	R	98.2	Very high	98.4	Very high	122 Å²	122	38.2 Å²	38.2	46%	0.46	19%	0.19	S	C	.	.	H	α-helix	trans	-62	-41.5	177.4	-77.3	-176.2	62.7	-112.4	-9.4	112.7	E248 G249 A250 T256 N288 F290	E248-R252 WeakPolarHBondContact O-CB 3.28Å; E248-R252 WeakPolarHBondContact O-CG 3.31Å; E248-R252 PolarHBondContact O-N 2.81Å; G249-R252 PolarHBondContact O-N 3.25Å; A250-R252 PolarHBondContact O-N 3.32Å; R252-T256 VanDerWaalsContact O-CB 3.27Å; R252-T256 WeakPolarHBondContact O-CB 3.47Å; R252-T256 PolarHBondContact O-N 3.02Å; R252-T256 PolarHBondContact O-OG1 3.12Å; R252-N288 PolarHBondContact NH2-O 3.01Å; R252-F290 HydrophobicContact CB-CZ 4.27Å
253	L	98.7	Very high	98.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.8	-57.1	177.1	178.1	69.5	0	0	0	110.5	I221 G249 A250 K251 Q255 T256 T257 F290 I335 E337 R359 A361	I221-L253 HydrophobicContact CD1-CD2 3.83Å; G249-L253 PolarHBondContact O-N 3.4Å; A250-L253 PolarHBondContact O-N 3.35Å; K251-L253 PolarHBondContact O-N 2.87Å; L253-Q255 PolarHBondContact O-N 3.16Å; L253-T256 PolarHBondContact O-N 3.16Å; L253-T257 PolarHBondContact O-N 2.81Å; L253-T257 PolarHBondContact O-OG1 2.94Å; L253-F290 HydrophobicContact CB-CE1 4.37Å; L253-F290 HydrophobicContact CB-CZ 4.18Å; L253-F290 HydrophobicContact CD1-CD1 3.95Å; L253-F290 HydrophobicContact CD1-CE1 3.99Å; L253-F290 HydrophobicContact CD1-CG 4.23Å; L253-F290 HydrophobicContact CD1-CZ 4.31Å; L253-I335 HydrophobicContact CD1-CB 4.49Å; L253-I335 HydrophobicContact CD1-CG2 4.01Å; L253-E337 HydrophobicContact CB-CG 4.25Å; L253-E337 HydrophobicContact CD1-CG 3.97Å; L253-E337 HydrophobicContact CD2-CG 3.73Å; L253-E337 HydrophobicContact CG-CG 4.18Å; L253-R359 HydrophobicContact CD2-CB 3.88Å; L253-A361 HydrophobicContact CD2-CB 3.92Å; L253-A361 HydrophobicContact CG-CB 3.87Å
254	V	98.8	Very high	98.4	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.7	-46.4	-176.9	173.4	0	0	0	0	111.2	I221 T240 F242 A250 K251 T256 T257 Y258 A361 F363 F389	I221-V254 HydrophobicContact CD1-CG2 4.22Å; I221-V254 HydrophobicContact CG2-CG2 4.18Å; T240-V254 HydrophobicContact CG2-CG1 4.44Å; T240-V254 HydrophobicContact CG2-CG2 3.65Å; F242-V254 HydrophobicContact CD1-CG2 4.4Å; F242-V254 HydrophobicContact CE1-CB 3.69Å; F242-V254 HydrophobicContact CE1-CG1 3.89Å; F242-V254 HydrophobicContact CE1-CG2 3.65Å; F242-V254 HydrophobicContact CZ-CB 4.06Å; F242-V254 HydrophobicContact CZ-CG1 4.08Å; F242-V254 HydrophobicContact CZ-CG2 4.5Å; A250-V254 WeakPolarHBondContact O-CG2 3.43Å; A250-V254 PolarHBondContact O-N 3.14Å; K251-V254 PolarHBondContact O-N 2.81Å; V254-T256 PolarHBondContact O-N 3.11Å; V254-T257 PolarHBondContact O-N 2.99Å; V254-Y258 PolarHBondContact O-N 2.87Å; V254-A361 HydrophobicContact CG2-CB 4.04Å; V254-F363 HydrophobicContact CG1-CE2 3.71Å; V254-F363 HydrophobicContact CG1-CZ 3.66Å; V254-F363 WeakPolarHBondContact O-CE2 3.32Å; V254-F389 HydrophobicContact CG1-CB 4.24Å; V254-F389 HydrophobicContact CG1-CD1 4Å; V254-F389 HydrophobicContact CG1-CD2 3.69Å; V254-F389 HydrophobicContact CG1-CE1 4.28Å; V254-F389 HydrophobicContact CG1-CE2 4Å; V254-F389 HydrophobicContact CG1-CG 3.69Å; V254-F389 HydrophobicContact CG1-CZ 4.28Å
255	Q	98.8	Very high	98.4	Very high	45 Å²	45	40.3 Å²	40.3	21%	0.21	19%	0.19	C	C	.	.	H	α-helix	trans	-58.3	-47.4	175.6	179.6	62.8	36.1	0	0	111.8	K251 L253 T257 Y258 E259 F389	K251-Q255 WeakPolarHBondContact O-CB 3.41Å; K251-Q255 PolarHBondContact O-N 3.15Å; L253-Q255 PolarHBondContact O-N 3.16Å; Q255-T257 VanDerWaalsContact C-N 3.34Å; Q255-T257 PolarHBondContact O-N 2.59Å; Q255-Y258 PolarHBondContact O-N 2.81Å; Q255-E259 WeakPolarHBondContact CG-OE1 3.49Å; Q255-E259 PolarHBondContact NE2-OE1 3.3Å; Q255-E259 VanDerWaalsContact O-CG 3.31Å; Q255-E259 WeakPolarHBondContact O-CG 3.33Å; Q255-E259 PolarHBondContact O-N 3.24Å; Q255-F389 HydrophobicContact CB-CE2 4.25Å
256	T	98.8	Very high	98.5	Very high	4 Å²	4	39.8 Å²	39.8	3%	0.025	19%	0.191	C	C	.	.	H	α-helix	trans	-66.6	-37.1	-178.4	-58.6	0	0	0	0	111.9	R252 L253 V254 E259 C260 N288 F290	R252-T256 VanDerWaalsContact O-CB 3.27Å; R252-T256 WeakPolarHBondContact O-CB 3.47Å; R252-T256 PolarHBondContact O-N 3.02Å; R252-T256 PolarHBondContact O-OG1 3.12Å; L253-T256 PolarHBondContact O-N 3.16Å; V254-T256 PolarHBondContact O-N 3.11Å; T256-E259 PolarHBondContact O-N 2.99Å; T256-C260 PolarHBondContact O-N 3.3Å; T256-C260 PolarHBondContact O-SG 2.91Å; T256-N288 HydrophobicContact CG2-CB 3.8Å; T256-F290 HydrophobicContact CG2-CD2 3.75Å; T256-F290 HydrophobicContact CG2-CE2 4.06Å; T256-F290 WeakPolarHBondContact OG1-CE2 3.28Å
257	T	98.9	Very high	98.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.9	-46.1	175.1	-57.1	0	0	0	0	111.1	L253 V254 Q255 E259 C260 L261 P333 I335 A361 F363	L253-T257 PolarHBondContact O-N 2.81Å; L253-T257 PolarHBondContact O-OG1 2.94Å; V254-T257 PolarHBondContact O-N 2.99Å; Q255-T257 VanDerWaalsContact C-N 3.34Å; Q255-T257 PolarHBondContact O-N 2.59Å; T257-E259 PolarHBondContact O-N 3.12Å; T257-C260 WeakPolarHBondContact O-CB 3.49Å; T257-C260 PolarHBondContact O-N 2.99Å; T257-L261 PolarHBondContact O-N 2.76Å; T257-L261 VanDerWaalsContact O-N 3.1Å; T257-P333 WeakPolarHBondContact CG2-O 3.18Å; T257-I335 HydrophobicContact CG2-CB 4.35Å; T257-I335 HydrophobicContact CG2-CG1 3.91Å; T257-I335 WeakPolarHBondContact OG1-CB 3.48Å; T257-A361 HydrophobicContact CG2-CB 4.38Å; T257-A361 VanDerWaalsContact CG2-O 3.29Å; T257-A361 WeakPolarHBondContact CG2-O 3.2Å; T257-F363 HydrophobicContact CG2-CD2 3.74Å; T257-F363 HydrophobicContact CG2-CE2 4.49Å
258	Y	98.9	Very high	98.6	Very high	30 Å²	30	35 Å²	35	12%	0.118	17%	0.172	C	C	.	.	H	α-helix	trans	-60.9	-44.5	176	-179.6	-109.2	0	0	0	111.7	V254 Q255 C260 L261 M262 F363 A387 F389 L390	V254-Y258 PolarHBondContact O-N 2.87Å; Q255-Y258 PolarHBondContact O-N 2.81Å; Y258-C260 VanDerWaalsContact C-N 3.33Å; Y258-C260 PolarHBondContact O-N 2.7Å; Y258-L261 WeakPolarHBondContact O-CB 3.1Å; Y258-L261 PolarHBondContact O-N 3.41Å; Y258-M262 HydrophobicContact CD1-CG 4.23Å; Y258-M262 HydrophobicContact CD2-CG 4.3Å; Y258-M262 HydrophobicContact CE1-CG 3.8Å; Y258-M262 HydrophobicContact CE2-CG 3.86Å; Y258-M262 HydrophobicContact CE2-SD 3.95Å; Y258-M262 HydrophobicContact CG-CG 4.46Å; Y258-M262 WeakPolarHBondContact O-CG 3.26Å; Y258-M262 PolarHBondContact O-N 3.18Å; Y258-F363 AromaticContact CD2-CD1 3.82Å; Y258-F363 HydrophobicContact CD2-CD1 3.82Å; Y258-F363 HydrophobicContact CD2-CE1 4.12Å; Y258-F363 HydrophobicContact CD2-CG 4.08Å; Y258-A387 HydrophobicContact CD2-CB 4Å; Y258-A387 HydrophobicContact CE2-CB 3.7Å; Y258-F389 HydrophobicContact CD1-CE1 4.14Å; Y258-F389 HydrophobicContact CD1-CZ 4.11Å; Y258-F389 HydrophobicContact CD2-CE1 4.21Å; Y258-F389 AromaticContact CG-CE1 3.77Å; Y258-F389 HydrophobicContact CG-CE1 3.77Å; Y258-F389 HydrophobicContact CG-CZ 4.04Å; Y258-L390 HydrophobicContact CE1-CD1 3.95Å
259	E	98.9	Very high	98.7	Very high	58 Å²	58	34.6 Å²	34.6	27%	0.271	17%	0.168	S	C	.	.	H	α-helix	trans	-62.1	-38.2	175.8	-70.7	167.6	178.2	0	0	112.8	Q255 T256 T257 L261 M262 Q263 H284	Q255-E259 WeakPolarHBondContact CG-OE1 3.49Å; Q255-E259 PolarHBondContact NE2-OE1 3.3Å; Q255-E259 VanDerWaalsContact O-CG 3.31Å; Q255-E259 WeakPolarHBondContact O-CG 3.33Å; Q255-E259 PolarHBondContact O-N 3.24Å; T256-E259 PolarHBondContact O-N 2.99Å; T257-E259 PolarHBondContact O-N 3.12Å; E259-L261 VanDerWaalsContact C-N 3.34Å; E259-M262 PolarHBondContact O-N 3.33Å; E259-Q263 WeakPolarHBondContact O-CB 3.3Å; E259-Q263 VanDerWaalsContact O-CG 3.28Å; E259-Q263 WeakPolarHBondContact O-CG 3.07Å; E259-Q263 PolarHBondContact O-N 2.92Å; E259-H284 VanDerWaalsContact CB-NE2 3.32Å; E259-H284 WeakPolarHBondContact CB-NE2 3.46Å; E259-H284 IonicContact OE2-CD2 2.65Å; E259-H284 IonicContact OE2-CE1 3.79Å; E259-H284 PolarHBondContact OE2-CE1 2.88Å; E259-H284 IonicContact OE2-NE2 3.31Å; E259-H284 PolarHBondContact OE2-NE2 2.76Å
260	C	98.9	Very high	98.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.3	-46.1	174.3	-72.3	0	0	0	0	111.4	T256 T257 Y258 A264 I281 P333	T256-C260 PolarHBondContact O-N 3.3Å; T256-C260 PolarHBondContact O-SG 2.91Å; T257-C260 WeakPolarHBondContact O-CB 3.49Å; T257-C260 PolarHBondContact O-N 2.99Å; Y258-C260 VanDerWaalsContact C-N 3.33Å; Y258-C260 PolarHBondContact O-N 2.7Å; C260-A264 WeakPolarHBondContact O-CB 3.39Å; C260-A264 PolarHBondContact O-N 3.07Å; C260-I281 HydrophobicContact CB-CG1 4.48Å; C260-I281 HydrophobicContact CB-CG2 4.05Å; C260-P333 HydrophobicContact CB-CG 4.45Å
261	L	98.9	Very high	98.8	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	20%	0.197	C	C	.	.	H	α-helix	trans	-60.5	-53.2	176.4	173.1	61.7	0	0	0	110.7	T257 Y258 E259 Q263 A264 I265 I331 P333 F363	T257-L261 PolarHBondContact O-N 2.76Å; T257-L261 VanDerWaalsContact O-N 3.1Å; Y258-L261 WeakPolarHBondContact O-CB 3.1Å; Y258-L261 PolarHBondContact O-N 3.41Å; E259-L261 VanDerWaalsContact C-N 3.34Å; L261-Q263 PolarHBondContact O-N 3.22Å; L261-A264 WeakPolarHBondContact O-CB 3.45Å; L261-A264 PolarHBondContact O-N 3.09Å; L261-A264 VanDerWaalsContact O-N 3.1Å; L261-I265 HydrophobicContact CD1-CD1 3.76Å; L261-I265 HydrophobicContact CD1-CG1 4.05Å; L261-I265 HydrophobicContact CD2-CD1 4.35Å; L261-I265 HydrophobicContact CG-CD1 3.73Å; L261-I265 HydrophobicContact CG-CG1 4.39Å; L261-I265 WeakPolarHBondContact O-CG1 3.45Å; L261-I265 PolarHBondContact O-N 3.04Å; L261-I331 HydrophobicContact CD1-CB 3.73Å; L261-I331 HydrophobicContact CD1-CG2 3.68Å; L261-I331 WeakPolarHBondContact CD1-O 3.33Å; L261-P333 HydrophobicContact CB-CG 3.91Å; L261-F363 HydrophobicContact CB-CB 4.42Å; L261-F363 HydrophobicContact CD2-CB 3.57Å
262	M	98.8	Very high	98.8	Very high	49 Å²	49	37.9 Å²	37.9	24%	0.241	20%	0.197	C	C	.	.	H	α-helix	trans	-64	-41.3	-174.7	-64.9	-51.3	-59.8	0	0	112.4	Y258 E259 A264 I265 D266	Y258-M262 HydrophobicContact CD1-CG 4.23Å; Y258-M262 HydrophobicContact CD2-CG 4.3Å; Y258-M262 HydrophobicContact CE1-CG 3.8Å; Y258-M262 HydrophobicContact CE2-CG 3.86Å; Y258-M262 HydrophobicContact CE2-SD 3.95Å; Y258-M262 HydrophobicContact CG-CG 4.46Å; Y258-M262 WeakPolarHBondContact O-CG 3.26Å; Y258-M262 PolarHBondContact O-N 3.18Å; E259-M262 PolarHBondContact O-N 3.33Å; M262-A264 VanDerWaalsContact C-N 3.27Å; M262-A264 PolarHBondContact O-N 3.27Å; M262-I265 WeakPolarHBondContact O-CB 3.25Å; M262-I265 PolarHBondContact O-N 2.88Å; M262-I265 HydrophobicContact SD-CD1 3.97Å; M262-D266 VanDerWaalsContact O-CG 3.32Å; M262-D266 PolarHBondContact O-N 2.56Å
263	Q	98.8	Very high	98.8	Very high	77 Å²	77	38.6 Å²	38.6	36%	0.36	20%	0.2	S	C	.	.	H	α-helix	trans	-62.4	-34.8	174.6	-73.3	179.9	44.1	0	0	112.6	E259 L261 I280 H284	E259-Q263 WeakPolarHBondContact O-CB 3.3Å; E259-Q263 VanDerWaalsContact O-CG 3.28Å; E259-Q263 WeakPolarHBondContact O-CG 3.07Å; E259-Q263 PolarHBondContact O-N 2.92Å; L261-Q263 PolarHBondContact O-N 3.22Å; Q263-I280 HydrophobicContact CB-CG2 3.87Å; Q263-H284 PolarHBondContact NE2-CE1 3.09Å; Q263-H284 PolarHBondContact NE2-ND1 2.79Å; Q263-H284 PolarHBondContact NE2-NE2 3.35Å
264	A	98.9	Very high	98.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-68.1	-45	174.3	0	0	0	0	0	111	C260 L261 M262 D266 S267 L277 I281 I331	C260-A264 WeakPolarHBondContact O-CB 3.39Å; C260-A264 PolarHBondContact O-N 3.07Å; L261-A264 WeakPolarHBondContact O-CB 3.45Å; L261-A264 PolarHBondContact O-N 3.09Å; L261-A264 VanDerWaalsContact O-N 3.1Å; M262-A264 VanDerWaalsContact C-N 3.27Å; M262-A264 PolarHBondContact O-N 3.27Å; A264-D266 VanDerWaalsContact C-N 3.34Å; A264-D266 PolarHBondContact O-N 3.14Å; A264-S267 WeakPolarHBondContact O-CB 3.17Å; A264-S267 PolarHBondContact O-N 3.14Å; A264-S267 VanDerWaalsContact O-N 3.12Å; A264-S267 PolarHBondContact O-OG 2.97Å; A264-L277 HydrophobicContact CB-CD2 4.22Å; A264-L277 WeakPolarHBondContact O-CD2 3.28Å; A264-I281 HydrophobicContact CB-CD1 3.94Å; A264-I281 HydrophobicContact CB-CG1 3.8Å; A264-I331 HydrophobicContact CB-CD1 4.17Å; A264-I331 HydrophobicContact CB-CG2 4.16Å
265	I	98.8	Very high	98.8	Very high	7 Å²	7	44.1 Å²	44.1	4%	0.036	22%	0.221	C	C	.	.	H	α-helix	trans	-57.3	-44.7	176.5	-69.4	172.8	0	0	0	111.3	L261 M262 S267 V268 I331 H365 L367 V376	L261-I265 HydrophobicContact CD1-CD1 3.76Å; L261-I265 HydrophobicContact CD1-CG1 4.05Å; L261-I265 HydrophobicContact CD2-CD1 4.35Å; L261-I265 HydrophobicContact CG-CD1 3.73Å; L261-I265 HydrophobicContact CG-CG1 4.39Å; L261-I265 WeakPolarHBondContact O-CG1 3.45Å; L261-I265 PolarHBondContact O-N 3.04Å; M262-I265 WeakPolarHBondContact O-CB 3.25Å; M262-I265 PolarHBondContact O-N 2.88Å; M262-I265 HydrophobicContact SD-CD1 3.97Å; I265-S267 PolarHBondContact O-N 3.33Å; I265-V268 WeakPolarHBondContact O-CB 3.26Å; I265-V268 WeakPolarHBondContact O-CG2 3.4Å; I265-V268 PolarHBondContact O-N 3.21Å; I265-I331 HydrophobicContact CG1-CD1 4.35Å; I265-H365 HydrophobicContact CD1-CB 4.13Å; I265-L367 HydrophobicContact CD1-CD2 4.04Å; I265-L367 HydrophobicContact CG1-CD1 3.85Å; I265-L367 HydrophobicContact CG1-CD2 4.04Å; I265-L367 HydrophobicContact CG2-CD2 4.32Å; I265-V376 HydrophobicContact CG2-CG2 3.86Å
266	D	98.7	Very high	98.8	Very high	133 Å²	133	45.9 Å²	45.9	71%	0.711	23%	0.229	S	C	*	.	H	α-helix	trans	-59.5	-22.1	179.6	-72.5	-17.4	0	0	0	113.2	M262 A264	M262-D266 VanDerWaalsContact O-CG 3.32Å; M262-D266 PolarHBondContact O-N 2.56Å; A264-D266 VanDerWaalsContact C-N 3.34Å; A264-D266 PolarHBondContact O-N 3.14Å
267	S	98.6	Very high	98.8	Very high	27 Å²	27	45.7 Å²	45.7	19%	0.189	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	-11	177.2	80.1	0	0	0	0	114.1	A264 I265 K269 L277 I280	A264-S267 WeakPolarHBondContact O-CB 3.17Å; A264-S267 PolarHBondContact O-N 3.14Å; A264-S267 VanDerWaalsContact O-N 3.12Å; A264-S267 PolarHBondContact O-OG 2.97Å; I265-S267 PolarHBondContact O-N 3.33Å; S267-K269 PolarHBondContact O-N 3.33Å; S267-L277 VanDerWaalsContact OG-CD2 3.28Å; S267-L277 WeakPolarHBondContact OG-CD2 3.48Å; S267-I280 VanDerWaalsContact CB-CD1 3.48Å; S267-I280 VanDerWaalsContact OG-CD1 3.26Å; S267-I280 WeakPolarHBondContact OG-CD1 3.27Å
268	V	98.9	Very high	98.8	Very high	4 Å²	4	45.7 Å²	45.7	2%	0.024	23%	0.228	C	C	.	.			trans	-74.2	113	-174.6	-179.4	0	0	0	0	110.7	I265 L277 M323 F329 I331 L367 V369 G373 C374	I265-V268 WeakPolarHBondContact O-CB 3.26Å; I265-V268 WeakPolarHBondContact O-CG2 3.4Å; I265-V268 PolarHBondContact O-N 3.21Å; V268-L277 HydrophobicContact CG2-CD2 4.18Å; V268-M323 HydrophobicContact CB-SD 4.3Å; V268-M323 HydrophobicContact CG1-CE 4.47Å; V268-M323 HydrophobicContact CG1-SD 3.78Å; V268-M323 HydrophobicContact CG2-CE 4.27Å; V268-M323 HydrophobicContact CG2-SD 4.45Å; V268-F329 HydrophobicContact CG1-CE1 4.12Å; V268-F329 HydrophobicContact CG1-CZ 3.87Å; V268-F329 HydrophobicContact CG2-CZ 4.11Å; V268-I331 HydrophobicContact CG2-CD1 3.87Å; V268-L367 HydrophobicContact CG2-CD1 4.06Å; V268-V369 HydrophobicContact CG1-CG2 3.98Å; V268-G373 CarbonylContact O-C 3.14Å; V268-G373 VanDerWaalsContact O-CA 3.32Å; V268-G373 WeakPolarHBondContact O-CA 3.48Å; V268-C374 HydrophobicContact CB-CB 3.98Å; V268-C374 HydrophobicContact CG1-CB 3.62Å; V268-C374 PolarHBondContact O-N 3.34Å
269	K	98.8	Very high	98.8	Very high	114 Å²	114	46.5 Å²	46.5	50%	0.496	23%	0.234	S	C	.	.	S	Bend	trans	-161.2	164.8	173.4	65.1	-174.2	175.6	-173.3	0	111	S267 G271 V272 M323	S267-K269 PolarHBondContact O-N 3.33Å; K269-G271 PolarHBondContact O-N 2.89Å; K269-V272 HydrophobicContact CG-CG2 3.71Å; K269-V272 WeakPolarHBondContact O-CB 3.15Å; K269-V272 PolarHBondContact O-N 3.28Å; K269-M323 WeakPolarHBondContact O-CB 3.42Å
270	P	98.9	Very high	98.8	Very high	44 Å²	44	45.4 Å²	45.4	29%	0.286	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.4	139.1	176.6	-29.9	38.3	0	0	0	113.4	V272 M323 P325 V369 T370	P270-V272 VanDerWaalsContact C-N 3.33Å; P270-V272 PolarHBondContact O-N 3.06Å; P270-M323 WeakPolarHBondContact CA-O 3.49Å; P270-P325 HydrophobicContact CB-CG 4.45Å; P270-P325 HydrophobicContact CG-CG 3.77Å; P270-V369 HydrophobicContact CG-CG1 4.01Å; P270-T370 VanDerWaalsContact CD-O 3.23Å; P270-T370 WeakPolarHBondContact CD-O 3.24Å; P270-T370 WeakPolarHBondContact CG-O 3.43Å
271	G	98.7	Very high	98.8	Very high	54 Å²	54	45.4 Å²	45.4	56%	0.557	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	88.3	-13.3	178.7	0	0	0	0	0	115.2	K269 V322 M323	K269-G271 PolarHBondContact O-N 2.89Å; G271-V322 VanDerWaalsContact C-CG1 3.46Å; G271-V322 WeakPolarHBondContact O-CG1 3.31Å; G271-M323 PolarHBondContact N-O 3Å
272	V	98.8	Very high	98.8	Very high	26 Å²	26	46.3 Å²	46.3	16%	0.158	23%	0.234	C	C	.	.			trans	-74.4	140.3	173.4	177.3	0	0	0	0	110	K269 P270 E276 V322 M323	K269-V272 HydrophobicContact CG-CG2 3.71Å; K269-V272 WeakPolarHBondContact O-CB 3.15Å; K269-V272 PolarHBondContact O-N 3.28Å; P270-V272 VanDerWaalsContact C-N 3.33Å; P270-V272 PolarHBondContact O-N 3.06Å; V272-E276 HydrophobicContact CG1-CB 4.32Å; V272-V322 WeakPolarHBondContact O-CA 3.43Å; V272-M323 HydrophobicContact CB-SD 3.84Å; V272-M323 HydrophobicContact CG1-CE 4.24Å; V272-M323 HydrophobicContact CG1-SD 4.07Å; V272-M323 WeakPolarHBondContact O-CG 3.48Å; V272-M323 PolarHBondContact O-N 2.88Å
273	R	98.8	Very high	98.8	Very high	138 Å²	138	51.7 Å²	51.7	52%	0.521	26%	0.256	S	S	.	.	B	Isolated β-bridge	trans	-84.6	137	177.4	-62.8	-174.8	175.8	80.4	0.4	109.7	R275 E276 V322	R273-R275 HydrophobicContact CB-CG 4Å; R273-R275 PolarHBondContact O-N 3.46Å; R273-R275 VanDerWaalsContact O-N 3.14Å; R273-E276 VanDerWaalsContact O-CB 3.29Å; R273-E276 WeakPolarHBondContact O-CB 3.39Å; R273-E276 PolarHBondContact O-N 3.13Å; R273-V322 HydrophobicContact CG-CG2 4.28Å
274	Y	98.9	Very high	98.8	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-54.3	-36.7	177.7	-74.1	-76.9	0	0	0	113.2	I133 E276 L277 P309 V311 G321 M323 H327 F329	I133-Y274 HydrophobicContact CD1-CD2 4.06Å; I133-Y274 HydrophobicContact CD1-CE2 3.38Å; Y274-E276 PolarHBondContact O-N 3.23Å; Y274-E276 VanDerWaalsContact O-N 3.08Å; Y274-L277 PolarHBondContact O-N 3.27Å; Y274-P309 HydrophobicContact CD1-CB 4.3Å; Y274-P309 HydrophobicContact CD1-CG 3.82Å; Y274-P309 HydrophobicContact CD2-CB 4.11Å; Y274-P309 HydrophobicContact CD2-CG 4.22Å; Y274-P309 HydrophobicContact CE1-CB 4.38Å; Y274-P309 HydrophobicContact CE1-CG 3.51Å; Y274-P309 HydrophobicContact CE2-CB 4.23Å; Y274-P309 HydrophobicContact CE2-CG 3.96Å; Y274-P309 HydrophobicContact CG-CB 4.17Å; Y274-P309 HydrophobicContact CG-CG 4.16Å; Y274-V311 HydrophobicContact CD1-CG2 3.76Å; Y274-V311 HydrophobicContact CE1-CG2 4.38Å; Y274-V311 HydrophobicContact CG-CG2 4.49Å; Y274-G321 PolarHBondContact N-O 3.3Å; Y274-M323 HydrophobicContact CD1-CE 3.86Å; Y274-M323 HydrophobicContact CD1-CG 4.25Å; Y274-M323 HydrophobicContact CD2-CG 4.49Å; Y274-M323 HydrophobicContact CE1-CE 4.04Å; Y274-M323 HydrophobicContact CE1-CG 3.79Å; Y274-M323 HydrophobicContact CE2-CG 4.02Å; Y274-M323 HydrophobicContact CG-CE 4.49Å; Y274-H327 AromaticContact CZ-ND1 3.85Å; Y274-H327 WeakPolarHBondContact OH-CB 3.17Å; Y274-H327 PolarHBondContact OH-ND1 3.45Å; Y274-F329 HydrophobicContact CD1-CD2 4.32Å; Y274-F329 HydrophobicContact CD1-CE2 4.16Å; Y274-F329 HydrophobicContact CD1-CZ 4.4Å; Y274-F329 AromaticContact CE1-CD1 3.78Å; Y274-F329 HydrophobicContact CE1-CD1 3.78Å; Y274-F329 AromaticContact CE1-CD2 3.85Å; Y274-F329 HydrophobicContact CE1-CD2 3.85Å; Y274-F329 AromaticContact CE1-CE1 3.75Å; Y274-F329 HydrophobicContact CE1-CE1 3.75Å; Y274-F329 AromaticContact CE1-CE2 3.82Å; Y274-F329 HydrophobicContact CE1-CE2 3.82Å; Y274-F329 AromaticContact CE1-CG 3.84Å; Y274-F329 HydrophobicContact CE1-CG 3.84Å; Y274-F329 AromaticContact CE1-CZ 3.77Å; Y274-F329 HydrophobicContact CE1-CZ 3.77Å
275	R	98.7	Very high	98.8	Very high	116 Å²	116	49.6 Å²	49.6	44%	0.438	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-60.4	-18.9	177.8	72	-176.8	-175.4	-167	1.4	115	R273 L277 N317 A319	R273-R275 HydrophobicContact CB-CG 4Å; R273-R275 PolarHBondContact O-N 3.46Å; R273-R275 VanDerWaalsContact O-N 3.14Å; R275-L277 VanDerWaalsContact C-N 3.34Å; R275-N317 VanDerWaalsContact CA-OD1 3.25Å; R275-N317 WeakPolarHBondContact CA-OD1 3.1Å; R275-N317 WeakPolarHBondContact CB-OD1 3.38Å; R275-N317 PolarHBondContact O-ND2 3.03Å; R275-A319 HydrophobicContact CB-CB 4.01Å
276	E	98.9	Very high	98.8	Very high	82 Å²	82	54.7 Å²	54.7	38%	0.383	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-71.8	-30.5	-178.7	-172.4	54.2	-150	0	0	112.4	V272 R273 Y274 G278 N279 I280	V272-E276 HydrophobicContact CG1-CB 4.32Å; R273-E276 VanDerWaalsContact O-CB 3.29Å; R273-E276 WeakPolarHBondContact O-CB 3.39Å; R273-E276 PolarHBondContact O-N 3.13Å; Y274-E276 PolarHBondContact O-N 3.23Å; Y274-E276 VanDerWaalsContact O-N 3.08Å; E276-G278 VanDerWaalsContact C-N 3.28Å; E276-G278 PolarHBondContact O-N 3.03Å; E276-N279 WeakPolarHBondContact O-CB 3.43Å; E276-N279 PolarHBondContact O-N 3.22Å; E276-N279 PolarHBondContact OE2-ND2 3.05Å; E276-I280 HydrophobicContact CG-CD1 4.4Å; E276-I280 PolarHBondContact O-N 3.1Å
277	L	98.9	Very high	98.7	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-57.8	-42	-177	-61.6	177.7	0	0	0	111.9	A264 S267 V268 Y274 R275 N279 I280 I281 V311 M323 F329 I331	A264-L277 HydrophobicContact CB-CD2 4.22Å; A264-L277 WeakPolarHBondContact O-CD2 3.28Å; S267-L277 VanDerWaalsContact OG-CD2 3.28Å; S267-L277 WeakPolarHBondContact OG-CD2 3.48Å; V268-L277 HydrophobicContact CG2-CD2 4.18Å; Y274-L277 PolarHBondContact O-N 3.27Å; R275-L277 VanDerWaalsContact C-N 3.34Å; L277-N279 VanDerWaalsContact C-N 3.28Å; L277-N279 PolarHBondContact O-N 3.35Å; L277-I280 PolarHBondContact O-N 2.8Å; L277-I281 WeakPolarHBondContact O-CG1 3.27Å; L277-I281 PolarHBondContact O-N 2.8Å; L277-V311 HydrophobicContact CB-CG1 4.35Å; L277-V311 HydrophobicContact CD1-CG1 3.53Å; L277-M323 HydrophobicContact CD1-CE 3.55Å; L277-M323 HydrophobicContact CD2-CE 4.02Å; L277-M323 HydrophobicContact CG-CE 3.87Å; L277-F329 HydrophobicContact CD1-CE2 3.9Å; L277-F329 HydrophobicContact CD1-CZ 4.43Å; L277-I331 HydrophobicContact CD1-CD1 3.57Å; L277-I331 HydrophobicContact CD1-CG1 3.98Å; L277-I331 HydrophobicContact CD2-CD1 4.15Å; L277-I331 HydrophobicContact CG-CD1 4.41Å
278	G	98.8	Very high	98.7	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-66.6	-25	176.4	0	0	0	0	0	114.8	E276 Q282 P312 H313 Y314 A315	E276-G278 VanDerWaalsContact C-N 3.28Å; E276-G278 PolarHBondContact O-N 3.03Å; G278-Q282 VanDerWaalsContact O-CB 3.25Å; G278-Q282 WeakPolarHBondContact O-CB 3.26Å; G278-Q282 PolarHBondContact O-N 2.74Å; G278-Q282 VanDerWaalsContact O-N 3.08Å; G278-P312 WeakPolarHBondContact CA-O 3.33Å; G278-H313 WeakPolarHBondContact CA-O 3.13Å; G278-Y314 WeakPolarHBondContact CA-O 3.18Å; G278-Y314 CarbonylContact O-C 3.44Å; G278-Y314 VanDerWaalsContact O-C 3.31Å; G278-A315 PolarHBondContact O-N 3.2Å; G278-A315 VanDerWaalsContact O-N 3.14Å
279	N	98.9	Very high	98.7	Very high	46 Å²	46	55.6 Å²	55.6	25%	0.246	30%	0.295	C	S	.	.	H	α-helix	trans	-69	-42.1	172.8	-65.1	-32.8	0	0	0	110.9	E276 L277 K283 A315 K316	E276-N279 WeakPolarHBondContact O-CB 3.43Å; E276-N279 PolarHBondContact O-N 3.22Å; E276-N279 PolarHBondContact OE2-ND2 3.05Å; L277-N279 VanDerWaalsContact C-N 3.28Å; L277-N279 PolarHBondContact O-N 3.35Å; N279-K283 VanDerWaalsContact O-CB 3.22Å; N279-K283 WeakPolarHBondContact O-CB 3.4Å; N279-K283 PolarHBondContact O-N 2.84Å; N279-K283 VanDerWaalsContact O-N 3.12Å; N279-A315 VanDerWaalsContact OD1-CA 3.22Å; N279-A315 WeakPolarHBondContact OD1-CA 3.44Å; N279-A315 WeakPolarHBondContact OD1-CB 3.46Å; N279-K316 PolarHBondContact OD1-N 2.89Å
280	I	98.9	Very high	98.6	Very high	35 Å²	35	50.8 Å²	50.8	18%	0.179	28%	0.275	C	S	.	.	H	α-helix	trans	-65.1	-53.3	179.3	-63.4	168	0	0	0	109.9	Q263 S267 E276 L277 Q282 K283 H284	Q263-I280 HydrophobicContact CB-CG2 3.87Å; S267-I280 VanDerWaalsContact CB-CD1 3.48Å; S267-I280 VanDerWaalsContact OG-CD1 3.26Å; S267-I280 WeakPolarHBondContact OG-CD1 3.27Å; E276-I280 HydrophobicContact CG-CD1 4.4Å; E276-I280 PolarHBondContact O-N 3.1Å; L277-I280 PolarHBondContact O-N 2.8Å; I280-Q282 PolarHBondContact O-N 3.26Å; I280-K283 PolarHBondContact O-N 3.24Å; I280-H284 PolarHBondContact O-N 2.91Å
281	I	98.9	Very high	98.6	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-57.4	-54.7	-179.1	-69.4	161.9	0	0	0	110.7	C260 A264 L277 K283 H284 A285 V292 H313 I331 P333 I335	C260-I281 HydrophobicContact CB-CG1 4.48Å; C260-I281 HydrophobicContact CB-CG2 4.05Å; A264-I281 HydrophobicContact CB-CD1 3.94Å; A264-I281 HydrophobicContact CB-CG1 3.8Å; L277-I281 WeakPolarHBondContact O-CG1 3.27Å; L277-I281 PolarHBondContact O-N 2.8Å; I281-K283 VanDerWaalsContact C-N 3.29Å; I281-K283 PolarHBondContact O-N 2.85Å; I281-H284 PolarHBondContact O-N 2.84Å; I281-A285 PolarHBondContact O-N 3.36Å; I281-V292 HydrophobicContact CG2-CG1 4.31Å; I281-V292 HydrophobicContact CG2-CG2 4.29Å; I281-H313 WeakPolarHBondContact CB-O 3.05Å; I281-H313 HydrophobicContact CD1-CB 4.09Å; I281-H313 HydrophobicContact CG2-CB 4.21Å; I281-H313 WeakPolarHBondContact CG2-O 3.27Å; I281-I331 HydrophobicContact CD1-CG2 4.03Å; I281-P333 HydrophobicContact CD1-CB 4.27Å; I281-P333 HydrophobicContact CG2-CB 3.89Å; I281-I335 HydrophobicContact CG2-CD1 4.14Å
282	Q	98.8	Very high	98.6	Very high	21 Å²	21	47.3 Å²	47.3	10%	0.098	24%	0.243	C	C	.	.	H	α-helix	trans	-65.5	-33.8	-175.9	-175	174.5	-23	0	0	112.4	G278 I280 Q286 V292 A315	G278-Q282 VanDerWaalsContact O-CB 3.25Å; G278-Q282 WeakPolarHBondContact O-CB 3.26Å; G278-Q282 PolarHBondContact O-N 2.74Å; G278-Q282 VanDerWaalsContact O-N 3.08Å; I280-Q282 PolarHBondContact O-N 3.26Å; Q282-Q286 HydrophobicContact CG-CG 3.89Å; Q282-Q286 VanDerWaalsContact O-CB 3.25Å; Q282-Q286 WeakPolarHBondContact O-CB 3.48Å; Q282-Q286 VanDerWaalsContact O-CG 3.23Å; Q282-Q286 WeakPolarHBondContact O-CG 3.27Å; Q282-Q286 PolarHBondContact O-N 2.65Å; Q282-V292 HydrophobicContact CB-CG2 3.88Å; Q282-V292 HydrophobicContact CG-CG2 3.95Å; Q282-A315 HydrophobicContact CB-CB 4.06Å; Q282-A315 HydrophobicContact CG-CB 4.36Å
283	K	98.8	Very high	98.6	Very high	162 Å²	162	46.2 Å²	46.2	70%	0.704	24%	0.236	S	C	*	.	H	α-helix	trans	-60.2	-46.7	175.6	179.8	-177.3	174.5	-171.7	0	111.3	N279 I280 I281 A287	N279-K283 VanDerWaalsContact O-CB 3.22Å; N279-K283 WeakPolarHBondContact O-CB 3.4Å; N279-K283 PolarHBondContact O-N 2.84Å; N279-K283 VanDerWaalsContact O-N 3.12Å; I280-K283 PolarHBondContact O-N 3.24Å; I281-K283 VanDerWaalsContact C-N 3.29Å; I281-K283 PolarHBondContact O-N 2.85Å; K283-A287 WeakPolarHBondContact O-CB 3.23Å; K283-A287 PolarHBondContact O-N 2.69Å; K283-A287 VanDerWaalsContact O-N 3.09Å
284	H	98.8	Very high	98.6	Very high	33 Å²	33	44.3 Å²	44.3	15%	0.153	23%	0.229	C	C	.	.	H	α-helix	trans	-69.2	-44.2	-179.4	-168.5	64.6	0	0	0	112.3	E259 Q263 I280 I281 Q286 A287 N288	E259-H284 VanDerWaalsContact CB-NE2 3.32Å; E259-H284 WeakPolarHBondContact CB-NE2 3.46Å; E259-H284 IonicContact OE2-CD2 2.65Å; E259-H284 IonicContact OE2-CE1 3.79Å; E259-H284 PolarHBondContact OE2-CE1 2.88Å; E259-H284 IonicContact OE2-NE2 3.31Å; E259-H284 PolarHBondContact OE2-NE2 2.76Å; Q263-H284 PolarHBondContact NE2-CE1 3.09Å; Q263-H284 PolarHBondContact NE2-ND1 2.79Å; Q263-H284 PolarHBondContact NE2-NE2 3.35Å; I280-H284 PolarHBondContact O-N 2.91Å; I281-H284 PolarHBondContact O-N 2.84Å; H284-Q286 PolarHBondContact O-N 2.69Å; H284-A287 PolarHBondContact O-N 2.88Å; H284-N288 PolarHBondContact O-N 3.15Å; H284-N288 PolarHBondContact O-ND2 3.14Å
285	A	98.6	Very high	98.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-59.4	-47.6	176.5	0	0	0	0	0	112	I281 A287 N288 G289 F290 V292 I335	I281-A285 PolarHBondContact O-N 3.36Å; A285-A287 PolarHBondContact O-N 3.1Å; A285-N288 CarbonylContact O-C 3.44Å; A285-N288 PolarHBondContact O-N 3.1Å; A285-N288 VanDerWaalsContact O-N 3.15Å; A285-G289 PolarHBondContact O-N 3.45Å; A285-F290 HydrophobicContact CB-CB 4.41Å; A285-F290 PolarHBondContact O-N 2.77Å; A285-V292 HydrophobicContact CB-CG2 3.89Å; A285-I335 HydrophobicContact CB-CD1 3.88Å; A285-I335 HydrophobicContact CB-CG2 4.3Å
286	Q	98.1	Very high	98.6	Very high	114 Å²	114	44.3 Å²	44.3	53%	0.533	24%	0.24	S	C	.	.	H	α-helix	trans	-67.8	-36.1	-178.9	-73.2	-174.4	-44.6	0	0	112.9	Q282 H284 N288 G289	Q282-Q286 HydrophobicContact CG-CG 3.89Å; Q282-Q286 VanDerWaalsContact O-CB 3.25Å; Q282-Q286 WeakPolarHBondContact O-CB 3.48Å; Q282-Q286 VanDerWaalsContact O-CG 3.23Å; Q282-Q286 WeakPolarHBondContact O-CG 3.27Å; Q282-Q286 PolarHBondContact O-N 2.65Å; H284-Q286 PolarHBondContact O-N 2.69Å; Q286-N288 PolarHBondContact O-N 2.88Å; Q286-G289 PolarHBondContact O-N 3.19Å
287	A	98.2	Very high	98.6	Very high	85 Å²	85	42.2 Å²	42.2	70%	0.702	23%	0.234	S	C	*	.	H	α-helix	trans	-60.4	-25.3	174.8	0	0	0	0	0	112.5	K283 H284 A285	K283-A287 WeakPolarHBondContact O-CB 3.23Å; K283-A287 PolarHBondContact O-N 2.69Å; K283-A287 VanDerWaalsContact O-N 3.09Å; H284-A287 PolarHBondContact O-N 2.88Å; A285-A287 PolarHBondContact O-N 3.1Å
288	N	98.2	Very high	98.6	Very high	50 Å²	50	42.2 Å²	42.2	27%	0.267	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	4.5	177.9	-75.4	-73.5	0	0	0	114.2	R252 T256 H284 A285 Q286 F290	R252-N288 PolarHBondContact NH2-O 3.01Å; T256-N288 HydrophobicContact CG2-CB 3.8Å; H284-N288 PolarHBondContact O-N 3.15Å; H284-N288 PolarHBondContact O-ND2 3.14Å; A285-N288 CarbonylContact O-C 3.44Å; A285-N288 PolarHBondContact O-N 3.1Å; A285-N288 VanDerWaalsContact O-N 3.15Å; Q286-N288 PolarHBondContact O-N 2.88Å; N288-F290 HydrophobicContact CB-CD2 3.78Å; N288-F290 HydrophobicContact CB-CE2 3.92Å
289	G	97.5	Very high	98.6	Very high	47 Å²	47	42.6 Å²	42.6	49%	0.485	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.5	18.8	177.9	0	0	0	0	0	115	A285 Q286	A285-G289 PolarHBondContact O-N 3.45Å; Q286-G289 PolarHBondContact O-N 3.19Å
290	F	98.6	Very high	98.6	Very high	14 Å²	14	40.4 Å²	40.4	6%	0.061	22%	0.224	C	C	.	.			trans	-108.1	164.9	-179.9	-56.8	-54.4	0	0	0	112.9	R252 L253 T256 A285 N288 I335 C336 E337	R252-F290 HydrophobicContact CB-CZ 4.27Å; L253-F290 HydrophobicContact CB-CE1 4.37Å; L253-F290 HydrophobicContact CB-CZ 4.18Å; L253-F290 HydrophobicContact CD1-CD1 3.95Å; L253-F290 HydrophobicContact CD1-CE1 3.99Å; L253-F290 HydrophobicContact CD1-CG 4.23Å; L253-F290 HydrophobicContact CD1-CZ 4.31Å; T256-F290 HydrophobicContact CG2-CD2 3.75Å; T256-F290 HydrophobicContact CG2-CE2 4.06Å; T256-F290 WeakPolarHBondContact OG1-CE2 3.28Å; A285-F290 HydrophobicContact CB-CB 4.41Å; A285-F290 PolarHBondContact O-N 2.77Å; N288-F290 HydrophobicContact CB-CD2 3.78Å; N288-F290 HydrophobicContact CB-CE2 3.92Å; F290-I335 HydrophobicContact CB-CG2 3.46Å; F290-I335 VanDerWaalsContact CB-CG2 3.46Å; F290-I335 HydrophobicContact CD2-CG2 4.39Å; F290-I335 HydrophobicContact CG-CG2 4.06Å; F290-C336 WeakPolarHBondContact CB-O 3.17Å; F290-E337 HydrophobicContact CE1-CG 4.21Å
291	S	98.6	Very high	98.6	Very high	20 Å²	20	38.8 Å²	38.8	14%	0.14	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	158.8	176.7	55	0	0	0	0	112.3	I335 C336 G340	S291-I335 WeakPolarHBondContact O-CA 3.45Å; S291-C336 PolarHBondContact N-O 3.24Å; S291-C336 VanDerWaalsContact N-O 3.15Å; S291-C336 PolarHBondContact O-N 3.14Å; S291-G340 PolarHBondContact OG-O 3.3Å
292	V	98.8	Very high	98.6	Very high	5 Å²	5	39.4 Å²	39.4	3%	0.03	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	126.5	-178.3	-170.1	0	0	0	0	110.4	I281 Q282 A285 H313 I335 W341	I281-V292 HydrophobicContact CG2-CG1 4.31Å; I281-V292 HydrophobicContact CG2-CG2 4.29Å; Q282-V292 HydrophobicContact CB-CG2 3.88Å; Q282-V292 HydrophobicContact CG-CG2 3.95Å; A285-V292 HydrophobicContact CB-CG2 3.89Å; V292-H313 HydrophobicContact CG1-CB 3.65Å; V292-H313 WeakPolarHBondContact CG1-O 3.46Å; V292-I335 HydrophobicContact CB-CD1 4.28Å; V292-I335 HydrophobicContact CG1-CD1 4.14Å; V292-I335 HydrophobicContact CG2-CD1 3.76Å; V292-W341 WeakPolarHBondContact O-CB 3.37Å
293	V	98.6	Very high	98.6	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.012	23%	0.234	C	C	.	.			trans	-58.8	148.1	175.4	176.4	0	0	0	0	110.9	I206 Y296 M334 C336	I206-V293 HydrophobicContact CD1-CG2 4.01Å; I206-V293 HydrophobicContact CG1-CG2 4.32Å; I206-V293 HydrophobicContact CG2-CB 4.48Å; I206-V293 HydrophobicContact CG2-CG1 4.15Å; I206-V293 HydrophobicContact CG2-CG2 3.82Å; V293-Y296 HydrophobicContact CG1-CD2 3.97Å; V293-M334 HydrophobicContact CB-CB 3.92Å; V293-M334 HydrophobicContact CG2-CB 3.76Å; V293-M334 PolarHBondContact N-O 2.86Å; V293-M334 VanDerWaalsContact N-O 3.11Å; V293-C336 WeakPolarHBondContact CG2-SG 3.34Å
294	R	98.6	Very high	98.5	Very high	98 Å²	98	36.8 Å²	36.8	37%	0.37	20%	0.204	S	C	.	.	S	Bend	trans	-119.9	-16.5	-174.3	-59.4	-170.1	173.5	164	-4.6	115.6	Y314 W341	R294-Y314 HydrophobicContact CB-CD1 3.88Å; R294-Y314 HydrophobicContact CB-CE1 3.93Å; R294-Y314 HydrophobicContact CG-CD1 3.68Å; R294-Y314 HydrophobicContact CG-CE1 4.17Å; R294-Y314 HydrophobicContact CG-CG 3.98Å; R294-W341 HydrophobicContact CB-CD2 4.47Å; R294-W341 HydrophobicContact CB-CE3 3.69Å; R294-W341 HydrophobicContact CB-CZ3 3.88Å; R294-W341 HydrophobicContact CG-CD2 3.87Å; R294-W341 HydrophobicContact CG-CE3 3.58Å; R294-W341 HydrophobicContact CG-CG 4.29Å; R294-W341 HydrophobicContact CG-CZ3 4.12Å
295	S	98.6	Very high	98.5	Very high	71 Å²	71	35.6 Å²	35.6	50%	0.497	20%	0.198	S	C	.	.	S	Bend	trans	-83.3	-18.5	-174.7	-57.3	0	0	0	0	113.1	D343	S295-D343 VanDerWaalsContact CB-OD1 3.3Å; S295-D343 WeakPolarHBondContact CB-OD1 3.44Å; S295-D343 VanDerWaalsContact CB-OD2 3.26Å; S295-D343 WeakPolarHBondContact CB-OD2 3.15Å; S295-D343 VanDerWaalsContact OG-CG 3.25Å; S295-D343 PolarHBondContact OG-OD1 3.42Å; S295-D343 PolarHBondContact OG-OD2 2.65Å
296	Y	98.8	Very high	98.5	Very high	46 Å²	46	38.5 Å²	38.5	18%	0.18	21%	0.212	C	C	.	.			trans	-121.1	153.1	179.4	-56.6	-87.6	0	0	0	110.7	H208 V293 M334 A352	H208-Y296 AromaticContact CE1-CD1 3.87Å; H208-Y296 AromaticContact CE1-CE1 3.62Å; H208-Y296 AromaticContact ND1-CE1 3.76Å; V293-Y296 HydrophobicContact CG1-CD2 3.97Å; Y296-M334 VanDerWaalsContact CB-CE 3.44Å; Y296-M334 HydrophobicContact CD2-SD 4.31Å; Y296-M334 HydrophobicContact CG-CE 4.41Å; Y296-M334 HydrophobicContact CG-SD 4.19Å; Y296-A352 HydrophobicContact CE2-CB 3.71Å; Y296-A352 VanDerWaalsContact OH-CB 3.26Å; Y296-A352 WeakPolarHBondContact OH-CB 3.44Å
297	C	98.7	Very high	98.6	Very high	37 Å²	37	34 Å²	34	25%	0.25	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	155.5	-173.9	62.8	0	0	0	0	110.9	V311	C297-V311 WeakPolarHBondContact CB-O 3.49Å
298	G	98.8	Very high	98.6	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	161.1	165.4	0	0	0	0	0	112	N310 V311 H313 T330 E332	G298-N310 CarbonylContact O-C 3.31Å; G298-V311 PolarHBondContact N-O 2.92Å; G298-V311 PolarHBondContact O-N 3.36Å; G298-H313 PolarHBondContact N-CE1 3.07Å; G298-H313 PolarHBondContact N-NE2 3.38Å; G298-T330 WeakPolarHBondContact CA-OG1 3.35Å; G298-E332 WeakPolarHBondContact CA-OE1 3.45Å
299	H	98.9	Very high	98.6	Very high	9 Å²	9	28.2 Å²	28.2	4%	0.042	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	158.4	-173.1	56	94.6	0	0	0	112.5	D236 F305 H306 P309 F329 T330 E332	D236-H299 IonicContact OD2-CE1 3.85Å; D236-H299 IonicContact OD2-NE2 3.85Å; H299-F305 PolarHBondContact CE1-O 3.49Å; H299-F305 VanDerWaalsContact CE1-O 3.26Å; H299-F305 PolarHBondContact ND1-O 3.17Å; H299-F305 VanDerWaalsContact ND1-O 3.09Å; H299-H306 AromaticContact CD2-CD2 3.46Å; H299-H306 PolarHBondContact CD2-CD2 3Å; H299-H306 VanDerWaalsContact CD2-CD2 3.46Å; H299-H306 AromaticContact CE1-CD2 3.56Å; H299-H306 AromaticContact CE1-NE2 3.92Å; H299-H306 AromaticContact CG-CD2 3.54Å; H299-H306 AromaticContact ND1-CD2 3.61Å; H299-H306 AromaticContact NE2-CD2 3.46Å; H299-H306 PolarHBondContact NE2-CD2 3.42Å; H299-H306 AromaticContact NE2-NE2 3.66Å; H299-P309 CarbonylContact C-O 3.57Å; H299-P309 VanDerWaalsContact CA-O 3.23Å; H299-P309 WeakPolarHBondContact CA-O 3.41Å; H299-F329 CarbonylContact O-C 3.54Å; H299-F329 WeakPolarHBondContact O-CA 3.3Å; H299-F329 WeakPolarHBondContact O-CB 3.4Å; H299-T330 PolarHBondContact CD2-OG1 2.93Å; H299-T330 PolarHBondContact N-OG1 2.92Å; H299-T330 PolarHBondContact O-N 2.92Å; H299-E332 IonicContact CD2-OE1 3.97Å; H299-E332 PolarHBondContact CD2-OE1 2.99Å; H299-E332 IonicContact NE2-OE1 3.18Å; H299-E332 PolarHBondContact NE2-OE1 2.67Å
300	G	98.9	Very high	98.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	140.3	161.2	0	0	0	0	0	109.8	T307 P309	G300-T307 WeakPolarHBondContact CA-O 3.35Å; G300-T307 PolarHBondContact N-O 3.31Å; G300-T307 WeakPolarHBondContact O-CG2 3.39Å; G300-T307 PolarHBondContact O-N 3.35Å; G300-P309 PolarHBondContact N-O 2.99Å
301	I	98.9	Very high	98.7	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.151	C	C	.	.			trans	-142.5	134.2	179.5	-174.4	173.1	0	0	0	110	M144 T227 H234 D236 V328 T330 T366	M144-I301 HydrophobicContact CE-CG2 4.23Å; T227-I301 HydrophobicContact CG2-CD1 4.37Å; H234-I301 HydrophobicContact CB-CD1 3.73Å; H234-I301 HydrophobicContact CB-CG1 3.82Å; D236-I301 HydrophobicContact CB-CD1 3.52Å; I301-V328 HydrophobicContact CG2-CG1 4.14Å; I301-V328 PolarHBondContact N-O 3.09Å; I301-V328 WeakPolarHBondContact O-CG1 3.41Å; I301-T330 HydrophobicContact CB-CG2 4.48Å; I301-T330 HydrophobicContact CG2-CG2 3.83Å; I301-T366 HydrophobicContact CG2-CG2 3.66Å
302	H	98.8	Very high	98.7	Very high	13 Å²	13	30 Å²	30	6%	0.06	15%	0.15	C	C	.	.	S	Bend	trans	-167.5	-116.1	173.2	46.9	61.3	0	0	0	109.6	L136 M144 F233 H234 L304	L136-H302 HydrophobicContact CD1-CB 4.36Å; L136-H302 HydrophobicContact CD2-CB 4.39Å; M144-H302 HydrophobicContact SD-CB 4.17Å; F233-H302 CarbonylContact C-O 3.55Å; F233-H302 WeakPolarHBondContact CA-O 3.38Å; H234-H302 PolarHBondContact CD2-O 3.48Å; H234-H302 PolarHBondContact N-O 3.03Å; H302-L304 CarbonylContact C-O 3.42Å; H302-L304 PolarHBondContact N-O 3.38Å; H302-L304 PolarHBondContact ND1-N 3.28Å; H302-L304 PolarHBondContact O-N 3.46Å
303	R	98.3	Very high	98.7	Very high	114 Å²	114	29.9 Å²	29.9	43%	0.43	15%	0.149	S	C	.	.	S	Bend	trans	-62.4	-14.5	165.9	-56.2	-176.2	174	-87.7	-0	115.2	D140 G232 F233	D140-R303 IonicContact OD1-CZ 2.75Å; D140-R303 IonicContact OD1-NE 3.46Å; D140-R303 PolarHBondContact OD1-NE 3.27Å; D140-R303 IonicContact OD1-NH2 3.62Å; D140-R303 PolarHBondContact OD1-NH2 3.21Å; G232-R303 WeakPolarHBondContact O-CA 3.32Å; G232-R303 WeakPolarHBondContact O-CG 3.49Å; F233-R303 HydrophobicContact CD1-CG 4.05Å; F233-R303 HydrophobicContact CE1-CG 3.79Å; F233-R303 HydrophobicContact CZ-CG 4.33Å
304	L	98.5	Very high	98.7	Very high	14 Å²	14	32.7 Å²	32.7	7%	0.073	16%	0.16	C	C	.	.	S	Bend	trans	-112.8	146.2	172.5	-59.7	-174.6	0	0	0	107.1	S123 E124 L127 H302 T307	S123-L304 VanDerWaalsContact OG-CD2 3.28Å; S123-L304 WeakPolarHBondContact OG-CD2 3.37Å; E124-L304 HydrophobicContact CG-CB 3.97Å; E124-L304 HydrophobicContact CG-CD1 4.12Å; E124-L304 HydrophobicContact CG-CD2 3.97Å; E124-L304 HydrophobicContact CG-CG 4.23Å; L127-L304 HydrophobicContact CD1-CD1 3.79Å; H302-L304 CarbonylContact C-O 3.42Å; H302-L304 PolarHBondContact N-O 3.38Å; H302-L304 PolarHBondContact ND1-N 3.28Å; H302-L304 PolarHBondContact O-N 3.46Å; L304-T307 HydrophobicContact CB-CG2 4.19Å; L304-T307 HydrophobicContact CD1-CG2 4.32Å
305	F	98.7	Very high	98.7	Very high	8 Å²	8	29.3 Å²	29.3	4%	0.035	15%	0.153	C	C	.	.	S	Bend	trans	-69.7	-53.4	177	-166.1	170	0	0	0	108	E124 S187 P188 Y191 T227 H234 D236 H299	E124-F305 WeakPolarHBondContact OE1-CA 3.24Å; E124-F305 VanDerWaalsContact OE1-CB 3.28Å; E124-F305 WeakPolarHBondContact OE1-CB 3.41Å; E124-F305 PolarHBondContact OE1-N 3.18Å; S187-F305 VanDerWaalsContact CB-CE1 3.47Å; P188-F305 HydrophobicContact CG-CZ 4.42Å; Y191-F305 HydrophobicContact CD1-CD1 4.27Å; Y191-F305 HydrophobicContact CD1-CE1 4.22Å; Y191-F305 AromaticContact CD2-CD1 3.96Å; Y191-F305 HydrophobicContact CD2-CD1 3.96Å; Y191-F305 HydrophobicContact CE1-CD1 4.41Å; Y191-F305 HydrophobicContact CE2-CB 4.41Å; Y191-F305 HydrophobicContact CE2-CD1 4.12Å; Y191-F305 HydrophobicContact CG-CD1 4.03Å; Y191-F305 HydrophobicContact CG-CE1 4.19Å; T227-F305 HydrophobicContact CG2-CD2 3.89Å; T227-F305 HydrophobicContact CG2-CE2 3.38Å; T227-F305 HydrophobicContact CG2-CZ 3.73Å; T227-F305 VanDerWaalsContact OG1-CE2 3.26Å; T227-F305 WeakPolarHBondContact OG1-CE2 3.43Å; T227-F305 WeakPolarHBondContact OG1-CZ 3.45Å; H234-F305 PolarHBondContact CD2-N 3.37Å; D236-F305 WeakPolarHBondContact OD2-CE2 3.36Å; H299-F305 PolarHBondContact CE1-O 3.49Å; H299-F305 VanDerWaalsContact CE1-O 3.26Å; H299-F305 PolarHBondContact ND1-O 3.17Å; H299-F305 VanDerWaalsContact ND1-O 3.09Å
306	H	98.7	Very high	98.7	Very high	61 Å²	61	35.3 Å²	35.3	28%	0.282	17%	0.17	S	C	.	.	S	Bend	trans	-124.5	124	177.9	-55.2	83.5	0	0	0	111.5	E124 Y191 H299	E124-H306 PolarHBondContact OE1-N 2.67Å; Y191-H306 AromaticContact CE1-CE1 3.71Å; Y191-H306 AromaticContact CE1-ND1 3.69Å; Y191-H306 AromaticContact CZ-CE1 3.92Å; Y191-H306 AromaticContact CZ-ND1 3.41Å; Y191-H306 PolarHBondContact OH-ND1 3.22Å; H299-H306 AromaticContact CD2-CD2 3.46Å; H299-H306 PolarHBondContact CD2-CD2 3Å; H299-H306 VanDerWaalsContact CD2-CD2 3.46Å; H299-H306 AromaticContact CE1-CD2 3.56Å; H299-H306 AromaticContact CE1-NE2 3.92Å; H299-H306 AromaticContact CG-CD2 3.54Å; H299-H306 AromaticContact ND1-CD2 3.61Å; H299-H306 AromaticContact NE2-CD2 3.46Å; H299-H306 PolarHBondContact NE2-CD2 3.42Å; H299-H306 AromaticContact NE2-NE2 3.66Å
307	T	98.8	Very high	98.7	Very high	19 Å²	19	33.6 Å²	33.6	12%	0.117	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	-175.2	176.1	-169.8	0	0	0	0	112	G300 L304	G300-T307 WeakPolarHBondContact CA-O 3.35Å; G300-T307 PolarHBondContact N-O 3.31Å; G300-T307 WeakPolarHBondContact O-CG2 3.39Å; G300-T307 PolarHBondContact O-N 3.35Å; L304-T307 HydrophobicContact CB-CG2 4.19Å; L304-T307 HydrophobicContact CD1-CG2 4.32Å
308	A	98.6	Very high	98.7	Very high	11 Å²	11	41 Å²	41	9%	0.091	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	140.4	176.2	0	0	0	0	0	111.7	I133	I133-A308 HydrophobicContact CG1-CB 4.37Å
309	P	98.7	Very high	98.7	Very high	4 Å²	4	41.8 Å²	41.8	3%	0.026	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	cis	-89.7	152.3	6.7	33.9	-32.9	0	0	0	113.5	I133 Y274 H299 G300 V311 F329	I133-P309 HydrophobicContact CD1-CB 3.76Å; I133-P309 HydrophobicContact CD1-CG 3.98Å; I133-P309 HydrophobicContact CG1-CB 4.14Å; I133-P309 HydrophobicContact CG1-CG 4.39Å; Y274-P309 HydrophobicContact CD1-CB 4.3Å; Y274-P309 HydrophobicContact CD1-CG 3.82Å; Y274-P309 HydrophobicContact CD2-CB 4.11Å; Y274-P309 HydrophobicContact CD2-CG 4.22Å; Y274-P309 HydrophobicContact CE1-CB 4.38Å; Y274-P309 HydrophobicContact CE1-CG 3.51Å; Y274-P309 HydrophobicContact CE2-CB 4.23Å; Y274-P309 HydrophobicContact CE2-CG 3.96Å; Y274-P309 HydrophobicContact CG-CB 4.17Å; Y274-P309 HydrophobicContact CG-CG 4.16Å; H299-P309 CarbonylContact C-O 3.57Å; H299-P309 VanDerWaalsContact CA-O 3.23Å; H299-P309 WeakPolarHBondContact CA-O 3.41Å; G300-P309 PolarHBondContact N-O 2.99Å; P309-V311 HydrophobicContact CB-CG2 4.32Å; P309-V311 HydrophobicContact CG-CG2 3.95Å; P309-F329 HydrophobicContact CG-CB 4.24Å
310	N	98.6	Very high	98.6	Very high	102 Å²	102	45.8 Å²	45.8	55%	0.545	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	133	159.4	-65.9	16.3	0	0	0	109	G298 P312	G298-N310 CarbonylContact O-C 3.31Å; N310-P312 WeakPolarHBondContact O-CD 3.45Å
311	V	98.9	Very high	98.6	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	84.1	-173.9	-172.5	0	0	0	0	110.4	Y274 L277 C297 G298 P309 H313 F329	Y274-V311 HydrophobicContact CD1-CG2 3.76Å; Y274-V311 HydrophobicContact CE1-CG2 4.38Å; Y274-V311 HydrophobicContact CG-CG2 4.49Å; L277-V311 HydrophobicContact CB-CG1 4.35Å; L277-V311 HydrophobicContact CD1-CG1 3.53Å; C297-V311 WeakPolarHBondContact CB-O 3.49Å; G298-V311 PolarHBondContact N-O 2.92Å; G298-V311 PolarHBondContact O-N 3.36Å; P309-V311 HydrophobicContact CB-CG2 4.32Å; P309-V311 HydrophobicContact CG-CG2 3.95Å; V311-H313 PolarHBondContact O-NE2 3Å; V311-F329 HydrophobicContact CG2-CD2 3.9Å; V311-F329 HydrophobicContact CG2-CE2 4.47Å
312	P	98.8	Very high	98.6	Very high	16 Å²	16	49.9 Å²	49.9	10%	0.104	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	140.4	179	-18	32.2	0	0	0	112.2	G278 N310 Y314 N317 A319	G278-P312 WeakPolarHBondContact CA-O 3.33Å; N310-P312 WeakPolarHBondContact O-CD 3.45Å; P312-Y314 HydrophobicContact CB-CD1 3.96Å; P312-Y314 HydrophobicContact CB-CE1 3.6Å; P312-N317 HydrophobicContact CB-CB 3.74Å; P312-N317 HydrophobicContact CG-CB 3.94Å; P312-A319 HydrophobicContact CG-CB 4.25Å
313	H	98.9	Very high	98.6	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.009	25%	0.25	C	S	.	.	S	Bend	trans	-87.8	-5	-177	-51.3	117.7	0	0	0	114.1	G278 I281 V292 G298 V311 E332 P333	G278-H313 WeakPolarHBondContact CA-O 3.13Å; I281-H313 WeakPolarHBondContact CB-O 3.05Å; I281-H313 HydrophobicContact CD1-CB 4.09Å; I281-H313 HydrophobicContact CG2-CB 4.21Å; I281-H313 WeakPolarHBondContact CG2-O 3.27Å; V292-H313 HydrophobicContact CG1-CB 3.65Å; V292-H313 WeakPolarHBondContact CG1-O 3.46Å; G298-H313 PolarHBondContact N-CE1 3.07Å; G298-H313 PolarHBondContact N-NE2 3.38Å; V311-H313 PolarHBondContact O-NE2 3Å; H313-E332 VanDerWaalsContact CE1-C 3.46Å; H313-E332 VanDerWaalsContact CE1-CG 3.42Å; H313-E332 WeakPolarHBondContact CE1-CG 3.42Å; H313-E332 PolarHBondContact CE1-O 3.32Å; H313-E332 VanDerWaalsContact CE1-O 3.26Å; H313-E332 PolarHBondContact NE2-N 2.75Å; H313-E332 VanDerWaalsContact NE2-N 3.15Å; H313-P333 HydrophobicContact CB-CB 4.34Å
314	Y	98.8	Very high	98.6	Very high	62 Å²	62	49.4 Å²	49.4	24%	0.243	25%	0.254	C	S	.	.	S	Bend	trans	-98.8	152.3	179.8	63.3	-93.2	0	0	0	112.8	G278 R294 P312 N317	G278-Y314 WeakPolarHBondContact CA-O 3.18Å; G278-Y314 CarbonylContact O-C 3.44Å; G278-Y314 VanDerWaalsContact O-C 3.31Å; R294-Y314 HydrophobicContact CB-CD1 3.88Å; R294-Y314 HydrophobicContact CB-CE1 3.93Å; R294-Y314 HydrophobicContact CG-CD1 3.68Å; R294-Y314 HydrophobicContact CG-CE1 4.17Å; R294-Y314 HydrophobicContact CG-CG 3.98Å; P312-Y314 HydrophobicContact CB-CD1 3.96Å; P312-Y314 HydrophobicContact CB-CE1 3.6Å; Y314-N317 HydrophobicContact CD2-CB 3.94Å; Y314-N317 HydrophobicContact CE2-CB 3.48Å; Y314-N317 VanDerWaalsContact CE2-CB 3.48Å; Y314-N317 PolarHBondContact O-ND2 2.84Å
315	A	98.6	Very high	98.7	Very high	27 Å²	27	50.4 Å²	50.4	22%	0.223	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	154.1	-179.3	0	0	0	0	0	112.7	G278 N279 Q282 N317	G278-A315 PolarHBondContact O-N 3.2Å; G278-A315 VanDerWaalsContact O-N 3.14Å; N279-A315 VanDerWaalsContact OD1-CA 3.22Å; N279-A315 WeakPolarHBondContact OD1-CA 3.44Å; N279-A315 WeakPolarHBondContact OD1-CB 3.46Å; Q282-A315 HydrophobicContact CB-CB 4.06Å; Q282-A315 HydrophobicContact CG-CB 4.36Å; A315-N317 PolarHBondContact O-N 2.87Å; A315-N317 VanDerWaalsContact O-N 3.16Å
316	K	98.3	Very high	98.7	Very high	196 Å²	196	50.4 Å²	50.4	85%	0.852	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	25.4	-179.9	-52.7	179.3	-177.3	177.7	0	113.8	N279	N279-K316 PolarHBondContact OD1-N 2.89Å
317	N	98.8	Very high	98.7	Very high	10 Å²	10	47.8 Å²	47.8	5%	0.053	25%	0.251	C	S	.	.			trans	-67.4	166.9	170.6	72.9	75.9	0	0	0	110.9	R275 P312 Y314 A315 A319	R275-N317 VanDerWaalsContact CA-OD1 3.25Å; R275-N317 WeakPolarHBondContact CA-OD1 3.1Å; R275-N317 WeakPolarHBondContact CB-OD1 3.38Å; R275-N317 PolarHBondContact O-ND2 3.03Å; P312-N317 HydrophobicContact CB-CB 3.74Å; P312-N317 HydrophobicContact CG-CB 3.94Å; Y314-N317 HydrophobicContact CD2-CB 3.94Å; Y314-N317 HydrophobicContact CE2-CB 3.48Å; Y314-N317 VanDerWaalsContact CE2-CB 3.48Å; Y314-N317 PolarHBondContact O-ND2 2.84Å; A315-N317 PolarHBondContact O-N 2.87Å; A315-N317 VanDerWaalsContact O-N 3.16Å; N317-A319 VanDerWaalsContact OD1-CB 3.24Å; N317-A319 WeakPolarHBondContact OD1-CB 3.39Å; N317-A319 PolarHBondContact OD1-N 3.06Å
318	K	98.5	Very high	98.7	Very high	192 Å²	192	47 Å²	47	84%	0.835	25%	0.247	S	C	*	.			trans	-110.5	26	-175.7	-60.8	-179.7	-177.5	175.8	0	112.8	V320	K318-V320 PolarHBondContact O-N 3.25Å
319	A	98.2	Very high	98.7	Very high	17 Å²	17	46.5 Å²	46.5	14%	0.14	24%	0.242	C	C	.	.			trans	-56.5	140.2	-179.2	0	0	0	0	0	111.8	R275 P312 N317	R275-A319 HydrophobicContact CB-CB 4.01Å; P312-A319 HydrophobicContact CG-CB 4.25Å; N317-A319 VanDerWaalsContact OD1-CB 3.24Å; N317-A319 WeakPolarHBondContact OD1-CB 3.39Å; N317-A319 PolarHBondContact OD1-N 3.06Å
320	V	98.4	Very high	98.7	Very high	93 Å²	93	46.3 Å²	46.3	56%	0.564	24%	0.241	S	C	*	.			trans	-96.6	144.4	-177.4	179.5	0	0	0	0	109.1	K318	K318-V320 PolarHBondContact O-N 3.25Å
321	G	98.4	Very high	98.7	Very high	26 Å²	26	41.4 Å²	41.4	27%	0.268	22%	0.215	S	C	.	.			trans	111.9	162.7	171.1	0	0	0	0	0	114.4	Y274	Y274-G321 PolarHBondContact N-O 3.3Å
322	V	98.8	Very high	98.7	Very high	60 Å²	60	42.1 Å²	42.1	36%	0.364	22%	0.219	S	C	.	.	B	Isolated β-bridge	trans	-129.9	135	177.4	-175	0	0	0	0	106.8	G271 V272 R273 H327	G271-V322 VanDerWaalsContact C-CG1 3.46Å; G271-V322 WeakPolarHBondContact O-CG1 3.31Å; V272-V322 WeakPolarHBondContact O-CA 3.43Å; R273-V322 HydrophobicContact CG-CG2 4.28Å; V322-H327 PolarHBondContact O-CE1 2.94Å
323	M	98.9	Very high	98.7	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	21%	0.214	C	C	.	.			trans	-62.8	136.1	178.9	-65.4	169.9	-172.7	0	0	110.3	V268 K269 P270 G271 V272 Y274 L277 F329 V369	V268-M323 HydrophobicContact CB-SD 4.3Å; V268-M323 HydrophobicContact CG1-CE 4.47Å; V268-M323 HydrophobicContact CG1-SD 3.78Å; V268-M323 HydrophobicContact CG2-CE 4.27Å; V268-M323 HydrophobicContact CG2-SD 4.45Å; K269-M323 WeakPolarHBondContact O-CB 3.42Å; P270-M323 WeakPolarHBondContact CA-O 3.49Å; G271-M323 PolarHBondContact N-O 3Å; V272-M323 HydrophobicContact CB-SD 3.84Å; V272-M323 HydrophobicContact CG1-CE 4.24Å; V272-M323 HydrophobicContact CG1-SD 4.07Å; V272-M323 WeakPolarHBondContact O-CG 3.48Å; V272-M323 PolarHBondContact O-N 2.88Å; Y274-M323 HydrophobicContact CD1-CE 3.86Å; Y274-M323 HydrophobicContact CD1-CG 4.25Å; Y274-M323 HydrophobicContact CD2-CG 4.49Å; Y274-M323 HydrophobicContact CE1-CE 4.04Å; Y274-M323 HydrophobicContact CE1-CG 3.79Å; Y274-M323 HydrophobicContact CE2-CG 4.02Å; Y274-M323 HydrophobicContact CG-CE 4.49Å; L277-M323 HydrophobicContact CD1-CE 3.55Å; L277-M323 HydrophobicContact CD2-CE 4.02Å; L277-M323 HydrophobicContact CG-CE 3.87Å; M323-F329 HydrophobicContact CE-CE2 4.4Å; M323-F329 HydrophobicContact CE-CZ 3.86Å; M323-F329 HydrophobicContact SD-CZ 4.43Å; M323-V369 HydrophobicContact CB-CG1 4.38Å; M323-V369 HydrophobicContact CB-CG2 4.22Å; M323-V369 HydrophobicContact CG-CG2 4.46Å
324	K	98.8	Very high	98.7	Very high	116 Å²	116	41.4 Å²	41.4	50%	0.504	21%	0.214	S	C	.	.			trans	-135.9	152.9	175	-61.2	-178.3	-179.7	-179.8	0	109.3	I135 G326 H327 V369	I135-K324 HydrophobicContact CD1-CD 4.36Å; K324-G326 PolarHBondContact O-N 2.8Å; K324-H327 PolarHBondContact N-ND1 3.34Å; K324-H327 WeakPolarHBondContact O-CB 3.47Å; K324-H327 PolarHBondContact O-N 3.24Å; K324-H327 VanDerWaalsContact O-N 3.12Å; K324-V369 VanDerWaalsContact O-CB 3.27Å; K324-V369 WeakPolarHBondContact O-CB 3.29Å; K324-V369 WeakPolarHBondContact O-CG1 3.48Å
325	P	98.9	Very high	98.7	Very high	35 Å²	35	38.4 Å²	38.4	23%	0.227	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.9	136.8	172.9	-24.6	34.4	0	0	0	111.3	P270 V369 E371	P270-P325 HydrophobicContact CB-CG 4.45Å; P270-P325 HydrophobicContact CG-CG 3.77Å; P325-V369 WeakPolarHBondContact CA-O 3.42Å; P325-E371 VanDerWaalsContact CB-OE1 3.25Å; P325-E371 WeakPolarHBondContact CB-OE1 3.45Å; P325-E371 WeakPolarHBondContact CG-OE1 3.32Å; P325-E371 WeakPolarHBondContact CG-OE2 3.22Å
326	G	98.8	Very high	98.7	Very high	8 Å²	8	37.1 Å²	37.1	8%	0.082	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	-3	-178.2	0	0	0	0	0	115.4	L136 K324 V369	L136-G326 WeakPolarHBondContact CD1-O 3.27Å; L136-G326 PolarHBondContact N-O 3.16Å; K324-G326 PolarHBondContact O-N 2.8Å; G326-V369 PolarHBondContact N-O 3.08Å
327	H	98.9	Very high	98.6	Very high	6 Å²	6	29.2 Å²	29.2	3%	0.028	16%	0.158	C	C	.	.			trans	-71.3	136.7	166.8	-70.6	-172	0	0	0	110.2	I133 Y274 V322 K324 V369	I133-H327 HydrophobicContact CG2-CB 4.31Å; Y274-H327 AromaticContact CZ-ND1 3.85Å; Y274-H327 WeakPolarHBondContact OH-CB 3.17Å; Y274-H327 PolarHBondContact OH-ND1 3.45Å; V322-H327 PolarHBondContact O-CE1 2.94Å; K324-H327 PolarHBondContact N-ND1 3.34Å; K324-H327 WeakPolarHBondContact O-CB 3.47Å; K324-H327 PolarHBondContact O-N 3.24Å; K324-H327 VanDerWaalsContact O-N 3.12Å; H327-V369 HydrophobicContact CB-CB 4.37Å; H327-V369 HydrophobicContact CB-CG2 3.98Å; H327-V369 PolarHBondContact O-N 3Å
328	V	98.9	Very high	97.4	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.018	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	129.7	172	-177.9	0	0	0	0	110.6	L136 M144 I301 T366 L367 L368 L377	L136-V328 HydrophobicContact CD1-CB 4.46Å; L136-V328 HydrophobicContact CD1-CG2 4.28Å; L136-V328 HydrophobicContact CD2-CB 4.32Å; L136-V328 HydrophobicContact CD2-CG2 3.66Å; M144-V328 HydrophobicContact CE-CG1 3.54Å; I301-V328 HydrophobicContact CG2-CG1 4.14Å; I301-V328 PolarHBondContact N-O 3.09Å; I301-V328 WeakPolarHBondContact O-CG1 3.41Å; V328-T366 HydrophobicContact CG1-CG2 3.57Å; V328-L367 VanDerWaalsContact CA-O 3.24Å; V328-L367 WeakPolarHBondContact CA-O 3.45Å; V328-L368 HydrophobicContact CG2-CB 4.09Å; V328-L368 HydrophobicContact CG2-CD1 3.57Å; V328-L368 HydrophobicContact CG2-CG 4.42Å; V328-L377 HydrophobicContact CG1-CD1 4.21Å
329	F	98.9	Very high	95.9	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160	165.3	-174.8	69.3	-77.3	0	0	0	111.5	V268 Y274 L277 H299 P309 V311 M323 I331 L367 V369	V268-F329 HydrophobicContact CG1-CE1 4.12Å; V268-F329 HydrophobicContact CG1-CZ 3.87Å; V268-F329 HydrophobicContact CG2-CZ 4.11Å; Y274-F329 HydrophobicContact CD1-CD2 4.32Å; Y274-F329 HydrophobicContact CD1-CE2 4.16Å; Y274-F329 HydrophobicContact CD1-CZ 4.4Å; Y274-F329 AromaticContact CE1-CD1 3.78Å; Y274-F329 HydrophobicContact CE1-CD1 3.78Å; Y274-F329 AromaticContact CE1-CD2 3.85Å; Y274-F329 HydrophobicContact CE1-CD2 3.85Å; Y274-F329 AromaticContact CE1-CE1 3.75Å; Y274-F329 HydrophobicContact CE1-CE1 3.75Å; Y274-F329 AromaticContact CE1-CE2 3.82Å; Y274-F329 HydrophobicContact CE1-CE2 3.82Å; Y274-F329 AromaticContact CE1-CG 3.84Å; Y274-F329 HydrophobicContact CE1-CG 3.84Å; Y274-F329 AromaticContact CE1-CZ 3.77Å; Y274-F329 HydrophobicContact CE1-CZ 3.77Å; L277-F329 HydrophobicContact CD1-CE2 3.9Å; L277-F329 HydrophobicContact CD1-CZ 4.43Å; H299-F329 CarbonylContact O-C 3.54Å; H299-F329 WeakPolarHBondContact O-CA 3.3Å; H299-F329 WeakPolarHBondContact O-CB 3.4Å; P309-F329 HydrophobicContact CG-CB 4.24Å; V311-F329 HydrophobicContact CG2-CD2 3.9Å; V311-F329 HydrophobicContact CG2-CE2 4.47Å; M323-F329 HydrophobicContact CE-CE2 4.4Å; M323-F329 HydrophobicContact CE-CZ 3.86Å; M323-F329 HydrophobicContact SD-CZ 4.43Å; F329-I331 HydrophobicContact CD2-CG1 4.26Å; F329-I331 HydrophobicContact CE2-CD1 4.01Å; F329-I331 HydrophobicContact CE2-CG1 3.66Å; F329-L367 HydrophobicContact CE1-CB 4.49Å; F329-L367 HydrophobicContact CE2-CD1 4.35Å; F329-L367 HydrophobicContact CZ-CD1 4.24Å; F329-L367 PolarHBondContact N-O 3.35Å; F329-L367 VanDerWaalsContact N-O 3.12Å; F329-L367 PolarHBondContact O-N 3.39Å; F329-V369 HydrophobicContact CD1-CG2 4.36Å; F329-V369 HydrophobicContact CE1-CG2 3.65Å
330	T	98.9	Very high	95.1	Very high	0 Å²	0	25 Å²	25	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	151.4	177.3	69.3	0	0	0	0	111.9	D236 G298 H299 I301 E332 E364 H365	D236-T330 HydrophobicContact CB-CG2 4.24Å; G298-T330 WeakPolarHBondContact CA-OG1 3.35Å; H299-T330 PolarHBondContact CD2-OG1 2.93Å; H299-T330 PolarHBondContact N-OG1 2.92Å; H299-T330 PolarHBondContact O-N 2.92Å; I301-T330 HydrophobicContact CB-CG2 4.48Å; I301-T330 HydrophobicContact CG2-CG2 3.83Å; T330-E332 PolarHBondContact OG1-OE1 3.47Å; T330-E364 WeakPolarHBondContact CB-OE1 3.37Å; T330-E364 WeakPolarHBondContact CG2-OE1 3.31Å; T330-E364 PolarHBondContact OG1-OE1 2.8Å; T330-H365 WeakPolarHBondContact CA-O 3.44Å
331	I	98.9	Very high	95	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	123.5	160.7	-55.7	179.6	0	0	0	105.6	L261 A264 I265 V268 L277 I281 F329 E364 H365 L367	L261-I331 HydrophobicContact CD1-CB 3.73Å; L261-I331 HydrophobicContact CD1-CG2 3.68Å; L261-I331 WeakPolarHBondContact CD1-O 3.33Å; A264-I331 HydrophobicContact CB-CD1 4.17Å; A264-I331 HydrophobicContact CB-CG2 4.16Å; I265-I331 HydrophobicContact CG1-CD1 4.35Å; V268-I331 HydrophobicContact CG2-CD1 3.87Å; L277-I331 HydrophobicContact CD1-CD1 3.57Å; L277-I331 HydrophobicContact CD1-CG1 3.98Å; L277-I331 HydrophobicContact CD2-CD1 4.15Å; L277-I331 HydrophobicContact CG-CD1 4.41Å; I281-I331 HydrophobicContact CD1-CG2 4.03Å; F329-I331 HydrophobicContact CD2-CG1 4.26Å; F329-I331 HydrophobicContact CE2-CD1 4.01Å; F329-I331 HydrophobicContact CE2-CG1 3.66Å; I331-E364 WeakPolarHBondContact O-CA 3.38Å; I331-H365 PolarHBondContact N-O 2.88Å; I331-H365 PolarHBondContact O-N 3.25Å; I331-L367 HydrophobicContact CB-CD1 4.45Å; I331-L367 HydrophobicContact CD1-CD1 3.45Å; I331-L367 VanDerWaalsContact CD1-CD1 3.45Å; I331-L367 HydrophobicContact CG1-CD1 3.69Å
332	E	98.9	Very high	95	Very high	15 Å²	15	27.3 Å²	27.3	7%	0.07	16%	0.161	C	C	.	.			trans	-142.3	53.9	-165.4	62.2	-177.4	84.3	0	0	112.9	G298 H299 H313 T330 M334 Q362 F363 E364	G298-E332 WeakPolarHBondContact CA-OE1 3.45Å; H299-E332 IonicContact CD2-OE1 3.97Å; H299-E332 PolarHBondContact CD2-OE1 2.99Å; H299-E332 IonicContact NE2-OE1 3.18Å; H299-E332 PolarHBondContact NE2-OE1 2.67Å; H313-E332 VanDerWaalsContact CE1-C 3.46Å; H313-E332 VanDerWaalsContact CE1-CG 3.42Å; H313-E332 WeakPolarHBondContact CE1-CG 3.42Å; H313-E332 PolarHBondContact CE1-O 3.32Å; H313-E332 VanDerWaalsContact CE1-O 3.26Å; H313-E332 PolarHBondContact NE2-N 2.75Å; H313-E332 VanDerWaalsContact NE2-N 3.15Å; T330-E332 PolarHBondContact OG1-OE1 3.47Å; E332-M334 HydrophobicContact CG-CE 4.2Å; E332-M334 WeakPolarHBondContact O-CE 3.46Å; E332-M334 PolarHBondContact O-N 3.46Å; E332-Q362 PolarHBondContact O-NE2 2.85Å; E332-F363 CarbonylContact C-O 3.6Å; E332-F363 VanDerWaalsContact CA-O 3.31Å; E332-F363 WeakPolarHBondContact CA-O 3.43Å; E332-E364 HydrophobicContact CB-CB 3.7Å; E332-E364 HydrophobicContact CB-CG 3.69Å
333	P	98.9	Very high	95	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.152	C	C	.	.			trans	-62.9	122.8	-169.5	27.9	-36.8	0	0	0	112.5	T257 C260 L261 I281 H313 I335 F363	T257-P333 WeakPolarHBondContact CG2-O 3.18Å; C260-P333 HydrophobicContact CB-CG 4.45Å; L261-P333 HydrophobicContact CB-CG 3.91Å; I281-P333 HydrophobicContact CD1-CB 4.27Å; I281-P333 HydrophobicContact CG2-CB 3.89Å; H313-P333 HydrophobicContact CB-CB 4.34Å; P333-I335 HydrophobicContact CB-CD1 4.33Å; P333-F363 WeakPolarHBondContact CD-O 3.28Å
334	M	98.9	Very high	95	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.01	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	116.2	168.6	-64.9	149.2	-110.8	0	0	109.4	I206 C207 V293 Y296 E332 Q362	I206-M334 HydrophobicContact CG2-CB 3.9Å; I206-M334 HydrophobicContact CG2-CG 3.9Å; I206-M334 HydrophobicContact CG2-SD 3.59Å; I206-M334 VanDerWaalsContact CG2-SD 3.59Å; C207-M334 HydrophobicContact CB-SD 3.96Å; V293-M334 HydrophobicContact CB-CB 3.92Å; V293-M334 HydrophobicContact CG2-CB 3.76Å; V293-M334 PolarHBondContact N-O 2.86Å; V293-M334 VanDerWaalsContact N-O 3.11Å; Y296-M334 VanDerWaalsContact CB-CE 3.44Å; Y296-M334 HydrophobicContact CD2-SD 4.31Å; Y296-M334 HydrophobicContact CG-CE 4.41Å; Y296-M334 HydrophobicContact CG-SD 4.19Å; E332-M334 HydrophobicContact CG-CE 4.2Å; E332-M334 WeakPolarHBondContact O-CE 3.46Å; E332-M334 PolarHBondContact O-N 3.46Å; M334-Q362 HydrophobicContact CG-CB 4.03Å; M334-Q362 VanDerWaalsContact CG-CD 3.49Å; M334-Q362 HydrophobicContact CG-CG 3.66Å
335	I	98.9	Very high	95	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	135.7	-176.4	-54.2	-60.1	0	0	0	108.9	L253 T257 I281 A285 F290 S291 V292 P333 S360 A361	L253-I335 HydrophobicContact CD1-CB 4.49Å; L253-I335 HydrophobicContact CD1-CG2 4.01Å; T257-I335 HydrophobicContact CG2-CB 4.35Å; T257-I335 HydrophobicContact CG2-CG1 3.91Å; T257-I335 WeakPolarHBondContact OG1-CB 3.48Å; I281-I335 HydrophobicContact CG2-CD1 4.14Å; A285-I335 HydrophobicContact CB-CD1 3.88Å; A285-I335 HydrophobicContact CB-CG2 4.3Å; F290-I335 HydrophobicContact CB-CG2 3.46Å; F290-I335 VanDerWaalsContact CB-CG2 3.46Å; F290-I335 HydrophobicContact CD2-CG2 4.39Å; F290-I335 HydrophobicContact CG-CG2 4.06Å; S291-I335 WeakPolarHBondContact O-CA 3.45Å; V292-I335 HydrophobicContact CB-CD1 4.28Å; V292-I335 HydrophobicContact CG1-CD1 4.14Å; V292-I335 HydrophobicContact CG2-CD1 3.76Å; P333-I335 HydrophobicContact CB-CD1 4.33Å; I335-S360 CarbonylContact O-C 3.57Å; I335-S360 WeakPolarHBondContact O-CA 3.41Å; I335-S360 PolarHBondContact O-OG 3.43Å; I335-A361 PolarHBondContact N-O 3.49Å; I335-A361 PolarHBondContact O-N 3.27Å
336	C	98.7	Very high	94.9	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	145	-179	-48.8	0	0	0	0	111.5	F290 S291 V293 T354 R359	F290-C336 WeakPolarHBondContact CB-O 3.17Å; S291-C336 PolarHBondContact N-O 3.24Å; S291-C336 VanDerWaalsContact N-O 3.15Å; S291-C336 PolarHBondContact O-N 3.14Å; V293-C336 WeakPolarHBondContact CG2-SG 3.34Å; C336-T354 HydrophobicContact CB-CG2 4.15Å; C336-R359 WeakPolarHBondContact CA-O 3.05Å
337	E	95.6	Very high	94.9	Very high	30 Å²	30	27.3 Å²	27.3	14%	0.14	16%	0.164	C	C	.	.			trans	-61.1	140.6	170.8	-77.8	-169.9	127.8	0	0	112.1	L253 F290 G339 K358 R359	L253-E337 HydrophobicContact CB-CG 4.25Å; L253-E337 HydrophobicContact CD1-CG 3.97Å; L253-E337 HydrophobicContact CD2-CG 3.73Å; L253-E337 HydrophobicContact CG-CG 4.18Å; F290-E337 HydrophobicContact CE1-CG 4.21Å; E337-G339 PolarHBondContact O-N 2.78Å; E337-K358 HydrophobicContact CB-CB 4.15Å; E337-R359 VanDerWaalsContact CD-NE 3.27Å; E337-R359 VanDerWaalsContact CD-NH2 3.27Å; E337-R359 HydrophobicContact CG-CB 4.27Å; E337-R359 PolarHBondContact N-O 2.98Å; E337-R359 IonicContact OE1-CZ 3.24Å; E337-R359 IonicContact OE1-NE 2.81Å; E337-R359 PolarHBondContact OE1-NE 3.49Å; E337-R359 IonicContact OE1-NH2 2.74Å; E337-R359 PolarHBondContact OE1-NH2 2.87Å; E337-R359 WeakPolarHBondContact OE2-CB 3.35Å; E337-R359 IonicContact OE2-CZ 3.82Å; E337-R359 IonicContact OE2-NE 3Å; E337-R359 PolarHBondContact OE2-NE 2.81Å; E337-R359 IonicContact OE2-NH2 3.94Å; E337-R359 PolarHBondContact OE2-NH2 3.27Å; E337-R359 VanDerWaalsContact OE2-NH2 3.11Å
338	A	72.5	Confident	94.9	Very high	53 Å²	53	28.5 Å²	28.5	44%	0.438	17%	0.171	S	C	.	.	S	Bend	trans	-17.7	117	178.2	0	0	0	0	0	114.9	K358	A338-K358 WeakPolarHBondContact O-CD 3.5Å; A338-K358 VanDerWaalsContact O-CE 3.28Å; A338-K358 WeakPolarHBondContact O-CE 3.23Å; A338-K358 PolarHBondContact O-NZ 2.86Å
339	G	67.5	Low	94.8	Very high	64 Å²	64	30.9 Å²	30.9	66%	0.66	20%	0.196	S	C	*	.	S	Bend	trans	158.2	-100	-176.7	0	0	0	0	0	110.5	E337 D356	E337-G339 PolarHBondContact O-N 2.78Å; G339-D356 WeakPolarHBondContact CA-OD2 3.37Å
340	G	82.4	Confident	94.8	Very high	13 Å²	13	33.4 Å²	33.4	13%	0.134	21%	0.206	C	C	.	.			trans	-138.2	160.3	177.3	0	0	0	0	0	114.5	S291 Q342 D356	S291-G340 PolarHBondContact OG-O 3.3Å; G340-Q342 VanDerWaalsContact C-N 3.32Å; G340-D356 PolarHBondContact N-OD2 3.43Å
341	W	95.5	Very high	94.8	Very high	87 Å²	87	33.6 Å²	33.6	33%	0.33	21%	0.207	S	C	.	.			trans	-87.1	-5.4	173.2	55.7	-90.7	0	0	0	113	V292 R294	V292-W341 WeakPolarHBondContact O-CB 3.37Å; R294-W341 HydrophobicContact CB-CD2 4.47Å; R294-W341 HydrophobicContact CB-CE3 3.69Å; R294-W341 HydrophobicContact CB-CZ3 3.88Å; R294-W341 HydrophobicContact CG-CD2 3.87Å; R294-W341 HydrophobicContact CG-CE3 3.58Å; R294-W341 HydrophobicContact CG-CG 4.29Å; R294-W341 HydrophobicContact CG-CZ3 4.12Å
342	Q	98.4	Very high	94.8	Very high	81 Å²	81	33.6 Å²	33.6	38%	0.379	21%	0.207	S	C	.	.			trans	-72.3	134.5	-171.8	-61.1	91.4	-39.6	0	0	110.8	G340 R355	G340-Q342 VanDerWaalsContact C-N 3.32Å; Q342-R355 HydrophobicContact CB-CB 4.32Å; Q342-R355 HydrophobicContact CB-CG 4.07Å; Q342-R355 WeakPolarHBondContact O-CG 3.4Å; Q342-R355 PolarHBondContact O-N 3.34Å
343	D	98.5	Very high	94.8	Very high	30 Å²	30	32.9 Å²	32.9	16%	0.16	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	158.2	176.4	57.7	-70.1	0	0	0	111.6	I206 S295 V353 R355	I206-D343 HydrophobicContact CD1-CB 3.53Å; S295-D343 VanDerWaalsContact CB-OD1 3.3Å; S295-D343 WeakPolarHBondContact CB-OD1 3.44Å; S295-D343 VanDerWaalsContact CB-OD2 3.26Å; S295-D343 WeakPolarHBondContact CB-OD2 3.15Å; S295-D343 VanDerWaalsContact OG-CG 3.25Å; S295-D343 PolarHBondContact OG-OD1 3.42Å; S295-D343 PolarHBondContact OG-OD2 2.65Å; D343-V353 CarbonylContact C-O 3.53Å; D343-V353 VanDerWaalsContact CA-O 3.25Å; D343-V353 WeakPolarHBondContact CA-O 3.43Å; D343-R355 VanDerWaalsContact C-CG 3.48Å; D343-R355 WeakPolarHBondContact O-CD 3.32Å
344	E	98.4	Very high	94.8	Very high	51 Å²	51	32.9 Å²	32.9	24%	0.238	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	155.8	162.2	63.6	-176.8	-120.1	0	0	110.2	Y85 T88 V353 R355	Y85-E344 PolarHBondContact OH-OE1 3.47Å; T88-E344 HydrophobicContact CG2-CG 3.85Å; T88-E344 WeakPolarHBondContact CG2-OE1 3.35Å; E344-V353 HydrophobicContact CG-CG2 3.94Å; E344-V353 PolarHBondContact N-O 3.44Å; E344-V353 WeakPolarHBondContact O-CG2 3.34Å; E344-V353 PolarHBondContact O-N 3.27Å; E344-R355 HydrophobicContact CB-CG 4.02Å; E344-R355 HydrophobicContact CG-CG 3.94Å; E344-R355 IonicContact OE2-CZ 3.95Å; E344-R355 IonicContact OE2-NE 3.17Å; E344-R355 PolarHBondContact OE2-NE 2.9Å; E344-R355 VanDerWaalsContact OE2-NE 3.1Å; E344-R355 IonicContact OE2-NH2 3.03Å
345	T	98.8	Very high	94.7	Very high	64 Å²	64	40 Å²	40	39%	0.393	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	135.3	-177.7	-44.6	0	0	0	0	110.2	T351	T345-T351 WeakPolarHBondContact CA-O 3.32Å
346	W	98.5	Very high	94.7	Very high	12 Å²	12	43 Å²	43	5%	0.045	25%	0.246	C	C	.	.			trans	-63.5	163.8	171.8	-75.8	6.4	0	0	0	112.2	W82 Y85 Y87 L91 P93 D348 G349 T351 V353	W82-W346 HydrophobicContact CZ3-CE3 4.34Å; Y85-W346 AromaticContact CE1-CD1 3.58Å; Y85-W346 HydrophobicContact CE1-CG 4.16Å; Y85-W346 AromaticContact CZ-CD1 3.93Å; Y87-W346 HydrophobicContact CD1-CD2 4.31Å; Y87-W346 AromaticContact CD1-CE2 3.63Å; Y87-W346 HydrophobicContact CD1-CH2 4.4Å; Y87-W346 AromaticContact CD1-CZ2 3.69Å; Y87-W346 HydrophobicContact CD1-CZ2 3.69Å; Y87-W346 AromaticContact CD1-NE1 3.77Å; Y87-W346 AromaticContact CE1-CD2 3.98Å; Y87-W346 HydrophobicContact CE1-CD2 3.98Å; Y87-W346 AromaticContact CE1-CE2 3.76Å; Y87-W346 HydrophobicContact CE1-CE3 4.3Å; Y87-W346 HydrophobicContact CE1-CH2 4.24Å; Y87-W346 AromaticContact CE1-CZ2 3.9Å; Y87-W346 HydrophobicContact CE1-CZ2 3.9Å; Y87-W346 HydrophobicContact CE1-CZ3 4.42Å; L91-W346 HydrophobicContact CB-CH2 4.3Å; L91-W346 HydrophobicContact CB-CZ2 4.4Å; L91-W346 HydrophobicContact CD2-CH2 4.03Å; L91-W346 HydrophobicContact CG-CH2 4.18Å; P93-W346 HydrophobicContact CB-CE3 4.43Å; P93-W346 HydrophobicContact CB-CZ3 3.93Å; P93-W346 HydrophobicContact CG-CZ3 4.32Å; W346-D348 PolarHBondContact O-N 3.37Å; W346-G349 PolarHBondContact O-N 2.91Å; W346-T351 HydrophobicContact CD2-CG2 3.8Å; W346-T351 HydrophobicContact CE3-CG2 3.68Å; W346-T351 HydrophobicContact CG-CG2 4.27Å; W346-T351 HydrophobicContact CH2-CG2 4.46Å; W346-T351 HydrophobicContact CZ3-CG2 4.03Å; W346-T351 PolarHBondContact N-O 3.17Å; W346-V353 HydrophobicContact CD2-CG1 4.47Å; W346-V353 HydrophobicContact CZ2-CG1 4.02Å; W346-V353 VanDerWaalsContact NE1-CG1 3.29Å
347	P	98.3	Very high	94.6	Very high	63 Å²	63	44 Å²	44	41%	0.409	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-8.5	179.7	-20.5	32.7	0	0	0	115.4	W82 Y85 G349	W82-P347 HydrophobicContact CB-CG 4.16Å; W82-P347 HydrophobicContact CD2-CB 3.71Å; W82-P347 HydrophobicContact CD2-CG 3.82Å; W82-P347 HydrophobicContact CE3-CB 4.33Å; W82-P347 HydrophobicContact CE3-CG 4.14Å; W82-P347 HydrophobicContact CG-CB 3.79Å; W82-P347 HydrophobicContact CG-CG 3.8Å; W82-P347 HydrophobicContact CZ2-CB 4.37Å; Y85-P347 HydrophobicContact CD1-CG 4.11Å; Y85-P347 HydrophobicContact CD2-CG 3.7Å; Y85-P347 HydrophobicContact CE2-CG 4.3Å; Y85-P347 HydrophobicContact CG-CG 3.62Å; P347-G349 PolarHBondContact O-N 3.27Å
348	D	97.8	Very high	94.7	Very high	30 Å²	30	46.9 Å²	46.9	16%	0.16	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-16.4	167.4	52.3	40.4	0	0	0	113.6	W82 I210 W346 W350 T351	W82-D348 HydrophobicContact CH2-CB 3.57Å; W82-D348 HydrophobicContact CZ2-CB 3.88Å; I210-D348 HydrophobicContact CD1-CB 3.84Å; W346-D348 PolarHBondContact O-N 3.37Å; D348-W350 VanDerWaalsContact C-N 3.33Å; D348-W350 PolarHBondContact OD1-N 3.17Å; D348-T351 PolarHBondContact OD1-N 3.37Å; D348-T351 WeakPolarHBondContact OD2-CB 3.22Å; D348-T351 PolarHBondContact OD2-OG1 3.14Å
349	G	98.1	Very high	95.9	Very high	54 Å²	54	46 Å²	46	56%	0.557	25%	0.254	S	S	*	.	S	Bend	trans	80.9	7	-178.7	0	0	0	0	0	114.9	W346 P347	W346-G349 PolarHBondContact O-N 2.91Å; P347-G349 PolarHBondContact O-N 3.27Å
350	W	98.6	Very high	97.4	Very high	53 Å²	53	43.2 Å²	43.2	20%	0.201	22%	0.224	C	C	.	.			trans	-128.8	-53.8	-175	-73.3	101.8	0	0	0	113.4	Y191 Y192 F194 H208 I210 D348 A352	Y191-W350 HydrophobicContact CD1-CH2 4.5Å; Y191-W350 WeakPolarHBondContact O-CH2 3.27Å; Y191-W350 WeakPolarHBondContact O-CZ2 3.37Å; Y192-W350 WeakPolarHBondContact O-CZ2 3.24Å; F194-W350 HydrophobicContact CB-CD2 4.37Å; F194-W350 HydrophobicContact CB-CH2 3.89Å; F194-W350 HydrophobicContact CB-CZ2 3.63Å; F194-W350 HydrophobicContact CB-CZ3 4.38Å; F194-W350 HydrophobicContact CD2-CB 4.37Å; F194-W350 AromaticContact CD2-CD2 3.57Å; F194-W350 HydrophobicContact CD2-CD2 3.57Å; F194-W350 AromaticContact CD2-CE2 3.91Å; F194-W350 AromaticContact CD2-CE3 3.77Å; F194-W350 HydrophobicContact CD2-CE3 3.77Å; F194-W350 AromaticContact CD2-CG 3.83Å; F194-W350 HydrophobicContact CD2-CG 3.83Å; F194-W350 HydrophobicContact CD2-CZ2 4.38Å; F194-W350 HydrophobicContact CD2-CZ3 4.25Å; F194-W350 HydrophobicContact CE2-CB 4.45Å; F194-W350 HydrophobicContact CE2-CD2 4.4Å; F194-W350 HydrophobicContact CE2-CE3 4.49Å; F194-W350 HydrophobicContact CE2-CG 4.38Å; F194-W350 HydrophobicContact CG-CD2 4.46Å; H208-W350 HydrophobicContact CB-CE3 4.45Å; H208-W350 WeakPolarHBondContact CB-O 3.08Å; I210-W350 HydrophobicContact CD1-CB 4.04Å; I210-W350 HydrophobicContact CD1-CG 4.38Å; I210-W350 HydrophobicContact CG1-CB 4.19Å; D348-W350 VanDerWaalsContact C-N 3.33Å; D348-W350 PolarHBondContact OD1-N 3.17Å; W350-A352 PolarHBondContact O-N 2.93Å
351	T	98.8	Very high	98.2	Very high	4 Å²	4	42.6 Å²	42.6	3%	0.025	22%	0.218	C	C	.	.			trans	-65.4	108.6	-170.5	-52.5	0	0	0	0	109.5	V205 T345 W346 D348 V353	V205-T351 HydrophobicContact CB-CG2 4.47Å; V205-T351 HydrophobicContact CG1-CG2 3.72Å; V205-T351 HydrophobicContact CG2-CG2 3.89Å; T345-T351 WeakPolarHBondContact CA-O 3.32Å; W346-T351 HydrophobicContact CD2-CG2 3.8Å; W346-T351 HydrophobicContact CE3-CG2 3.68Å; W346-T351 HydrophobicContact CG-CG2 4.27Å; W346-T351 HydrophobicContact CH2-CG2 4.46Å; W346-T351 HydrophobicContact CZ3-CG2 4.03Å; W346-T351 PolarHBondContact N-O 3.17Å; D348-T351 PolarHBondContact OD1-N 3.37Å; D348-T351 WeakPolarHBondContact OD2-CB 3.22Å; D348-T351 PolarHBondContact OD2-OG1 3.14Å; T351-V353 HydrophobicContact CG2-CG1 4.1Å
352	A	98.8	Very high	98.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	125.7	178.1	0	0	0	0	0	109.4	V205 I206 C207 Y296 W350	V205-A352 CarbonylContact C-O 3.59Å; V205-A352 WeakPolarHBondContact CA-O 3.37Å; I206-A352 HydrophobicContact CB-CB 4.35Å; I206-A352 PolarHBondContact N-O 3.04Å; C207-A352 PolarHBondContact O-N 3.16Å; C207-A352 VanDerWaalsContact O-N 3.16Å; Y296-A352 HydrophobicContact CE2-CB 3.71Å; Y296-A352 VanDerWaalsContact OH-CB 3.26Å; Y296-A352 WeakPolarHBondContact OH-CB 3.44Å; W350-A352 PolarHBondContact O-N 2.93Å
353	V	98.8	Very high	98.4	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	152.3	-178.2	-63.3	0	0	0	0	112	T88 E204 V205 D343 E344 W346 T351	T88-V353 HydrophobicContact CG2-CG2 3.97Å; E204-V353 WeakPolarHBondContact O-CA 3.44Å; V205-V353 HydrophobicContact CG2-CG1 3.98Å; D343-V353 CarbonylContact C-O 3.53Å; D343-V353 VanDerWaalsContact CA-O 3.25Å; D343-V353 WeakPolarHBondContact CA-O 3.43Å; E344-V353 HydrophobicContact CG-CG2 3.94Å; E344-V353 PolarHBondContact N-O 3.44Å; E344-V353 WeakPolarHBondContact O-CG2 3.34Å; E344-V353 PolarHBondContact O-N 3.27Å; W346-V353 HydrophobicContact CD2-CG1 4.47Å; W346-V353 HydrophobicContact CZ2-CG1 4.02Å; W346-V353 VanDerWaalsContact NE1-CG1 3.29Å; T351-V353 HydrophobicContact CG2-CG1 4.1Å
354	T	98.6	Very high	98.4	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	136.4	169	61.5	0	0	0	0	109.8	T88 E204 I206 C336 D356 G357 K358	T88-T354 WeakPolarHBondContact CB-O 3.26Å; T88-T354 WeakPolarHBondContact CG2-O 3.3Å; T88-T354 PolarHBondContact OG1-O 3.03Å; E204-T354 PolarHBondContact O-N 3.18Å; I206-T354 HydrophobicContact CD1-CG2 3.9Å; I206-T354 HydrophobicContact CG1-CG2 3.72Å; C336-T354 HydrophobicContact CB-CG2 4.15Å; T354-D356 PolarHBondContact O-N 2.8Å; T354-G357 PolarHBondContact O-N 2.8Å; T354-G357 WeakPolarHBondContact OG1-CA 3.38Å; T354-G357 PolarHBondContact OG1-N 3.12Å; T354-K358 WeakPolarHBondContact CB-O 3.39Å; T354-K358 VanDerWaalsContact CG2-O 3.28Å; T354-K358 WeakPolarHBondContact CG2-O 3.36Å; T354-K358 PolarHBondContact OG1-N 2.89Å; T354-K358 VanDerWaalsContact OG1-N 3.15Å; T354-K358 PolarHBondContact OG1-O 3.31Å
355	R	97.9	Very high	98.4	Very high	150 Å²	150	31.7 Å²	31.7	57%	0.566	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-21.2	-179	-69.1	-167.8	73.8	-159.5	-4.6	114.2	Q342 D343 E344	Q342-R355 HydrophobicContact CB-CB 4.32Å; Q342-R355 HydrophobicContact CB-CG 4.07Å; Q342-R355 WeakPolarHBondContact O-CG 3.4Å; Q342-R355 PolarHBondContact O-N 3.34Å; D343-R355 VanDerWaalsContact C-CG 3.48Å; D343-R355 WeakPolarHBondContact O-CD 3.32Å; E344-R355 HydrophobicContact CB-CG 4.02Å; E344-R355 HydrophobicContact CG-CG 3.94Å; E344-R355 IonicContact OE2-CZ 3.95Å; E344-R355 IonicContact OE2-NE 3.17Å; E344-R355 PolarHBondContact OE2-NE 2.9Å; E344-R355 VanDerWaalsContact OE2-NE 3.1Å; E344-R355 IonicContact OE2-NH2 3.03Å
356	D	97.2	Very high	98.4	Very high	63 Å²	63	28.6 Å²	28.6	34%	0.337	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	0.3	177.6	63.9	6.8	0	0	0	113.5	G339 G340 T354 K358	G339-D356 WeakPolarHBondContact CA-OD2 3.37Å; G340-D356 PolarHBondContact N-OD2 3.43Å; T354-D356 PolarHBondContact O-N 2.8Å; D356-K358 PolarHBondContact O-N 2.91Å; D356-K358 WeakPolarHBondContact OD1-CB 3.38Å; D356-K358 PolarHBondContact OD1-N 3.44Å; D356-K358 VanDerWaalsContact OD1-N 3.14Å
357	G	97.2	Very high	98.5	Very high	21 Å²	21	28 Å²	28	22%	0.216	15%	0.149	C	C	.	.			trans	71.2	13.8	177.6	0	0	0	0	0	114.5	T88 T354	T88-G357 WeakPolarHBondContact O-CA 3.35Å; T354-G357 PolarHBondContact O-N 2.8Å; T354-G357 WeakPolarHBondContact OG1-CA 3.38Å; T354-G357 PolarHBondContact OG1-N 3.12Å
358	K	98	Very high	98.5	Very high	92 Å²	92	25.3 Å²	25.3	40%	0.4	13%	0.131	S	C	.	.			trans	-84.6	161.6	174.4	-64.5	-172.9	178.3	-166.1	0	111.5	E204 E337 A338 T354 D356	E204-K358 VanDerWaalsContact CA-O 3.3Å; E204-K358 WeakPolarHBondContact CA-O 3.36Å; E204-K358 WeakPolarHBondContact CB-O 3.32Å; E337-K358 HydrophobicContact CB-CB 4.15Å; A338-K358 WeakPolarHBondContact O-CD 3.5Å; A338-K358 VanDerWaalsContact O-CE 3.28Å; A338-K358 WeakPolarHBondContact O-CE 3.23Å; A338-K358 PolarHBondContact O-NZ 2.86Å; T354-K358 WeakPolarHBondContact CB-O 3.39Å; T354-K358 VanDerWaalsContact CG2-O 3.28Å; T354-K358 WeakPolarHBondContact CG2-O 3.36Å; T354-K358 PolarHBondContact OG1-N 2.89Å; T354-K358 VanDerWaalsContact OG1-N 3.15Å; T354-K358 PolarHBondContact OG1-O 3.31Å; D356-K358 PolarHBondContact O-N 2.91Å; D356-K358 WeakPolarHBondContact OD1-CB 3.38Å; D356-K358 PolarHBondContact OD1-N 3.44Å; D356-K358 VanDerWaalsContact OD1-N 3.14Å
359	R	98.4	Very high	98.6	Very high	34 Å²	34	24 Å²	24	13%	0.128	12%	0.124	C	C	.	.			trans	-67	152.1	-175.2	-65.3	174.6	-69.3	-144.7	-7	112.5	N203 I221 E247 L253 C336 E337	N203-R359 HydrophobicContact CB-CG 4.16Å; N203-R359 CarbonylContact O-C 3.49Å; N203-R359 VanDerWaalsContact O-CA 3.3Å; N203-R359 WeakPolarHBondContact O-CA 3.24Å; I221-R359 HydrophobicContact CD1-CB 4.07Å; I221-R359 HydrophobicContact CD1-CG 4.46Å; E247-R359 IonicContact OE1-CZ 3.15Å; E247-R359 IonicContact OE1-NH1 3.6Å; E247-R359 PolarHBondContact OE1-NH1 2.86Å; E247-R359 IonicContact OE1-NH2 3.59Å; E247-R359 PolarHBondContact OE1-NH2 3.45Å; L253-R359 HydrophobicContact CD2-CB 3.88Å; C336-R359 WeakPolarHBondContact CA-O 3.05Å; E337-R359 VanDerWaalsContact CD-NE 3.27Å; E337-R359 VanDerWaalsContact CD-NH2 3.27Å; E337-R359 HydrophobicContact CG-CB 4.27Å; E337-R359 PolarHBondContact N-O 2.98Å; E337-R359 IonicContact OE1-CZ 3.24Å; E337-R359 IonicContact OE1-NE 2.81Å; E337-R359 PolarHBondContact OE1-NE 3.49Å; E337-R359 IonicContact OE1-NH2 2.74Å; E337-R359 PolarHBondContact OE1-NH2 2.87Å; E337-R359 WeakPolarHBondContact OE2-CB 3.35Å; E337-R359 IonicContact OE2-CZ 3.82Å; E337-R359 IonicContact OE2-NE 3Å; E337-R359 PolarHBondContact OE2-NE 2.81Å; E337-R359 IonicContact OE2-NH2 3.94Å; E337-R359 PolarHBondContact OE2-NH2 3.27Å; E337-R359 VanDerWaalsContact OE2-NH2 3.11Å
360	S	98.8	Very high	98.6	Very high	5 Å²	5	23.4 Å²	23.4	4%	0.035	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	152.3	166.1	-166.8	0	0	0	0	110.2	N203 I221 I335	N203-S360 PolarHBondContact O-N 2.87Å; I221-S360 WeakPolarHBondContact CD1-O 3.37Å; I335-S360 CarbonylContact O-C 3.57Å; I335-S360 WeakPolarHBondContact O-CA 3.41Å; I335-S360 PolarHBondContact O-OG 3.43Å
361	A	98.9	Very high	98.6	Very high	1 Å²	1	28 Å²	28	1%	0.008	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	150.8	171.6	0	0	0	0	0	109.7	I221 T240 L253 V254 T257 I335	I221-A361 HydrophobicContact CD1-CB 4.35Å; T240-A361 HydrophobicContact CG2-CB 4.14Å; L253-A361 HydrophobicContact CD2-CB 3.92Å; L253-A361 HydrophobicContact CG-CB 3.87Å; V254-A361 HydrophobicContact CG2-CB 4.04Å; T257-A361 HydrophobicContact CG2-CB 4.38Å; T257-A361 VanDerWaalsContact CG2-O 3.29Å; T257-A361 WeakPolarHBondContact CG2-O 3.2Å; I335-A361 PolarHBondContact N-O 3.49Å; I335-A361 PolarHBondContact O-N 3.27Å
362	Q	98.9	Very high	98.6	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	146.1	-179	-169.6	-175.5	6	0	0	110.8	N223 N238 T240 E332 M334	N223-Q362 PolarHBondContact ND2-O 2.99Å; N238-Q362 PolarHBondContact ND2-NE2 3.15Å; N238-Q362 WeakPolarHBondContact OD1-CG 3.34Å; N238-Q362 PolarHBondContact OD1-O 2.82Å; T240-Q362 PolarHBondContact N-O 2.91Å; T240-Q362 PolarHBondContact OG1-N 3.37Å; T240-Q362 PolarHBondContact OG1-O 2.93Å; E332-Q362 PolarHBondContact O-NE2 2.85Å; M334-Q362 HydrophobicContact CG-CB 4.03Å; M334-Q362 VanDerWaalsContact CG-CD 3.49Å; M334-Q362 HydrophobicContact CG-CG 3.66Å
363	F	98.9	Very high	98.6	Very high	3 Å²	3	34.6 Å²	34.6	1%	0.013	18%	0.177	C	C	.	.			trans	-136.6	150	166.5	-75.9	-91.1	0	0	0	108.2	N238 E239 V254 T257 Y258 L261 E332 P333 A387 F389	N238-F363 VanDerWaalsContact OD1-C 3.29Å; N238-F363 WeakPolarHBondContact OD1-CA 3.32Å; N238-F363 PolarHBondContact OD1-N 3.37Å; E239-F363 HydrophobicContact CB-CD1 4.07Å; E239-F363 HydrophobicContact CB-CE1 3.85Å; E239-F363 HydrophobicContact CG-CD1 3.82Å; E239-F363 HydrophobicContact CG-CE1 3.89Å; V254-F363 HydrophobicContact CG1-CE2 3.71Å; V254-F363 HydrophobicContact CG1-CZ 3.66Å; V254-F363 WeakPolarHBondContact O-CE2 3.32Å; T257-F363 HydrophobicContact CG2-CD2 3.74Å; T257-F363 HydrophobicContact CG2-CE2 4.49Å; Y258-F363 AromaticContact CD2-CD1 3.82Å; Y258-F363 HydrophobicContact CD2-CD1 3.82Å; Y258-F363 HydrophobicContact CD2-CE1 4.12Å; Y258-F363 HydrophobicContact CD2-CG 4.08Å; L261-F363 HydrophobicContact CB-CB 4.42Å; L261-F363 HydrophobicContact CD2-CB 3.57Å; E332-F363 CarbonylContact C-O 3.6Å; E332-F363 VanDerWaalsContact CA-O 3.31Å; E332-F363 WeakPolarHBondContact CA-O 3.43Å; P333-F363 WeakPolarHBondContact CD-O 3.28Å; F363-A387 HydrophobicContact CE1-CB 4.04Å; F363-F389 AromaticContact CE1-CD1 3.78Å; F363-F389 HydrophobicContact CE1-CD1 3.78Å; F363-F389 AromaticContact CE1-CE1 3.86Å; F363-F389 HydrophobicContact CE1-CE1 3.86Å; F363-F389 HydrophobicContact CE2-CD1 4.49Å; F363-F389 HydrophobicContact CE2-CE1 4.25Å; F363-F389 AromaticContact CZ-CD1 3.41Å; F363-F389 HydrophobicContact CZ-CD1 3.41Å; F363-F389 VanDerWaalsContact CZ-CD1 3.41Å; F363-F389 AromaticContact CZ-CE1 3.47Å; F363-F389 HydrophobicContact CZ-CE1 3.47Å; F363-F389 VanDerWaalsContact CZ-CE1 3.47Å; F363-F389 HydrophobicContact CZ-CG 4.34Å; F363-F389 HydrophobicContact CZ-CZ 4.44Å
364	E	98.9	Very high	98.6	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.009	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	145.3	179.8	173.7	175.8	-156.9	0	0	113.8	N238 T330 I331 E332	N238-E364 HydrophobicContact CB-CB 4.34Å; N238-E364 WeakPolarHBondContact ND2-CB 3.44Å; N238-E364 PolarHBondContact ND2-OE2 3.32Å; N238-E364 PolarHBondContact O-N 3.43Å; N238-E364 PolarHBondContact OD1-N 3Å; T330-E364 WeakPolarHBondContact CB-OE1 3.37Å; T330-E364 WeakPolarHBondContact CG2-OE1 3.31Å; T330-E364 PolarHBondContact OG1-OE1 2.8Å; I331-E364 WeakPolarHBondContact O-CA 3.38Å; E332-E364 HydrophobicContact CB-CB 3.7Å; E332-E364 HydrophobicContact CB-CG 3.69Å
365	H	98.9	Very high	98.6	Very high	13 Å²	13	38.5 Å²	38.5	6%	0.06	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	143.7	163.7	-80.8	-54.3	0	0	0	112.6	I265 T330 I331 L367 V376 T378	I265-H365 HydrophobicContact CD1-CB 4.13Å; T330-H365 WeakPolarHBondContact CA-O 3.44Å; I331-H365 PolarHBondContact N-O 2.88Å; I331-H365 PolarHBondContact O-N 3.25Å; H365-L367 HydrophobicContact CB-CD2 3.87Å; H365-V376 HydrophobicContact CB-CG1 3.87Å; H365-V376 VanDerWaalsContact CG-CG1 3.5Å; H365-T378 WeakPolarHBondContact CA-OG1 3.35Å; H365-T378 PolarHBondContact CE1-O 2.86Å; H365-T378 PolarHBondContact ND1-O 3.44Å; H365-T378 PolarHBondContact ND1-OG1 3.28Å
366	T	98.9	Very high	98.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	127.3	161.2	-61.2	0	0	0	0	109.6	M144 D236 I301 V328 L377 T378	M144-T366 HydrophobicContact CE-CG2 4.01Å; D236-T366 PolarHBondContact N-OG1 2.62Å; D236-T366 PolarHBondContact O-N 2.85Å; D236-T366 PolarHBondContact O-OG1 3.49Å; I301-T366 HydrophobicContact CG2-CG2 3.66Å; V328-T366 HydrophobicContact CG1-CG2 3.57Å; T366-L377 HydrophobicContact CG2-CD1 4.15Å; T366-L377 WeakPolarHBondContact O-CB 3.08Å; T366-L377 PolarHBondContact O-N 3.33Å; T366-T378 PolarHBondContact N-OG1 3.15Å; T366-T378 VanDerWaalsContact N-OG1 3.1Å
367	L	98.9	Very high	98.7	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	136.6	-172.5	-52.2	176.4	0	0	0	111.3	I265 V268 V328 F329 I331 H365 V376	I265-L367 HydrophobicContact CD1-CD2 4.04Å; I265-L367 HydrophobicContact CG1-CD1 3.85Å; I265-L367 HydrophobicContact CG1-CD2 4.04Å; I265-L367 HydrophobicContact CG2-CD2 4.32Å; V268-L367 HydrophobicContact CG2-CD1 4.06Å; V328-L367 VanDerWaalsContact CA-O 3.24Å; V328-L367 WeakPolarHBondContact CA-O 3.45Å; F329-L367 HydrophobicContact CE1-CB 4.49Å; F329-L367 HydrophobicContact CE2-CD1 4.35Å; F329-L367 HydrophobicContact CZ-CD1 4.24Å; F329-L367 PolarHBondContact N-O 3.35Å; F329-L367 VanDerWaalsContact N-O 3.12Å; F329-L367 PolarHBondContact O-N 3.39Å; I331-L367 HydrophobicContact CB-CD1 4.45Å; I331-L367 HydrophobicContact CD1-CD1 3.45Å; I331-L367 VanDerWaalsContact CD1-CD1 3.45Å; I331-L367 HydrophobicContact CG1-CD1 3.69Å; H365-L367 HydrophobicContact CB-CD2 3.87Å; L367-V376 HydrophobicContact CD2-CB 4.23Å; L367-V376 HydrophobicContact CD2-CG1 4.1Å; L367-V376 HydrophobicContact CD2-CG2 3.9Å
368	L	98.9	Very high	98.8	Very high	6 Å²	6	29.1 Å²	29.1	3%	0.031	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	121.8	167.6	167.9	65.6	0	0	0	109.8	I141 V328 T370 C374 E375 L377	I141-L368 HydrophobicContact CD1-CD1 4.21Å; I141-L368 HydrophobicContact CD1-CD2 4.38Å; I141-L368 HydrophobicContact CG1-CD1 4.12Å; I141-L368 HydrophobicContact CG1-CD2 4.26Å; I141-L368 HydrophobicContact CG2-CD2 3.61Å; V328-L368 HydrophobicContact CG2-CB 4.09Å; V328-L368 HydrophobicContact CG2-CD1 3.57Å; V328-L368 HydrophobicContact CG2-CG 4.42Å; L368-T370 PolarHBondContact O-N 3.41Å; L368-C374 CarbonylContact O-C 3.4Å; L368-C374 WeakPolarHBondContact O-CA 3.39Å; L368-C374 WeakPolarHBondContact O-CB 3.19Å; L368-E375 HydrophobicContact CB-CB 4.33Å; L368-E375 PolarHBondContact N-O 3.32Å; L368-E375 PolarHBondContact O-N 3.42Å; L368-L377 HydrophobicContact CB-CD1 3.95Å; L368-L377 HydrophobicContact CB-CD2 4.13Å; L368-L377 HydrophobicContact CB-CG 4.03Å; L368-L377 HydrophobicContact CD2-CD2 4.48Å
369	V	98.9	Very high	98.8	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.006	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	127.9	171.3	-174.9	0	0	0	0	109.3	V268 P270 M323 K324 P325 G326 H327 F329	V268-V369 HydrophobicContact CG1-CG2 3.98Å; P270-V369 HydrophobicContact CG-CG1 4.01Å; M323-V369 HydrophobicContact CB-CG1 4.38Å; M323-V369 HydrophobicContact CB-CG2 4.22Å; M323-V369 HydrophobicContact CG-CG2 4.46Å; K324-V369 VanDerWaalsContact O-CB 3.27Å; K324-V369 WeakPolarHBondContact O-CB 3.29Å; K324-V369 WeakPolarHBondContact O-CG1 3.48Å; P325-V369 WeakPolarHBondContact CA-O 3.42Å; G326-V369 PolarHBondContact N-O 3.08Å; H327-V369 HydrophobicContact CB-CB 4.37Å; H327-V369 HydrophobicContact CB-CG2 3.98Å; H327-V369 PolarHBondContact O-N 3Å; F329-V369 HydrophobicContact CD1-CG2 4.36Å; F329-V369 HydrophobicContact CE1-CG2 3.65Å
370	T	98.8	Very high	98.6	Very high	42 Å²	42	29.4 Å²	29.4	26%	0.258	16%	0.155	S	C	.	.			trans	-106.5	-177.8	176.5	65.4	0	0	0	0	110.4	P270 L368 T372 G373 E375	P270-T370 VanDerWaalsContact CD-O 3.23Å; P270-T370 WeakPolarHBondContact CD-O 3.24Å; P270-T370 WeakPolarHBondContact CG-O 3.43Å; L368-T370 PolarHBondContact O-N 3.41Å; T370-T372 PolarHBondContact O-N 3.21Å; T370-G373 PolarHBondContact N-O 2.81Å; T370-G373 VanDerWaalsContact OG1-C 3.26Å; T370-G373 PolarHBondContact OG1-N 3.47Å; T370-G373 PolarHBondContact OG1-O 3.36Å; T370-E375 HydrophobicContact CG2-CB 4.18Å
371	E	98.6	Very high	98.1	Very high	149 Å²	149	34.6 Å²	34.6	70%	0.696	18%	0.181	S	C	*	.	S	Bend	trans	-61.7	-28	178.4	-63.6	-57.7	147.9	0	0	113.7	P325	P325-E371 VanDerWaalsContact CB-OE1 3.25Å; P325-E371 WeakPolarHBondContact CB-OE1 3.45Å; P325-E371 WeakPolarHBondContact CG-OE1 3.32Å; P325-E371 WeakPolarHBondContact CG-OE2 3.22Å
372	T	98.4	Very high	97.6	Very high	128 Å²	128	41.3 Å²	41.3	79%	0.785	21%	0.212	S	C	*	.	S	Bend	trans	-124.1	-8.2	-172	54.5	0	0	0	0	114.4	T370	T370-T372 PolarHBondContact O-N 3.21Å
373	G	98.7	Very high	96.8	Very high	16 Å²	16	44.6 Å²	44.6	17%	0.165	23%	0.23	C	C	.	.	S	Bend	trans	-176.1	-133	-174.4	0	0	0	0	0	111.8	V268 T370	V268-G373 CarbonylContact O-C 3.14Å; V268-G373 VanDerWaalsContact O-CA 3.32Å; V268-G373 WeakPolarHBondContact O-CA 3.48Å; T370-G373 PolarHBondContact N-O 2.81Å; T370-G373 VanDerWaalsContact OG1-C 3.26Å; T370-G373 PolarHBondContact OG1-N 3.47Å; T370-G373 PolarHBondContact OG1-O 3.36Å
374	C	98.8	Very high	96.1	Very high	37 Å²	37	52.2 Å²	52.2	25%	0.25	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	158.9	169.6	70.7	0	0	0	0	112.3	V268 L368	V268-C374 HydrophobicContact CB-CB 3.98Å; V268-C374 HydrophobicContact CG1-CB 3.62Å; V268-C374 PolarHBondContact O-N 3.34Å; L368-C374 CarbonylContact O-C 3.4Å; L368-C374 WeakPolarHBondContact O-CA 3.39Å; L368-C374 WeakPolarHBondContact O-CB 3.19Å
375	E	98.8	Very high	95.5	Very high	44 Å²	44	53.1 Å²	53.1	21%	0.206	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	124	164.1	-178.1	-177.6	165.7	0	0	108.2	R145 L368 T370 L377 R379	R145-E375 IonicContact CZ-OE2 2.84Å; R145-E375 IonicContact NE-OE1 3.1Å; R145-E375 PolarHBondContact NE-OE1 3.2Å; R145-E375 IonicContact NE-OE2 3.2Å; R145-E375 PolarHBondContact NE-OE2 3.18Å; R145-E375 VanDerWaalsContact NE-OE2 3.14Å; R145-E375 IonicContact NH2-OE2 3.44Å; R145-E375 PolarHBondContact NH2-OE2 2.92Å; L368-E375 HydrophobicContact CB-CB 4.33Å; L368-E375 PolarHBondContact N-O 3.32Å; L368-E375 PolarHBondContact O-N 3.42Å; T370-E375 HydrophobicContact CG2-CB 4.18Å; E375-L377 HydrophobicContact CB-CD2 4.48Å; E375-L377 HydrophobicContact CG-CD2 3.95Å; E375-L377 PolarHBondContact O-N 3.07Å; E375-R379 IonicContact OE1-NH1 3.78Å
376	V	98.7	Very high	95	Very high	26 Å²	26	57.9 Å²	57.9	16%	0.158	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	103.3	171.5	-172.9	0	0	0	0	107.9	I265 H365 L367 R379	I265-V376 HydrophobicContact CG2-CG2 3.86Å; H365-V376 HydrophobicContact CB-CG1 3.87Å; H365-V376 VanDerWaalsContact CG-CG1 3.5Å; L367-V376 HydrophobicContact CD2-CB 4.23Å; L367-V376 HydrophobicContact CD2-CG1 4.1Å; L367-V376 HydrophobicContact CD2-CG2 3.9Å; V376-R379 HydrophobicContact CB-CB 4.13Å; V376-R379 HydrophobicContact CG1-CB 3.89Å; V376-R379 WeakPolarHBondContact O-CG 3.26Å; V376-R379 PolarHBondContact O-NH1 3Å
377	L	98.8	Very high	94.7	Very high	11 Å²	11	58 Å²	58	6%	0.058	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-31.1	-171.9	-63.9	178.9	0	0	0	112.3	M144 R145 C148 V328 T366 L368 E375	M144-L377 HydrophobicContact CB-CD1 3.99Å; R145-L377 HydrophobicContact CG-CD2 3.69Å; C148-L377 HydrophobicContact CB-CB 3.62Å; C148-L377 WeakPolarHBondContact CB-O 3.31Å; V328-L377 HydrophobicContact CG1-CD1 4.21Å; T366-L377 HydrophobicContact CG2-CD1 4.15Å; T366-L377 WeakPolarHBondContact O-CB 3.08Å; T366-L377 PolarHBondContact O-N 3.33Å; L368-L377 HydrophobicContact CB-CD1 3.95Å; L368-L377 HydrophobicContact CB-CD2 4.13Å; L368-L377 HydrophobicContact CB-CG 4.03Å; L368-L377 HydrophobicContact CD2-CD2 4.48Å; E375-L377 HydrophobicContact CB-CD2 4.48Å; E375-L377 HydrophobicContact CG-CD2 3.95Å; E375-L377 PolarHBondContact O-N 3.07Å
378	T	98.8	Very high	94.6	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	18.8	180	51.6	0	0	0	0	114	C148 R152 D236 L237 H365 T366	C148-T378 HydrophobicContact CB-CG2 3.52Å; R152-T378 PolarHBondContact NE-O 3.32Å; R152-T378 PolarHBondContact NH2-O 3.01Å; R152-T378 VanDerWaalsContact NH2-O 3.17Å; D236-T378 WeakPolarHBondContact O-CG2 3.38Å; L237-T378 HydrophobicContact CB-CG2 4.04Å; L237-T378 HydrophobicContact CD1-CG2 4.31Å; L237-T378 HydrophobicContact CD2-CG2 4.37Å; L237-T378 HydrophobicContact CG-CG2 4.46Å; H365-T378 WeakPolarHBondContact CA-OG1 3.35Å; H365-T378 PolarHBondContact CE1-O 2.86Å; H365-T378 PolarHBondContact ND1-O 3.44Å; H365-T378 PolarHBondContact ND1-OG1 3.28Å; T366-T378 PolarHBondContact N-OG1 3.15Å; T366-T378 VanDerWaalsContact N-OG1 3.1Å
379	R	97.9	Very high	94.3	Very high	108 Å²	108	59.2 Å²	59.2	41%	0.408	30%	0.304	S	S	.	.			trans	-60.2	149.1	175.3	70.5	-178.3	-176.8	-86.9	2.1	111.2	E375 V376 L381	E375-R379 IonicContact OE1-NH1 3.78Å; V376-R379 HydrophobicContact CB-CB 4.13Å; V376-R379 HydrophobicContact CG1-CB 3.89Å; V376-R379 WeakPolarHBondContact O-CG 3.26Å; V376-R379 PolarHBondContact O-NH1 3Å; R379-L381 HydrophobicContact CG-CD2 4.43Å
380	R	95.6	Very high	94	Very high	25 Å²	25	60.6 Å²	60.6	9%	0.094	31%	0.312	C	S	.	.			trans	-65.7	139.9	165.5	-64.2	-177.6	70.6	-155.3	0.8	109.4	R152 D156 G385 R386 H388	R152-R380 VanDerWaalsContact NH1-CG 3.27Å; D156-R380 IonicContact OD1-NE 3.87Å; R380-G385 WeakPolarHBondContact O-CA 3.33Å; R380-R386 WeakPolarHBondContact CD-O 3.28Å; R380-R386 PolarHBondContact NH1-O 3.35Å; R380-H388 VanDerWaalsContact CZ-CE1 3.44Å; R380-H388 PolarHBondContact NE-NE2 2.87Å; R380-H388 PolarHBondContact NH2-CE1 3.25Å; R380-H388 VanDerWaalsContact NH2-CE1 3.34Å
381	L	88.3	Confident	93.5	Very high	113 Å²	113	62.1 Å²	62.1	59%	0.592	33%	0.329	S	S	*	.	S	Bend	trans	-89.7	-22.6	174.9	-61	-178.9	0	0	0	111.9	K149 R379	K149-L381 HydrophobicContact CD-CD1 4.38Å; K149-L381 HydrophobicContact CG-CD1 4.38Å; R379-L381 HydrophobicContact CG-CD2 4.43Å
382	E	87.1	Confident	92.8	Very high	142 Å²	142	59 Å²	59	66%	0.664	31%	0.314	S	S	*	.	S	Bend	trans	-93.3	167.7	173.6	-61.1	-177.5	176.6	0	0	111	N384 G385	E382-N384 PolarHBondContact O-N 3.26Å; E382-G385 PolarHBondContact O-N 3.5Å
383	D	83.3	Confident	91.6	Very high	70 Å²	70	59.1 Å²	59.1	37%	0.374	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	48.1	38.7	175.7	-162.7	24.7	0	0	0	114.2	G385 R386	D383-G385 PolarHBondContact O-N 3.07Å; D383-R386 WeakPolarHBondContact O-CB 3.5Å; D383-R386 VanDerWaalsContact O-CG 3.31Å; D383-R386 WeakPolarHBondContact O-CG 3.32Å; D383-R386 PolarHBondContact O-N 3.48Å; D383-R386 VanDerWaalsContact O-N 3.09Å
384	N	84.6	Confident	91.2	Very high	163 Å²	163	61.3 Å²	61.3	87%	0.872	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	53	28.6	-178.7	-59.9	-37.4	0	0	0	114.5	E382 R386	E382-N384 PolarHBondContact O-N 3.26Å; N384-R386 VanDerWaalsContact C-N 3.35Å
385	G	85.4	Confident	90.8	Very high	21 Å²	21	62.5 Å²	62.5	22%	0.216	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	82.4	6.3	178.1	0	0	0	0	0	115.1	R380 E382 D383	R380-G385 WeakPolarHBondContact O-CA 3.33Å; E382-G385 PolarHBondContact O-N 3.5Å; D383-G385 PolarHBondContact O-N 3.07Å
386	R	87.9	Confident	90.4	Very high	113 Å²	113	63.6 Å²	63.6	43%	0.426	32%	0.324	S	S	.	.			trans	-71.4	134.4	-176.7	-67.4	179.2	73.8	-166.8	1.3	111.9	R380 D383 N384 L390	R380-R386 WeakPolarHBondContact CD-O 3.28Å; R380-R386 PolarHBondContact NH1-O 3.35Å; D383-R386 WeakPolarHBondContact O-CB 3.5Å; D383-R386 VanDerWaalsContact O-CG 3.31Å; D383-R386 WeakPolarHBondContact O-CG 3.32Å; D383-R386 PolarHBondContact O-N 3.48Å; D383-R386 VanDerWaalsContact O-N 3.09Å; N384-R386 VanDerWaalsContact C-N 3.35Å; R386-L390 HydrophobicContact CB-CD1 4.02Å; R386-L390 HydrophobicContact CG-CD1 4.39Å
387	A	94.1	Very high	89.9	Confident	2 Å²	2	65.8 Å²	65.8	2%	0.017	33%	0.334	C	S	.	.			trans	-56.7	150.8	174.2	0	0	0	0	0	112.4	E239 Y258 F363 F389 L390	E239-A387 WeakPolarHBondContact OE2-CA 3.32Å; Y258-A387 HydrophobicContact CD2-CB 4Å; Y258-A387 HydrophobicContact CE2-CB 3.7Å; F363-A387 HydrophobicContact CE1-CB 4.04Å; A387-F389 VanDerWaalsContact C-N 3.32Å; A387-F389 HydrophobicContact CB-CD1 3.71Å; A387-F389 HydrophobicContact CB-CE1 3.71Å; A387-F389 PolarHBondContact O-N 3.01Å; A387-L390 WeakPolarHBondContact O-CB 3.13Å; A387-L390 PolarHBondContact O-N 3.43Å; A387-L390 VanDerWaalsContact O-N 3.15Å
388	H	96	Very high	89.4	Confident	32 Å²	32	69.2 Å²	69.2	15%	0.148	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-60.4	-38.9	-172.9	-75.9	-85.4	0	0	0	113.3	D156 E239 F241 R380 L390 A391	D156-H388 IonicContact OD1-CD2 3.91Å; D156-H388 IonicContact OD1-CE1 3.39Å; D156-H388 IonicContact OD1-NE2 2.71Å; D156-H388 PolarHBondContact OD1-NE2 3.11Å; E239-H388 IonicContact OE2-CD2 3.2Å; E239-H388 PolarHBondContact OE2-CD2 3.5Å; E239-H388 IonicContact OE2-CG 2.92Å; E239-H388 PolarHBondContact OE2-N 3.07Å; F241-H388 HydrophobicContact CD1-CB 3.92Å; F241-H388 HydrophobicContact CE1-CB 3.65Å; F241-H388 AromaticContact CE1-CD2 3.81Å; F241-H388 AromaticContact CE1-CG 3.86Å; R380-H388 VanDerWaalsContact CZ-CE1 3.44Å; R380-H388 PolarHBondContact NE-NE2 2.87Å; R380-H388 PolarHBondContact NH2-CE1 3.25Å; R380-H388 VanDerWaalsContact NH2-CE1 3.34Å; H388-L390 PolarHBondContact O-N 2.86Å; H388-L390 VanDerWaalsContact O-N 3.13Å; H388-A391 PolarHBondContact O-N 3.26Å
389	F	93.4	Very high	88.7	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	37%	0.374	C	S	.	.	G	3₁₀ helix	trans	-61.8	-24.3	-178.8	85.2	-84.5	0	0	0	113.1	F242 V254 Q255 Y258 F363 A387 A391 Q392 M393	F242-F389 HydrophobicContact CD2-CB 4.39Å; F242-F389 HydrophobicContact CE2-CB 4.12Å; F242-F389 AromaticContact CE2-CD2 4Å; F242-F389 HydrophobicContact CE2-CD2 4Å; F242-F389 HydrophobicContact CZ-CB 4.36Å; F242-F389 AromaticContact CZ-CD2 3.86Å; F242-F389 HydrophobicContact CZ-CD2 3.86Å; V254-F389 HydrophobicContact CG1-CB 4.24Å; V254-F389 HydrophobicContact CG1-CD1 4Å; V254-F389 HydrophobicContact CG1-CD2 3.69Å; V254-F389 HydrophobicContact CG1-CE1 4.28Å; V254-F389 HydrophobicContact CG1-CE2 4Å; V254-F389 HydrophobicContact CG1-CG 3.69Å; V254-F389 HydrophobicContact CG1-CZ 4.28Å; Q255-F389 HydrophobicContact CB-CE2 4.25Å; Y258-F389 HydrophobicContact CD1-CE1 4.14Å; Y258-F389 HydrophobicContact CD1-CZ 4.11Å; Y258-F389 HydrophobicContact CD2-CE1 4.21Å; Y258-F389 AromaticContact CG-CE1 3.77Å; Y258-F389 HydrophobicContact CG-CE1 3.77Å; Y258-F389 HydrophobicContact CG-CZ 4.04Å; F363-F389 AromaticContact CE1-CD1 3.78Å; F363-F389 HydrophobicContact CE1-CD1 3.78Å; F363-F389 AromaticContact CE1-CE1 3.86Å; F363-F389 HydrophobicContact CE1-CE1 3.86Å; F363-F389 HydrophobicContact CE2-CD1 4.49Å; F363-F389 HydrophobicContact CE2-CE1 4.25Å; F363-F389 AromaticContact CZ-CD1 3.41Å; F363-F389 HydrophobicContact CZ-CD1 3.41Å; F363-F389 VanDerWaalsContact CZ-CD1 3.41Å; F363-F389 AromaticContact CZ-CE1 3.47Å; F363-F389 HydrophobicContact CZ-CE1 3.47Å; F363-F389 VanDerWaalsContact CZ-CE1 3.47Å; F363-F389 HydrophobicContact CZ-CG 4.34Å; F363-F389 HydrophobicContact CZ-CZ 4.44Å; A387-F389 VanDerWaalsContact C-N 3.32Å; A387-F389 HydrophobicContact CB-CD1 3.71Å; A387-F389 HydrophobicContact CB-CE1 3.71Å; A387-F389 PolarHBondContact O-N 3.01Å; F389-A391 PolarHBondContact O-N 3.02Å; F389-Q392 WeakPolarHBondContact O-CA 3.46Å; F389-Q392 WeakPolarHBondContact O-CB 2.99Å; F389-Q392 PolarHBondContact O-N 3.37Å; F389-M393 HydrophobicContact CD2-CG 4.26Å; F389-M393 WeakPolarHBondContact O-CG 3.41Å; F389-M393 PolarHBondContact O-N 3.27Å
390	L	92.1	Very high	88.1	Confident	30 Å²	30	71.4 Å²	71.4	16%	0.157	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-69.1	-21	177.4	-67.7	173.1	0	0	0	113.2	Y258 R386 A387 H388	Y258-L390 HydrophobicContact CE1-CD1 3.95Å; R386-L390 HydrophobicContact CB-CD1 4.02Å; R386-L390 HydrophobicContact CG-CD1 4.39Å; A387-L390 WeakPolarHBondContact O-CB 3.13Å; A387-L390 PolarHBondContact O-N 3.43Å; A387-L390 VanDerWaalsContact O-N 3.15Å; H388-L390 PolarHBondContact O-N 2.86Å; H388-L390 VanDerWaalsContact O-N 3.13Å
391	A	88.9	Confident	87.5	Confident	75 Å²	75	74.9 Å²	74.9	62%	0.62	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-87.4	-10.3	171.1	0	0	0	0	0	112.4	H388 F389	H388-A391 PolarHBondContact O-N 3.26Å; F389-A391 PolarHBondContact O-N 3.02Å
392	Q	84.1	Confident	87.4	Confident	83 Å²	83	71.8 Å²	71.8	39%	0.388	38%	0.377	S	S	.	.			trans	-93.6	-8.8	175.6	-56.8	177.3	-40.2	0	0	112.7	F242 F389	F242-Q392 HydrophobicContact CD2-CB 3.87Å; F242-Q392 PolarHBondContact O-NE2 2.91Å; F389-Q392 WeakPolarHBondContact O-CA 3.46Å; F389-Q392 WeakPolarHBondContact O-CB 2.99Å; F389-Q392 PolarHBondContact O-N 3.37Å
393	M	72.2	Confident	87.5	Confident	130 Å²	130	65.4 Å²	65.4	64%	0.64	35%	0.351	S	S	*	.			trans	-80.5	0	-176	-76.4	-76.3	-85.7	0	0	114.3	F242 K251 F389	F242-M393 HydrophobicContact CE2-CG 4.13Å; F242-M393 HydrophobicContact CE2-SD 3.77Å; F242-M393 HydrophobicContact CZ-SD 4.13Å; K251-M393 HydrophobicContact CB-CE 4.4Å; K251-M393 HydrophobicContact CB-SD 4.05Å; K251-M393 HydrophobicContact CD-SD 3.9Å; K251-M393 HydrophobicContact CG-SD 4.04Å; F389-M393 HydrophobicContact CD2-CG 4.26Å; F389-M393 WeakPolarHBondContact O-CG 3.41Å; F389-M393 PolarHBondContact O-N 3.27Å

Retrieved 393 of 393 residues in 132.7 ms (Link to these results)

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