A0A3Q0KSF3_SCHMA Loading...

F-box domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KSF3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 812 aa.

						>A0A3Q0KSF3_SCHMA|A0A3Q0KSF3
MRLNDWRLVRMALDCGSSVHSWSLLPYHIVKHIYSYLGDEVVYVSTVCKRWRGVAYTDRSVWKKLHICPPNFPEVEAFKNQIIPMKNCNEITLEFDPRDESHVAVLEYILNALCSNAGIHSISLRPTLKLLYNKSSSNISNRLSKKIINALCDVIMNAKCLKNFYWGGTYCGSYEVSRVLQSLTKSQKHNLLSLQIIRLFQINQSMSYLNTRLFIFSNLNQFSINYLNLSEDILLILSENSNHLRILKLFVQNNVQDLPIIRNQIWRHVHEILPNFCVTLFLICVNDLKQSIVHSDLTNQRMSFIQNTTQELDNQLSSSSYSSMPSSCSVTSTSSSPTSSSSPHIPVQCRLENEREQHLREYHHPYGEQNQIYQLLSTKLLPSALPLNSIYIYYCKPDPLSYLIQYLMDTFAMSLEHFYLIDTFNVISVMSNNSNGILHNISHYTEYTTITTSSNDNSSDSNNNNNGNIIRFIANTPTTSYDAVVNYDNYDCVDSDYQSMFSSYSSHHSLLLDSTSDFDILSCDSSYDLFDYEDKSCSNNNYYSGNFLLPVSTSLSLTSSSSSLPVPSGSCLSDNQIHQSLVAPVSLHKMLEQTECSSNSEIISKNDNDSLSIIKSALCEESAINKGGCSDTSLVSHQALISTHDSINTTNANVNDFCDYLPYDRNYYPNFSEAPQSSTSSNLVFYSPNLYKAPDDVNPDPFVMLAWRCQQLSHFTLIGYWFNIVDMKAFTALRGTSLKSFRIPSCCVSIDDQSWPFNLDENLNEMSRNVGYKWIPLEDLNLPSAVWNHQPPDPTACFYEIQNSCGLDNVND
					

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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	M	31.8	Very low	41.1	Very low	242 Å²	242	128.8 Å²	128.8	100%	1.192	59%	0.59	S	S	*	*				0	121.7	0	-163.2	176.1	-167.2	0	0	108
2	R	31.3	Very low	41.5	Very low	164 Å²	164	123.3 Å²	123.3	62%	0.619	58%	0.584	S	S	*	*			trans	-72.5	139.6	-170.9	-70.8	179.5	170.7	136.8	0.2	112.1	N4 D519	R2-N4 WeakPolarHBondContact CB-OD1 3.25Å; R2-N4 PolarHBondContact O-N 3.23Å; R2-D519 IonicContact CZ-OD2 3.47Å; R2-D519 IonicContact NH1-OD2 2.71Å; R2-D519 PolarHBondContact NH1-OD2 2.76Å; R2-D519 IonicContact NH2-OD2 2.68Å; R2-D519 PolarHBondContact NH2-OD2 3.33Å
3	L	35.4	Very low	42.1	Very low	138 Å²	138	124 Å²	124	72%	0.723	59%	0.592	S	S	*	*			trans	-74.1	57.6	174.9	-103.7	155	0	0	0	111.5	D5 L8	L3-D5 PolarHBondContact O-N 2.9Å; L3-L8 HydrophobicContact CD2-CD1 4.26Å
4	N	37.2	Very low	42.5	Very low	126 Å²	126	123.4 Å²	123.4	67%	0.674	59%	0.594	S	S	*	*			trans	-81	9.6	-173.6	-80.3	5.3	0	0	0	114.5	R2 W6	R2-N4 WeakPolarHBondContact CB-OD1 3.25Å; R2-N4 PolarHBondContact O-N 3.23Å; N4-W6 VanDerWaalsContact C-N 3.25Å; N4-W6 PolarHBondContact O-N 3.24Å
5	D	46.6	Very low	42.7	Very low	75 Å²	75	118.9 Å²	118.9	40%	0.401	58%	0.579	S	S	.	*			trans	-72.8	88.8	164.5	-169.9	1.6	0	0	0	109.3	L3 R7 L8 V9	L3-D5 PolarHBondContact O-N 2.9Å; D5-R7 PolarHBondContact O-N 3.39Å; D5-R7 WeakPolarHBondContact OD1-CB 3.37Å; D5-R7 WeakPolarHBondContact OD1-CG 3.1Å; D5-R7 PolarHBondContact OD1-N 3.13Å; D5-L8 HydrophobicContact CB-CD1 4.45Å; D5-L8 WeakPolarHBondContact O-CB 3.27Å; D5-L8 PolarHBondContact O-N 2.83Å; D5-V9 PolarHBondContact O-N 2.95Å
6	W	43.3	Very low	42.5	Very low	152 Å²	152	116.2 Å²	116.2	58%	0.576	59%	0.592	S	S	*	*	H	α-helix	trans	-52.4	-17.1	175.4	58.3	-89.7	0	0	0	113.5	N4 R10	N4-W6 VanDerWaalsContact C-N 3.25Å; N4-W6 PolarHBondContact O-N 3.24Å; W6-R10 WeakPolarHBondContact O-CB 3.21Å; W6-R10 PolarHBondContact O-N 2.74Å
7	R	44.3	Very low	42.7	Very low	156 Å²	156	114.3 Å²	114.3	59%	0.589	59%	0.592	S	S	*	*	H	α-helix	trans	-73.5	-41.7	173.3	-58.7	173.6	168.8	-173.1	-4.3	111.9	D5 V9 R10 M11	D5-R7 PolarHBondContact O-N 3.39Å; D5-R7 WeakPolarHBondContact OD1-CB 3.37Å; D5-R7 WeakPolarHBondContact OD1-CG 3.1Å; D5-R7 PolarHBondContact OD1-N 3.13Å; R7-V9 VanDerWaalsContact C-N 3.35Å; R7-R10 PolarHBondContact O-N 2.82Å; R7-M11 WeakPolarHBondContact O-CB 3.47Å; R7-M11 VanDerWaalsContact O-CG 3.28Å; R7-M11 WeakPolarHBondContact O-CG 3.16Å; R7-M11 PolarHBondContact O-N 3.44Å
8	L	45	Very low	42.8	Very low	51 Å²	51	113.7 Å²	113.7	27%	0.267	60%	0.599	S	S	.	*	H	α-helix	trans	-62.2	-44.3	172	-95.5	163.5	0	0	0	110.7	L3 D5 M11 A12 I29	L3-L8 HydrophobicContact CD2-CD1 4.26Å; D5-L8 HydrophobicContact CB-CD1 4.45Å; D5-L8 WeakPolarHBondContact O-CB 3.27Å; D5-L8 PolarHBondContact O-N 2.83Å; L8-M11 PolarHBondContact O-N 2.74Å; L8-A12 PolarHBondContact O-N 3.37Å; L8-A12 VanDerWaalsContact O-N 3.08Å; L8-I29 HydrophobicContact CD2-CD1 4.1Å; L8-I29 HydrophobicContact CD2-CG2 3.96Å
9	V	46.2	Very low	42.9	Very low	68 Å²	68	115 Å²	115	41%	0.412	61%	0.612	S	S	.	*	H	α-helix	trans	-64.9	-40.9	177.1	179	0	0	0	0	111.5	D5 R7 A12 L13	D5-V9 PolarHBondContact O-N 2.95Å; R7-V9 VanDerWaalsContact C-N 3.35Å; V9-A12 PolarHBondContact O-N 2.91Å; V9-L13 HydrophobicContact CG1-CD1 3.72Å; V9-L13 HydrophobicContact CG1-CG 4.3Å; V9-L13 WeakPolarHBondContact O-CB 3.49Å; V9-L13 WeakPolarHBondContact O-CG 3.08Å; V9-L13 PolarHBondContact O-N 3.08Å
10	R	45.6	Very low	43.5	Very low	146 Å²	146	115.9 Å²	115.9	55%	0.551	61%	0.612	S	S	*	*	H	α-helix	trans	-63.5	-42.9	171.5	-105.7	-168.8	166.7	144.2	1.6	113	W6 R7 A12 L13 D14	W6-R10 WeakPolarHBondContact O-CB 3.21Å; W6-R10 PolarHBondContact O-N 2.74Å; R7-R10 PolarHBondContact O-N 2.82Å; R10-A12 PolarHBondContact O-N 3.18Å; R10-L13 PolarHBondContact O-N 2.74Å; R10-L13 VanDerWaalsContact O-N 3.11Å; R10-D14 WeakPolarHBondContact CB-OD2 3.42Å; R10-D14 WeakPolarHBondContact CD-OD2 3.45Å; R10-D14 VanDerWaalsContact CG-OD2 3.3Å; R10-D14 WeakPolarHBondContact CG-OD2 3.3Å; R10-D14 IonicContact NE-OD2 2.8Å; R10-D14 VanDerWaalsContact O-CB 3.3Å; R10-D14 WeakPolarHBondContact O-CB 3.2Å; R10-D14 PolarHBondContact O-N 3.38Å
11	M	45.5	Very low	44.7	Very low	99 Å²	99	113.3 Å²	113.3	49%	0.488	60%	0.603	S	S	.	*	H	α-helix	trans	-61.9	-25.3	176.5	-73	-179	70.8	0	0	112.8	R7 L8 C15 P26	R7-M11 WeakPolarHBondContact O-CB 3.47Å; R7-M11 VanDerWaalsContact O-CG 3.28Å; R7-M11 WeakPolarHBondContact O-CG 3.16Å; R7-M11 PolarHBondContact O-N 3.44Å; L8-M11 PolarHBondContact O-N 2.74Å; M11-C15 PolarHBondContact O-SG 3.07Å; M11-P26 HydrophobicContact CE-CG 4.03Å
12	A	45.5	Very low	47	Very low	62 Å²	62	110.6 Å²	110.6	51%	0.512	58%	0.58	S	S	.	*	H	α-helix	trans	-81.1	-40.1	170.2	0	0	0	0	0	113.5	L8 V9 R10	L8-A12 PolarHBondContact O-N 3.37Å; L8-A12 VanDerWaalsContact O-N 3.08Å; V9-A12 PolarHBondContact O-N 2.91Å; R10-A12 PolarHBondContact O-N 3.18Å
13	L	50	Low	49.4	Very low	133 Å²	133	104.8 Å²	104.8	70%	0.696	56%	0.564	S	S	*	*	H	α-helix	trans	-89.8	-30.7	-172.4	-68.8	178.5	0	0	0	115.4	V9 R10 C15	V9-L13 HydrophobicContact CG1-CD1 3.72Å; V9-L13 HydrophobicContact CG1-CG 4.3Å; V9-L13 WeakPolarHBondContact O-CB 3.49Å; V9-L13 WeakPolarHBondContact O-CG 3.08Å; V9-L13 PolarHBondContact O-N 3.08Å; R10-L13 PolarHBondContact O-N 2.74Å; R10-L13 VanDerWaalsContact O-N 3.11Å; L13-C15 PolarHBondContact O-N 2.67Å
14	D	47.7	Very low	51.6	Low	116 Å²	116	103 Å²	103	62%	0.62	56%	0.555	S	S	*	*	S	Bend	trans	-70.2	-8.5	177	-66.3	-31.3	0	0	0	111.6	R10 G16	R10-D14 WeakPolarHBondContact CB-OD2 3.42Å; R10-D14 WeakPolarHBondContact CD-OD2 3.45Å; R10-D14 VanDerWaalsContact CG-OD2 3.3Å; R10-D14 WeakPolarHBondContact CG-OD2 3.3Å; R10-D14 IonicContact NE-OD2 2.8Å; R10-D14 VanDerWaalsContact O-CB 3.3Å; R10-D14 WeakPolarHBondContact O-CB 3.2Å; R10-D14 PolarHBondContact O-N 3.38Å; D14-G16 PolarHBondContact O-N 3.34Å
15	C	44.9	Very low	54	Low	55 Å²	55	98.6 Å²	98.6	37%	0.372	53%	0.531	S	S	.	.			trans	-76.3	44.3	175.8	-69.9	0	0	0	0	113.7	M11 L13 S17 H20	M11-C15 PolarHBondContact O-SG 3.07Å; L13-C15 PolarHBondContact O-N 2.67Å; C15-S17 PolarHBondContact O-N 2.96Å; C15-H20 HydrophobicContact CB-CB 4.31Å; C15-H20 VanDerWaalsContact SG-CD2 3.52Å
16	G	40	Very low	55.9	Low	76 Å²	76	96.6 Å²	96.6	78%	0.784	52%	0.523	S	S	*	.			trans	-69.2	4.5	-175.5	0	0	0	0	0	116.6	D14	D14-G16 PolarHBondContact O-N 3.34Å
17	S	46	Very low	58	Low	84 Å²	84	94 Å²	94	59%	0.587	51%	0.513	S	S	*	.	S	Bend	trans	-145.1	114.2	-178.3	51.4	0	0	0	0	113.6	C15	C15-S17 PolarHBondContact O-N 2.96Å
18	S	44.5	Very low	60	Low	103 Å²	103	92.1 Å²	92.1	72%	0.72	51%	0.511	S	S	*	.	S	Bend	trans	48.4	115	158.2	56.4	0	0	0	0	119.1	H20	S18-H20 PolarHBondContact O-ND1 3.13Å
19	V	44.4	Very low	62.1	Low	139 Å²	139	90.7 Å²	90.7	84%	0.842	50%	0.503	S	S	*	.			trans	61.9	54.4	156.9	-158.9	0	0	0	0	115.6
20	H	54	Low	64	Low	133 Å²	133	87.4 Å²	87.4	62%	0.616	48%	0.484	S	S	*	.			trans	-102.4	88.2	166	-77	50.9	0	0	0	110.1	C15 S18	C15-H20 HydrophobicContact CB-CB 4.31Å; C15-H20 VanDerWaalsContact SG-CD2 3.52Å; S18-H20 PolarHBondContact O-ND1 3.13Å
21	S	69.6	Low	65.9	Low	61 Å²	61	83.7 Å²	83.7	43%	0.427	47%	0.471	S	S	.	.			trans	-75.7	138.6	-179.6	179.1	0	0	0	0	112	S23 L24	S21-S23 WeakPolarHBondContact CB-OG 3.47Å; S21-S23 PolarHBondContact O-N 3.21Å; S21-S23 PolarHBondContact OG-N 3.27Å; S21-S23 PolarHBondContact OG-OG 3.44Å; S21-L24 WeakPolarHBondContact O-CB 3.22Å; S21-L24 PolarHBondContact O-N 3.43Å
22	W	80.8	Confident	67.9	Low	186 Å²	186	83 Å²	83	71%	0.705	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-50.8	-25.3	169.7	-68	95.9	0	0	0	113.6	L24 L25 W51	W22-L24 PolarHBondContact O-N 2.83Å; W22-L25 HydrophobicContact CE3-CD1 3.91Å; W22-L25 HydrophobicContact CE3-CG 4.32Å; W22-L25 HydrophobicContact CZ3-CD1 4.28Å; W22-L25 PolarHBondContact O-N 3.4Å; W22-W51 PolarHBondContact O-NE1 2.9Å
23	S	81.4	Confident	69.9	Low	42 Å²	42	82.5 Å²	82.5	29%	0.294	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-62.3	-8.6	172.1	66.8	0	0	0	0	114.8	S21 R50	S21-S23 WeakPolarHBondContact CB-OG 3.47Å; S21-S23 PolarHBondContact O-N 3.21Å; S21-S23 PolarHBondContact OG-N 3.27Å; S21-S23 PolarHBondContact OG-OG 3.44Å; S23-R50 WeakPolarHBondContact O-CB 3.34Å; S23-R50 WeakPolarHBondContact O-CD 3.3Å
24	L	81.8	Confident	71.6	Confident	101 Å²	101	76.6 Å²	76.6	53%	0.529	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-107.3	4.7	-179.3	-61.6	177.1	0	0	0	114.6	S21 W22 R50	S21-L24 WeakPolarHBondContact O-CB 3.22Å; S21-L24 PolarHBondContact O-N 3.43Å; W22-L24 PolarHBondContact O-N 2.83Å; L24-R50 PolarHBondContact O-NH1 3.02Å; L24-R50 PolarHBondContact O-NH2 3.03Å
25	L	86.1	Confident	73.4	Confident	33 Å²	33	74.9 Å²	74.9	17%	0.173	42%	0.421	C	S	.	.			trans	-53.1	141.2	179.5	-77.7	-173.2	0	0	0	113.1	W22 I29 V30 I33 R50 W51	W22-L25 HydrophobicContact CE3-CD1 3.91Å; W22-L25 HydrophobicContact CE3-CG 4.32Å; W22-L25 HydrophobicContact CZ3-CD1 4.28Å; W22-L25 PolarHBondContact O-N 3.4Å; L25-I29 HydrophobicContact CD1-CG2 3.94Å; L25-I29 HydrophobicContact CD2-CG2 4.39Å; L25-V30 HydrophobicContact CB-CG2 3.67Å; L25-V30 HydrophobicContact CD1-CG2 4.44Å; L25-I33 HydrophobicContact CD1-CD1 3.72Å; L25-R50 PolarHBondContact O-NE 2.84Å; L25-R50 PolarHBondContact O-NH2 2.73Å; L25-W51 HydrophobicContact CD1-CH2 4.41Å; L25-W51 HydrophobicContact CD1-CZ2 3.75Å
26	P	87.5	Confident	75.2	Confident	33 Å²	33	80.5 Å²	80.5	21%	0.214	44%	0.435	C	S	.	.			trans	-56.8	149.1	176.1	-23.6	32.7	0	0	0	113	M11 H28 I29 V30	M11-P26 HydrophobicContact CE-CG 4.03Å; P26-H28 VanDerWaalsContact CB-CE1 3.42Å; P26-H28 WeakPolarHBondContact CB-CE1 3.49Å; P26-H28 PolarHBondContact O-N 3.09Å; P26-H28 VanDerWaalsContact O-N 3.17Å; P26-I29 HydrophobicContact CB-CG1 4.11Å; P26-I29 HydrophobicContact CG-CG1 4.06Å; P26-I29 PolarHBondContact O-N 2.97Å; P26-V30 PolarHBondContact O-N 2.73Å; P26-V30 VanDerWaalsContact O-N 3.12Å
27	Y	87.3	Confident	77	Confident	96 Å²	96	78.9 Å²	78.9	38%	0.376	41%	0.408	S	S	.	.	H	α-helix	trans	-48.6	-45.5	179.6	178.3	-78	0	0	0	112.5	I29 V30 K31 V54 T57 D58	Y27-I29 PolarHBondContact O-N 2.83Å; Y27-V30 PolarHBondContact O-N 3.05Å; Y27-K31 HydrophobicContact CE1-CB 4.46Å; Y27-K31 HydrophobicContact CE1-CD 4.33Å; Y27-K31 VanDerWaalsContact O-CB 3.32Å; Y27-K31 WeakPolarHBondContact O-CB 3.28Å; Y27-K31 PolarHBondContact O-N 3.21Å; Y27-V54 HydrophobicContact CD2-CB 4.48Å; Y27-V54 HydrophobicContact CD2-CG1 4.29Å; Y27-V54 HydrophobicContact CD2-CG2 3.8Å; Y27-V54 HydrophobicContact CE2-CG1 4.19Å; Y27-V54 HydrophobicContact CE2-CG2 4.29Å; Y27-V54 HydrophobicContact CG-CG2 4.36Å; Y27-T57 HydrophobicContact CE2-CG2 4.39Å; Y27-D58 VanDerWaalsContact CE1-OD2 3.31Å; Y27-D58 WeakPolarHBondContact CE1-OD2 3.49Å; Y27-D58 WeakPolarHBondContact OH-CB 3.21Å; Y27-D58 PolarHBondContact OH-OD2 3.18Å
28	H	86.7	Confident	78.2	Confident	118 Å²	118	77.6 Å²	77.6	55%	0.546	41%	0.409	S	S	.	.	H	α-helix	trans	-67.9	-31.8	-178.2	56.9	-102	0	0	0	113.1	P26 H32	P26-H28 VanDerWaalsContact CB-CE1 3.42Å; P26-H28 WeakPolarHBondContact CB-CE1 3.49Å; P26-H28 PolarHBondContact O-N 3.09Å; P26-H28 VanDerWaalsContact O-N 3.17Å; H28-H32 WeakPolarHBondContact O-CB 3.35Å; H28-H32 PolarHBondContact O-N 2.98Å
29	I	88	Confident	79.2	Confident	20 Å²	20	77.6 Å²	77.6	10%	0.103	40%	0.401	C	S	.	.	H	α-helix	trans	-70.9	-46.9	175.3	-54.4	-61.2	0	0	0	110	L8 L25 P26 Y27 K31 H32 I33	L8-I29 HydrophobicContact CD2-CD1 4.1Å; L8-I29 HydrophobicContact CD2-CG2 3.96Å; L25-I29 HydrophobicContact CD1-CG2 3.94Å; L25-I29 HydrophobicContact CD2-CG2 4.39Å; P26-I29 HydrophobicContact CB-CG1 4.11Å; P26-I29 HydrophobicContact CG-CG1 4.06Å; P26-I29 PolarHBondContact O-N 2.97Å; Y27-I29 PolarHBondContact O-N 2.83Å; I29-K31 VanDerWaalsContact C-N 3.34Å; I29-K31 PolarHBondContact O-N 3.17Å; I29-H32 PolarHBondContact O-N 2.81Å; I29-H32 VanDerWaalsContact O-N 3.08Å; I29-I33 HydrophobicContact CG2-CD1 3.99Å; I29-I33 HydrophobicContact CG2-CG1 4.5Å; I29-I33 WeakPolarHBondContact O-CG1 3.38Å; I29-I33 PolarHBondContact O-N 3.03Å
30	V	87.4	Confident	80.6	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-63.5	-40.2	178	-178.8	0	0	0	0	111.3	L25 P26 Y27 H32 I33 Y34 W51 V54	L25-V30 HydrophobicContact CB-CG2 3.67Å; L25-V30 HydrophobicContact CD1-CG2 4.44Å; P26-V30 PolarHBondContact O-N 2.73Å; P26-V30 VanDerWaalsContact O-N 3.12Å; Y27-V30 PolarHBondContact O-N 3.05Å; V30-H32 VanDerWaalsContact C-N 3.31Å; V30-H32 PolarHBondContact O-N 3.37Å; V30-I33 PolarHBondContact O-N 3.04Å; V30-Y34 HydrophobicContact CG1-CD2 4.14Å; V30-Y34 HydrophobicContact CG1-CE1 4.37Å; V30-Y34 HydrophobicContact CG1-CE2 3.62Å; V30-Y34 WeakPolarHBondContact O-CD2 3.38Å; V30-Y34 PolarHBondContact O-N 2.95Å; V30-W51 HydrophobicContact CG1-CB 4.26Å; V30-W51 HydrophobicContact CG1-CD2 3.86Å; V30-W51 HydrophobicContact CG1-CE3 3.97Å; V30-W51 HydrophobicContact CG1-CG 3.96Å; V30-W51 HydrophobicContact CG2-CD2 4.17Å; V30-W51 HydrophobicContact CG2-CG 4.29Å; V30-V54 HydrophobicContact CB-CB 4.35Å; V30-V54 HydrophobicContact CB-CG1 4.14Å; V30-V54 HydrophobicContact CB-CG2 4.12Å; V30-V54 HydrophobicContact CG1-CB 3.91Å; V30-V54 HydrophobicContact CG1-CG1 3.93Å; V30-V54 HydrophobicContact CG1-CG2 4.09Å
31	K	85.3	Confident	81.7	Confident	68 Å²	68	70.9 Å²	70.9	30%	0.296	36%	0.361	S	S	.	.	H	α-helix	trans	-57.7	-42.6	171	179.6	-162.7	176.9	70	0	111.8	Y27 I29 Y34 S35 V54 D58 S60	Y27-K31 HydrophobicContact CE1-CB 4.46Å; Y27-K31 HydrophobicContact CE1-CD 4.33Å; Y27-K31 VanDerWaalsContact O-CB 3.32Å; Y27-K31 WeakPolarHBondContact O-CB 3.28Å; Y27-K31 PolarHBondContact O-N 3.21Å; I29-K31 VanDerWaalsContact C-N 3.34Å; I29-K31 PolarHBondContact O-N 3.17Å; K31-Y34 PolarHBondContact O-N 3.49Å; K31-S35 PolarHBondContact O-N 3.49Å; K31-S35 VanDerWaalsContact O-N 3.09Å; K31-V54 HydrophobicContact CB-CG1 4.39Å; K31-D58 WeakPolarHBondContact CD-OD2 3.48Å; K31-D58 IonicContact NZ-OD1 2.85Å; K31-D58 PolarHBondContact NZ-OD1 3.45Å; K31-D58 IonicContact NZ-OD2 2.68Å; K31-D58 PolarHBondContact NZ-OD2 2.86Å; K31-S60 PolarHBondContact NZ-OG 3.35Å
32	H	86.7	Confident	81.9	Confident	84 Å²	84	71.5 Å²	71.5	39%	0.389	36%	0.362	S	S	.	.	H	α-helix	trans	-70.8	-39.4	-179.7	-165.3	23.1	0	0	0	111.8	H28 I29 V30 Y34 S35 Y36	H28-H32 WeakPolarHBondContact O-CB 3.35Å; H28-H32 PolarHBondContact O-N 2.98Å; I29-H32 PolarHBondContact O-N 2.81Å; I29-H32 VanDerWaalsContact O-N 3.08Å; V30-H32 VanDerWaalsContact C-N 3.31Å; V30-H32 PolarHBondContact O-N 3.37Å; H32-Y34 VanDerWaalsContact C-N 3.33Å; H32-Y34 PolarHBondContact O-N 2.93Å; H32-S35 WeakPolarHBondContact CA-OG 3.47Å; H32-S35 PolarHBondContact ND1-OG 2.96Å; H32-S35 PolarHBondContact O-N 2.78Å; H32-S35 PolarHBondContact O-OG 2.93Å; H32-Y36 AromaticContact CE1-CE2 3.38Å; H32-Y36 WeakPolarHBondContact CE1-CE2 3.43Å; H32-Y36 AromaticContact CE1-CZ 3.62Å; H32-Y36 PolarHBondContact CE1-OH 3.38Å; H32-Y36 AromaticContact ND1-CE2 3.54Å; H32-Y36 AromaticContact NE2-CE2 3.92Å; H32-Y36 WeakPolarHBondContact O-CD2 3.35Å
33	I	87.5	Confident	81.7	Confident	52 Å²	52	71 Å²	71	27%	0.267	36%	0.361	S	S	.	.	H	α-helix	trans	-56.5	-47.9	170	-69.8	165.7	0	0	0	110.2	L25 I29 V30 S35 Y36 L37 W51	L25-I33 HydrophobicContact CD1-CD1 3.72Å; I29-I33 HydrophobicContact CG2-CD1 3.99Å; I29-I33 HydrophobicContact CG2-CG1 4.5Å; I29-I33 WeakPolarHBondContact O-CG1 3.38Å; I29-I33 PolarHBondContact O-N 3.03Å; V30-I33 PolarHBondContact O-N 3.04Å; I33-S35 VanDerWaalsContact C-N 3.25Å; I33-S35 PolarHBondContact O-N 3.01Å; I33-Y36 PolarHBondContact O-N 3.42Å; I33-L37 HydrophobicContact CG2-CD1 3.63Å; I33-L37 HydrophobicContact CG2-CG 4.47Å; I33-W51 HydrophobicContact CD1-CH2 4.01Å; I33-W51 HydrophobicContact CG2-CH2 4.46Å; I33-W51 HydrophobicContact CG2-CZ3 4.1Å
34	Y	86.8	Confident	81.6	Confident	8 Å²	8	70.1 Å²	70.1	3%	0.031	35%	0.354	C	S	.	.	H	α-helix	trans	-61.8	-27.2	175.5	-65.9	-29.8	0	0	0	114.3	V30 K31 H32 Y36 L37 V41 V44 S45 W51 V54 A55 V61	V30-Y34 HydrophobicContact CG1-CD2 4.14Å; V30-Y34 HydrophobicContact CG1-CE1 4.37Å; V30-Y34 HydrophobicContact CG1-CE2 3.62Å; V30-Y34 WeakPolarHBondContact O-CD2 3.38Å; V30-Y34 PolarHBondContact O-N 2.95Å; K31-Y34 PolarHBondContact O-N 3.49Å; H32-Y34 VanDerWaalsContact C-N 3.33Å; H32-Y34 PolarHBondContact O-N 2.93Å; Y34-Y36 PolarHBondContact O-N 3.42Å; Y34-L37 HydrophobicContact CD1-CD1 4.02Å; Y34-L37 PolarHBondContact O-N 2.91Å; Y34-V41 HydrophobicContact CD1-CB 4.12Å; Y34-V41 HydrophobicContact CD1-CG1 3.57Å; Y34-V41 HydrophobicContact CD1-CG2 3.77Å; Y34-V41 HydrophobicContact CD2-CG1 4.07Å; Y34-V41 HydrophobicContact CE1-CG1 3.81Å; Y34-V41 HydrophobicContact CE2-CG1 4.28Å; Y34-V41 HydrophobicContact CG-CB 4.48Å; Y34-V41 HydrophobicContact CG-CG1 3.71Å; Y34-V41 HydrophobicContact CG-CG2 3.99Å; Y34-V44 HydrophobicContact CE1-CB 4.35Å; Y34-V44 HydrophobicContact CE1-CG1 4.06Å; Y34-S45 WeakPolarHBondContact OH-CA 3.27Å; Y34-W51 HydrophobicContact CE1-CE3 4.25Å; Y34-W51 WeakPolarHBondContact OH-CB 3.37Å; Y34-W51 PolarHBondContact OH-O 2.64Å; Y34-V54 HydrophobicContact CD2-CG1 4.16Å; Y34-V54 HydrophobicContact CE2-CB 4.08Å; Y34-V54 HydrophobicContact CE2-CG1 3.95Å; Y34-A55 HydrophobicContact CE2-CB 3.72Å; Y34-V61 HydrophobicContact CD2-CG2 3.97Å; Y34-V61 HydrophobicContact CG-CG2 4.42Å
35	S	84	Confident	81.6	Confident	81 Å²	81	65.4 Å²	65.4	57%	0.566	33%	0.329	S	S	*	.	H	α-helix	trans	-70.2	-7.9	174.4	61.9	0	0	0	0	114.7	K31 H32 I33	K31-S35 PolarHBondContact O-N 3.49Å; K31-S35 VanDerWaalsContact O-N 3.09Å; H32-S35 WeakPolarHBondContact CA-OG 3.47Å; H32-S35 PolarHBondContact ND1-OG 2.96Å; H32-S35 PolarHBondContact O-N 2.78Å; H32-S35 PolarHBondContact O-OG 2.93Å; I33-S35 VanDerWaalsContact C-N 3.25Å; I33-S35 PolarHBondContact O-N 3.01Å
36	Y	82.9	Confident	81.4	Confident	172 Å²	172	67.4 Å²	67.4	68%	0.675	34%	0.343	S	S	*	.	H	α-helix	trans	-106.3	-12.3	174.1	-65.5	-68.7	0	0	0	114.3	H32 I33 Y34	H32-Y36 AromaticContact CE1-CE2 3.38Å; H32-Y36 WeakPolarHBondContact CE1-CE2 3.43Å; H32-Y36 AromaticContact CE1-CZ 3.62Å; H32-Y36 PolarHBondContact CE1-OH 3.38Å; H32-Y36 AromaticContact ND1-CE2 3.54Å; H32-Y36 AromaticContact NE2-CE2 3.92Å; H32-Y36 WeakPolarHBondContact O-CD2 3.35Å; I33-Y36 PolarHBondContact O-N 3.42Å; Y34-Y36 PolarHBondContact O-N 3.42Å
37	L	78.7	Confident	81.1	Confident	42 Å²	42	70.7 Å²	70.7	22%	0.22	36%	0.362	C	S	.	.	H	α-helix	trans	-96	-9.7	-169.1	-75.6	168	0	0	0	115	I33 Y34 D39 E40 V41 V44	I33-L37 HydrophobicContact CG2-CD1 3.63Å; I33-L37 HydrophobicContact CG2-CG 4.47Å; Y34-L37 HydrophobicContact CD1-CD1 4.02Å; Y34-L37 PolarHBondContact O-N 2.91Å; L37-D39 PolarHBondContact O-N 2.98Å; L37-E40 HydrophobicContact CB-CB 4.31Å; L37-E40 HydrophobicContact CD2-CB 4.37Å; L37-E40 WeakPolarHBondContact CD2-OE2 3.43Å; L37-E40 WeakPolarHBondContact O-CB 3.32Å; L37-E40 PolarHBondContact O-N 3.06Å; L37-V41 HydrophobicContact CB-CG2 3.78Å; L37-V44 HydrophobicContact CD1-CB 4.06Å; L37-V44 HydrophobicContact CD1-CG1 3.91Å; L37-V44 HydrophobicContact CD1-CG2 3.92Å; L37-V44 HydrophobicContact CD2-CG2 4.38Å
38	G	71	Confident	81	Confident	58 Å²	58	67.2 Å²	67.2	60%	0.598	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	54.6	-121.7	-179	0	0	0	0	0	112.3	V41	G38-V41 VanDerWaalsContact O-CG2 3.25Å; G38-V41 WeakPolarHBondContact O-CG2 3.37Å
39	D	65.6	Low	80.9	Confident	102 Å²	102	70.5 Å²	70.5	55%	0.545	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-77.3	-19.3	-178.6	-57.2	-55.4	0	0	0	113.5	L37 V41 V42	L37-D39 PolarHBondContact O-N 2.98Å; D39-V41 PolarHBondContact O-N 3.37Å; D39-V42 PolarHBondContact O-N 2.85Å
40	E	73.8	Confident	80.7	Confident	124 Å²	124	74.7 Å²	74.7	58%	0.579	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-64.2	-13.7	178	-61.1	-169.3	162.4	0	0	113.3	L37 V42 Y43 V44	L37-E40 HydrophobicContact CB-CB 4.31Å; L37-E40 HydrophobicContact CD2-CB 4.37Å; L37-E40 WeakPolarHBondContact CD2-OE2 3.43Å; L37-E40 WeakPolarHBondContact O-CB 3.32Å; L37-E40 PolarHBondContact O-N 3.06Å; E40-V42 PolarHBondContact O-N 3.5Å; E40-V42 VanDerWaalsContact O-N 3.09Å; E40-Y43 PolarHBondContact O-N 3Å; E40-V44 PolarHBondContact O-N 2.69Å
41	V	77	Confident	80.7	Confident	7 Å²	7	75.8 Å²	75.8	4%	0.042	38%	0.383	C	S	.	.	H	α-helix	trans	-52.9	-32.6	177.5	175.8	0	0	0	0	111.9	Y34 L37 G38 D39 S45 A55 V61	Y34-V41 HydrophobicContact CD1-CB 4.12Å; Y34-V41 HydrophobicContact CD1-CG1 3.57Å; Y34-V41 HydrophobicContact CD1-CG2 3.77Å; Y34-V41 HydrophobicContact CD2-CG1 4.07Å; Y34-V41 HydrophobicContact CE1-CG1 3.81Å; Y34-V41 HydrophobicContact CE2-CG1 4.28Å; Y34-V41 HydrophobicContact CG-CB 4.48Å; Y34-V41 HydrophobicContact CG-CG1 3.71Å; Y34-V41 HydrophobicContact CG-CG2 3.99Å; L37-V41 HydrophobicContact CB-CG2 3.78Å; G38-V41 VanDerWaalsContact O-CG2 3.25Å; G38-V41 WeakPolarHBondContact O-CG2 3.37Å; D39-V41 PolarHBondContact O-N 3.37Å; V41-S45 WeakPolarHBondContact O-CB 3.19Å; V41-S45 PolarHBondContact O-N 2.97Å; V41-S45 PolarHBondContact O-OG 2.91Å; V41-A55 HydrophobicContact CG1-CB 4.35Å; V41-V61 HydrophobicContact CB-CG1 4.33Å; V41-V61 HydrophobicContact CG1-CG1 3.57Å
42	V	74.6	Confident	80.7	Confident	74 Å²	74	78 Å²	78	45%	0.448	39%	0.39	S	S	.	.	H	α-helix	trans	-58.7	-54.2	174.3	-175.7	0	0	0	0	110.6	D39 E40 S45 W62	D39-V42 PolarHBondContact O-N 2.85Å; E40-V42 PolarHBondContact O-N 3.5Å; E40-V42 VanDerWaalsContact O-N 3.09Å; V42-S45 PolarHBondContact O-N 2.91Å; V42-S45 PolarHBondContact O-OG 3.11Å; V42-W62 HydrophobicContact CG2-CH2 4.07Å; V42-W62 HydrophobicContact CG2-CZ3 4.34Å
43	Y	74.9	Confident	80.6	Confident	177 Å²	177	75.6 Å²	75.6	69%	0.694	39%	0.387	S	S	*	.	H	α-helix	trans	-63.3	-49.4	-179.8	179.5	-101	0	0	0	111.4	E40 S45 T46	E40-Y43 PolarHBondContact O-N 3Å; Y43-S45 PolarHBondContact O-N 3.26Å; Y43-T46 VanDerWaalsContact O-CB 3.29Å; Y43-T46 WeakPolarHBondContact O-CB 3.29Å; Y43-T46 WeakPolarHBondContact O-CG2 3.48Å; Y43-T46 PolarHBondContact O-N 3.26Å; Y43-T46 PolarHBondContact O-OG1 3.4Å
44	V	81.1	Confident	80.4	Confident	23 Å²	23	73.3 Å²	73.3	14%	0.139	38%	0.376	C	S	.	.	H	α-helix	trans	-65.5	-27.8	-178.9	-179.6	0	0	0	0	111.9	Y34 L37 E40 T46 V47 W51	Y34-V44 HydrophobicContact CE1-CB 4.35Å; Y34-V44 HydrophobicContact CE1-CG1 4.06Å; L37-V44 HydrophobicContact CD1-CB 4.06Å; L37-V44 HydrophobicContact CD1-CG1 3.91Å; L37-V44 HydrophobicContact CD1-CG2 3.92Å; L37-V44 HydrophobicContact CD2-CG2 4.38Å; E40-V44 PolarHBondContact O-N 2.69Å; V44-T46 PolarHBondContact O-N 2.74Å; V44-V47 WeakPolarHBondContact O-CB 3.48Å; V44-V47 WeakPolarHBondContact O-CG2 3.26Å; V44-V47 PolarHBondContact O-N 3.49Å; V44-W51 HydrophobicContact CG1-CE3 3.7Å; V44-W51 HydrophobicContact CG1-CZ3 3.49Å; V44-W51 VanDerWaalsContact CG1-CZ3 3.49Å
45	S	81.8	Confident	80.2	Confident	2 Å²	2	73 Å²	73	1%	0.014	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-17.2	172.3	84.7	0	0	0	0	114.1	Y34 V41 V42 Y43 V47 R52	Y34-S45 WeakPolarHBondContact OH-CA 3.27Å; V41-S45 WeakPolarHBondContact O-CB 3.19Å; V41-S45 PolarHBondContact O-N 2.97Å; V41-S45 PolarHBondContact O-OG 2.91Å; V42-S45 PolarHBondContact O-N 2.91Å; V42-S45 PolarHBondContact O-OG 3.11Å; Y43-S45 PolarHBondContact O-N 3.26Å; S45-V47 VanDerWaalsContact C-N 3.33Å; S45-R52 WeakPolarHBondContact O-CA 3.45Å; S45-R52 WeakPolarHBondContact O-CB 3.17Å; S45-R52 WeakPolarHBondContact O-CG 3.41Å; S45-R52 PolarHBondContact O-N 2.94Å; S45-R52 PolarHBondContact O-NE 2.76Å
46	T	80.5	Confident	79.9	Confident	74 Å²	74	72.8 Å²	72.8	45%	0.454	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-31.9	176.9	70.6	0	0	0	0	111.9	Y43 V44 C48 R52	Y43-T46 VanDerWaalsContact O-CB 3.29Å; Y43-T46 WeakPolarHBondContact O-CB 3.29Å; Y43-T46 WeakPolarHBondContact O-CG2 3.48Å; Y43-T46 PolarHBondContact O-N 3.26Å; Y43-T46 PolarHBondContact O-OG1 3.4Å; V44-T46 PolarHBondContact O-N 2.74Å; T46-C48 VanDerWaalsContact C-N 3.31Å; T46-C48 PolarHBondContact O-N 2.68Å; T46-C48 VanDerWaalsContact O-N 3.09Å; T46-R52 PolarHBondContact O-NH2 3.17Å
47	V	82.5	Confident	79.7	Confident	102 Å²	102	69 Å²	69	62%	0.618	36%	0.357	S	S	*	.	S	Bend	trans	-50.2	-42.5	-168.8	175.3	0	0	0	0	113.8	V44 S45	V44-V47 WeakPolarHBondContact O-CB 3.48Å; V44-V47 WeakPolarHBondContact O-CG2 3.26Å; V44-V47 PolarHBondContact O-N 3.49Å; S45-V47 VanDerWaalsContact C-N 3.33Å
48	C	83.8	Confident	79.6	Confident	24 Å²	24	67.7 Å²	67.7	16%	0.162	35%	0.35	C	S	.	.			trans	-156.1	161.8	169.8	77.4	0	0	0	0	113.7	T46 R50 W51 R52	T46-C48 VanDerWaalsContact C-N 3.31Å; T46-C48 PolarHBondContact O-N 2.68Å; T46-C48 VanDerWaalsContact O-N 3.09Å; C48-R50 PolarHBondContact O-N 3.44Å; C48-R50 VanDerWaalsContact O-N 3.15Å; C48-W51 PolarHBondContact O-N 3.35Å; C48-R52 WeakPolarHBondContact O-CB 3.48Å; C48-R52 PolarHBondContact O-N 3.43Å
49	K	84.7	Confident	79.9	Confident	186 Å²	186	73.3 Å²	73.3	81%	0.809	35%	0.353	S	S	*	.	H	α-helix	trans	-54.6	-33.7	-179.8	-174.5	176.9	179.3	179.2	0	113.8	G53	K49-G53 PolarHBondContact O-N 2.81Å
50	R	84.1	Confident	80.6	Confident	108 Å²	108	70.7 Å²	70.7	41%	0.408	34%	0.343	S	S	.	.	H	α-helix	trans	-70.4	-49.4	179	-172.4	-171.9	-179.1	131.4	-16.5	111.4	S23 L24 L25 C48 R52 G53 V54	S23-R50 WeakPolarHBondContact O-CB 3.34Å; S23-R50 WeakPolarHBondContact O-CD 3.3Å; L24-R50 PolarHBondContact O-NH1 3.02Å; L24-R50 PolarHBondContact O-NH2 3.03Å; L25-R50 PolarHBondContact O-NE 2.84Å; L25-R50 PolarHBondContact O-NH2 2.73Å; C48-R50 PolarHBondContact O-N 3.44Å; C48-R50 VanDerWaalsContact O-N 3.15Å; R50-R52 VanDerWaalsContact C-N 3.31Å; R50-R52 PolarHBondContact O-N 2.89Å; R50-G53 WeakPolarHBondContact O-CA 3.44Å; R50-G53 PolarHBondContact O-N 3.09Å; R50-G53 VanDerWaalsContact O-N 3.1Å; R50-V54 PolarHBondContact O-N 3.23Å
51	W	88	Confident	80.9	Confident	24 Å²	24	66.3 Å²	66.3	9%	0.091	33%	0.325	C	S	.	.	H	α-helix	trans	-62.2	-42.1	177.8	-75	50.5	0	0	0	110.7	W22 L25 V30 I33 Y34 V44 C48 G53 V54 A55	W22-W51 PolarHBondContact O-NE1 2.9Å; L25-W51 HydrophobicContact CD1-CH2 4.41Å; L25-W51 HydrophobicContact CD1-CZ2 3.75Å; V30-W51 HydrophobicContact CG1-CB 4.26Å; V30-W51 HydrophobicContact CG1-CD2 3.86Å; V30-W51 HydrophobicContact CG1-CE3 3.97Å; V30-W51 HydrophobicContact CG1-CG 3.96Å; V30-W51 HydrophobicContact CG2-CD2 4.17Å; V30-W51 HydrophobicContact CG2-CG 4.29Å; I33-W51 HydrophobicContact CD1-CH2 4.01Å; I33-W51 HydrophobicContact CG2-CH2 4.46Å; I33-W51 HydrophobicContact CG2-CZ3 4.1Å; Y34-W51 HydrophobicContact CE1-CE3 4.25Å; Y34-W51 WeakPolarHBondContact OH-CB 3.37Å; Y34-W51 PolarHBondContact OH-O 2.64Å; V44-W51 HydrophobicContact CG1-CE3 3.7Å; V44-W51 HydrophobicContact CG1-CZ3 3.49Å; V44-W51 VanDerWaalsContact CG1-CZ3 3.49Å; C48-W51 PolarHBondContact O-N 3.35Å; W51-G53 VanDerWaalsContact C-N 3.33Å; W51-G53 PolarHBondContact O-N 2.91Å; W51-V54 PolarHBondContact O-N 3.35Å; W51-V54 VanDerWaalsContact O-N 3.17Å; W51-A55 PolarHBondContact O-N 3.28Å
52	R	85.4	Confident	81	Confident	114 Å²	114	66.6 Å²	66.6	43%	0.43	33%	0.325	S	S	.	.	H	α-helix	trans	-55.4	-44.9	169.9	-150.9	174	-56.1	160.7	3.5	113	S45 T46 C48 R50 V54 A55 Y56	S45-R52 WeakPolarHBondContact O-CA 3.45Å; S45-R52 WeakPolarHBondContact O-CB 3.17Å; S45-R52 WeakPolarHBondContact O-CG 3.41Å; S45-R52 PolarHBondContact O-N 2.94Å; S45-R52 PolarHBondContact O-NE 2.76Å; T46-R52 PolarHBondContact O-NH2 3.17Å; C48-R52 WeakPolarHBondContact O-CB 3.48Å; C48-R52 PolarHBondContact O-N 3.43Å; R50-R52 VanDerWaalsContact C-N 3.31Å; R50-R52 PolarHBondContact O-N 2.89Å; R52-V54 PolarHBondContact O-N 2.87Å; R52-A55 PolarHBondContact O-N 2.96Å; R52-Y56 HydrophobicContact CG-CD2 3.92Å; R52-Y56 HydrophobicContact CG-CE2 3.57Å; R52-Y56 WeakPolarHBondContact O-CD2 3.21Å; R52-Y56 PolarHBondContact O-N 3.31Å; R52-Y56 VanDerWaalsContact O-N 3.16Å
53	G	83	Confident	81.4	Confident	33 Å²	33	68.3 Å²	68.3	34%	0.34	33%	0.326	S	S	.	.	H	α-helix	trans	-59.7	-43.5	175	0	0	0	0	0	112.7	K49 R50 W51 T57	K49-G53 PolarHBondContact O-N 2.81Å; R50-G53 WeakPolarHBondContact O-CA 3.44Å; R50-G53 PolarHBondContact O-N 3.09Å; R50-G53 VanDerWaalsContact O-N 3.1Å; W51-G53 VanDerWaalsContact C-N 3.33Å; W51-G53 PolarHBondContact O-N 2.91Å; G53-T57 WeakPolarHBondContact O-CB 3.4Å; G53-T57 PolarHBondContact O-N 3.2Å; G53-T57 PolarHBondContact O-OG1 3.36Å
54	V	85.3	Confident	81.8	Confident	5 Å²	5	66 Å²	66	3%	0.03	32%	0.32	C	S	.	.	H	α-helix	trans	-62	-45.3	175	179.3	0	0	0	0	110.8	Y27 V30 K31 Y34 R50 W51 R52 Y56 T57 D58	Y27-V54 HydrophobicContact CD2-CB 4.48Å; Y27-V54 HydrophobicContact CD2-CG1 4.29Å; Y27-V54 HydrophobicContact CD2-CG2 3.8Å; Y27-V54 HydrophobicContact CE2-CG1 4.19Å; Y27-V54 HydrophobicContact CE2-CG2 4.29Å; Y27-V54 HydrophobicContact CG-CG2 4.36Å; V30-V54 HydrophobicContact CB-CB 4.35Å; V30-V54 HydrophobicContact CB-CG1 4.14Å; V30-V54 HydrophobicContact CB-CG2 4.12Å; V30-V54 HydrophobicContact CG1-CB 3.91Å; V30-V54 HydrophobicContact CG1-CG1 3.93Å; V30-V54 HydrophobicContact CG1-CG2 4.09Å; K31-V54 HydrophobicContact CB-CG1 4.39Å; Y34-V54 HydrophobicContact CD2-CG1 4.16Å; Y34-V54 HydrophobicContact CE2-CB 4.08Å; Y34-V54 HydrophobicContact CE2-CG1 3.95Å; R50-V54 PolarHBondContact O-N 3.23Å; W51-V54 PolarHBondContact O-N 3.35Å; W51-V54 VanDerWaalsContact O-N 3.17Å; R52-V54 PolarHBondContact O-N 2.87Å; V54-Y56 PolarHBondContact O-N 3.13Å; V54-T57 PolarHBondContact O-N 3.24Å; V54-D58 WeakPolarHBondContact O-CB 3.44Å; V54-D58 PolarHBondContact O-N 2.78Å
55	A	81.6	Confident	81.9	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-58.6	-51.1	-178	0	0	0	0	0	111.8	Y34 V41 W51 R52 W62	Y34-A55 HydrophobicContact CE2-CB 3.72Å; V41-A55 HydrophobicContact CG1-CB 4.35Å; W51-A55 PolarHBondContact O-N 3.28Å; R52-A55 PolarHBondContact O-N 2.96Å; A55-W62 PolarHBondContact O-NE1 2.91Å
56	Y	77.5	Confident	81.9	Confident	77 Å²	77	68.4 Å²	68.4	30%	0.302	33%	0.33	S	S	.	.	H	α-helix	trans	-81.5	-15	-177.3	-60.6	-62.6	0	0	0	114.5	R52 V54 W62 I82	R52-Y56 HydrophobicContact CG-CD2 3.92Å; R52-Y56 HydrophobicContact CG-CE2 3.57Å; R52-Y56 WeakPolarHBondContact O-CD2 3.21Å; R52-Y56 PolarHBondContact O-N 3.31Å; R52-Y56 VanDerWaalsContact O-N 3.16Å; V54-Y56 PolarHBondContact O-N 3.13Å; Y56-W62 AromaticContact CD1-CZ2 3.79Å; Y56-W62 HydrophobicContact CD1-CZ2 3.79Å; Y56-W62 AromaticContact CE1-CH2 3.99Å; Y56-W62 HydrophobicContact CE1-CH2 3.99Å; Y56-W62 AromaticContact CE1-CZ2 3.42Å; Y56-W62 HydrophobicContact CE1-CZ2 3.42Å; Y56-W62 VanDerWaalsContact CE1-CZ2 3.42Å; Y56-I82 WeakPolarHBondContact CD1-O 3.22Å; Y56-I82 HydrophobicContact CE1-CG2 3.72Å; Y56-I82 WeakPolarHBondContact CE1-O 3.34Å; Y56-I82 VanDerWaalsContact OH-CG2 3.3Å; Y56-I82 WeakPolarHBondContact OH-CG2 3.43Å
57	T	78	Confident	81.9	Confident	94 Å²	94	65.3 Å²	65.3	58%	0.577	31%	0.31	S	S	*	.	H	α-helix	trans	-85.8	-38.1	174	-54.9	0	0	0	0	112	Y27 G53 V54 R59	Y27-T57 HydrophobicContact CE2-CG2 4.39Å; G53-T57 WeakPolarHBondContact O-CB 3.4Å; G53-T57 PolarHBondContact O-N 3.2Å; G53-T57 PolarHBondContact O-OG1 3.36Å; V54-T57 PolarHBondContact O-N 3.24Å; T57-R59 PolarHBondContact O-N 3.43Å
58	D	78.1	Confident	81.5	Confident	14 Å²	14	61.2 Å²	61.2	8%	0.075	29%	0.286	C	S	.	.			trans	-83.1	110.4	-173.1	-152.1	-55.3	0	0	0	112.8	Y27 K31 V54 S60 V61	Y27-D58 VanDerWaalsContact CE1-OD2 3.31Å; Y27-D58 WeakPolarHBondContact CE1-OD2 3.49Å; Y27-D58 WeakPolarHBondContact OH-CB 3.21Å; Y27-D58 PolarHBondContact OH-OD2 3.18Å; K31-D58 WeakPolarHBondContact CD-OD2 3.48Å; K31-D58 IonicContact NZ-OD1 2.85Å; K31-D58 PolarHBondContact NZ-OD1 3.45Å; K31-D58 IonicContact NZ-OD2 2.68Å; K31-D58 PolarHBondContact NZ-OD2 2.86Å; V54-D58 WeakPolarHBondContact O-CB 3.44Å; V54-D58 PolarHBondContact O-N 2.78Å; D58-S60 PolarHBondContact O-N 3.21Å; D58-S60 VanDerWaalsContact O-N 3.15Å; D58-S60 WeakPolarHBondContact OD1-CB 3.17Å; D58-S60 PolarHBondContact OD1-N 3.32Å; D58-S60 PolarHBondContact OD1-OG 2.99Å; D58-V61 HydrophobicContact CB-CG2 4.25Å; D58-V61 PolarHBondContact O-N 2.96Å
59	R	77.5	Confident	80.7	Confident	176 Å²	176	61.8 Å²	61.8	66%	0.664	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-21.5	177.4	-52.3	-167.3	-172.6	-167.5	5.4	113.4	T57 V61 N87	T57-R59 PolarHBondContact O-N 3.43Å; R59-V61 VanDerWaalsContact C-N 3.31Å; R59-N87 HydrophobicContact CB-CB 4.31Å; R59-N87 WeakPolarHBondContact CD-OD1 3.11Å; R59-N87 HydrophobicContact CG-CB 4.49Å
60	S	80	Confident	79.6	Confident	47 Å²	47	58.4 Å²	58.4	33%	0.329	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-24	-178.7	77	0	0	0	0	113.6	K31 D58	K31-S60 PolarHBondContact NZ-OG 3.35Å; D58-S60 PolarHBondContact O-N 3.21Å; D58-S60 VanDerWaalsContact O-N 3.15Å; D58-S60 WeakPolarHBondContact OD1-CB 3.17Å; D58-S60 PolarHBondContact OD1-N 3.32Å; D58-S60 PolarHBondContact OD1-OG 2.99Å
61	V	79.4	Confident	78.3	Confident	31 Å²	31	57.9 Å²	57.9	19%	0.188	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-63.2	-52.1	176.6	170	0	0	0	0	109.8	Y34 V41 D58 R59 K63	Y34-V61 HydrophobicContact CD2-CG2 3.97Å; Y34-V61 HydrophobicContact CG-CG2 4.42Å; V41-V61 HydrophobicContact CB-CG1 4.33Å; V41-V61 HydrophobicContact CG1-CG1 3.57Å; D58-V61 HydrophobicContact CB-CG2 4.25Å; D58-V61 PolarHBondContact O-N 2.96Å; R59-V61 VanDerWaalsContact C-N 3.31Å; V61-K63 VanDerWaalsContact C-N 3.29Å; V61-K63 PolarHBondContact O-N 3.26Å
62	W	78.4	Confident	76.9	Confident	14 Å²	14	58.3 Å²	58.3	5%	0.053	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-90	21.1	-172.6	-50.9	94.4	0	0	0	114.1	V42 A55 Y56 L65 I83 P84 C88	V42-W62 HydrophobicContact CG2-CH2 4.07Å; V42-W62 HydrophobicContact CG2-CZ3 4.34Å; A55-W62 PolarHBondContact O-NE1 2.91Å; Y56-W62 AromaticContact CD1-CZ2 3.79Å; Y56-W62 HydrophobicContact CD1-CZ2 3.79Å; Y56-W62 AromaticContact CE1-CH2 3.99Å; Y56-W62 HydrophobicContact CE1-CH2 3.99Å; Y56-W62 AromaticContact CE1-CZ2 3.42Å; Y56-W62 HydrophobicContact CE1-CZ2 3.42Å; Y56-W62 VanDerWaalsContact CE1-CZ2 3.42Å; W62-L65 HydrophobicContact CE3-CD1 4.47Å; W62-I83 HydrophobicContact CE3-CG2 3.82Å; W62-I83 HydrophobicContact CH2-CG1 4.43Å; W62-I83 HydrophobicContact CZ3-CB 4.48Å; W62-I83 HydrophobicContact CZ3-CG1 4.1Å; W62-I83 HydrophobicContact CZ3-CG2 3.94Å; W62-P84 HydrophobicContact CB-CG 3.96Å; W62-P84 HydrophobicContact CD2-CG 3.98Å; W62-P84 HydrophobicContact CG-CG 3.48Å; W62-P84 VanDerWaalsContact CG-CG 3.48Å; W62-C88 VanDerWaalsContact O-CA 3.31Å; W62-C88 WeakPolarHBondContact O-CA 3.33Å
63	K	83.7	Confident	75.5	Confident	109 Å²	109	54.5 Å²	54.5	47%	0.474	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-67.6	-40.5	180	-90.4	-178.8	176.8	-172.7	0	112.4	V61 N89 E90	V61-K63 VanDerWaalsContact C-N 3.29Å; V61-K63 PolarHBondContact O-N 3.26Å; K63-N89 WeakPolarHBondContact O-CA 3.28Å; K63-N89 PolarHBondContact O-N 3.2Å; K63-E90 PolarHBondContact O-N 3.48Å
64	K	84.6	Confident	74.2	Confident	128 Å²	128	60.4 Å²	60.4	56%	0.557	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.8	145.6	172	-54.4	-157.7	-177.9	-139.3	0	107.8	E90	K64-E90 CarbonylContact C-O 3.59Å; K64-E90 WeakPolarHBondContact CA-O 3.46Å; K64-E90 HydrophobicContact CB-CB 4.46Å; K64-E90 VanDerWaalsContact CE-CD 3.45Å; K64-E90 WeakPolarHBondContact CE-OE1 3.01Å; K64-E90 VanDerWaalsContact CE-OE2 3.26Å; K64-E90 WeakPolarHBondContact CE-OE2 3.3Å; K64-E90 HydrophobicContact CG-CB 4.15Å; K64-E90 HydrophobicContact CG-CG 4.45Å; K64-E90 VanDerWaalsContact NZ-CD 3.29Å; K64-E90 IonicContact NZ-OE1 3.53Å; K64-E90 PolarHBondContact NZ-OE1 2.79Å; K64-E90 VanDerWaalsContact NZ-OE1 3.16Å; K64-E90 IonicContact NZ-OE2 3.16Å; K64-E90 PolarHBondContact NZ-OE2 2.85Å
65	L	83	Confident	72.7	Confident	18 Å²	18	62.4 Å²	62.4	9%	0.094	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	119	178.5	-176.1	62.4	0	0	0	109.9	W62 I67 I83 M85 E90 I91 T92	W62-L65 HydrophobicContact CE3-CD1 4.47Å; L65-I67 HydrophobicContact CD1-CG1 4.39Å; L65-I67 HydrophobicContact CD2-CD1 3.84Å; L65-I67 HydrophobicContact CD2-CG1 4.38Å; L65-I67 HydrophobicContact CG-CD1 4.02Å; L65-I67 HydrophobicContact CG-CG1 4.02Å; L65-I83 HydrophobicContact CD2-CG2 3.83Å; L65-M85 HydrophobicContact CD2-CE 3.66Å; L65-M85 HydrophobicContact CD2-SD 4.15Å; L65-E90 PolarHBondContact N-O 2.76Å; L65-I91 HydrophobicContact CB-CG1 4.31Å; L65-I91 HydrophobicContact CD2-CD1 4.26Å; L65-I91 WeakPolarHBondContact O-CA 3.45Å; L65-T92 PolarHBondContact O-N 3.31Å
66	H	81.2	Confident	71.2	Confident	59 Å²	59	67.7 Å²	67.7	27%	0.273	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	133.4	170	-170.5	-92.8	0	0	0	108.8	T92 E94	H66-T92 VanDerWaalsContact CD2-CG2 3.48Å; H66-T92 WeakPolarHBondContact CD2-CG2 3.41Å; H66-E94 IonicContact CD2-OE1 3.89Å; H66-E94 IonicContact CE1-OE1 3.92Å; H66-E94 IonicContact CE1-OE2 2.86Å; H66-E94 PolarHBondContact CE1-OE2 3.39Å; H66-E94 IonicContact NE2-OE1 3.64Å; H66-E94 PolarHBondContact NE2-OE1 2.75Å; H66-E94 IonicContact NE2-OE2 3.21Å; H66-E94 PolarHBondContact NE2-OE2 3.28Å
67	I	79.4	Confident	70.1	Confident	8 Å²	8	65.5 Å²	65.5	4%	0.041	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	114	177.2	-60.3	165.5	0	0	0	106.7	L65 F72 F78 M85 I91 T92 L93 E94 I109	L65-I67 HydrophobicContact CD1-CG1 4.39Å; L65-I67 HydrophobicContact CD2-CD1 3.84Å; L65-I67 HydrophobicContact CD2-CG1 4.38Å; L65-I67 HydrophobicContact CG-CD1 4.02Å; L65-I67 HydrophobicContact CG-CG1 4.02Å; I67-F72 HydrophobicContact CG2-CD2 3.82Å; I67-F72 HydrophobicContact CG2-CE2 3.62Å; I67-F72 HydrophobicContact CG2-CZ 4.24Å; I67-F78 HydrophobicContact CD1-CZ 3.95Å; I67-M85 HydrophobicContact CD1-CE 4.3Å; I67-I91 HydrophobicContact CD1-CD1 4.38Å; I67-T92 PolarHBondContact N-O 3.02Å; I67-L93 HydrophobicContact CB-CD2 3.92Å; I67-L93 HydrophobicContact CD1-CD2 3.76Å; I67-L93 HydrophobicContact CG1-CD2 4.29Å; I67-E94 PolarHBondContact O-N 2.93Å; I67-I109 HydrophobicContact CD1-CD1 3.76Å; I67-I109 HydrophobicContact CG2-CD1 4.49Å
68	C	74.6	Confident	68.9	Low	16 Å²	16	61.8 Å²	61.8	11%	0.108	31%	0.314	C	S	.	.			trans	-130	156.6	-177.2	61.3	0	0	0	0	110.7	P70 N71 F72 E94	C68-P70 VanDerWaalsContact C-CD 3.45Å; C68-P70 WeakPolarHBondContact O-CD 3.28Å; C68-P70 VanDerWaalsContact O-N 3.11Å; C68-N71 CarbonylContact O-C 3.57Å; C68-N71 VanDerWaalsContact O-CA 3.32Å; C68-N71 WeakPolarHBondContact O-CA 3.49Å; C68-N71 WeakPolarHBondContact O-CB 3.43Å; C68-N71 PolarHBondContact O-N 3.46Å; C68-F72 VanDerWaalsContact C-CD2 3.43Å; C68-F72 VanDerWaalsContact O-CD2 3.3Å; C68-F72 WeakPolarHBondContact O-CD2 3.41Å; C68-F72 PolarHBondContact O-N 2.82Å; C68-E94 HydrophobicContact CB-CB 3.77Å
69	P	67.7	Low	67.8	Low	37 Å²	37	66.8 Å²	66.8	24%	0.24	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-42.5	-48	-168.5	-34.6	39.4	0	0	0	118	N71 F72 E94 T127	P69-N71 PolarHBondContact O-N 3.48Å; P69-F72 PolarHBondContact O-N 3.16Å; P69-E94 WeakPolarHBondContact CD-O 3.3Å; P69-T127 HydrophobicContact CG-CG2 4.37Å; P69-T127 WeakPolarHBondContact CG-OG1 3.38Å
70	P	60.5	Low	66.6	Low	115 Å²	115	62.6 Å²	62.6	75%	0.747	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-64.9	-20.6	178.2	27.9	-36.8	0	0	0	113.8	C68	C68-P70 VanDerWaalsContact C-CD 3.45Å; C68-P70 WeakPolarHBondContact O-CD 3.28Å; C68-P70 VanDerWaalsContact O-N 3.11Å
71	N	56.8	Low	65.6	Low	96 Å²	96	69.5 Å²	69.5	51%	0.513	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-101	10.7	176.3	-69.5	-21.1	0	0	0	112.8	C68 P69 P73	C68-N71 CarbonylContact O-C 3.57Å; C68-N71 VanDerWaalsContact O-CA 3.32Å; C68-N71 WeakPolarHBondContact O-CA 3.49Å; C68-N71 WeakPolarHBondContact O-CB 3.43Å; C68-N71 PolarHBondContact O-N 3.46Å; P69-N71 PolarHBondContact O-N 3.48Å; N71-P73 WeakPolarHBondContact O-CD 3.36Å
72	F	60.1	Low	64.7	Low	33 Å²	33	71.8 Å²	71.8	15%	0.145	36%	0.363	C	S	.	.			trans	-71.2	113.4	171.1	-87.6	-128.1	0	0	0	108.4	I67 C68 P69 E94 F95 H102 V105	I67-F72 HydrophobicContact CG2-CD2 3.82Å; I67-F72 HydrophobicContact CG2-CE2 3.62Å; I67-F72 HydrophobicContact CG2-CZ 4.24Å; C68-F72 VanDerWaalsContact C-CD2 3.43Å; C68-F72 VanDerWaalsContact O-CD2 3.3Å; C68-F72 WeakPolarHBondContact O-CD2 3.41Å; C68-F72 PolarHBondContact O-N 2.82Å; P69-F72 PolarHBondContact O-N 3.16Å; F72-E94 WeakPolarHBondContact CE2-O 3.11Å; F72-E94 WeakPolarHBondContact CZ-O 3.07Å; F72-F95 HydrophobicContact CZ-CB 4.13Å; F72-H102 HydrophobicContact CD1-CB 4.43Å; F72-H102 AromaticContact CD1-CD2 3.46Å; F72-H102 VanDerWaalsContact CD1-CD2 3.46Å; F72-H102 WeakPolarHBondContact CD1-CD2 3.3Å; F72-H102 HydrophobicContact CE1-CB 3.94Å; F72-H102 AromaticContact CE1-CD2 3.7Å; F72-H102 AromaticContact CG-CD2 3.75Å; F72-V105 HydrophobicContact CD1-CB 3.56Å; F72-V105 HydrophobicContact CD1-CG1 3.49Å; F72-V105 VanDerWaalsContact CD1-CG1 3.49Å; F72-V105 HydrophobicContact CD1-CG2 3.82Å; F72-V105 HydrophobicContact CE1-CB 3.56Å; F72-V105 HydrophobicContact CE1-CG1 3.43Å; F72-V105 VanDerWaalsContact CE1-CG1 3.43Å; F72-V105 HydrophobicContact CE1-CG2 4.33Å; F72-V105 HydrophobicContact CG-CG1 4.41Å; F72-V105 HydrophobicContact CZ-CG1 4.29Å
73	P	55.9	Low	64.2	Low	34 Å²	34	73.1 Å²	73.1	22%	0.221	37%	0.371	C	S	.	.			trans	-66.2	152.7	166.3	-8.8	28.1	0	0	0	108.3	N71 V75 A77 F78	N71-P73 WeakPolarHBondContact O-CD 3.36Å; P73-V75 PolarHBondContact O-N 2.99Å; P73-A77 HydrophobicContact CB-CB 3.73Å; P73-F78 HydrophobicContact CB-CD2 4.43Å; P73-F78 HydrophobicContact CG-CD2 4.01Å; P73-F78 HydrophobicContact CG-CE2 3.74Å; P73-F78 HydrophobicContact CG-CZ 4.16Å
74	E	55.6	Low	63.6	Low	157 Å²	157	69.3 Å²	69.3	73%	0.734	36%	0.357	S	S	*	.			trans	-49.8	139.7	160.3	-64.4	-176	148.4	0	0	109.1	E76 A77	E74-E76 HydrophobicContact CB-CB 4.38Å; E74-E76 PolarHBondContact O-N 3.02Å; E74-A77 PolarHBondContact O-N 3.28Å
75	V	53.9	Low	63.2	Low	47 Å²	47	64.2 Å²	64.2	29%	0.285	34%	0.335	S	S	.	.	H	α-helix	trans	-50.7	-31.7	-175.9	-174	0	0	0	0	111.8	P73 A77 F78 K79 V105	P73-V75 PolarHBondContact O-N 2.99Å; V75-A77 PolarHBondContact O-N 3.18Å; V75-F78 PolarHBondContact O-N 2.9Å; V75-K79 PolarHBondContact O-N 2.95Å; V75-V105 HydrophobicContact CG2-CG2 3.69Å
76	E	50.5	Low	63.1	Low	112 Å²	112	70.6 Å²	70.6	52%	0.523	36%	0.362	S	S	.	.	H	α-helix	trans	-46.6	-49.6	169.7	-60.8	-69.2	104	0	0	113.9	E74 F78 K79	E74-E76 HydrophobicContact CB-CB 4.38Å; E74-E76 PolarHBondContact O-N 3.02Å; E76-F78 VanDerWaalsContact C-N 3.29Å; E76-F78 PolarHBondContact O-N 3.07Å; E76-K79 WeakPolarHBondContact O-CB 3.38Å; E76-K79 PolarHBondContact O-N 2.65Å; E76-K79 VanDerWaalsContact O-N 3.11Å; E76-K79 WeakPolarHBondContact OE1-CE 3.29Å; E76-K79 IonicContact OE1-NZ 2.6Å; E76-K79 PolarHBondContact OE1-NZ 2.82Å
77	A	52.4	Low	63	Low	31 Å²	31	69.3 Å²	69.3	26%	0.256	36%	0.358	S	S	.	.	H	α-helix	trans	-70	-27	-176.4	0	0	0	0	0	112.6	P73 E74 V75	P73-A77 HydrophobicContact CB-CB 3.73Å; E74-A77 PolarHBondContact O-N 3.28Å; V75-A77 PolarHBondContact O-N 3.18Å
78	F	54	Low	63.3	Low	16 Å²	16	69 Å²	69	7%	0.07	36%	0.356	C	S	.	.	H	α-helix	trans	-74.2	-24.8	170.8	-92.4	-57.6	0	0	0	113.7	I67 P73 V75 E76 N80 I83 M85 V105 Y108 I109	I67-F78 HydrophobicContact CD1-CZ 3.95Å; P73-F78 HydrophobicContact CB-CD2 4.43Å; P73-F78 HydrophobicContact CG-CD2 4.01Å; P73-F78 HydrophobicContact CG-CE2 3.74Å; P73-F78 HydrophobicContact CG-CZ 4.16Å; V75-F78 PolarHBondContact O-N 2.9Å; E76-F78 VanDerWaalsContact C-N 3.29Å; E76-F78 PolarHBondContact O-N 3.07Å; F78-N80 CarbonylContact C-O 3.29Å; F78-N80 PolarHBondContact O-N 3.44Å; F78-I83 HydrophobicContact CE1-CD1 3.96Å; F78-M85 HydrophobicContact CE1-CE 3.77Å; F78-V105 HydrophobicContact CD2-CG1 4.06Å; F78-V105 HydrophobicContact CE2-CG1 3.64Å; F78-Y108 HydrophobicContact CB-CD1 3.86Å; F78-Y108 HydrophobicContact CB-CE1 3.69Å; F78-Y108 HydrophobicContact CD1-CE1 4.48Å; F78-Y108 HydrophobicContact CG-CD1 4.27Å; F78-Y108 HydrophobicContact CG-CE1 4.33Å; F78-Y108 PolarHBondContact O-OH 3.07Å; F78-I109 HydrophobicContact CE1-CG1 4.33Å; F78-I109 HydrophobicContact CE2-CD1 4.02Å; F78-I109 HydrophobicContact CE2-CG1 4.32Å; F78-I109 HydrophobicContact CZ-CD1 3.85Å; F78-I109 HydrophobicContact CZ-CG1 4.1Å
79	K	53.8	Low	64	Low	118 Å²	118	70.5 Å²	70.5	51%	0.513	36%	0.363	S	S	.	.	H	α-helix	trans	-65	-31.5	174.6	-62.3	173.4	-172.1	172.5	0	111.7	V75 E76	V75-K79 PolarHBondContact O-N 2.95Å; E76-K79 WeakPolarHBondContact O-CB 3.38Å; E76-K79 PolarHBondContact O-N 2.65Å; E76-K79 VanDerWaalsContact O-N 3.11Å; E76-K79 WeakPolarHBondContact OE1-CE 3.29Å; E76-K79 IonicContact OE1-NZ 2.6Å; E76-K79 PolarHBondContact OE1-NZ 2.82Å
80	N	53.1	Low	65.1	Low	89 Å²	89	72 Å²	72	48%	0.476	37%	0.367	S	S	.	.	S	Bend	trans	-73.1	132.1	167.4	-66.8	-52.8	0	0	0	109	F78 I82	F78-N80 CarbonylContact C-O 3.29Å; F78-N80 PolarHBondContact O-N 3.44Å; N80-I82 HydrophobicContact CB-CD1 3.92Å; N80-I82 HydrophobicContact CB-CG1 3.85Å; N80-I82 PolarHBondContact O-N 3.04Å
81	Q	59.1	Low	66.5	Low	192 Å²	192	66.5 Å²	66.5	90%	0.897	33%	0.331	S	S	*	.	S	Bend	trans	-74.9	44	-175.1	-59.8	-178.6	16.2	0	0	113.4
82	I	59.9	Low	68	Low	79 Å²	79	63.2 Å²	63.2	41%	0.405	32%	0.315	S	S	.	.			trans	-67.9	-54.4	-175.7	-60.5	173.8	0	0	0	109.5	Y56 N80 P84	Y56-I82 WeakPolarHBondContact CD1-O 3.22Å; Y56-I82 HydrophobicContact CE1-CG2 3.72Å; Y56-I82 WeakPolarHBondContact CE1-O 3.34Å; Y56-I82 VanDerWaalsContact OH-CG2 3.3Å; Y56-I82 WeakPolarHBondContact OH-CG2 3.43Å; N80-I82 HydrophobicContact CB-CD1 3.92Å; N80-I82 HydrophobicContact CB-CG1 3.85Å; N80-I82 PolarHBondContact O-N 3.04Å; I82-P84 WeakPolarHBondContact O-CD 3.33Å
83	I	67.9	Low	69.3	Low	42 Å²	42	61.7 Å²	61.7	22%	0.215	31%	0.308	C	S	.	.	S	Bend	trans	-85.1	118.8	179.5	-56.2	-178.8	0	0	0	109.2	W62 L65 F78 M85	W62-I83 HydrophobicContact CE3-CG2 3.82Å; W62-I83 HydrophobicContact CH2-CG1 4.43Å; W62-I83 HydrophobicContact CZ3-CB 4.48Å; W62-I83 HydrophobicContact CZ3-CG1 4.1Å; W62-I83 HydrophobicContact CZ3-CG2 3.94Å; L65-I83 HydrophobicContact CD2-CG2 3.83Å; F78-I83 HydrophobicContact CE1-CD1 3.96Å; I83-M85 VanDerWaalsContact C-N 3.29Å; I83-M85 HydrophobicContact CB-CE 4.32Å; I83-M85 HydrophobicContact CG2-CE 3.9Å; I83-M85 PolarHBondContact O-N 3.26Å
84	P	71.7	Confident	70.6	Confident	29 Å²	29	61.3 Å²	61.3	19%	0.188	30%	0.303	C	S	.	.			trans	-81.3	72.4	-172.4	34.1	-36.3	0	0	0	111.4	W62 I82 K86 N87	W62-P84 HydrophobicContact CB-CG 3.96Å; W62-P84 HydrophobicContact CD2-CG 3.98Å; W62-P84 HydrophobicContact CG-CG 3.48Å; W62-P84 VanDerWaalsContact CG-CG 3.48Å; I82-P84 WeakPolarHBondContact O-CD 3.33Å; P84-K86 PolarHBondContact O-N 3.22Å; P84-N87 WeakPolarHBondContact O-CB 3.44Å; P84-N87 PolarHBondContact O-N 3.03Å
85	M	77	Confident	71.8	Confident	20 Å²	20	53.9 Å²	53.9	10%	0.099	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-48.5	-25.8	-176.5	-73.2	-69	166.6	0	0	115.3	L65 I67 F78 I83 N87 C88 I91 I109 A112 L113 N116	L65-M85 HydrophobicContact CD2-CE 3.66Å; L65-M85 HydrophobicContact CD2-SD 4.15Å; I67-M85 HydrophobicContact CD1-CE 4.3Å; F78-M85 HydrophobicContact CE1-CE 3.77Å; I83-M85 VanDerWaalsContact C-N 3.29Å; I83-M85 HydrophobicContact CB-CE 4.32Å; I83-M85 HydrophobicContact CG2-CE 3.9Å; I83-M85 PolarHBondContact O-N 3.26Å; M85-N87 VanDerWaalsContact C-N 3.25Å; M85-N87 PolarHBondContact O-N 3.26Å; M85-C88 PolarHBondContact O-N 3.47Å; M85-I91 HydrophobicContact SD-CD1 4.44Å; M85-I109 HydrophobicContact CE-CG2 4.3Å; M85-I109 HydrophobicContact SD-CG2 4.37Å; M85-A112 HydrophobicContact CG-CB 4.36Å; M85-L113 HydrophobicContact SD-CD2 4.18Å; M85-N116 PolarHBondContact O-ND2 3.13Å
86	K	78.9	Confident	73	Confident	152 Å²	152	52.8 Å²	52.8	66%	0.661	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-72.7	-9.3	175.9	-64.1	-178.4	179	179	0	114.8	P84	P84-K86 PolarHBondContact O-N 3.22Å
87	N	80.1	Confident	74.1	Confident	32 Å²	32	48.2 Å²	48.2	17%	0.171	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-103.3	-3	176.5	-65.7	-31.2	0	0	0	113	R59 P84 M85 N89	R59-N87 HydrophobicContact CB-CB 4.31Å; R59-N87 WeakPolarHBondContact CD-OD1 3.11Å; R59-N87 HydrophobicContact CG-CB 4.49Å; P84-N87 WeakPolarHBondContact O-CB 3.44Å; P84-N87 PolarHBondContact O-N 3.03Å; M85-N87 VanDerWaalsContact C-N 3.25Å; M85-N87 PolarHBondContact O-N 3.26Å; N87-N89 PolarHBondContact O-OD1 3.07Å
88	C	84.9	Confident	75.1	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.014	25%	0.247	C	C	.	.			trans	-78.6	126.1	-175.6	-168.2	0	0	0	0	111.3	W62 M85 E90 N116	W62-C88 VanDerWaalsContact O-CA 3.31Å; W62-C88 WeakPolarHBondContact O-CA 3.33Å; M85-C88 PolarHBondContact O-N 3.47Å; C88-E90 PolarHBondContact SG-O 2.79Å; C88-E90 VanDerWaalsContact SG-O 3.33Å; C88-N116 PolarHBondContact O-ND2 3.23Å
89	N	89.8	Confident	76.2	Confident	47 Å²	47	53.7 Å²	53.7	25%	0.251	26%	0.259	S	S	.	.	S	Bend	trans	-101.2	-30	175.4	-76	40.4	0	0	0	111.5	K63 N87 H120 S121	K63-N89 WeakPolarHBondContact O-CA 3.28Å; K63-N89 PolarHBondContact O-N 3.2Å; N87-N89 PolarHBondContact O-OD1 3.07Å; N89-H120 WeakPolarHBondContact O-CA 3.26Å; N89-H120 PolarHBondContact O-N 3.39Å; N89-S121 PolarHBondContact O-N 2.76Å
90	E	90.9	Very high	77.5	Confident	68 Å²	68	56.2 Å²	56.2	32%	0.318	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	121.6	-177.6	-57.7	176	-133.7	0	0	109.4	K63 K64 L65 C88 S121	K63-E90 PolarHBondContact O-N 3.48Å; K64-E90 CarbonylContact C-O 3.59Å; K64-E90 WeakPolarHBondContact CA-O 3.46Å; K64-E90 HydrophobicContact CB-CB 4.46Å; K64-E90 VanDerWaalsContact CE-CD 3.45Å; K64-E90 WeakPolarHBondContact CE-OE1 3.01Å; K64-E90 VanDerWaalsContact CE-OE2 3.26Å; K64-E90 WeakPolarHBondContact CE-OE2 3.3Å; K64-E90 HydrophobicContact CG-CB 4.15Å; K64-E90 HydrophobicContact CG-CG 4.45Å; K64-E90 VanDerWaalsContact NZ-CD 3.29Å; K64-E90 IonicContact NZ-OE1 3.53Å; K64-E90 PolarHBondContact NZ-OE1 2.79Å; K64-E90 VanDerWaalsContact NZ-OE1 3.16Å; K64-E90 IonicContact NZ-OE2 3.16Å; K64-E90 PolarHBondContact NZ-OE2 2.85Å; L65-E90 PolarHBondContact N-O 2.76Å; C88-E90 PolarHBondContact SG-O 2.79Å; C88-E90 VanDerWaalsContact SG-O 3.33Å; E90-S121 WeakPolarHBondContact CA-O 3.25Å
91	I	89.9	Confident	78.7	Confident	1 Å²	1	55 Å²	55	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	136.6	177	-158.6	172.3	0	0	0	111.9	L65 I67 M85 L93 I109 L113 I119 S121 I122 S123	L65-I91 HydrophobicContact CB-CG1 4.31Å; L65-I91 HydrophobicContact CD2-CD1 4.26Å; L65-I91 WeakPolarHBondContact O-CA 3.45Å; I67-I91 HydrophobicContact CD1-CD1 4.38Å; M85-I91 HydrophobicContact SD-CD1 4.44Å; I91-L93 HydrophobicContact CD1-CD2 3.7Å; I91-L93 HydrophobicContact CD1-CG 4.22Å; I91-L93 HydrophobicContact CG1-CD2 3.88Å; I91-L93 HydrophobicContact CG1-CG 4.24Å; I91-I109 HydrophobicContact CD1-CG2 3.7Å; I91-L113 HydrophobicContact CD1-CD1 3.87Å; I91-L113 HydrophobicContact CG2-CD1 3.94Å; I91-I119 HydrophobicContact CG2-CD1 3.92Å; I91-S121 PolarHBondContact N-O 3.32Å; I91-I122 HydrophobicContact CG2-CG1 4.39Å; I91-I122 CarbonylContact O-C 3.59Å; I91-S123 PolarHBondContact O-N 3.03Å
92	T	88.2	Confident	79.8	Confident	26 Å²	26	47 Å²	47	16%	0.16	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	121.5	169.9	-64.3	0	0	0	0	109.1	L65 H66 I67 E94 S123 R125	L65-T92 PolarHBondContact O-N 3.31Å; H66-T92 VanDerWaalsContact CD2-CG2 3.48Å; H66-T92 WeakPolarHBondContact CD2-CG2 3.41Å; I67-T92 PolarHBondContact N-O 3.02Å; T92-E94 HydrophobicContact CG2-CG 4.46Å; T92-S123 WeakPolarHBondContact CA-O 3.44Å; T92-R125 HydrophobicContact CG2-CG 4.36Å
93	L	87	Confident	80.9	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	110.2	178.8	-58.7	-176.4	0	0	0	109	I67 I91 F95 L106 I109 S123 L124 R125	I67-L93 HydrophobicContact CB-CD2 3.92Å; I67-L93 HydrophobicContact CD1-CD2 3.76Å; I67-L93 HydrophobicContact CG1-CD2 4.29Å; I91-L93 HydrophobicContact CD1-CD2 3.7Å; I91-L93 HydrophobicContact CD1-CG 4.22Å; I91-L93 HydrophobicContact CG1-CD2 3.88Å; I91-L93 HydrophobicContact CG1-CG 4.24Å; L93-F95 WeakPolarHBondContact O-CD1 3.4Å; L93-L106 HydrophobicContact CB-CD1 4.45Å; L93-L106 HydrophobicContact CD1-CD1 3.62Å; L93-I109 HydrophobicContact CD1-CB 4.29Å; L93-I109 HydrophobicContact CD1-CG2 3.94Å; L93-I109 HydrophobicContact CD2-CD1 3.82Å; L93-I109 HydrophobicContact CD2-CG2 4.16Å; L93-S123 PolarHBondContact N-O 3.28Å; L93-L124 HydrophobicContact CB-CD2 4.08Å; L93-L124 HydrophobicContact CD1-CD2 3.95Å; L93-L124 HydrophobicContact CG-CD2 4.36Å; L93-R125 PolarHBondContact O-N 3.09Å
94	E	83.6	Confident	81.6	Confident	26 Å²	26	45.1 Å²	45.1	12%	0.121	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	123.5	174.4	-85.8	168.4	-154.1	0	0	109.5	H66 I67 C68 P69 F72 T92 R125 T127	H66-E94 IonicContact CD2-OE1 3.89Å; H66-E94 IonicContact CE1-OE1 3.92Å; H66-E94 IonicContact CE1-OE2 2.86Å; H66-E94 PolarHBondContact CE1-OE2 3.39Å; H66-E94 IonicContact NE2-OE1 3.64Å; H66-E94 PolarHBondContact NE2-OE1 2.75Å; H66-E94 IonicContact NE2-OE2 3.21Å; H66-E94 PolarHBondContact NE2-OE2 3.28Å; I67-E94 PolarHBondContact O-N 2.93Å; C68-E94 HydrophobicContact CB-CB 3.77Å; P69-E94 WeakPolarHBondContact CD-O 3.3Å; F72-E94 WeakPolarHBondContact CE2-O 3.11Å; F72-E94 WeakPolarHBondContact CZ-O 3.07Å; T92-E94 HydrophobicContact CG2-CG 4.46Å; E94-R125 CarbonylContact C-O 3.58Å; E94-R125 WeakPolarHBondContact CA-O 3.41Å; E94-R125 HydrophobicContact CB-CB 4.48Å; E94-R125 HydrophobicContact CG-CB 3.49Å; E94-R125 VanDerWaalsContact CG-CB 3.49Å; E94-R125 HydrophobicContact CG-CG 4.28Å; E94-R125 VanDerWaalsContact OE1-CD 3.27Å; E94-R125 WeakPolarHBondContact OE1-CD 3.49Å; E94-R125 IonicContact OE1-CZ 3.99Å; E94-R125 IonicContact OE1-NE 2.97Å; E94-R125 IonicContact OE1-NH1 2.69Å; E94-R125 PolarHBondContact OE1-NH1 3.43Å; E94-T127 HydrophobicContact CB-CG2 3.66Å; E94-T127 HydrophobicContact CG-CG2 3.99Å
95	F	81	Confident	82.1	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	142.6	-169.1	62.1	-84.9	0	0	0	112.9	F72 L93 P97 H102 L106 L124 R125 P126 T127 L143 T169	F72-F95 HydrophobicContact CZ-CB 4.13Å; L93-F95 WeakPolarHBondContact O-CD1 3.4Å; F95-P97 HydrophobicContact CD2-CB 4.45Å; F95-P97 HydrophobicContact CE2-CB 4.17Å; F95-P97 VanDerWaalsContact O-CD 3.31Å; F95-P97 WeakPolarHBondContact O-CD 3.43Å; F95-H102 HydrophobicContact CB-CB 4.06Å; F95-L106 HydrophobicContact CD1-CD2 4.17Å; F95-L106 HydrophobicContact CD2-CD2 3.92Å; F95-L106 HydrophobicContact CE1-CD2 4Å; F95-L106 HydrophobicContact CE2-CD2 3.74Å; F95-L106 HydrophobicContact CG-CD2 4.15Å; F95-L106 HydrophobicContact CZ-CD2 3.78Å; F95-L124 HydrophobicContact CE1-CB 4.1Å; F95-R125 PolarHBondContact N-O 3.36Å; F95-P126 HydrophobicContact CE2-CB 4.47Å; F95-P126 CarbonylContact O-C 3.4Å; F95-P126 WeakPolarHBondContact O-CA 3.39Å; F95-T127 PolarHBondContact O-N 3.12Å; F95-T127 PolarHBondContact O-OG1 3.42Å; F95-L143 HydrophobicContact CE2-CD2 4.2Å; F95-T169 HydrophobicContact CE2-CG2 3.7Å; F95-T169 HydrophobicContact CZ-CG2 3.6Å
96	D	78.3	Confident	82.6	Confident	25 Å²	25	43 Å²	43	13%	0.134	22%	0.221	C	C	.	.			trans	-81.9	117.5	166.7	-164.9	-34.9	0	0	0	109.7	R98 D99 H102 T127 L128	D96-R98 PolarHBondContact O-N 3Å; D96-R98 VanDerWaalsContact O-N 3.15Å; D96-R98 VanDerWaalsContact OD1-CB 3.28Å; D96-R98 WeakPolarHBondContact OD1-CB 3.33Å; D96-R98 PolarHBondContact OD1-N 3.48Å; D96-D99 HydrophobicContact CB-CB 4.08Å; D96-D99 PolarHBondContact O-N 3.14Å; D96-D99 VanDerWaalsContact O-N 3.12Å; D96-H102 PolarHBondContact N-ND1 3.02Å; D96-T127 PolarHBondContact N-OG1 3.16Å; D96-L128 WeakPolarHBondContact OD1-CD2 3.38Å
97	P	74.9	Confident	83.1	Confident	16 Å²	16	37.7 Å²	37.7	10%	0.104	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-5.8	176.6	29.7	-37.3	0	0	0	114.7	F95 P126 L128	F95-P97 HydrophobicContact CD2-CB 4.45Å; F95-P97 HydrophobicContact CE2-CB 4.17Å; F95-P97 VanDerWaalsContact O-CD 3.31Å; F95-P97 WeakPolarHBondContact O-CD 3.43Å; P97-P126 HydrophobicContact CG-CB 4.1Å; P97-L128 HydrophobicContact CG-CD1 3.82Å; P97-L128 HydrophobicContact CG-CD2 4.17Å; P97-L128 HydrophobicContact CG-CG 3.9Å
98	R	72.8	Confident	83.3	Confident	102 Å²	102	40 Å²	40	39%	0.385	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-16.8	172.2	-62.3	171.3	177	-177.6	0.6	113.3	D96 L128 N141	D96-R98 PolarHBondContact O-N 3Å; D96-R98 VanDerWaalsContact O-N 3.15Å; D96-R98 VanDerWaalsContact OD1-CB 3.28Å; D96-R98 WeakPolarHBondContact OD1-CB 3.33Å; D96-R98 PolarHBondContact OD1-N 3.48Å; R98-L128 HydrophobicContact CG-CD2 3.92Å; R98-L128 VanDerWaalsContact NE-CD2 3.33Å; R98-N141 WeakPolarHBondContact CG-OD1 3.17Å
99	D	77.6	Confident	83.5	Confident	59 Å²	59	40 Å²	40	32%	0.316	21%	0.205	S	C	.	.			trans	-95.1	113.4	-176.2	-173.1	-39.6	0	0	0	109.8	D96 S101 H102 V103	D96-D99 HydrophobicContact CB-CB 4.08Å; D96-D99 PolarHBondContact O-N 3.14Å; D96-D99 VanDerWaalsContact O-N 3.12Å; D99-S101 PolarHBondContact O-N 3.09Å; D99-S101 WeakPolarHBondContact OD1-CA 3.34Å; D99-S101 VanDerWaalsContact OD1-CB 3.26Å; D99-S101 WeakPolarHBondContact OD1-CB 3.37Å; D99-S101 PolarHBondContact OD1-N 3.03Å; D99-S101 PolarHBondContact OD1-OG 3.44Å; D99-H102 HydrophobicContact CB-CB 4.07Å; D99-H102 VanDerWaalsContact CB-ND1 3.25Å; D99-H102 WeakPolarHBondContact CB-ND1 3.5Å; D99-H102 PolarHBondContact O-N 2.85Å; D99-H102 PolarHBondContact OD1-N 2.99Å; D99-H102 IonicContact OD2-CE1 3.8Å; D99-H102 PolarHBondContact OD2-CE1 2.88Å; D99-H102 IonicContact OD2-ND1 3.36Å; D99-H102 PolarHBondContact OD2-ND1 2.88Å; D99-V103 VanDerWaalsContact O-CG2 3.32Å; D99-V103 WeakPolarHBondContact O-CG2 3.49Å; D99-V103 PolarHBondContact O-N 2.85Å
100	E	80.1	Confident	83.5	Confident	172 Å²	172	37.9 Å²	37.9	80%	0.804	19%	0.193	S	C	*	.	H	α-helix	trans	-61.8	-27.2	-178.6	-61.9	-165	154.5	0	0	112.9	A104	E100-A104 VanDerWaalsContact O-CB 3.22Å; E100-A104 WeakPolarHBondContact O-CB 3.11Å; E100-A104 PolarHBondContact O-N 3.11Å
101	S	79.3	Confident	83.4	Confident	64 Å²	64	38.6 Å²	38.6	45%	0.448	20%	0.199	S	C	.	.	H	α-helix	trans	-72.5	-43.8	176.7	78.6	0	0	0	0	111.4	D99 V103 A104 V105	D99-S101 PolarHBondContact O-N 3.09Å; D99-S101 WeakPolarHBondContact OD1-CA 3.34Å; D99-S101 VanDerWaalsContact OD1-CB 3.26Å; D99-S101 WeakPolarHBondContact OD1-CB 3.37Å; D99-S101 PolarHBondContact OD1-N 3.03Å; D99-S101 PolarHBondContact OD1-OG 3.44Å; S101-V103 VanDerWaalsContact C-N 3.34Å; S101-V103 PolarHBondContact O-N 2.92Å; S101-A104 PolarHBondContact O-N 2.92Å; S101-V105 WeakPolarHBondContact O-CG2 3.37Å; S101-V105 PolarHBondContact O-N 2.81Å
102	H	82.7	Confident	83.2	Confident	23 Å²	23	39.9 Å²	39.9	11%	0.106	21%	0.21	C	C	.	.	H	α-helix	trans	-63.3	-41.8	173.8	-63.9	145.4	0	0	0	111.2	F72 F95 D96 D99 V105 L106	F72-H102 HydrophobicContact CD1-CB 4.43Å; F72-H102 AromaticContact CD1-CD2 3.46Å; F72-H102 VanDerWaalsContact CD1-CD2 3.46Å; F72-H102 WeakPolarHBondContact CD1-CD2 3.3Å; F72-H102 HydrophobicContact CE1-CB 3.94Å; F72-H102 AromaticContact CE1-CD2 3.7Å; F72-H102 AromaticContact CG-CD2 3.75Å; F95-H102 HydrophobicContact CB-CB 4.06Å; D96-H102 PolarHBondContact N-ND1 3.02Å; D99-H102 HydrophobicContact CB-CB 4.07Å; D99-H102 VanDerWaalsContact CB-ND1 3.25Å; D99-H102 WeakPolarHBondContact CB-ND1 3.5Å; D99-H102 PolarHBondContact O-N 2.85Å; D99-H102 PolarHBondContact OD1-N 2.99Å; D99-H102 IonicContact OD2-CE1 3.8Å; D99-H102 PolarHBondContact OD2-CE1 2.88Å; D99-H102 IonicContact OD2-ND1 3.36Å; D99-H102 PolarHBondContact OD2-ND1 2.88Å; H102-V105 PolarHBondContact O-N 3.33Å; H102-L106 WeakPolarHBondContact O-CB 3.17Å; H102-L106 PolarHBondContact O-N 2.68Å
103	V	82.2	Confident	83.3	Confident	35 Å²	35	38.7 Å²	38.7	21%	0.212	20%	0.203	C	C	.	.	H	α-helix	trans	-66	-36.7	177	173.2	0	0	0	0	111.8	D99 S101 L106 E107 I147	D99-V103 VanDerWaalsContact O-CG2 3.32Å; D99-V103 WeakPolarHBondContact O-CG2 3.49Å; D99-V103 PolarHBondContact O-N 2.85Å; S101-V103 VanDerWaalsContact C-N 3.34Å; S101-V103 PolarHBondContact O-N 2.92Å; V103-L106 PolarHBondContact O-N 3.47Å; V103-E107 PolarHBondContact O-N 3.21Å; V103-I147 HydrophobicContact CG1-CD1 3.61Å
104	A	82.8	Confident	83.4	Confident	46 Å²	46	39.7 Å²	39.7	38%	0.38	21%	0.21	S	C	.	.	H	α-helix	trans	-68.8	-41.1	174.9	0	0	0	0	0	112.7	E100 S101 E107 Y108	E100-A104 VanDerWaalsContact O-CB 3.22Å; E100-A104 WeakPolarHBondContact O-CB 3.11Å; E100-A104 PolarHBondContact O-N 3.11Å; S101-A104 PolarHBondContact O-N 2.92Å; A104-E107 PolarHBondContact O-N 2.84Å; A104-Y108 PolarHBondContact O-N 3.12Å
105	V	82.7	Confident	83.4	Confident	4 Å²	4	42.5 Å²	42.5	2%	0.024	23%	0.232	C	C	.	.	H	α-helix	trans	-64.9	-40.1	173.1	168	0	0	0	0	111	F72 V75 F78 S101 H102 Y108 I109	F72-V105 HydrophobicContact CD1-CB 3.56Å; F72-V105 HydrophobicContact CD1-CG1 3.49Å; F72-V105 VanDerWaalsContact CD1-CG1 3.49Å; F72-V105 HydrophobicContact CD1-CG2 3.82Å; F72-V105 HydrophobicContact CE1-CB 3.56Å; F72-V105 HydrophobicContact CE1-CG1 3.43Å; F72-V105 VanDerWaalsContact CE1-CG1 3.43Å; F72-V105 HydrophobicContact CE1-CG2 4.33Å; F72-V105 HydrophobicContact CG-CG1 4.41Å; F72-V105 HydrophobicContact CZ-CG1 4.29Å; V75-V105 HydrophobicContact CG2-CG2 3.69Å; F78-V105 HydrophobicContact CD2-CG1 4.06Å; F78-V105 HydrophobicContact CE2-CG1 3.64Å; S101-V105 WeakPolarHBondContact O-CG2 3.37Å; S101-V105 PolarHBondContact O-N 2.81Å; H102-V105 PolarHBondContact O-N 3.33Å; V105-Y108 PolarHBondContact O-N 2.97Å; V105-I109 HydrophobicContact CG1-CD1 3.48Å; V105-I109 VanDerWaalsContact CG1-CD1 3.48Å; V105-I109 HydrophobicContact CG1-CG1 4.16Å; V105-I109 VanDerWaalsContact O-CG1 3.31Å; V105-I109 WeakPolarHBondContact O-CG1 3.43Å; V105-I109 PolarHBondContact O-N 3.01Å
106	L	87.5	Confident	83.8	Confident	2 Å²	2	42.8 Å²	42.8	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-59.8	-45.3	172.9	175.2	62	0	0	0	112	L93 F95 H102 V103 Y108 L110 L124 L143 I147	L93-L106 HydrophobicContact CB-CD1 4.45Å; L93-L106 HydrophobicContact CD1-CD1 3.62Å; F95-L106 HydrophobicContact CD1-CD2 4.17Å; F95-L106 HydrophobicContact CD2-CD2 3.92Å; F95-L106 HydrophobicContact CE1-CD2 4Å; F95-L106 HydrophobicContact CE2-CD2 3.74Å; F95-L106 HydrophobicContact CG-CD2 4.15Å; F95-L106 HydrophobicContact CZ-CD2 3.78Å; H102-L106 WeakPolarHBondContact O-CB 3.17Å; H102-L106 PolarHBondContact O-N 2.68Å; V103-L106 PolarHBondContact O-N 3.47Å; L106-Y108 VanDerWaalsContact C-N 3.34Å; L106-Y108 PolarHBondContact O-N 3.32Å; L106-L110 HydrophobicContact CD1-CD1 3.74Å; L106-L110 HydrophobicContact CD1-CG 4.12Å; L106-L110 HydrophobicContact CG-CD1 4.09Å; L106-L110 WeakPolarHBondContact O-CB 3.28Å; L106-L110 WeakPolarHBondContact O-CG 3.37Å; L106-L110 PolarHBondContact O-N 2.92Å; L106-L110 VanDerWaalsContact O-N 3.13Å; L106-L124 HydrophobicContact CD1-CD2 3.88Å; L106-L143 HydrophobicContact CD2-CD2 3.89Å; L106-I147 HydrophobicContact CD2-CD1 4.47Å; L106-I147 HydrophobicContact CD2-CG2 4.32Å; L106-I147 HydrophobicContact CG-CG2 4.43Å
107	E	87.8	Confident	84.3	Confident	40 Å²	40	43.4 Å²	43.4	19%	0.187	24%	0.243	C	C	.	.	H	α-helix	trans	-61.3	-41.9	174.1	-170	168.3	123.6	0	0	111.1	V103 A104 N111 S144 K146 I147	V103-E107 PolarHBondContact O-N 3.21Å; A104-E107 PolarHBondContact O-N 2.84Å; E107-N111 WeakPolarHBondContact O-CB 3.21Å; E107-N111 PolarHBondContact O-N 3.19Å; E107-N111 PolarHBondContact O-ND2 3.28Å; E107-S144 PolarHBondContact OE2-OG 2.93Å; E107-S144 VanDerWaalsContact OE2-OG 3.07Å; E107-K146 VanDerWaalsContact CD-CD 3.48Å; E107-K146 WeakPolarHBondContact OE1-CD 3.41Å; E107-K146 IonicContact OE1-NZ 2.96Å; E107-K146 PolarHBondContact OE1-NZ 2.92Å; E107-K146 WeakPolarHBondContact OE2-CB 3.38Å; E107-K146 WeakPolarHBondContact OE2-CD 3.44Å; E107-I147 HydrophobicContact CB-CD1 4.2Å; E107-I147 HydrophobicContact CB-CG1 3.72Å; E107-I147 HydrophobicContact CG-CG1 4Å
108	Y	85.7	Confident	85.1	Confident	81 Å²	81	44 Å²	44	32%	0.318	25%	0.251	S	S	.	.	H	α-helix	trans	-63.8	-50.9	177.5	-176	-89.6	0	0	0	112.8	F78 A104 V105 L106 L110 N111 A112	F78-Y108 HydrophobicContact CB-CD1 3.86Å; F78-Y108 HydrophobicContact CB-CE1 3.69Å; F78-Y108 HydrophobicContact CD1-CE1 4.48Å; F78-Y108 HydrophobicContact CG-CD1 4.27Å; F78-Y108 HydrophobicContact CG-CE1 4.33Å; F78-Y108 PolarHBondContact O-OH 3.07Å; A104-Y108 PolarHBondContact O-N 3.12Å; V105-Y108 PolarHBondContact O-N 2.97Å; L106-Y108 VanDerWaalsContact C-N 3.34Å; L106-Y108 PolarHBondContact O-N 3.32Å; Y108-L110 PolarHBondContact O-N 3.25Å; Y108-N111 PolarHBondContact O-N 2.85Å; Y108-A112 HydrophobicContact CE1-CB 4.44Å; Y108-A112 PolarHBondContact O-N 3.14Å
109	I	87.7	Confident	86	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-63.7	-43.4	-175.9	-64.9	162.9	0	0	0	110.6	I67 F78 M85 I91 L93 V105 N111 A112 L113	I67-I109 HydrophobicContact CD1-CD1 3.76Å; I67-I109 HydrophobicContact CG2-CD1 4.49Å; F78-I109 HydrophobicContact CE1-CG1 4.33Å; F78-I109 HydrophobicContact CE2-CD1 4.02Å; F78-I109 HydrophobicContact CE2-CG1 4.32Å; F78-I109 HydrophobicContact CZ-CD1 3.85Å; F78-I109 HydrophobicContact CZ-CG1 4.1Å; M85-I109 HydrophobicContact CE-CG2 4.3Å; M85-I109 HydrophobicContact SD-CG2 4.37Å; I91-I109 HydrophobicContact CD1-CG2 3.7Å; L93-I109 HydrophobicContact CD1-CB 4.29Å; L93-I109 HydrophobicContact CD1-CG2 3.94Å; L93-I109 HydrophobicContact CD2-CD1 3.82Å; L93-I109 HydrophobicContact CD2-CG2 4.16Å; V105-I109 HydrophobicContact CG1-CD1 3.48Å; V105-I109 VanDerWaalsContact CG1-CD1 3.48Å; V105-I109 HydrophobicContact CG1-CG1 4.16Å; V105-I109 VanDerWaalsContact O-CG1 3.31Å; V105-I109 WeakPolarHBondContact O-CG1 3.43Å; V105-I109 PolarHBondContact O-N 3.01Å; I109-N111 PolarHBondContact O-N 3.03Å; I109-A112 PolarHBondContact O-N 2.94Å; I109-L113 HydrophobicContact CG2-CD1 3.96Å; I109-L113 HydrophobicContact CG2-CG 4.24Å; I109-L113 WeakPolarHBondContact O-CB 3.3Å; I109-L113 WeakPolarHBondContact O-CG 3.37Å; I109-L113 PolarHBondContact O-N 3.11Å
110	L	89.8	Confident	86.7	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	23%	0.232	C	C	.	.	H	α-helix	trans	-61.3	-43.5	176.9	-71.2	170.2	0	0	0	111.6	L106 Y108 A112 L113 C114 I147 A150 L151 V154	L106-L110 HydrophobicContact CD1-CD1 3.74Å; L106-L110 HydrophobicContact CD1-CG 4.12Å; L106-L110 HydrophobicContact CG-CD1 4.09Å; L106-L110 WeakPolarHBondContact O-CB 3.28Å; L106-L110 WeakPolarHBondContact O-CG 3.37Å; L106-L110 PolarHBondContact O-N 2.92Å; L106-L110 VanDerWaalsContact O-N 3.13Å; Y108-L110 PolarHBondContact O-N 3.25Å; L110-A112 VanDerWaalsContact C-N 3.33Å; L110-A112 PolarHBondContact O-N 3.32Å; L110-L113 PolarHBondContact O-N 3.26Å; L110-C114 PolarHBondContact O-N 2.88Å; L110-C114 VanDerWaalsContact O-N 3.08Å; L110-C114 PolarHBondContact O-SG 3.08Å; L110-I147 HydrophobicContact CD1-CG2 3.81Å; L110-A150 HydrophobicContact CB-CB 3.82Å; L110-L151 HydrophobicContact CD1-CB 4.39Å; L110-L151 HydrophobicContact CD2-CD1 3.97Å; L110-V154 HydrophobicContact CD2-CG2 4.47Å; L110-V154 VanDerWaalsContact O-CG2 3.28Å; L110-V154 WeakPolarHBondContact O-CG2 3.46Å
111	N	88.9	Confident	87.4	Confident	83 Å²	83	31.6 Å²	31.6	44%	0.444	20%	0.197	S	C	.	.	H	α-helix	trans	-62.1	-37.4	174.4	-79.2	-61.2	0	0	0	112.8	E107 Y108 I109 C114	E107-N111 WeakPolarHBondContact O-CB 3.21Å; E107-N111 PolarHBondContact O-N 3.19Å; E107-N111 PolarHBondContact O-ND2 3.28Å; Y108-N111 PolarHBondContact O-N 2.85Å; I109-N111 PolarHBondContact O-N 3.03Å; N111-C114 WeakPolarHBondContact O-CB 3.48Å; N111-C114 PolarHBondContact O-N 3.4Å
112	A	86.5	Confident	88	Confident	28 Å²	28	28.6 Å²	28.6	23%	0.231	18%	0.176	C	C	.	.	H	α-helix	trans	-67.1	-38.1	174.6	0	0	0	0	0	112.2	M85 Y108 I109 L110 C114 S115	M85-A112 HydrophobicContact CG-CB 4.36Å; Y108-A112 HydrophobicContact CE1-CB 4.44Å; Y108-A112 PolarHBondContact O-N 3.14Å; I109-A112 PolarHBondContact O-N 2.94Å; L110-A112 VanDerWaalsContact C-N 3.33Å; L110-A112 PolarHBondContact O-N 3.32Å; A112-C114 VanDerWaalsContact C-N 3.3Å; A112-C114 PolarHBondContact O-N 2.89Å; A112-S115 PolarHBondContact O-N 2.85Å
113	L	89.3	Confident	88.4	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-70.1	-19.8	176.2	-71.9	174.9	0	0	0	113.7	M85 I91 I109 L110 S115 N116 I119 V154	M85-L113 HydrophobicContact SD-CD2 4.18Å; I91-L113 HydrophobicContact CD1-CD1 3.87Å; I91-L113 HydrophobicContact CG2-CD1 3.94Å; I109-L113 HydrophobicContact CG2-CD1 3.96Å; I109-L113 HydrophobicContact CG2-CG 4.24Å; I109-L113 WeakPolarHBondContact O-CB 3.3Å; I109-L113 WeakPolarHBondContact O-CG 3.37Å; I109-L113 PolarHBondContact O-N 3.11Å; L110-L113 PolarHBondContact O-N 3.26Å; L113-S115 PolarHBondContact O-N 2.79Å; L113-N116 HydrophobicContact CD2-CB 4.38Å; L113-N116 WeakPolarHBondContact O-CB 3.44Å; L113-N116 PolarHBondContact O-N 3.06Å; L113-I119 HydrophobicContact CD1-CD1 4.2Å; L113-I119 HydrophobicContact CD2-CD1 4.16Å; L113-V154 HydrophobicContact CB-CG1 4.24Å; L113-V154 HydrophobicContact CB-CG2 3.7Å
114	C	89.1	Confident	88.7	Confident	23 Å²	23	26 Å²	26	16%	0.155	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-24.3	174.9	-66.7	0	0	0	0	112.7	L110 N111 A112 N157	L110-C114 PolarHBondContact O-N 2.88Å; L110-C114 VanDerWaalsContact O-N 3.08Å; L110-C114 PolarHBondContact O-SG 3.08Å; N111-C114 WeakPolarHBondContact O-CB 3.48Å; N111-C114 PolarHBondContact O-N 3.4Å; A112-C114 VanDerWaalsContact C-N 3.3Å; A112-C114 PolarHBondContact O-N 2.89Å; C114-N157 PolarHBondContact O-ND2 2.92Å
115	S	85.4	Confident	88.6	Confident	85 Å²	85	24.6 Å²	24.6	59%	0.594	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-0.5	174.6	-66.9	0	0	0	0	114.9	A112 L113	A112-S115 PolarHBondContact O-N 2.85Å; L113-S115 PolarHBondContact O-N 2.79Å
116	N	88.4	Confident	88.4	Confident	6 Å²	6	24.4 Å²	24.4	3%	0.032	15%	0.146	C	C	.	.			trans	-105.7	94.1	-174	-178.1	3.7	0	0	0	112.1	M85 C88 L113 G118	M85-N116 PolarHBondContact O-ND2 3.13Å; C88-N116 PolarHBondContact O-ND2 3.23Å; L113-N116 HydrophobicContact CD2-CB 4.38Å; L113-N116 WeakPolarHBondContact O-CB 3.44Å; L113-N116 PolarHBondContact O-N 3.06Å; N116-G118 PolarHBondContact O-N 2.94Å; N116-G118 WeakPolarHBondContact OD1-CA 3.42Å; N116-G118 PolarHBondContact OD1-N 3.36Å
117	A	89.9	Confident	87.5	Confident	39 Å²	39	25.7 Å²	25.7	32%	0.322	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-5	175.4	0	0	0	0	0	114.6	N157 K159	A117-N157 WeakPolarHBondContact CA-O 3.18Å; A117-K159 HydrophobicContact CB-CD 4.36Å; A117-K159 HydrophobicContact CB-CG 4.2Å; A117-K159 WeakPolarHBondContact O-CB 3.47Å; A117-K159 WeakPolarHBondContact O-CG 3.38Å; A117-K159 PolarHBondContact O-N 3.33Å
118	G	90.3	Very high	86.2	Confident	28 Å²	28	24.3 Å²	24.3	29%	0.289	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-3.6	-175.7	0	0	0	0	0	115.4	N116 H120	N116-G118 PolarHBondContact O-N 2.94Å; N116-G118 WeakPolarHBondContact OD1-CA 3.42Å; N116-G118 PolarHBondContact OD1-N 3.36Å; G118-H120 PolarHBondContact O-CE1 3.03Å; G118-H120 VanDerWaalsContact O-CE1 3.26Å; G118-H120 PolarHBondContact O-ND1 3.14Å; G118-H120 VanDerWaalsContact O-ND1 3.13Å
119	I	91.9	Very high	84.6	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.171	C	C	.	.			trans	-67.9	143.1	-176.2	-162.6	159.3	0	0	0	112.6	I91 L113 I122 V154 A158	I91-I119 HydrophobicContact CG2-CD1 3.92Å; L113-I119 HydrophobicContact CD1-CD1 4.2Å; L113-I119 HydrophobicContact CD2-CD1 4.16Å; I119-I122 HydrophobicContact CD1-CD1 4.06Å; I119-I122 HydrophobicContact CD1-CG1 3.53Å; I119-I122 HydrophobicContact CG1-CD1 4.49Å; I119-I122 HydrophobicContact CG1-CG1 3.97Å; I119-V154 HydrophobicContact CG2-CG1 4.26Å; I119-A158 HydrophobicContact CG2-CB 3.46Å; I119-A158 VanDerWaalsContact CG2-CB 3.46Å
120	H	92.9	Very high	82.5	Confident	62 Å²	62	30.8 Å²	30.8	29%	0.287	18%	0.179	S	C	.	.			trans	-130.5	-28.8	-173.8	-66.3	-4.3	0	0	0	113.1	N89 G118 C160 K162 N163	N89-H120 WeakPolarHBondContact O-CA 3.26Å; N89-H120 PolarHBondContact O-N 3.39Å; G118-H120 PolarHBondContact O-CE1 3.03Å; G118-H120 VanDerWaalsContact O-CE1 3.26Å; G118-H120 PolarHBondContact O-ND1 3.14Å; G118-H120 VanDerWaalsContact O-ND1 3.13Å; H120-C160 WeakPolarHBondContact CA-O 3.2Å; H120-C160 PolarHBondContact ND1-O 3Å; H120-K162 PolarHBondContact O-N 3.11Å; H120-N163 PolarHBondContact O-N 3.17Å
121	S	93.7	Very high	79.9	Confident	10 Å²	10	37.3 Å²	37.3	7%	0.07	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	134.6	173.3	-171.7	0	0	0	0	110.8	N89 E90 I91 N163	N89-S121 PolarHBondContact O-N 2.76Å; E90-S121 WeakPolarHBondContact CA-O 3.25Å; I91-S121 PolarHBondContact N-O 3.32Å; S121-N163 WeakPolarHBondContact CA-O 3.49Å
122	I	93.5	Very high	77.4	Confident	1 Å²	1	41 Å²	41	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	125.6	171.3	-62.5	166.5	0	0	0	107.8	I91 I119 L124 V154 L161 N163 F164 Y165	I91-I122 HydrophobicContact CG2-CG1 4.39Å; I91-I122 CarbonylContact O-C 3.59Å; I119-I122 HydrophobicContact CD1-CD1 4.06Å; I119-I122 HydrophobicContact CD1-CG1 3.53Å; I119-I122 HydrophobicContact CG1-CD1 4.49Å; I119-I122 HydrophobicContact CG1-CG1 3.97Å; I122-L124 HydrophobicContact CG2-CD2 4.41Å; I122-L124 HydrophobicContact CG2-CG 4.37Å; I122-V154 HydrophobicContact CD1-CG1 3.55Å; I122-L161 HydrophobicContact CB-CD1 4.4Å; I122-L161 HydrophobicContact CD1-CD1 3.7Å; I122-L161 HydrophobicContact CD1-CD2 4.24Å; I122-L161 HydrophobicContact CG1-CD1 3.8Å; I122-N163 PolarHBondContact N-O 3.2Å; I122-N163 VanDerWaalsContact N-O 3.08Å; I122-F164 HydrophobicContact CB-CD2 4.3Å; I122-F164 HydrophobicContact CG2-CE2 4.46Å; I122-Y165 PolarHBondContact O-N 3.35Å
123	S	90.5	Very high	74.7	Confident	4 Å²	4	45.6 Å²	45.6	3%	0.028	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	118.8	174	-159.7	0	0	0	0	111.4	I91 T92 L93 R125 Y165	I91-S123 PolarHBondContact O-N 3.03Å; T92-S123 WeakPolarHBondContact CA-O 3.44Å; L93-S123 PolarHBondContact N-O 3.28Å; S123-R125 PolarHBondContact OG-NE 3.07Å; S123-R125 VanDerWaalsContact OG-NE 3.1Å; S123-Y165 WeakPolarHBondContact CA-O 3.42Å; S123-Y165 WeakPolarHBondContact OG-CB 3.48Å
124	L	88.7	Confident	72.2	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	113.3	173.9	-59.8	-172.9	0	0	0	108.7	L93 F95 L106 I122 L151 Y165 G167	L93-L124 HydrophobicContact CB-CD2 4.08Å; L93-L124 HydrophobicContact CD1-CD2 3.95Å; L93-L124 HydrophobicContact CG-CD2 4.36Å; F95-L124 HydrophobicContact CE1-CB 4.1Å; L106-L124 HydrophobicContact CD1-CD2 3.88Å; I122-L124 HydrophobicContact CG2-CD2 4.41Å; I122-L124 HydrophobicContact CG2-CG 4.37Å; L124-L151 HydrophobicContact CD1-CD1 3.88Å; L124-L151 HydrophobicContact CD1-CD2 3.74Å; L124-L151 HydrophobicContact CD1-CG 4.46Å; L124-Y165 PolarHBondContact N-O 3.47Å; L124-G167 WeakPolarHBondContact O-CA 3.37Å; L124-G167 PolarHBondContact O-N 3.48Å
125	R	81.1	Confident	69.4	Low	17 Å²	17	57.5 Å²	57.5	6%	0.064	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	102	-166.6	-73	-176.4	-175.5	-162.4	-9.6	111.1	T92 L93 E94 F95 S123 T127 N803 G806	T92-R125 HydrophobicContact CG2-CG 4.36Å; L93-R125 PolarHBondContact O-N 3.09Å; E94-R125 CarbonylContact C-O 3.58Å; E94-R125 WeakPolarHBondContact CA-O 3.41Å; E94-R125 HydrophobicContact CB-CB 4.48Å; E94-R125 HydrophobicContact CG-CB 3.49Å; E94-R125 VanDerWaalsContact CG-CB 3.49Å; E94-R125 HydrophobicContact CG-CG 4.28Å; E94-R125 VanDerWaalsContact OE1-CD 3.27Å; E94-R125 WeakPolarHBondContact OE1-CD 3.49Å; E94-R125 IonicContact OE1-CZ 3.99Å; E94-R125 IonicContact OE1-NE 2.97Å; E94-R125 IonicContact OE1-NH1 2.69Å; E94-R125 PolarHBondContact OE1-NH1 3.43Å; F95-R125 PolarHBondContact N-O 3.36Å; S123-R125 PolarHBondContact OG-NE 3.07Å; S123-R125 VanDerWaalsContact OG-NE 3.1Å; R125-T127 PolarHBondContact O-N 3.06Å; R125-N803 VanDerWaalsContact CB-OD1 3.24Å; R125-N803 WeakPolarHBondContact CB-OD1 3.42Å; R125-N803 WeakPolarHBondContact CG-OD1 3.19Å; R125-N803 PolarHBondContact NH1-O 3.09Å; R125-N803 PolarHBondContact NH2-O 2.82Å; R125-G806 PolarHBondContact NH2-O 2.97Å
126	P	76.9	Confident	67	Low	0 Å²	0	56.5 Å²	56.5	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	131.6	177.5	23	-27	0	0	0	111.4	F95 P97 G167 Y799	F95-P126 HydrophobicContact CE2-CB 4.47Å; F95-P126 CarbonylContact O-C 3.4Å; F95-P126 WeakPolarHBondContact O-CA 3.39Å; P97-P126 HydrophobicContact CG-CB 4.1Å; P126-G167 VanDerWaalsContact CD-O 3.25Å; P126-G167 WeakPolarHBondContact CD-O 3.43Å; P126-G167 WeakPolarHBondContact CG-O 3.47Å; P126-Y799 HydrophobicContact CG-CD1 3.96Å; P126-Y799 HydrophobicContact CG-CE1 3.87Å
127	T	70.1	Confident	64.4	Low	29 Å²	29	60.8 Å²	60.8	18%	0.178	33%	0.325	C	S	.	.			trans	-104.5	68.4	177.8	55.5	0	0	0	0	110.3	P69 E94 F95 D96 R125 K129	P69-T127 HydrophobicContact CG-CG2 4.37Å; P69-T127 WeakPolarHBondContact CG-OG1 3.38Å; E94-T127 HydrophobicContact CB-CG2 3.66Å; E94-T127 HydrophobicContact CG-CG2 3.99Å; F95-T127 PolarHBondContact O-N 3.12Å; F95-T127 PolarHBondContact O-OG1 3.42Å; D96-T127 PolarHBondContact N-OG1 3.16Å; R125-T127 PolarHBondContact O-N 3.06Å; T127-K129 PolarHBondContact O-N 3.18Å
128	L	60.3	Low	62	Low	10 Å²	10	66.4 Å²	66.4	5%	0.052	35%	0.35	C	S	.	.			trans	-78.7	90.3	-178.4	-88.3	163	0	0	0	111.5	D96 P97 R98 L130 Y799	D96-L128 WeakPolarHBondContact OD1-CD2 3.38Å; P97-L128 HydrophobicContact CG-CD1 3.82Å; P97-L128 HydrophobicContact CG-CD2 4.17Å; P97-L128 HydrophobicContact CG-CG 3.9Å; R98-L128 HydrophobicContact CG-CD2 3.92Å; R98-L128 VanDerWaalsContact NE-CD2 3.33Å; L128-L130 VanDerWaalsContact C-N 3.27Å; L128-L130 HydrophobicContact CB-CD1 4.08Å; L128-L130 HydrophobicContact CB-CG 4.41Å; L128-L130 PolarHBondContact O-N 3.1Å; L128-Y799 HydrophobicContact CB-CD2 3.59Å; L128-Y799 HydrophobicContact CB-CE2 3.71Å; L128-Y799 HydrophobicContact CD1-CD2 4.09Å; L128-Y799 HydrophobicContact CD1-CE2 3.31Å; L128-Y799 HydrophobicContact CG-CD2 4.38Å; L128-Y799 HydrophobicContact CG-CE2 4.07Å
129	K	52.2	Low	59.8	Low	187 Å²	187	69.7 Å²	69.7	81%	0.813	36%	0.36	S	S	*	.			trans	-69.1	84.7	164.6	-73.4	-172.2	175.8	-175.7	0	109.1	T127 L131	T127-K129 PolarHBondContact O-N 3.18Å; K129-L131 VanDerWaalsContact C-N 3.33Å; K129-L131 PolarHBondContact O-N 3.1Å
130	L	43.1	Very low	57.9	Low	33 Å²	33	73.7 Å²	73.7	17%	0.173	39%	0.387	C	S	.	.			trans	-73.3	81.6	-177.1	-85.2	137.5	0	0	0	112.7	L128 Y132 D793 T795 A796	L128-L130 VanDerWaalsContact C-N 3.27Å; L128-L130 HydrophobicContact CB-CD1 4.08Å; L128-L130 HydrophobicContact CB-CG 4.41Å; L128-L130 PolarHBondContact O-N 3.1Å; L130-Y132 PolarHBondContact O-N 2.94Å; L130-Y132 VanDerWaalsContact O-N 3.09Å; L130-D793 HydrophobicContact CB-CB 4.07Å; L130-D793 HydrophobicContact CD1-CB 4.26Å; L130-T795 HydrophobicContact CD1-CG2 3.59Å; L130-A796 HydrophobicContact CB-CB 4.24Å; L130-A796 HydrophobicContact CD1-CB 4.01Å
131	L	35.6	Very low	56.2	Low	137 Å²	137	71.8 Å²	71.8	72%	0.717	38%	0.379	S	S	*	.			trans	-61.9	103.6	145.2	-78.3	173	0	0	0	107.8	K129 N133	K129-L131 VanDerWaalsContact C-N 3.33Å; K129-L131 PolarHBondContact O-N 3.1Å; L131-N133 VanDerWaalsContact C-N 3.29Å; L131-N133 PolarHBondContact O-N 3.12Å
132	Y	35.1	Very low	54.8	Low	162 Å²	162	78.1 Å²	78.1	64%	0.635	40%	0.402	S	S	*	.			trans	-78.3	76.8	-176.9	-157.8	-69.7	0	0	0	110.6	L130 K134 D793	L130-Y132 PolarHBondContact O-N 2.94Å; L130-Y132 VanDerWaalsContact O-N 3.09Å; Y132-K134 HydrophobicContact CD1-CG 3.89Å; Y132-K134 HydrophobicContact CE1-CG 3.63Å; Y132-K134 PolarHBondContact O-N 2.87Å; Y132-D793 WeakPolarHBondContact CD2-OD2 3.49Å
133	N	30.9	Very low	54	Low	124 Å²	124	78.7 Å²	78.7	66%	0.663	41%	0.405	S	S	*	.			trans	-77.1	113.9	168.8	-154.8	-18.2	0	0	0	108.7	L131 S135	L131-N133 VanDerWaalsContact C-N 3.29Å; L131-N133 PolarHBondContact O-N 3.12Å; N133-S135 PolarHBondContact O-N 2.9Å; N133-S135 PolarHBondContact OD1-OG 3.23Å
134	K	36	Very low	53.5	Low	190 Å²	190	80.4 Å²	80.4	83%	0.826	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	13.7	-163.3	-118.8	-178.3	-175.9	179.1	0	115.7	Y132	Y132-K134 HydrophobicContact CD1-CG 3.89Å; Y132-K134 HydrophobicContact CE1-CG 3.63Å; Y132-K134 PolarHBondContact O-N 2.87Å
135	S	31.9	Very low	53.3	Low	84 Å²	84	87.6 Å²	87.6	59%	0.587	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.4	-10.1	-152.8	51.6	0	0	0	0	115	N133 S137	N133-S135 PolarHBondContact O-N 2.9Å; N133-S135 PolarHBondContact OD1-OG 3.23Å; S135-S137 PolarHBondContact O-N 3.43Å
136	S	33.7	Very low	53.6	Low	63 Å²	63	93.2 Å²	93.2	44%	0.441	47%	0.473	S	S	.	.			trans	-93.4	66.5	-174.2	72.1	0	0	0	0	113.8
137	S	34.2	Very low	54.1	Low	97 Å²	97	93.2 Å²	93.2	68%	0.678	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	146.7	159.9	52.3	0	0	0	0	109.9	S135	S135-S137 PolarHBondContact O-N 3.43Å
138	N	40.4	Very low	55	Low	157 Å²	157	91.9 Å²	91.9	84%	0.84	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	2.3	178.2	-48.1	-44.8	0	0	0	119.5	S140	N138-S140 PolarHBondContact O-N 3.35Å
139	I	44.4	Very low	56.5	Low	97 Å²	97	94.4 Å²	94.4	50%	0.497	48%	0.478	S	S	.	.			trans	-70	104.9	170.4	-61.7	-176.1	0	0	0	110.3	N141	I139-N141 PolarHBondContact O-N 2.89Å
140	S	52	Low	58.4	Low	83 Å²	83	85.5 Å²	85.5	58%	0.58	44%	0.44	S	S	*	.			trans	-76.6	88.4	-179	169.9	0	0	0	0	111.3	N138 R142	N138-S140 PolarHBondContact O-N 3.35Å; S140-R142 PolarHBondContact O-N 2.9Å; S140-R142 WeakPolarHBondContact OG-CB 3.22Å; S140-R142 VanDerWaalsContact OG-CG 3.32Å; S140-R142 WeakPolarHBondContact OG-CG 3.49Å
141	N	56.6	Low	60.7	Low	22 Å²	22	84 Å²	84	12%	0.118	43%	0.432	C	S	.	.			trans	-65.6	32.7	169.8	-56.7	-44.4	0	0	0	113.7	R98 I139 Y170	R98-N141 WeakPolarHBondContact CG-OD1 3.17Å; I139-N141 PolarHBondContact O-N 2.89Å; N141-Y170 HydrophobicContact CB-CD2 3.5Å; N141-Y170 HydrophobicContact CB-CE2 4.09Å; N141-Y170 HydrophobicContact CB-CG 4.22Å; N141-Y170 PolarHBondContact O-N 2.68Å
142	R	64.1	Low	63.5	Low	143 Å²	143	77.6 Å²	77.6	54%	0.54	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-99.5	125.7	-177.1	-54.9	-171.6	165.7	-171.6	-2.8	109.7	S140 Y170	S140-R142 PolarHBondContact O-N 2.9Å; S140-R142 WeakPolarHBondContact OG-CB 3.22Å; S140-R142 VanDerWaalsContact OG-CG 3.32Å; S140-R142 WeakPolarHBondContact OG-CG 3.49Å; R142-Y170 VanDerWaalsContact CA-O 3.26Å; R142-Y170 WeakPolarHBondContact CA-O 3.48Å; R142-Y170 WeakPolarHBondContact CB-O 3.29Å; R142-Y170 VanDerWaalsContact CG-O 3.26Å; R142-Y170 WeakPolarHBondContact CG-O 3.38Å
143	L	75.6	Confident	66.2	Low	14 Å²	14	73.6 Å²	73.6	7%	0.073	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-58.1	142.9	173.4	-66.4	177	0	0	0	111.2	F95 L106 I147 I148 T169	F95-L143 HydrophobicContact CE2-CD2 4.2Å; L106-L143 HydrophobicContact CD2-CD2 3.89Å; L143-I147 HydrophobicContact CB-CB 4.41Å; L143-I147 HydrophobicContact CB-CG2 4.13Å; L143-I147 HydrophobicContact CD1-CG2 4.02Å; L143-I147 HydrophobicContact CD2-CD1 4.29Å; L143-I147 HydrophobicContact CD2-CG2 4.18Å; L143-I147 HydrophobicContact CG-CG2 4.33Å; L143-I148 HydrophobicContact CB-CD1 4.16Å; L143-I148 HydrophobicContact CB-CG1 4.24Å; L143-I148 HydrophobicContact CD1-CD1 4.14Å; L143-T169 HydrophobicContact CD1-CG2 3.93Å; L143-T169 HydrophobicContact CD2-CG2 3.93Å; L143-T169 HydrophobicContact CG-CG2 3.83Å
144	S	80.3	Confident	69.2	Low	39 Å²	39	67.7 Å²	67.7	27%	0.273	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-61.3	150.7	179.3	92	0	0	0	0	111.1	E107 K146 I147 I148	E107-S144 PolarHBondContact OE2-OG 2.93Å; E107-S144 VanDerWaalsContact OE2-OG 3.07Å; S144-K146 PolarHBondContact O-N 3.48Å; S144-K146 VanDerWaalsContact O-N 3.12Å; S144-K146 WeakPolarHBondContact OG-CB 3.28Å; S144-K146 PolarHBondContact OG-N 3.49Å; S144-I147 PolarHBondContact O-N 2.92Å; S144-I147 VanDerWaalsContact O-N 3.08Å; S144-I147 WeakPolarHBondContact OG-CG1 3.49Å; S144-I147 PolarHBondContact OG-N 3.2Å; S144-I148 PolarHBondContact O-N 3.36Å; S144-I148 VanDerWaalsContact O-N 3.08Å
145	K	85	Confident	72	Confident	151 Å²	151	58.6 Å²	58.6	66%	0.657	32%	0.317	S	S	*	.	H	α-helix	trans	-59.2	-24.3	173.5	-71.7	-175.5	178.3	178.7	0	112.5	N149	K145-N149 WeakPolarHBondContact O-CB 3.46Å; K145-N149 PolarHBondContact O-N 3.47Å; K145-N149 PolarHBondContact O-ND2 3.43Å; K145-N149 PolarHBondContact O-OD1 2.89Å
146	K	86.4	Confident	74.8	Confident	135 Å²	135	58.1 Å²	58.1	59%	0.587	31%	0.306	S	S	*	.	H	α-helix	trans	-71.4	-45.7	173.8	-56	176.3	-180	176.3	0	111.5	E107 S144 I148 N149 A150	E107-K146 VanDerWaalsContact CD-CD 3.48Å; E107-K146 WeakPolarHBondContact OE1-CD 3.41Å; E107-K146 IonicContact OE1-NZ 2.96Å; E107-K146 PolarHBondContact OE1-NZ 2.92Å; E107-K146 WeakPolarHBondContact OE2-CB 3.38Å; E107-K146 WeakPolarHBondContact OE2-CD 3.44Å; S144-K146 PolarHBondContact O-N 3.48Å; S144-K146 VanDerWaalsContact O-N 3.12Å; S144-K146 WeakPolarHBondContact OG-CB 3.28Å; S144-K146 PolarHBondContact OG-N 3.49Å; K146-I148 VanDerWaalsContact C-N 3.31Å; K146-I148 PolarHBondContact O-N 2.9Å; K146-N149 WeakPolarHBondContact O-CB 3.32Å; K146-N149 PolarHBondContact O-N 3.22Å; K146-N149 VanDerWaalsContact O-N 3.1Å; K146-A150 PolarHBondContact O-N 3.4Å
147	I	88.8	Confident	77.7	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-59.1	-43.9	176	-70.6	165.9	0	0	0	110.5	V103 L106 E107 L110 L143 S144 N149 A150 L151	V103-I147 HydrophobicContact CG1-CD1 3.61Å; L106-I147 HydrophobicContact CD2-CD1 4.47Å; L106-I147 HydrophobicContact CD2-CG2 4.32Å; L106-I147 HydrophobicContact CG-CG2 4.43Å; E107-I147 HydrophobicContact CB-CD1 4.2Å; E107-I147 HydrophobicContact CB-CG1 3.72Å; E107-I147 HydrophobicContact CG-CG1 4Å; L110-I147 HydrophobicContact CD1-CG2 3.81Å; L143-I147 HydrophobicContact CB-CB 4.41Å; L143-I147 HydrophobicContact CB-CG2 4.13Å; L143-I147 HydrophobicContact CD1-CG2 4.02Å; L143-I147 HydrophobicContact CD2-CD1 4.29Å; L143-I147 HydrophobicContact CD2-CG2 4.18Å; L143-I147 HydrophobicContact CG-CG2 4.33Å; S144-I147 PolarHBondContact O-N 2.92Å; S144-I147 VanDerWaalsContact O-N 3.08Å; S144-I147 WeakPolarHBondContact OG-CG1 3.49Å; S144-I147 PolarHBondContact OG-N 3.2Å; I147-N149 VanDerWaalsContact C-N 3.33Å; I147-N149 PolarHBondContact O-N 3.04Å; I147-A150 PolarHBondContact O-N 2.81Å; I147-L151 VanDerWaalsContact O-CB 3.26Å; I147-L151 WeakPolarHBondContact O-CB 3.38Å; I147-L151 PolarHBondContact O-N 3.39Å
148	I	88.7	Confident	80.5	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-66.8	-32.7	176.6	-61	-68.1	0	0	0	112	L143 S144 K146 C152 W166 E175 V179	L143-I148 HydrophobicContact CB-CD1 4.16Å; L143-I148 HydrophobicContact CB-CG1 4.24Å; L143-I148 HydrophobicContact CD1-CD1 4.14Å; S144-I148 PolarHBondContact O-N 3.36Å; S144-I148 VanDerWaalsContact O-N 3.08Å; K146-I148 VanDerWaalsContact C-N 3.31Å; K146-I148 PolarHBondContact O-N 2.9Å; I148-C152 WeakPolarHBondContact O-CB 3.23Å; I148-C152 PolarHBondContact O-N 2.95Å; I148-C152 VanDerWaalsContact O-N 3.12Å; I148-C152 PolarHBondContact O-SG 2.94Å; I148-C152 VanDerWaalsContact O-SG 3.4Å; I148-W166 HydrophobicContact CD1-CH2 4.23Å; I148-W166 HydrophobicContact CD1-CZ2 3.84Å; I148-E175 HydrophobicContact CD1-CB 4.34Å; I148-E175 HydrophobicContact CG1-CB 4.32Å; I148-E175 HydrophobicContact CG1-CG 4.17Å; I148-E175 HydrophobicContact CG2-CB 4.19Å; I148-E175 HydrophobicContact CG2-CG 4.34Å; I148-V179 HydrophobicContact CG2-CG2 4.16Å
149	N	91.6	Very high	82.9	Confident	63 Å²	63	55.3 Å²	55.3	34%	0.337	27%	0.272	S	S	.	.	H	α-helix	trans	-67	-53.5	171.3	-72.5	-13.3	0	0	0	111.3	K145 K146 I147 L151 C152 D153 R178	K145-N149 WeakPolarHBondContact O-CB 3.46Å; K145-N149 PolarHBondContact O-N 3.47Å; K145-N149 PolarHBondContact O-ND2 3.43Å; K145-N149 PolarHBondContact O-OD1 2.89Å; K146-N149 WeakPolarHBondContact O-CB 3.32Å; K146-N149 PolarHBondContact O-N 3.22Å; K146-N149 VanDerWaalsContact O-N 3.1Å; I147-N149 VanDerWaalsContact C-N 3.33Å; I147-N149 PolarHBondContact O-N 3.04Å; N149-L151 VanDerWaalsContact C-N 3.29Å; N149-L151 PolarHBondContact O-N 2.93Å; N149-C152 CarbonylContact O-C 3.58Å; N149-C152 WeakPolarHBondContact O-CA 3.46Å; N149-C152 VanDerWaalsContact O-CB 3.32Å; N149-C152 WeakPolarHBondContact O-CB 3.31Å; N149-C152 PolarHBondContact O-N 2.99Å; N149-D153 VanDerWaalsContact O-CG 3.26Å; N149-D153 PolarHBondContact O-N 3.21Å; N149-R178 VanDerWaalsContact OD1-CZ 3.26Å; N149-R178 PolarHBondContact OD1-NH1 3.21Å; N149-R178 PolarHBondContact OD1-NH2 2.84Å
150	A	91.7	Very high	85.1	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.008	26%	0.259	C	S	.	.	H	α-helix	trans	-57.7	-41.7	179.6	0	0	0	0	0	111.7	L110 K146 I147 C152 D153 V154	L110-A150 HydrophobicContact CB-CB 3.82Å; K146-A150 PolarHBondContact O-N 3.4Å; I147-A150 PolarHBondContact O-N 2.81Å; A150-C152 PolarHBondContact O-N 2.72Å; A150-D153 PolarHBondContact O-N 3.37Å; A150-D153 VanDerWaalsContact O-N 3.15Å; A150-V154 WeakPolarHBondContact O-CG2 3.38Å; A150-V154 PolarHBondContact O-N 3.28Å
151	L	92.9	Very high	87.1	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.1	-44.6	173.8	-174.6	59.5	0	0	0	112.3	L110 L124 I147 N149 D153 I155 F164 V179	L110-L151 HydrophobicContact CD1-CB 4.39Å; L110-L151 HydrophobicContact CD2-CD1 3.97Å; L124-L151 HydrophobicContact CD1-CD1 3.88Å; L124-L151 HydrophobicContact CD1-CD2 3.74Å; L124-L151 HydrophobicContact CD1-CG 4.46Å; I147-L151 VanDerWaalsContact O-CB 3.26Å; I147-L151 WeakPolarHBondContact O-CB 3.38Å; I147-L151 PolarHBondContact O-N 3.39Å; N149-L151 VanDerWaalsContact C-N 3.29Å; N149-L151 PolarHBondContact O-N 2.93Å; L151-D153 VanDerWaalsContact C-N 3.34Å; L151-I155 HydrophobicContact CD1-CD1 4.38Å; L151-I155 HydrophobicContact CG-CD1 4.1Å; L151-I155 WeakPolarHBondContact O-CD1 3.49Å; L151-I155 WeakPolarHBondContact O-CG1 3.47Å; L151-I155 PolarHBondContact O-N 3.16Å; L151-I155 VanDerWaalsContact O-N 3.08Å; L151-F164 HydrophobicContact CD1-CE2 4.02Å; L151-F164 HydrophobicContact CD1-CZ 4.39Å; L151-F164 HydrophobicContact CD2-CZ 4.26Å; L151-F164 HydrophobicContact CG-CZ 4.49Å; L151-V179 HydrophobicContact CD2-CG2 4.23Å
152	C	92.9	Very high	88.8	Confident	4 Å²	4	51.4 Å²	51.4	3%	0.027	24%	0.243	C	C	.	.	H	α-helix	trans	-60.1	-42.5	172	-80.8	0	0	0	0	112.2	I148 N149 A150 I155 M156 S182	I148-C152 WeakPolarHBondContact O-CB 3.23Å; I148-C152 PolarHBondContact O-N 2.95Å; I148-C152 VanDerWaalsContact O-N 3.12Å; I148-C152 PolarHBondContact O-SG 2.94Å; I148-C152 VanDerWaalsContact O-SG 3.4Å; N149-C152 CarbonylContact O-C 3.58Å; N149-C152 WeakPolarHBondContact O-CA 3.46Å; N149-C152 VanDerWaalsContact O-CB 3.32Å; N149-C152 WeakPolarHBondContact O-CB 3.31Å; N149-C152 PolarHBondContact O-N 2.99Å; A150-C152 PolarHBondContact O-N 2.72Å; C152-I155 PolarHBondContact O-N 3.09Å; C152-M156 WeakPolarHBondContact O-CB 3.44Å; C152-M156 VanDerWaalsContact O-CG 3.25Å; C152-M156 WeakPolarHBondContact O-CG 3.39Å; C152-M156 PolarHBondContact O-N 2.85Å; C152-S182 PolarHBondContact SG-OG 3.2Å
153	D	93.4	Very high	90.2	Very high	77 Å²	77	46.1 Å²	46.1	41%	0.412	23%	0.226	S	C	.	.	H	α-helix	trans	-68.4	-39.4	-177.3	-63.1	-27.9	0	0	0	111.6	N149 A150 L151 M156 N157	N149-D153 VanDerWaalsContact O-CG 3.26Å; N149-D153 PolarHBondContact O-N 3.21Å; A150-D153 PolarHBondContact O-N 3.37Å; A150-D153 VanDerWaalsContact O-N 3.15Å; L151-D153 VanDerWaalsContact C-N 3.34Å; D153-M156 PolarHBondContact O-N 3.04Å; D153-N157 VanDerWaalsContact O-CB 3.31Å; D153-N157 WeakPolarHBondContact O-CB 3.36Å; D153-N157 PolarHBondContact O-N 3.29Å; D153-N157 PolarHBondContact O-ND2 3.36Å
154	V	93.5	Very high	91	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58.9	-47.8	169.4	178.6	0	0	0	0	110.9	L110 L113 I119 I122 A150 M156 N157 A158	L110-V154 HydrophobicContact CD2-CG2 4.47Å; L110-V154 VanDerWaalsContact O-CG2 3.28Å; L110-V154 WeakPolarHBondContact O-CG2 3.46Å; L113-V154 HydrophobicContact CB-CG1 4.24Å; L113-V154 HydrophobicContact CB-CG2 3.7Å; I119-V154 HydrophobicContact CG2-CG1 4.26Å; I122-V154 HydrophobicContact CD1-CG1 3.55Å; A150-V154 WeakPolarHBondContact O-CG2 3.38Å; A150-V154 PolarHBondContact O-N 3.28Å; V154-M156 VanDerWaalsContact C-N 3.3Å; V154-M156 PolarHBondContact O-N 2.96Å; V154-N157 PolarHBondContact O-N 3.46Å; V154-A158 WeakPolarHBondContact O-CB 3.29Å; V154-A158 PolarHBondContact O-N 2.93Å
155	I	93.4	Very high	91.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-62.2	-37.7	178.9	-69	162.3	0	0	0	111.5	L151 C152 L161 F164 V179 L183 Q187	L151-I155 HydrophobicContact CD1-CD1 4.38Å; L151-I155 HydrophobicContact CG-CD1 4.1Å; L151-I155 WeakPolarHBondContact O-CD1 3.49Å; L151-I155 WeakPolarHBondContact O-CG1 3.47Å; L151-I155 PolarHBondContact O-N 3.16Å; L151-I155 VanDerWaalsContact O-N 3.08Å; C152-I155 PolarHBondContact O-N 3.09Å; I155-L161 HydrophobicContact CG1-CD2 4.14Å; I155-F164 HydrophobicContact CD1-CD2 4.34Å; I155-F164 HydrophobicContact CD1-CE2 3.66Å; I155-F164 HydrophobicContact CD1-CZ 3.92Å; I155-F164 HydrophobicContact CG1-CE2 4.15Å; I155-V179 HydrophobicContact CD1-CG1 3.83Å; I155-L183 HydrophobicContact CD1-CD2 4.26Å; I155-L183 HydrophobicContact CD1-CG 4.25Å; I155-L183 HydrophobicContact CG1-CD2 4.32Å; I155-L183 HydrophobicContact CG2-CB 4.49Å; I155-L183 HydrophobicContact CG2-CD2 3.74Å; I155-L183 HydrophobicContact CG2-CG 3.97Å; I155-Q187 HydrophobicContact CG2-CG 4.15Å; I155-Q187 PolarHBondContact O-NE2 2.99Å
156	M	92.4	Very high	91.4	Very high	73 Å²	73	37.2 Å²	37.2	36%	0.36	18%	0.181	S	C	.	.	H	α-helix	trans	-72.1	-35.5	179.4	-72.9	-61.6	-55.2	0	0	112.4	C152 D153 V154 K185 S186	C152-M156 WeakPolarHBondContact O-CB 3.44Å; C152-M156 VanDerWaalsContact O-CG 3.25Å; C152-M156 WeakPolarHBondContact O-CG 3.39Å; C152-M156 PolarHBondContact O-N 2.85Å; D153-M156 PolarHBondContact O-N 3.04Å; V154-M156 VanDerWaalsContact C-N 3.3Å; V154-M156 PolarHBondContact O-N 2.96Å; M156-K185 HydrophobicContact CE-CB 4.34Å; M156-K185 HydrophobicContact SD-CB 4.07Å; M156-K185 HydrophobicContact SD-CD 4.47Å; M156-S186 VanDerWaalsContact CE-OG 3.29Å; M156-S186 WeakPolarHBondContact CE-OG 3.37Å; M156-S186 PolarHBondContact O-OG 3.31Å; M156-S186 PolarHBondContact SD-OG 3.49Å
157	N	93	Very high	90.7	Very high	84 Å²	84	30.8 Å²	30.8	45%	0.449	15%	0.154	S	C	.	.	H	α-helix	trans	-88.5	-20	-175.1	-67.6	-13.2	0	0	0	114.4	C114 A117 D153 V154	C114-N157 PolarHBondContact O-ND2 2.92Å; A117-N157 WeakPolarHBondContact CA-O 3.18Å; D153-N157 VanDerWaalsContact O-CB 3.31Å; D153-N157 WeakPolarHBondContact O-CB 3.36Å; D153-N157 PolarHBondContact O-N 3.29Å; D153-N157 PolarHBondContact O-ND2 3.36Å; V154-N157 PolarHBondContact O-N 3.46Å
158	A	92.8	Very high	89.4	Confident	6 Å²	6	30.9 Å²	30.9	5%	0.05	15%	0.154	C	C	.	.			trans	-63.3	132	175.2	0	0	0	0	0	111.8	I119 V154 L161 Q187	I119-A158 HydrophobicContact CG2-CB 3.46Å; I119-A158 VanDerWaalsContact CG2-CB 3.46Å; V154-A158 WeakPolarHBondContact O-CB 3.29Å; V154-A158 PolarHBondContact O-N 2.93Å; A158-L161 HydrophobicContact CB-CB 4.22Å; A158-Q187 PolarHBondContact O-NE2 3.07Å
159	K	91	Very high	88.3	Confident	169 Å²	169	30.9 Å²	30.9	74%	0.735	16%	0.155	S	C	*	.	S	Bend	trans	-76.1	-31	179	-73.7	177.6	176.8	-173.2	0	114.2	A117 N190	A117-K159 HydrophobicContact CB-CD 4.36Å; A117-K159 HydrophobicContact CB-CG 4.2Å; A117-K159 WeakPolarHBondContact O-CB 3.47Å; A117-K159 WeakPolarHBondContact O-CG 3.38Å; A117-K159 PolarHBondContact O-N 3.33Å; K159-N190 PolarHBondContact O-ND2 3.35Å; K159-N190 VanDerWaalsContact O-ND2 3.16Å
160	C	92	Very high	87	Confident	33 Å²	33	31.7 Å²	31.7	22%	0.223	15%	0.153	C	C	.	.			trans	-154.6	73.6	-176.1	-168	0	0	0	0	110.6	H120 K162 N190	H120-C160 WeakPolarHBondContact CA-O 3.2Å; H120-C160 PolarHBondContact ND1-O 3Å; C160-K162 PolarHBondContact O-N 3.34Å; C160-N190 PolarHBondContact SG-OD1 2.96Å
161	L	93.4	Very high	85.9	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.154	C	C	.	.			trans	-77.5	110.5	173	-173.1	69.3	0	0	0	108.8	I122 I155 A158 F164 L183 Q187 N190 L191	I122-L161 HydrophobicContact CB-CD1 4.4Å; I122-L161 HydrophobicContact CD1-CD1 3.7Å; I122-L161 HydrophobicContact CD1-CD2 4.24Å; I122-L161 HydrophobicContact CG1-CD1 3.8Å; I155-L161 HydrophobicContact CG1-CD2 4.14Å; A158-L161 HydrophobicContact CB-CB 4.22Å; L161-F164 HydrophobicContact CD2-CB 4.3Å; L161-F164 HydrophobicContact CD2-CD2 4.05Å; L161-L183 HydrophobicContact CD2-CD2 3.89Å; L161-Q187 HydrophobicContact CB-CB 4.49Å; L161-Q187 HydrophobicContact CB-CG 3.79Å; L161-Q187 HydrophobicContact CD2-CG 4.25Å; L161-N190 CarbonylContact O-C 3.57Å; L161-N190 WeakPolarHBondContact O-CB 3.37Å; L161-L191 PolarHBondContact O-N 2.76Å
162	K	93.2	Very high	84.7	Confident	86 Å²	86	32.5 Å²	32.5	37%	0.374	16%	0.161	S	C	.	.			trans	-91.4	-40.7	-178.7	-64	-177.5	177.6	-175.1	0	112.2	H120 C160 N190 L192 S193	H120-K162 PolarHBondContact O-N 3.11Å; C160-K162 PolarHBondContact O-N 3.34Å; K162-N190 WeakPolarHBondContact CA-O 3.27Å; K162-L192 HydrophobicContact CB-CD1 4.22Å; K162-L192 HydrophobicContact CB-CG 4.22Å; K162-L192 HydrophobicContact CD-CD1 4.06Å; K162-L192 HydrophobicContact CG-CD1 4.3Å; K162-L192 HydrophobicContact CG-CG 4.46Å; K162-L192 PolarHBondContact O-N 3.39Å; K162-S193 PolarHBondContact O-N 2.85Å
163	N	92.7	Very high	83.6	Confident	33 Å²	33	34.9 Å²	34.9	18%	0.176	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	126.3	-174.2	-64.7	7.4	0	0	0	109.6	H120 S121 I122 Y165 S193 D808	H120-N163 PolarHBondContact O-N 3.17Å; S121-N163 WeakPolarHBondContact CA-O 3.49Å; I122-N163 PolarHBondContact N-O 3.2Å; I122-N163 VanDerWaalsContact N-O 3.08Å; N163-Y165 HydrophobicContact CB-CD2 4.32Å; N163-Y165 HydrophobicContact CB-CE2 3.65Å; N163-S193 WeakPolarHBondContact CA-O 3.16Å; N163-D808 PolarHBondContact ND2-OD2 3.03Å
164	F	92.8	Very high	82.8	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	107.6	175.6	-174.6	-101.6	0	0	0	110.9	I122 L151 I155 L161 W166 V179 L183 L191 S193 L194 Q195	I122-F164 HydrophobicContact CB-CD2 4.3Å; I122-F164 HydrophobicContact CG2-CE2 4.46Å; L151-F164 HydrophobicContact CD1-CE2 4.02Å; L151-F164 HydrophobicContact CD1-CZ 4.39Å; L151-F164 HydrophobicContact CD2-CZ 4.26Å; L151-F164 HydrophobicContact CG-CZ 4.49Å; I155-F164 HydrophobicContact CD1-CD2 4.34Å; I155-F164 HydrophobicContact CD1-CE2 3.66Å; I155-F164 HydrophobicContact CD1-CZ 3.92Å; I155-F164 HydrophobicContact CG1-CE2 4.15Å; L161-F164 HydrophobicContact CD2-CB 4.3Å; L161-F164 HydrophobicContact CD2-CD2 4.05Å; F164-W166 HydrophobicContact CD1-CB 4.5Å; F164-W166 HydrophobicContact CE1-CB 3.76Å; F164-W166 HydrophobicContact CE1-CE3 4.2Å; F164-W166 HydrophobicContact CE1-CG 4.47Å; F164-W166 HydrophobicContact CZ-CB 4.15Å; F164-V179 HydrophobicContact CE1-CG1 3.9Å; F164-V179 HydrophobicContact CZ-CG1 3.71Å; F164-L183 HydrophobicContact CB-CD2 4.23Å; F164-L183 HydrophobicContact CD1-CD1 3.71Å; F164-L183 HydrophobicContact CD1-CD2 4.36Å; F164-L183 HydrophobicContact CD2-CD2 4.35Å; F164-L183 HydrophobicContact CE1-CD1 3.92Å; F164-L183 HydrophobicContact CG-CD1 4.24Å; F164-L183 HydrophobicContact CG-CD2 4.05Å; F164-L191 HydrophobicContact CB-CD1 3.9Å; F164-S193 PolarHBondContact N-O 3.43Å; F164-L194 HydrophobicContact CB-CD1 4.26Å; F164-L194 HydrophobicContact CD1-CD1 3.73Å; F164-L194 HydrophobicContact CG-CD1 4.48Å; F164-Q195 PolarHBondContact O-N 2.71Å
165	Y	89.3	Confident	82.1	Confident	6 Å²	6	40 Å²	40	2%	0.024	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	111.9	-179.9	-58.2	-77.2	0	0	0	110	I122 S123 L124 N163 S193 Q195 Q221 D808	I122-Y165 PolarHBondContact O-N 3.35Å; S123-Y165 WeakPolarHBondContact CA-O 3.42Å; S123-Y165 WeakPolarHBondContact OG-CB 3.48Å; L124-Y165 PolarHBondContact N-O 3.47Å; N163-Y165 HydrophobicContact CB-CD2 4.32Å; N163-Y165 HydrophobicContact CB-CE2 3.65Å; Y165-S193 WeakPolarHBondContact CE1-OG 3.34Å; Y165-S193 WeakPolarHBondContact OH-CB 3.41Å; Y165-S193 PolarHBondContact OH-OG 2.87Å; Y165-Q195 HydrophobicContact CD1-CB 3.49Å; Y165-Q195 VanDerWaalsContact CD1-CB 3.49Å; Y165-Q195 HydrophobicContact CD1-CG 4.1Å; Y165-Q195 HydrophobicContact CE1-CB 4.08Å; Y165-Q195 HydrophobicContact CG-CB 4.43Å; Y165-Q221 PolarHBondContact OH-NE2 3.17Å; Y165-D808 PolarHBondContact OH-OD1 3.17Å; Y165-D808 PolarHBondContact OH-OD2 3.34Å
166	W	84.2	Confident	81.4	Confident	10 Å²	10	40.4 Å²	40.4	4%	0.038	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	103.5	176	-172.3	10.4	0	0	0	110.6	I148 F164 T169 C171 V176 V179 Q195	I148-W166 HydrophobicContact CD1-CH2 4.23Å; I148-W166 HydrophobicContact CD1-CZ2 3.84Å; F164-W166 HydrophobicContact CD1-CB 4.5Å; F164-W166 HydrophobicContact CE1-CB 3.76Å; F164-W166 HydrophobicContact CE1-CE3 4.2Å; F164-W166 HydrophobicContact CE1-CG 4.47Å; F164-W166 HydrophobicContact CZ-CB 4.15Å; W166-T169 PolarHBondContact NE1-OG1 2.96Å; W166-C171 HydrophobicContact CH2-CB 4.21Å; W166-C171 HydrophobicContact CZ2-CB 3.91Å; W166-V176 HydrophobicContact CH2-CB 4.47Å; W166-V176 HydrophobicContact CH2-CG2 3.89Å; W166-V176 HydrophobicContact CZ3-CB 4.4Å; W166-V176 HydrophobicContact CZ3-CG2 4.1Å; W166-V179 HydrophobicContact CE3-CB 4.37Å; W166-V179 HydrophobicContact CE3-CG1 3.96Å; W166-V179 HydrophobicContact CH2-CB 4.1Å; W166-V179 HydrophobicContact CH2-CG1 4.49Å; W166-V179 HydrophobicContact CH2-CG2 3.75Å; W166-V179 HydrophobicContact CZ3-CB 3.63Å; W166-V179 HydrophobicContact CZ3-CG1 3.72Å; W166-V179 HydrophobicContact CZ3-CG2 3.79Å; W166-Q195 PolarHBondContact N-O 3.41Å
167	G	70.9	Confident	80.7	Confident	1 Å²	1	38 Å²	38	1%	0.01	19%	0.186	C	C	.	.			trans	-94.1	141.4	177.8	0	0	0	0	0	114.5	L124 P126 T169	L124-G167 WeakPolarHBondContact O-CA 3.37Å; L124-G167 PolarHBondContact O-N 3.48Å; P126-G167 VanDerWaalsContact CD-O 3.25Å; P126-G167 WeakPolarHBondContact CD-O 3.43Å; P126-G167 WeakPolarHBondContact CG-O 3.47Å; G167-T169 PolarHBondContact O-N 3.09Å
168	G	62	Low	80.3	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.01	18%	0.177	C	C	.	.	S	Bend	trans	64.8	-16.7	139.4	0	0	0	0	0	121.5	Y799	G168-Y799 VanDerWaalsContact CA-CE1 3.45Å; G168-Y799 PolarHBondContact O-OH 2.91Å
169	T	65.5	Low	80.1	Confident	2 Å²	2	37 Å²	37	1%	0.012	18%	0.175	C	C	.	.			trans	-74.5	136.9	177.5	57.1	0	0	0	0	110.5	F95 L143 W166 G167 C171	F95-T169 HydrophobicContact CE2-CG2 3.7Å; F95-T169 HydrophobicContact CZ-CG2 3.6Å; L143-T169 HydrophobicContact CD1-CG2 3.93Å; L143-T169 HydrophobicContact CD2-CG2 3.93Å; L143-T169 HydrophobicContact CG-CG2 3.83Å; W166-T169 PolarHBondContact NE1-OG1 2.96Å; G167-T169 PolarHBondContact O-N 3.09Å; T169-C171 PolarHBondContact O-N 3.31Å
170	Y	64.4	Low	79.9	Confident	80 Å²	80	29.1 Å²	29.1	31%	0.314	14%	0.141	S	C	.	.			trans	-75.1	99.1	-178.2	-71	-109.1	0	0	0	109.4	N141 R142 R198 F200	N141-Y170 HydrophobicContact CB-CD2 3.5Å; N141-Y170 HydrophobicContact CB-CE2 4.09Å; N141-Y170 HydrophobicContact CB-CG 4.22Å; N141-Y170 PolarHBondContact O-N 2.68Å; R142-Y170 VanDerWaalsContact CA-O 3.26Å; R142-Y170 WeakPolarHBondContact CA-O 3.48Å; R142-Y170 WeakPolarHBondContact CB-O 3.29Å; R142-Y170 VanDerWaalsContact CG-O 3.26Å; R142-Y170 WeakPolarHBondContact CG-O 3.38Å; Y170-R198 PolarHBondContact OH-NH1 3.12Å; Y170-F200 HydrophobicContact CD1-CD2 4.49Å
171	C	68.6	Low	79.5	Confident	4 Å²	4	31.6 Å²	31.6	3%	0.027	15%	0.149	C	C	.	.	B	Isolated β-bridge	trans	-114.6	141.9	178.7	-71.8	0	0	0	0	111.8	W166 T169 E175 V176 F200	W166-C171 HydrophobicContact CH2-CB 4.21Å; W166-C171 HydrophobicContact CZ2-CB 3.91Å; T169-C171 PolarHBondContact O-N 3.31Å; C171-E175 HydrophobicContact CB-CB 4.23Å; C171-V176 HydrophobicContact CB-CG2 3.92Å; C171-F200 WeakPolarHBondContact O-CB 3.23Å
172	G	66.5	Low	79.3	Confident	13 Å²	13	32.2 Å²	32.2	13%	0.134	15%	0.153	C	C	.	.			trans	-70.2	160.9	176.8	0	0	0	0	0	111.6	Y174 E175 V176	G172-Y174 PolarHBondContact O-N 3.46Å; G172-Y174 VanDerWaalsContact O-N 3.12Å; G172-E175 VanDerWaalsContact CA-OE2 3.28Å; G172-E175 WeakPolarHBondContact CA-OE2 3.45Å; G172-E175 PolarHBondContact N-OE2 3.11Å; G172-E175 PolarHBondContact O-N 3Å; G172-V176 VanDerWaalsContact O-CG2 3.27Å; G172-V176 WeakPolarHBondContact O-CG2 3.29Å; G172-V176 PolarHBondContact O-N 2.9Å; G172-V176 VanDerWaalsContact O-N 3.1Å
173	S	70	Confident	79.2	Confident	54 Å²	54	28.1 Å²	28.1	38%	0.378	14%	0.136	S	C	.	.	H	α-helix	trans	-55.9	-29	175.8	54.9	0	0	0	0	112.6	S177 I202	S173-S177 WeakPolarHBondContact O-CB 3.44Å; S173-S177 PolarHBondContact O-N 3.05Å; S173-I202 WeakPolarHBondContact OG-CD1 3.48Å
174	Y	76.9	Confident	78.8	Confident	147 Å²	147	27.7 Å²	27.7	58%	0.576	14%	0.135	S	C	*	.	H	α-helix	trans	-69.6	-49.3	175.8	-178.4	-100	0	0	0	113.4	G172 V176 S177 R178	G172-Y174 PolarHBondContact O-N 3.46Å; G172-Y174 VanDerWaalsContact O-N 3.12Å; Y174-V176 VanDerWaalsContact C-N 3.33Å; Y174-V176 PolarHBondContact O-N 2.89Å; Y174-S177 WeakPolarHBondContact O-CB 3.17Å; Y174-S177 PolarHBondContact O-N 3.35Å; Y174-R178 HydrophobicContact CE1-CG 4.3Å; Y174-R178 PolarHBondContact O-N 3.45Å
175	E	78.8	Confident	78.6	Confident	38 Å²	38	33.8 Å²	33.8	18%	0.178	16%	0.161	C	C	.	.	H	α-helix	trans	-61.4	-44.7	177.9	-70.7	66.9	-144.7	0	0	110.9	I148 C171 G172 R178 V179	I148-E175 HydrophobicContact CD1-CB 4.34Å; I148-E175 HydrophobicContact CG1-CB 4.32Å; I148-E175 HydrophobicContact CG1-CG 4.17Å; I148-E175 HydrophobicContact CG2-CB 4.19Å; I148-E175 HydrophobicContact CG2-CG 4.34Å; C171-E175 HydrophobicContact CB-CB 4.23Å; G172-E175 VanDerWaalsContact CA-OE2 3.28Å; G172-E175 WeakPolarHBondContact CA-OE2 3.45Å; G172-E175 PolarHBondContact N-OE2 3.11Å; G172-E175 PolarHBondContact O-N 3Å; E175-R178 PolarHBondContact O-N 3.36Å; E175-V179 PolarHBondContact O-N 3.08Å
176	V	78.5	Confident	78.5	Confident	9 Å²	9	35.4 Å²	35.4	6%	0.055	17%	0.173	C	C	.	.	H	α-helix	trans	-62.7	-46.4	177.2	173.3	0	0	0	0	111	W166 C171 G172 Y174 R178 V179 L180 L199	W166-V176 HydrophobicContact CH2-CB 4.47Å; W166-V176 HydrophobicContact CH2-CG2 3.89Å; W166-V176 HydrophobicContact CZ3-CB 4.4Å; W166-V176 HydrophobicContact CZ3-CG2 4.1Å; C171-V176 HydrophobicContact CB-CG2 3.92Å; G172-V176 VanDerWaalsContact O-CG2 3.27Å; G172-V176 WeakPolarHBondContact O-CG2 3.29Å; G172-V176 PolarHBondContact O-N 2.9Å; G172-V176 VanDerWaalsContact O-N 3.1Å; Y174-V176 VanDerWaalsContact C-N 3.33Å; Y174-V176 PolarHBondContact O-N 2.89Å; V176-R178 VanDerWaalsContact C-N 3.27Å; V176-R178 PolarHBondContact O-N 3.47Å; V176-V179 PolarHBondContact O-N 3.12Å; V176-L180 HydrophobicContact CG1-CD1 3.86Å; V176-L180 WeakPolarHBondContact O-CB 3.47Å; V176-L180 WeakPolarHBondContact O-CG 3.45Å; V176-L180 PolarHBondContact O-N 2.96Å; V176-L199 HydrophobicContact CB-CD2 4.15Å; V176-L199 HydrophobicContact CG1-CD1 4.28Å; V176-L199 HydrophobicContact CG1-CD2 3.51Å; V176-L199 HydrophobicContact CG2-CD2 3.54Å
177	S	79.2	Confident	78.7	Confident	21 Å²	21	35 Å²	35	15%	0.147	17%	0.172	C	C	.	.	H	α-helix	trans	-55.1	-40.3	173.5	170.3	0	0	0	0	111.8	S173 Y174 Q181 R212	S173-S177 WeakPolarHBondContact O-CB 3.44Å; S173-S177 PolarHBondContact O-N 3.05Å; Y174-S177 WeakPolarHBondContact O-CB 3.17Å; Y174-S177 PolarHBondContact O-N 3.35Å; S177-Q181 WeakPolarHBondContact O-CB 3.4Å; S177-Q181 PolarHBondContact O-N 2.79Å; S177-R212 PolarHBondContact O-NH1 2.7Å; S177-R212 PolarHBondContact OG-NH1 3.31Å; S177-R212 PolarHBondContact OG-NH2 2.88Å
178	R	84.7	Confident	79.4	Confident	69 Å²	69	38.8 Å²	38.8	26%	0.26	19%	0.188	S	C	.	.	H	α-helix	trans	-68.4	-48.3	176.8	-74.8	-174.5	65	-143.9	-1.4	113.1	N149 Y174 E175 V176 L180 Q181 S182	N149-R178 VanDerWaalsContact OD1-CZ 3.26Å; N149-R178 PolarHBondContact OD1-NH1 3.21Å; N149-R178 PolarHBondContact OD1-NH2 2.84Å; Y174-R178 HydrophobicContact CE1-CG 4.3Å; Y174-R178 PolarHBondContact O-N 3.45Å; E175-R178 PolarHBondContact O-N 3.36Å; V176-R178 VanDerWaalsContact C-N 3.27Å; V176-R178 PolarHBondContact O-N 3.47Å; R178-L180 VanDerWaalsContact C-N 3.33Å; R178-L180 PolarHBondContact O-N 3.41Å; R178-Q181 WeakPolarHBondContact O-CB 3.49Å; R178-Q181 PolarHBondContact O-N 2.93Å; R178-Q181 VanDerWaalsContact O-N 3.09Å; R178-S182 PolarHBondContact O-N 3.12Å; R178-S182 PolarHBondContact O-OG 3.17Å
179	V	87.7	Confident	80.6	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.006	21%	0.211	C	C	.	.	H	α-helix	trans	-60.2	-45	178.8	172.9	0	0	0	0	110.7	I148 L151 I155 F164 W166 E175 V176 Q181 S182 L183	I148-V179 HydrophobicContact CG2-CG2 4.16Å; L151-V179 HydrophobicContact CD2-CG2 4.23Å; I155-V179 HydrophobicContact CD1-CG1 3.83Å; F164-V179 HydrophobicContact CE1-CG1 3.9Å; F164-V179 HydrophobicContact CZ-CG1 3.71Å; W166-V179 HydrophobicContact CE3-CB 4.37Å; W166-V179 HydrophobicContact CE3-CG1 3.96Å; W166-V179 HydrophobicContact CH2-CB 4.1Å; W166-V179 HydrophobicContact CH2-CG1 4.49Å; W166-V179 HydrophobicContact CH2-CG2 3.75Å; W166-V179 HydrophobicContact CZ3-CB 3.63Å; W166-V179 HydrophobicContact CZ3-CG1 3.72Å; W166-V179 HydrophobicContact CZ3-CG2 3.79Å; E175-V179 PolarHBondContact O-N 3.08Å; V176-V179 PolarHBondContact O-N 3.12Å; V179-Q181 PolarHBondContact O-N 3.35Å; V179-S182 PolarHBondContact O-N 2.78Å; V179-L183 HydrophobicContact CG1-CD1 4.3Å; V179-L183 PolarHBondContact O-N 2.89Å
180	L	85.8	Confident	81.7	Confident	3 Å²	3	45.8 Å²	45.8	2%	0.016	22%	0.221	C	C	.	.	H	α-helix	trans	-59.6	-43.4	172.7	-73.2	168.2	0	0	0	111.9	V176 R178 S182 L183 T184 I196 L209	V176-L180 HydrophobicContact CG1-CD1 3.86Å; V176-L180 WeakPolarHBondContact O-CB 3.47Å; V176-L180 WeakPolarHBondContact O-CG 3.45Å; V176-L180 PolarHBondContact O-N 2.96Å; R178-L180 VanDerWaalsContact C-N 3.33Å; R178-L180 PolarHBondContact O-N 3.41Å; L180-S182 VanDerWaalsContact C-N 3.26Å; L180-S182 PolarHBondContact O-N 2.89Å; L180-L183 HydrophobicContact CD2-CD1 4.43Å; L180-L183 PolarHBondContact O-N 2.95Å; L180-T184 WeakPolarHBondContact O-CB 3.42Å; L180-T184 PolarHBondContact O-N 3Å; L180-T184 PolarHBondContact O-OG1 2.78Å; L180-I196 HydrophobicContact CD2-CD1 3.79Å; L180-L209 HydrophobicContact CD1-CD2 3.28Å
181	Q	85.4	Confident	83	Confident	85 Å²	85	42 Å²	42	40%	0.397	21%	0.206	S	C	.	.	H	α-helix	trans	-61.3	-34.5	177.7	-160.5	-171.6	34.4	0	0	112.4	S177 R178 V179 K185	S177-Q181 WeakPolarHBondContact O-CB 3.4Å; S177-Q181 PolarHBondContact O-N 2.79Å; R178-Q181 WeakPolarHBondContact O-CB 3.49Å; R178-Q181 PolarHBondContact O-N 2.93Å; R178-Q181 VanDerWaalsContact O-N 3.09Å; V179-Q181 PolarHBondContact O-N 3.35Å; Q181-K185 HydrophobicContact CG-CD 4.31Å; Q181-K185 WeakPolarHBondContact O-CB 3.27Å; Q181-K185 WeakPolarHBondContact O-CD 3.35Å; Q181-K185 WeakPolarHBondContact O-CG 3.31Å; Q181-K185 PolarHBondContact O-N 2.89Å
182	S	88.3	Confident	84.1	Confident	13 Å²	13	44.8 Å²	44.8	9%	0.091	22%	0.221	C	C	.	.	H	α-helix	trans	-68.8	-44.9	173.9	-58.1	0	0	0	0	112	C152 R178 V179 L180 T184 K185 S186	C152-S182 PolarHBondContact SG-OG 3.2Å; R178-S182 PolarHBondContact O-N 3.12Å; R178-S182 PolarHBondContact O-OG 3.17Å; V179-S182 PolarHBondContact O-N 2.78Å; L180-S182 VanDerWaalsContact C-N 3.26Å; L180-S182 PolarHBondContact O-N 2.89Å; S182-T184 PolarHBondContact O-N 2.85Å; S182-K185 PolarHBondContact O-N 2.85Å; S182-S186 PolarHBondContact O-N 3.49Å
183	L	90	Very high	85.3	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-58.9	-47.6	174.1	-70	164.8	0	0	0	111.3	I155 L161 F164 V179 L180 K185 Q187 K188 L191 L194 F216	I155-L183 HydrophobicContact CD1-CD2 4.26Å; I155-L183 HydrophobicContact CD1-CG 4.25Å; I155-L183 HydrophobicContact CG1-CD2 4.32Å; I155-L183 HydrophobicContact CG2-CB 4.49Å; I155-L183 HydrophobicContact CG2-CD2 3.74Å; I155-L183 HydrophobicContact CG2-CG 3.97Å; L161-L183 HydrophobicContact CD2-CD2 3.89Å; F164-L183 HydrophobicContact CB-CD2 4.23Å; F164-L183 HydrophobicContact CD1-CD1 3.71Å; F164-L183 HydrophobicContact CD1-CD2 4.36Å; F164-L183 HydrophobicContact CD2-CD2 4.35Å; F164-L183 HydrophobicContact CE1-CD1 3.92Å; F164-L183 HydrophobicContact CG-CD1 4.24Å; F164-L183 HydrophobicContact CG-CD2 4.05Å; V179-L183 HydrophobicContact CG1-CD1 4.3Å; V179-L183 PolarHBondContact O-N 2.89Å; L180-L183 HydrophobicContact CD2-CD1 4.43Å; L180-L183 PolarHBondContact O-N 2.95Å; L183-K185 VanDerWaalsContact C-N 3.27Å; L183-K185 PolarHBondContact O-N 3.47Å; L183-Q187 HydrophobicContact CD2-CB 4.49Å; L183-Q187 HydrophobicContact CD2-CG 4.45Å; L183-Q187 CarbonylContact O-C 3.58Å; L183-Q187 WeakPolarHBondContact O-CA 3.39Å; L183-Q187 WeakPolarHBondContact O-CB 3.38Å; L183-Q187 PolarHBondContact O-N 3.01Å; L183-K188 PolarHBondContact O-N 3.29Å; L183-L191 HydrophobicContact CD2-CD1 4.46Å; L183-L194 HydrophobicContact CD1-CD1 4.2Å; L183-F216 HydrophobicContact CB-CE1 4.05Å; L183-F216 HydrophobicContact CB-CZ 3.84Å
184	T	86.2	Confident	86.2	Confident	25 Å²	25	41.9 Å²	41.9	15%	0.153	20%	0.198	C	C	.	.	H	α-helix	trans	-59.6	-33.8	176.4	-61.5	0	0	0	0	112.6	L180 S182 I215	L180-T184 WeakPolarHBondContact O-CB 3.42Å; L180-T184 PolarHBondContact O-N 3Å; L180-T184 PolarHBondContact O-OG1 2.78Å; S182-T184 PolarHBondContact O-N 2.85Å; T184-I215 HydrophobicContact CG2-CB 4.13Å; T184-I215 HydrophobicContact CG2-CD1 3.38Å; T184-I215 HydrophobicContact CG2-CG1 4.32Å; T184-I215 HydrophobicContact CG2-CG2 3.83Å
185	K	86.7	Confident	86.7	Confident	127 Å²	127	35 Å²	35	55%	0.552	17%	0.172	S	C	*	.	H	α-helix	trans	-78.7	-51.2	-179.4	-80.2	168.7	178	170.8	0	113.4	M156 Q181 S182 L183	M156-K185 HydrophobicContact CE-CB 4.34Å; M156-K185 HydrophobicContact SD-CB 4.07Å; M156-K185 HydrophobicContact SD-CD 4.47Å; Q181-K185 HydrophobicContact CG-CD 4.31Å; Q181-K185 WeakPolarHBondContact O-CB 3.27Å; Q181-K185 WeakPolarHBondContact O-CD 3.35Å; Q181-K185 WeakPolarHBondContact O-CG 3.31Å; Q181-K185 PolarHBondContact O-N 2.89Å; S182-K185 PolarHBondContact O-N 2.85Å; L183-K185 VanDerWaalsContact C-N 3.27Å; L183-K185 PolarHBondContact O-N 3.47Å
186	S	88.2	Confident	86.9	Confident	41 Å²	41	33.4 Å²	33.4	29%	0.287	16%	0.164	S	C	.	.	H	α-helix	trans	-100.1	-24.2	-173	-72.7	0	0	0	0	114.7	M156 S182	M156-S186 VanDerWaalsContact CE-OG 3.29Å; M156-S186 WeakPolarHBondContact CE-OG 3.37Å; M156-S186 PolarHBondContact O-OG 3.31Å; M156-S186 PolarHBondContact SD-OG 3.49Å; S182-S186 PolarHBondContact O-N 3.49Å
187	Q	89.1	Confident	86.5	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.161	C	C	.	.			trans	-118.5	8.1	-167.2	-49.5	-55.9	-24.1	0	0	114.3	I155 A158 L161 L183 H189 N190 L191	I155-Q187 HydrophobicContact CG2-CG 4.15Å; I155-Q187 PolarHBondContact O-NE2 2.99Å; A158-Q187 PolarHBondContact O-NE2 3.07Å; L161-Q187 HydrophobicContact CB-CB 4.49Å; L161-Q187 HydrophobicContact CB-CG 3.79Å; L161-Q187 HydrophobicContact CD2-CG 4.25Å; L183-Q187 HydrophobicContact CD2-CB 4.49Å; L183-Q187 HydrophobicContact CD2-CG 4.45Å; L183-Q187 CarbonylContact O-C 3.58Å; L183-Q187 WeakPolarHBondContact O-CA 3.39Å; L183-Q187 WeakPolarHBondContact O-CB 3.38Å; L183-Q187 PolarHBondContact O-N 3.01Å; Q187-H189 PolarHBondContact O-N 3.25Å; Q187-N190 HydrophobicContact CB-CB 4.49Å; Q187-N190 PolarHBondContact O-N 3.05Å; Q187-N190 PolarHBondContact OE1-ND2 3.23Å; Q187-L191 PolarHBondContact O-N 2.95Å; Q187-L191 VanDerWaalsContact O-N 3.09Å
188	K	85.3	Confident	85.8	Confident	82 Å²	82	34.1 Å²	34.1	36%	0.357	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-33.7	-51.9	177.3	174.7	169.2	-175.1	175.9	0	114.8	L183 I215 F216	L183-K188 PolarHBondContact O-N 3.29Å; K188-I215 HydrophobicContact CB-CG2 4.19Å; K188-I215 HydrophobicContact CD-CG2 3.46Å; K188-I215 VanDerWaalsContact CD-CG2 3.46Å; K188-I215 WeakPolarHBondContact CE-O 3.25Å; K188-I215 HydrophobicContact CG-CG2 3.6Å; K188-I215 VanDerWaalsContact CG-O 3.27Å; K188-I215 WeakPolarHBondContact CG-O 3.31Å; K188-F216 WeakPolarHBondContact O-CA 3.48Å
189	H	86.1	Confident	84.5	Confident	106 Å²	106	32 Å²	32	49%	0.491	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-1	-174	-60.9	-67	0	0	0	113.4	Q187 S217 N218	Q187-H189 PolarHBondContact O-N 3.25Å; H189-S217 PolarHBondContact ND1-OG 2.97Å; H189-N218 PolarHBondContact O-ND2 2.92Å
190	N	90	Very high	82.8	Confident	43 Å²	43	36.6 Å²	36.6	23%	0.23	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-33.6	-178.1	-67.3	-40.1	0	0	0	112.2	K159 C160 L161 K162 Q187 L192	K159-N190 PolarHBondContact O-ND2 3.35Å; K159-N190 VanDerWaalsContact O-ND2 3.16Å; C160-N190 PolarHBondContact SG-OD1 2.96Å; L161-N190 CarbonylContact O-C 3.57Å; L161-N190 WeakPolarHBondContact O-CB 3.37Å; K162-N190 WeakPolarHBondContact CA-O 3.27Å; Q187-N190 HydrophobicContact CB-CB 4.49Å; Q187-N190 PolarHBondContact O-N 3.05Å; Q187-N190 PolarHBondContact OE1-ND2 3.23Å; N190-L192 PolarHBondContact O-N 2.82Å
191	L	90.5	Very high	81	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.198	C	C	.	.			trans	-72.2	119.6	-169.5	-161.1	71.1	0	0	0	111.8	L161 F164 L183 Q187 L194 F216 N218 L219	L161-L191 PolarHBondContact O-N 2.76Å; F164-L191 HydrophobicContact CB-CD1 3.9Å; L183-L191 HydrophobicContact CD2-CD1 4.46Å; Q187-L191 PolarHBondContact O-N 2.95Å; Q187-L191 VanDerWaalsContact O-N 3.09Å; L191-L194 HydrophobicContact CD2-CB 4Å; L191-L194 HydrophobicContact CD2-CD1 4.23Å; L191-L194 HydrophobicContact CD2-CD2 4.08Å; L191-L194 HydrophobicContact CD2-CG 4.33Å; L191-F216 HydrophobicContact CB-CD1 4.13Å; L191-F216 HydrophobicContact CD2-CD1 3.77Å; L191-F216 HydrophobicContact CD2-CE1 3.75Å; L191-F216 HydrophobicContact CD2-CG 4.32Å; L191-F216 HydrophobicContact CD2-CZ 4.28Å; L191-N218 CarbonylContact O-C 3.45Å; L191-N218 VanDerWaalsContact O-C 3.32Å; L191-L219 HydrophobicContact CG-CD1 4.49Å; L191-L219 PolarHBondContact O-N 3.01Å
192	L	92.3	Very high	78.7	Confident	64 Å²	64	41.2 Å²	41.2	34%	0.335	20%	0.2	S	C	.	.			trans	-106.3	-32.2	177.9	-54.4	-177.5	0	0	0	112	K162 N190 N218 N220 Q221	K162-L192 HydrophobicContact CB-CD1 4.22Å; K162-L192 HydrophobicContact CB-CG 4.22Å; K162-L192 HydrophobicContact CD-CD1 4.06Å; K162-L192 HydrophobicContact CG-CD1 4.3Å; K162-L192 HydrophobicContact CG-CG 4.46Å; K162-L192 PolarHBondContact O-N 3.39Å; N190-L192 PolarHBondContact O-N 2.82Å; L192-N218 HydrophobicContact CD2-CB 4.08Å; L192-N218 WeakPolarHBondContact CD2-O 3.38Å; L192-N220 WeakPolarHBondContact O-CA 3.24Å; L192-N220 PolarHBondContact O-N 3.44Å; L192-Q221 PolarHBondContact O-N 2.89Å
193	S	91.1	Very high	76.4	Confident	5 Å²	5	47.5 Å²	47.5	4%	0.035	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	127.4	-178.9	-173.3	0	0	0	0	111.1	K162 N163 F164 Y165 Q221	K162-S193 PolarHBondContact O-N 2.85Å; N163-S193 WeakPolarHBondContact CA-O 3.16Å; F164-S193 PolarHBondContact N-O 3.43Å; Y165-S193 WeakPolarHBondContact CE1-OG 3.34Å; Y165-S193 WeakPolarHBondContact OH-CB 3.41Å; Y165-S193 PolarHBondContact OH-OG 2.87Å; S193-Q221 WeakPolarHBondContact CA-O 3.34Å; S193-Q221 PolarHBondContact OG-NE2 3.12Å
194	L	90.1	Very high	74.2	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	124.1	179.4	179.4	57.6	0	0	0	110.8	F164 L183 L191 I196 L213 L219 Q221 F222 S223	F164-L194 HydrophobicContact CB-CD1 4.26Å; F164-L194 HydrophobicContact CD1-CD1 3.73Å; F164-L194 HydrophobicContact CG-CD1 4.48Å; L183-L194 HydrophobicContact CD1-CD1 4.2Å; L191-L194 HydrophobicContact CD2-CB 4Å; L191-L194 HydrophobicContact CD2-CD1 4.23Å; L191-L194 HydrophobicContact CD2-CD2 4.08Å; L191-L194 HydrophobicContact CD2-CG 4.33Å; L194-I196 HydrophobicContact CD1-CD1 3.96Å; L194-I196 HydrophobicContact CD1-CG1 3.95Å; L194-I196 HydrophobicContact CD2-CD1 4.29Å; L194-I196 HydrophobicContact CG-CD1 4.16Å; L194-I196 HydrophobicContact CG-CG1 4.21Å; L194-L213 HydrophobicContact CD2-CD2 4.3Å; L194-L219 HydrophobicContact CB-CD1 3.73Å; L194-Q221 PolarHBondContact N-O 3.36Å; L194-F222 HydrophobicContact CB-CD2 4.12Å; L194-F222 HydrophobicContact CD2-CD2 4.23Å; L194-F222 HydrophobicContact CD2-CE2 3.98Å; L194-F222 HydrophobicContact CG-CD2 4.14Å; L194-F222 HydrophobicContact CG-CE2 4.09Å; L194-F222 CarbonylContact O-C 3.32Å; L194-F222 WeakPolarHBondContact O-CA 3.39Å; L194-F222 WeakPolarHBondContact O-CD2 3.46Å; L194-S223 PolarHBondContact O-N 2.86Å
195	Q	87.7	Confident	72	Confident	3 Å²	3	56.5 Å²	56.5	1%	0.014	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	122.5	-178.9	173.5	167.5	-28.1	0	0	111.9	F164 Y165 W166 I197 S223	F164-Q195 PolarHBondContact O-N 2.71Å; Y165-Q195 HydrophobicContact CD1-CB 3.49Å; Y165-Q195 VanDerWaalsContact CD1-CB 3.49Å; Y165-Q195 HydrophobicContact CD1-CG 4.1Å; Y165-Q195 HydrophobicContact CE1-CB 4.08Å; Y165-Q195 HydrophobicContact CG-CB 4.43Å; W166-Q195 PolarHBondContact N-O 3.41Å; Q195-I197 HydrophobicContact CG-CD1 3.6Å; Q195-I197 HydrophobicContact CG-CG1 3.53Å; Q195-S223 WeakPolarHBondContact CA-O 3.24Å
196	I	82	Confident	70.4	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.021	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	84.2	-175	-49.4	-179.6	0	0	0	109.2	L180 L194 L199 S223	L180-I196 HydrophobicContact CD2-CD1 3.79Å; L194-I196 HydrophobicContact CD1-CD1 3.96Å; L194-I196 HydrophobicContact CD1-CG1 3.95Å; L194-I196 HydrophobicContact CD2-CD1 4.29Å; L194-I196 HydrophobicContact CG-CD1 4.16Å; L194-I196 HydrophobicContact CG-CG1 4.21Å; I196-L199 HydrophobicContact CG2-CD1 4.16Å; I196-L199 HydrophobicContact CG2-CD2 3.35Å; I196-L199 HydrophobicContact CG2-CG 3.78Å; I196-S223 PolarHBondContact N-O 3.48Å
197	I	69.8	Low	68.7	Low	0 Å²	0	53.7 Å²	53.7	0%	0	27%	0.27	C	S	.	.			trans	-102.7	-1.5	-166.3	-31.2	-179.4	0	0	0	114.6	Q195 N225 F250 F798 Q802	Q195-I197 HydrophobicContact CG-CD1 3.6Å; Q195-I197 HydrophobicContact CG-CG1 3.53Å; I197-N225 HydrophobicContact CG2-CB 4.17Å; I197-N225 WeakPolarHBondContact O-CB 3.42Å; I197-F250 HydrophobicContact CD1-CD1 4.05Å; I197-F250 HydrophobicContact CD1-CD2 3.62Å; I197-F250 HydrophobicContact CD1-CE1 3.84Å; I197-F250 HydrophobicContact CD1-CE2 3.38Å; I197-F250 HydrophobicContact CD1-CG 3.96Å; I197-F250 HydrophobicContact CD1-CZ 3.5Å; I197-F250 HydrophobicContact CG1-CD2 4.25Å; I197-F250 HydrophobicContact CG1-CE2 4.32Å; I197-F250 HydrophobicContact CG2-CB 3.42Å; I197-F250 VanDerWaalsContact CG2-CB 3.42Å; I197-F250 HydrophobicContact CG2-CD1 4.19Å; I197-F250 HydrophobicContact CG2-CD2 3.66Å; I197-F250 HydrophobicContact CG2-CE2 4.48Å; I197-F250 HydrophobicContact CG2-CG 3.5Å; I197-F250 VanDerWaalsContact CG2-CG 3.5Å; I197-F798 HydrophobicContact CB-CZ 3.82Å; I197-F798 HydrophobicContact CG2-CE2 3.73Å; I197-F798 HydrophobicContact CG2-CZ 3.51Å; I197-Q802 HydrophobicContact CD1-CG 4.21Å
198	R	65	Low	67	Low	46 Å²	46	58.6 Å²	58.6	17%	0.174	29%	0.289	C	S	.	.			trans	-143.7	83.3	172	-139.1	171.8	-160.3	180	5.1	113.1	Y170 T795 Y799	Y170-R198 PolarHBondContact OH-NH1 3.12Å; R198-T795 PolarHBondContact NH2-OG1 3.45Å; R198-Y799 PolarHBondContact NH1-OH 3.44Å
199	L	57.3	Low	65.9	Low	23 Å²	23	55 Å²	55	12%	0.12	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-86.7	145.2	166.9	-57.9	-174.3	0	0	0	109.8	V176 I196 Q201 M206 L209	V176-L199 HydrophobicContact CB-CD2 4.15Å; V176-L199 HydrophobicContact CG1-CD1 4.28Å; V176-L199 HydrophobicContact CG1-CD2 3.51Å; V176-L199 HydrophobicContact CG2-CD2 3.54Å; I196-L199 HydrophobicContact CG2-CD1 4.16Å; I196-L199 HydrophobicContact CG2-CD2 3.35Å; I196-L199 HydrophobicContact CG2-CG 3.78Å; L199-Q201 PolarHBondContact O-N 2.86Å; L199-M206 HydrophobicContact CD1-CE 4.22Å; L199-M206 HydrophobicContact CD1-SD 4.37Å; L199-L209 HydrophobicContact CD1-CD1 4.31Å
200	F	51.2	Low	64.4	Low	98 Å²	98	51.1 Å²	51.1	43%	0.43	26%	0.256	S	S	.	.			trans	-66.2	126.9	177.7	-169.3	-83.3	0	0	0	110.7	Y170 C171 I202	Y170-F200 HydrophobicContact CD1-CD2 4.49Å; C171-F200 WeakPolarHBondContact O-CB 3.23Å; F200-I202 HydrophobicContact CD1-CG1 3.86Å; F200-I202 HydrophobicContact CE1-CG1 4.46Å; F200-I202 PolarHBondContact O-N 3.08Å
201	Q	47.8	Very low	62.8	Low	103 Å²	103	53.2 Å²	53.2	48%	0.481	27%	0.27	S	S	.	.			trans	-68.3	89.2	179.3	-176.5	176.6	3.7	0	0	110.7	L199 L227	L199-Q201 PolarHBondContact O-N 2.86Å; Q201-L227 HydrophobicContact CB-CD2 4.4Å; Q201-L227 HydrophobicContact CG-CD2 3.94Å
202	I	38	Very low	61.5	Low	82 Å²	82	55.6 Å²	55.6	42%	0.421	28%	0.28	S	S	.	.			trans	-94.4	118	160.3	-49.3	-178.3	0	0	0	105.8	S173 F200 Q204	S173-I202 WeakPolarHBondContact OG-CD1 3.48Å; F200-I202 HydrophobicContact CD1-CG1 3.86Å; F200-I202 HydrophobicContact CE1-CG1 4.46Å; F200-I202 PolarHBondContact O-N 3.08Å; I202-Q204 HydrophobicContact CG2-CB 4.35Å; I202-Q204 WeakPolarHBondContact CG2-O 3.15Å; I202-Q204 PolarHBondContact O-N 3.38Å
203	N	40.6	Very low	60.1	Low	145 Å²	145	52.7 Å²	52.7	78%	0.775	26%	0.264	S	S	*	.	S	Bend	trans	-67.5	16.6	178.9	-67.5	-14.1	0	0	0	113.6
204	Q	42.2	Very low	58.5	Low	158 Å²	158	56.6 Å²	56.6	74%	0.738	28%	0.281	S	S	*	.	S	Bend	trans	-146.8	127.5	-177.8	-62.8	-178.2	-5.3	0	0	109.5	I202	I202-Q204 HydrophobicContact CG2-CB 4.35Å; I202-Q204 WeakPolarHBondContact CG2-O 3.15Å; I202-Q204 PolarHBondContact O-N 3.38Å
205	S	42	Very low	57.5	Low	56 Å²	56	58.9 Å²	58.9	39%	0.392	29%	0.292	S	S	.	.			trans	71.3	74.9	170.8	-156.5	0	0	0	0	118.5	S207 Y208	S205-S207 PolarHBondContact OG-OG 2.63Å; S205-Y208 VanDerWaalsContact O-CD2 3.31Å; S205-Y208 WeakPolarHBondContact O-CD2 3.36Å; S205-Y208 WeakPolarHBondContact O-CE2 3.07Å; S205-Y208 VanDerWaalsContact OG-CE2 3.27Å; S205-Y208 WeakPolarHBondContact OG-CE2 3.34Å
206	M	52.2	Low	57.1	Low	59 Å²	59	58.7 Å²	58.7	29%	0.291	29%	0.292	S	S	.	.			trans	-83.1	6.5	154.2	-81.4	-71	-77.4	0	0	113.7	L199 Y208 L209 N228 I233	L199-M206 HydrophobicContact CD1-CE 4.22Å; L199-M206 HydrophobicContact CD1-SD 4.37Å; M206-Y208 PolarHBondContact O-N 3.19Å; M206-L209 HydrophobicContact CE-CB 4.35Å; M206-L209 HydrophobicContact CE-CD1 3.38Å; M206-L209 HydrophobicContact CE-CG 3.63Å; M206-L209 PolarHBondContact O-N 3.07Å; M206-L209 HydrophobicContact SD-CG 4.35Å; M206-N228 HydrophobicContact CE-CB 3.75Å; M206-N228 VanDerWaalsContact CE-O 3.27Å; M206-N228 WeakPolarHBondContact CE-O 3.25Å; M206-I233 HydrophobicContact CE-CD1 4.26Å
207	S	51.5	Low	57	Low	51 Å²	51	60.2 Å²	60.2	36%	0.357	30%	0.303	S	S	.	.	H	α-helix	trans	-53.7	-21.5	177.8	67.8	0	0	0	0	114.4	S205 T211	S205-S207 PolarHBondContact OG-OG 2.63Å; S207-T211 WeakPolarHBondContact O-CG2 3.33Å; S207-T211 PolarHBondContact O-N 2.99Å; S207-T211 VanDerWaalsContact O-N 3.09Å; S207-T211 PolarHBondContact O-OG1 3.01Å
208	Y	55.1	Low	57.8	Low	103 Å²	103	62.8 Å²	62.8	40%	0.404	32%	0.316	S	S	.	.	H	α-helix	trans	-72.6	-24.8	175.9	-49	-63.5	0	0	0	114.2	S205 M206 R212	S205-Y208 VanDerWaalsContact O-CD2 3.31Å; S205-Y208 WeakPolarHBondContact O-CD2 3.36Å; S205-Y208 WeakPolarHBondContact O-CE2 3.07Å; S205-Y208 VanDerWaalsContact OG-CE2 3.27Å; S205-Y208 WeakPolarHBondContact OG-CE2 3.34Å; M206-Y208 PolarHBondContact O-N 3.19Å; Y208-R212 WeakPolarHBondContact O-CD 3.49Å; Y208-R212 WeakPolarHBondContact O-CG 3.44Å
209	L	60.4	Low	59	Low	6 Å²	6	60.6 Å²	60.6	3%	0.031	31%	0.308	C	S	.	.	H	α-helix	trans	-76.4	-52.2	167.5	-71.9	-152.9	0	0	0	109.9	L180 L199 M206 T211 R212 L213 I224 I233	L180-L209 HydrophobicContact CD1-CD2 3.28Å; L199-L209 HydrophobicContact CD1-CD1 4.31Å; M206-L209 HydrophobicContact CE-CB 4.35Å; M206-L209 HydrophobicContact CE-CD1 3.38Å; M206-L209 HydrophobicContact CE-CG 3.63Å; M206-L209 PolarHBondContact O-N 3.07Å; M206-L209 HydrophobicContact SD-CG 4.35Å; L209-T211 VanDerWaalsContact C-N 3.34Å; L209-T211 PolarHBondContact O-N 3.43Å; L209-R212 PolarHBondContact O-N 3.01Å; L209-L213 HydrophobicContact CB-CD1 4.09Å; L209-L213 HydrophobicContact CB-CG 4.47Å; L209-L213 HydrophobicContact CD1-CD1 4.34Å; L209-L213 WeakPolarHBondContact O-CG 3.19Å; L209-L213 PolarHBondContact O-N 3.46Å; L209-I224 HydrophobicContact CD1-CD1 3.94Å; L209-I233 HydrophobicContact CB-CD1 4.09Å; L209-I233 HydrophobicContact CB-CG1 4.39Å; L209-I233 HydrophobicContact CD1-CD1 4.04Å
210	N	55.5	Low	60.5	Low	25 Å²	25	62.2 Å²	62.2	13%	0.134	32%	0.317	C	S	.	.	H	α-helix	trans	-44.2	-60.8	179.3	-61.5	13.3	0	0	0	110.2	R212 F214 D232 I233 I236	N210-R212 PolarHBondContact O-N 2.87Å; N210-F214 WeakPolarHBondContact O-CD2 3.46Å; N210-F214 WeakPolarHBondContact O-CE2 3.46Å; N210-D232 WeakPolarHBondContact ND2-CB 3.35Å; N210-D232 VanDerWaalsContact ND2-CG 3.32Å; N210-D232 PolarHBondContact ND2-OD2 3.27Å; N210-I233 WeakPolarHBondContact OD1-CG1 3.49Å; N210-I236 HydrophobicContact CB-CD1 3.71Å
211	T	56.3	Low	62.4	Low	86 Å²	86	58.4 Å²	58.4	53%	0.528	30%	0.301	S	S	.	.	H	α-helix	trans	-64.7	-1.4	-175.6	52.2	0	0	0	0	116.2	S207 L209	S207-T211 WeakPolarHBondContact O-CG2 3.33Å; S207-T211 PolarHBondContact O-N 2.99Å; S207-T211 VanDerWaalsContact O-N 3.09Å; S207-T211 PolarHBondContact O-OG1 3.01Å; L209-T211 VanDerWaalsContact C-N 3.34Å; L209-T211 PolarHBondContact O-N 3.43Å
212	R	63.9	Low	64.4	Low	51 Å²	51	53.6 Å²	53.6	19%	0.192	28%	0.278	C	S	.	.	H	α-helix	trans	-133.2	-22	-173.3	-58.7	-175.1	-170.6	178.1	9.1	115	S177 Y208 L209 N210 F214	S177-R212 PolarHBondContact O-NH1 2.7Å; S177-R212 PolarHBondContact OG-NH1 3.31Å; S177-R212 PolarHBondContact OG-NH2 2.88Å; Y208-R212 WeakPolarHBondContact O-CD 3.49Å; Y208-R212 WeakPolarHBondContact O-CG 3.44Å; L209-R212 PolarHBondContact O-N 3.01Å; N210-R212 PolarHBondContact O-N 2.87Å; R212-F214 VanDerWaalsContact C-N 3.31Å
213	L	61.6	Low	66.8	Low	3 Å²	3	49.7 Å²	49.7	2%	0.016	26%	0.258	C	S	.	.	H	α-helix	trans	-71	-25.2	173.7	-70	177	0	0	0	112.8	L194 L209 I215 F216 F222 I233 I236	L194-L213 HydrophobicContact CD2-CD2 4.3Å; L209-L213 HydrophobicContact CB-CD1 4.09Å; L209-L213 HydrophobicContact CB-CG 4.47Å; L209-L213 HydrophobicContact CD1-CD1 4.34Å; L209-L213 WeakPolarHBondContact O-CG 3.19Å; L209-L213 PolarHBondContact O-N 3.46Å; L213-I215 PolarHBondContact O-N 3.14Å; L213-F216 HydrophobicContact CD2-CD2 4.33Å; L213-F216 HydrophobicContact CD2-CE2 4.35Å; L213-F216 PolarHBondContact O-N 2.99Å; L213-F222 HydrophobicContact CD1-CE1 4.39Å; L213-F222 HydrophobicContact CD1-CZ 4.07Å; L213-F222 HydrophobicContact CD2-CE2 4.35Å; L213-F222 HydrophobicContact CD2-CZ 4.4Å; L213-I233 HydrophobicContact CD1-CG1 4.4Å; L213-I233 HydrophobicContact CD1-CG2 3.93Å; L213-I236 HydrophobicContact CB-CG2 4.2Å
214	F	58.1	Low	69	Low	86 Å²	86	42.8 Å²	42.8	38%	0.377	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-43.5	-19.5	170	-76.8	-76.3	0	0	0	115.5	N210 R212 I236 N240	N210-F214 WeakPolarHBondContact O-CD2 3.46Å; N210-F214 WeakPolarHBondContact O-CE2 3.46Å; R212-F214 VanDerWaalsContact C-N 3.31Å; F214-I236 HydrophobicContact CB-CG2 4.25Å; F214-I236 HydrophobicContact CD1-CG1 4.28Å; F214-I236 HydrophobicContact CD1-CG2 3.76Å; F214-I236 HydrophobicContact CD2-CD1 4.37Å; F214-I236 HydrophobicContact CD2-CG2 4.03Å; F214-I236 HydrophobicContact CE1-CB 4.39Å; F214-I236 HydrophobicContact CE1-CD1 4.24Å; F214-I236 HydrophobicContact CE1-CG1 3.7Å; F214-I236 HydrophobicContact CE1-CG2 4.07Å; F214-I236 HydrophobicContact CE2-CD1 3.68Å; F214-I236 HydrophobicContact CE2-CG1 4.06Å; F214-I236 HydrophobicContact CE2-CG2 4.33Å; F214-I236 HydrophobicContact CG-CG2 3.71Å; F214-I236 HydrophobicContact CZ-CD1 3.6Å; F214-I236 HydrophobicContact CZ-CG1 3.57Å; F214-I236 HydrophobicContact CZ-CG2 4.34Å; F214-N240 WeakPolarHBondContact CD1-ND2 3.32Å; F214-N240 WeakPolarHBondContact O-CB 3.3Å; F214-N240 PolarHBondContact O-OD1 3.28Å
215	I	68.9	Low	70.8	Confident	48 Å²	48	35.6 Å²	35.6	25%	0.246	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-23.8	-159.4	-64.1	172	0	0	0	112	T184 K188 L213 S217	T184-I215 HydrophobicContact CG2-CB 4.13Å; T184-I215 HydrophobicContact CG2-CD1 3.38Å; T184-I215 HydrophobicContact CG2-CG1 4.32Å; T184-I215 HydrophobicContact CG2-CG2 3.83Å; K188-I215 HydrophobicContact CB-CG2 4.19Å; K188-I215 HydrophobicContact CD-CG2 3.46Å; K188-I215 VanDerWaalsContact CD-CG2 3.46Å; K188-I215 WeakPolarHBondContact CE-O 3.25Å; K188-I215 HydrophobicContact CG-CG2 3.6Å; K188-I215 VanDerWaalsContact CG-O 3.27Å; K188-I215 WeakPolarHBondContact CG-O 3.31Å; L213-I215 PolarHBondContact O-N 3.14Å; I215-S217 PolarHBondContact O-N 3.12Å; I215-S217 VanDerWaalsContact O-N 3.07Å
216	F	79.7	Confident	72.9	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.169	C	C	.	.			trans	-84.4	79.3	-172	-60.4	-71.6	0	0	0	113.9	L183 K188 L191 L213 N218 L219	L183-F216 HydrophobicContact CB-CE1 4.05Å; L183-F216 HydrophobicContact CB-CZ 3.84Å; K188-F216 WeakPolarHBondContact O-CA 3.48Å; L191-F216 HydrophobicContact CB-CD1 4.13Å; L191-F216 HydrophobicContact CD2-CD1 3.77Å; L191-F216 HydrophobicContact CD2-CE1 3.75Å; L191-F216 HydrophobicContact CD2-CG 4.32Å; L191-F216 HydrophobicContact CD2-CZ 4.28Å; L213-F216 HydrophobicContact CD2-CD2 4.33Å; L213-F216 HydrophobicContact CD2-CE2 4.35Å; L213-F216 PolarHBondContact O-N 2.99Å; F216-N218 PolarHBondContact O-N 3.22Å; F216-L219 HydrophobicContact CB-CB 4.11Å; F216-L219 PolarHBondContact O-N 3.04Å
217	S	80.1	Confident	74.2	Confident	36 Å²	36	31.9 Å²	31.9	25%	0.252	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-24.4	-172.9	66	0	0	0	0	115.9	H189 I215	H189-S217 PolarHBondContact ND1-OG 2.97Å; I215-S217 PolarHBondContact O-N 3.12Å; I215-S217 VanDerWaalsContact O-N 3.07Å
218	N	86.7	Confident	75.5	Confident	53 Å²	53	30.2 Å²	30.2	28%	0.283	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.7	10	-170.1	-63.5	6	0	0	0	113	H189 L191 L192 F216 N220	H189-N218 PolarHBondContact O-ND2 2.92Å; L191-N218 CarbonylContact O-C 3.45Å; L191-N218 VanDerWaalsContact O-C 3.32Å; L192-N218 HydrophobicContact CD2-CB 4.08Å; L192-N218 WeakPolarHBondContact CD2-O 3.38Å; F216-N218 PolarHBondContact O-N 3.22Å; N218-N220 PolarHBondContact O-N 2.82Å
219	L	89	Confident	76.9	Confident	1 Å²	1	25.5 Å²	25.5	1%	0.005	13%	0.133	C	C	.	.			trans	-66.6	122.5	-178.2	-168.6	66.3	0	0	0	110.5	L191 L194 F216 Q221 F222 L237 H243 L244	L191-L219 HydrophobicContact CG-CD1 4.49Å; L191-L219 PolarHBondContact O-N 3.01Å; L194-L219 HydrophobicContact CB-CD1 3.73Å; F216-L219 HydrophobicContact CB-CB 4.11Å; F216-L219 PolarHBondContact O-N 3.04Å; L219-Q221 WeakPolarHBondContact CD1-O 3.48Å; L219-F222 HydrophobicContact CD2-CB 4.09Å; L219-F222 HydrophobicContact CD2-CD2 4.25Å; L219-F222 HydrophobicContact CD2-CG 4.37Å; L219-L237 HydrophobicContact CD2-CD2 4.08Å; L219-H243 CarbonylContact O-C 3.58Å; L219-L244 HydrophobicContact CG-CD1 4.29Å; L219-L244 VanDerWaalsContact O-CA 3.22Å; L219-L244 WeakPolarHBondContact O-CA 3.34Å; L219-L244 PolarHBondContact O-N 2.59Å; L219-L244 VanDerWaalsContact O-N 3.12Å
220	N	90.6	Very high	78.1	Confident	57 Å²	57	26.5 Å²	26.5	31%	0.305	14%	0.141	S	C	.	.			trans	-109.2	-39.5	-176.6	-177.2	2.1	0	0	0	111.5	L192 N218 H243 R245 I246	L192-N220 WeakPolarHBondContact O-CA 3.24Å; L192-N220 PolarHBondContact O-N 3.44Å; N218-N220 PolarHBondContact O-N 2.82Å; N220-H243 WeakPolarHBondContact CA-O 3.34Å; N220-H243 PolarHBondContact OD1-O 3.01Å; N220-R245 PolarHBondContact O-N 2.8Å; N220-R245 WeakPolarHBondContact OD1-CB 3.43Å; N220-R245 WeakPolarHBondContact OD1-CD 3.36Å; N220-R245 WeakPolarHBondContact OD1-CG 3.28Å; N220-I246 PolarHBondContact O-N 2.94Å; N220-I246 VanDerWaalsContact O-N 3.08Å
221	Q	90.7	Very high	79.6	Confident	18 Å²	18	27.3 Å²	27.3	8%	0.084	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	123.6	175.8	-179.7	171	-108.5	0	0	110.4	Y165 L192 S193 L194 L219 I246 K248	Y165-Q221 PolarHBondContact OH-NE2 3.17Å; L192-Q221 PolarHBondContact O-N 2.89Å; S193-Q221 WeakPolarHBondContact CA-O 3.34Å; S193-Q221 PolarHBondContact OG-NE2 3.12Å; L194-Q221 PolarHBondContact N-O 3.36Å; L219-Q221 WeakPolarHBondContact CD1-O 3.48Å; Q221-I246 WeakPolarHBondContact CA-O 3.39Å; Q221-I246 HydrophobicContact CB-CB 4.42Å; Q221-I246 HydrophobicContact CG-CB 4.29Å; Q221-I246 HydrophobicContact CG-CG2 4.35Å; Q221-K248 HydrophobicContact CG-CD 4.48Å
222	F	90.1	Very high	81	Confident	1 Å²	1	27.2 Å²	27.2	0%	0.004	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	138.1	169.6	-173.3	-129.1	0	0	0	110.1	L194 L213 L219 I224 I233 L237 L244 I246 L247 K248	L194-F222 HydrophobicContact CB-CD2 4.12Å; L194-F222 HydrophobicContact CD2-CD2 4.23Å; L194-F222 HydrophobicContact CD2-CE2 3.98Å; L194-F222 HydrophobicContact CG-CD2 4.14Å; L194-F222 HydrophobicContact CG-CE2 4.09Å; L194-F222 CarbonylContact O-C 3.32Å; L194-F222 WeakPolarHBondContact O-CA 3.39Å; L194-F222 WeakPolarHBondContact O-CD2 3.46Å; L213-F222 HydrophobicContact CD1-CE1 4.39Å; L213-F222 HydrophobicContact CD1-CZ 4.07Å; L213-F222 HydrophobicContact CD2-CE2 4.35Å; L213-F222 HydrophobicContact CD2-CZ 4.4Å; L219-F222 HydrophobicContact CD2-CB 4.09Å; L219-F222 HydrophobicContact CD2-CD2 4.25Å; L219-F222 HydrophobicContact CD2-CG 4.37Å; F222-I224 HydrophobicContact CD1-CG2 4.47Å; F222-I224 HydrophobicContact CE1-CB 3.98Å; F222-I224 HydrophobicContact CE1-CD1 4.06Å; F222-I224 HydrophobicContact CE1-CG2 4.02Å; F222-I224 HydrophobicContact CZ-CB 4.11Å; F222-I224 HydrophobicContact CZ-CD1 3.97Å; F222-I224 HydrophobicContact CZ-CG1 4.43Å; F222-I233 HydrophobicContact CE1-CG2 4.32Å; F222-L237 HydrophobicContact CD1-CD1 3.64Å; F222-L237 HydrophobicContact CD1-CD2 4.48Å; F222-L237 HydrophobicContact CE1-CD1 4.02Å; F222-L237 HydrophobicContact CG-CD1 4.5Å; F222-L244 HydrophobicContact CB-CD1 4.03Å; F222-I246 PolarHBondContact N-O 2.89Å; F222-L247 HydrophobicContact CB-CD1 4.24Å; F222-L247 HydrophobicContact CD1-CD1 3.71Å; F222-L247 HydrophobicContact CG-CD1 4.38Å; F222-L247 CarbonylContact O-C 3.51Å; F222-L247 WeakPolarHBondContact O-CA 3.25Å; F222-K248 PolarHBondContact O-N 3.12Å
223	S	88.4	Confident	82	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	121.7	-177.6	-45.9	0	0	0	0	111.2	L194 Q195 I196 K248	L194-S223 PolarHBondContact O-N 2.86Å; Q195-S223 WeakPolarHBondContact CA-O 3.24Å; I196-S223 PolarHBondContact N-O 3.48Å; S223-K248 CarbonylContact C-O 3.51Å; S223-K248 VanDerWaalsContact CA-O 3.27Å; S223-K248 WeakPolarHBondContact CA-O 3.43Å
224	I	85.9	Confident	83.1	Confident	1 Å²	1	24.7 Å²	24.7	1%	0.005	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	155.2	-172.6	-163.2	174.9	0	0	0	111.5	L209 F222 N228 L229 L247 K248 L249 F250	L209-I224 HydrophobicContact CD1-CD1 3.94Å; F222-I224 HydrophobicContact CD1-CG2 4.47Å; F222-I224 HydrophobicContact CE1-CB 3.98Å; F222-I224 HydrophobicContact CE1-CD1 4.06Å; F222-I224 HydrophobicContact CE1-CG2 4.02Å; F222-I224 HydrophobicContact CZ-CB 4.11Å; F222-I224 HydrophobicContact CZ-CD1 3.97Å; F222-I224 HydrophobicContact CZ-CG1 4.43Å; I224-N228 HydrophobicContact CD1-CB 3.85Å; I224-N228 HydrophobicContact CG1-CB 4Å; I224-L229 HydrophobicContact CG2-CD1 4.31Å; I224-L247 HydrophobicContact CG2-CD1 4.37Å; I224-K248 PolarHBondContact N-O 2.85Å; I224-L249 HydrophobicContact CG2-CD2 3.65Å; I224-L249 WeakPolarHBondContact O-CA 3.37Å; I224-F250 PolarHBondContact O-N 2.98Å
225	N	81	Confident	84.5	Confident	7 Å²	7	22.8 Å²	22.8	4%	0.037	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	134.7	166.7	-167.3	-61.8	0	0	0	110	I197 L227 N228 F250 Q252	I197-N225 HydrophobicContact CG2-CB 4.17Å; I197-N225 WeakPolarHBondContact O-CB 3.42Å; N225-L227 PolarHBondContact O-N 2.88Å; N225-L227 WeakPolarHBondContact OD1-CB 3.5Å; N225-L227 PolarHBondContact OD1-N 2.86Å; N225-L227 VanDerWaalsContact OD1-N 3.09Å; N225-N228 WeakPolarHBondContact O-CB 3.45Å; N225-N228 PolarHBondContact O-N 2.82Å; N225-F250 CarbonylContact C-O 3.6Å; N225-F250 WeakPolarHBondContact CA-O 3.14Å; N225-F250 PolarHBondContact OD1-O 2.89Å; N225-Q252 PolarHBondContact ND2-OE1 2.82Å
226	Y	84.3	Confident	85.1	Confident	1 Å²	1	21.1 Å²	21.1	0%	0.004	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-58.7	-33.5	-176.8	-162.6	-71.8	0	0	0	112.5	N228 L229 L249 F250 V251 L258 P259 L280 K379	Y226-N228 PolarHBondContact O-N 3.13Å; Y226-N228 VanDerWaalsContact O-N 3.15Å; Y226-L229 WeakPolarHBondContact O-CB 3.07Å; Y226-L229 PolarHBondContact O-N 3.21Å; Y226-L229 VanDerWaalsContact O-N 3.08Å; Y226-L249 HydrophobicContact CD2-CB 4.11Å; Y226-L249 HydrophobicContact CD2-CD1 3.72Å; Y226-L249 HydrophobicContact CD2-CG 4.43Å; Y226-L249 HydrophobicContact CE2-CD1 3.82Å; Y226-F250 PolarHBondContact N-O 3.14Å; Y226-V251 HydrophobicContact CD2-CG2 4.04Å; Y226-V251 HydrophobicContact CG-CG2 4.04Å; Y226-L258 HydrophobicContact CD1-CB 4.05Å; Y226-L258 HydrophobicContact CD1-CD1 4.05Å; Y226-L258 HydrophobicContact CD1-CD2 4.03Å; Y226-L258 HydrophobicContact CD1-CG 4.26Å; Y226-L258 HydrophobicContact CE1-CB 4.14Å; Y226-L258 HydrophobicContact CE1-CD1 4.32Å; Y226-P259 HydrophobicContact CD1-CG 4.26Å; Y226-P259 HydrophobicContact CE1-CG 4.34Å; Y226-P259 WeakPolarHBondContact O-CG 3.37Å; Y226-L280 HydrophobicContact CD2-CD1 4.24Å; Y226-K379 VanDerWaalsContact CE1-O 3.23Å; Y226-K379 WeakPolarHBondContact CE1-O 3.32Å; Y226-K379 PolarHBondContact OH-O 3.45Å
227	L	80.2	Confident	85.3	Confident	35 Å²	35	21.2 Å²	21.2	18%	0.183	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-57.8	-29.4	175.4	-173.9	74	0	0	0	112.7	Q201 N225 N253 D257	Q201-L227 HydrophobicContact CB-CD2 4.4Å; Q201-L227 HydrophobicContact CG-CD2 3.94Å; N225-L227 PolarHBondContact O-N 2.88Å; N225-L227 WeakPolarHBondContact OD1-CB 3.5Å; N225-L227 PolarHBondContact OD1-N 2.86Å; N225-L227 VanDerWaalsContact OD1-N 3.09Å; L227-N253 WeakPolarHBondContact CD2-ND2 3.45Å; L227-D257 HydrophobicContact CD1-CB 4.48Å; L227-D257 WeakPolarHBondContact CD1-O 3.12Å
228	N	79	Confident	85.5	Confident	16 Å²	16	19.5 Å²	19.5	9%	0.086	10%	0.104	C	C	.	.	G	3₁₀ helix	trans	-93.7	4.2	-177.2	-65.6	-35.3	0	0	0	113	M206 I224 N225 Y226 I233	M206-N228 HydrophobicContact CE-CB 3.75Å; M206-N228 VanDerWaalsContact CE-O 3.27Å; M206-N228 WeakPolarHBondContact CE-O 3.25Å; I224-N228 HydrophobicContact CD1-CB 3.85Å; I224-N228 HydrophobicContact CG1-CB 4Å; N225-N228 WeakPolarHBondContact O-CB 3.45Å; N225-N228 PolarHBondContact O-N 2.82Å; Y226-N228 PolarHBondContact O-N 3.13Å; Y226-N228 VanDerWaalsContact O-N 3.15Å; N228-I233 WeakPolarHBondContact O-CD1 3.45Å
229	L	85	Confident	85.3	Confident	4 Å²	4	22.8 Å²	22.8	2%	0.021	12%	0.118	C	C	.	.			trans	-87	143.9	177.4	-168.2	65.3	0	0	0	110.7	I224 Y226 I233 L234 L249 P259 I261 W266	I224-L229 HydrophobicContact CG2-CD1 4.31Å; Y226-L229 WeakPolarHBondContact O-CB 3.07Å; Y226-L229 PolarHBondContact O-N 3.21Å; Y226-L229 VanDerWaalsContact O-N 3.08Å; L229-I233 HydrophobicContact CD1-CB 4.5Å; L229-I233 HydrophobicContact CD1-CG2 4Å; L229-L234 HydrophobicContact CD1-CD2 4Å; L229-L234 HydrophobicContact CD1-CG 4.03Å; L229-L234 HydrophobicContact CD2-CD1 4.32Å; L229-L234 HydrophobicContact CD2-CD2 4.39Å; L229-L234 HydrophobicContact CD2-CG 4.47Å; L229-L234 HydrophobicContact CG-CD1 4.47Å; L229-L234 HydrophobicContact CG-CG 4.31Å; L229-L249 HydrophobicContact CD2-CD1 3.91Å; L229-L249 HydrophobicContact CD2-CD2 3.89Å; L229-P259 WeakPolarHBondContact O-CG 3.09Å; L229-I261 HydrophobicContact CB-CD1 4.14Å; L229-I261 HydrophobicContact CD2-CD1 3.49Å; L229-I261 VanDerWaalsContact CD2-CD1 3.49Å; L229-I261 HydrophobicContact CG-CD1 3.64Å; L229-W266 HydrophobicContact CD2-CH2 3.96Å; L229-W266 HydrophobicContact CD2-CZ2 4.07Å
230	S	84.8	Confident	84.5	Confident	28 Å²	28	25.2 Å²	25.2	20%	0.196	13%	0.131	C	C	.	.			trans	-139.4	162.6	175.5	69.3	0	0	0	0	111	D232 I233 L234	S230-D232 PolarHBondContact O-N 2.64Å; S230-I233 PolarHBondContact O-N 3.02Å; S230-I233 WeakPolarHBondContact OG-CG1 3.49Å; S230-I233 PolarHBondContact OG-N 3.23Å; S230-I233 VanDerWaalsContact OG-N 3.15Å; S230-L234 PolarHBondContact O-N 2.79Å
231	E	88	Confident	83.6	Confident	42 Å²	42	22.5 Å²	22.5	20%	0.196	12%	0.116	C	C	.	.	H	α-helix	trans	-57.4	-40.5	172.6	-58.6	-165	147.2	0	0	111	I233 L234 L235 I261 R262 I265	E231-I233 PolarHBondContact O-N 3.44Å; E231-L234 PolarHBondContact O-N 3.47Å; E231-L235 WeakPolarHBondContact O-CG 3.5Å; E231-L235 PolarHBondContact O-N 2.7Å; E231-I261 HydrophobicContact CG-CG2 4.23Å; E231-R262 WeakPolarHBondContact OE1-CB 3.35Å; E231-R262 VanDerWaalsContact OE1-CG 3.27Å; E231-R262 WeakPolarHBondContact OE1-CG 3.37Å; E231-R262 IonicContact OE1-CZ 3.78Å; E231-R262 PolarHBondContact OE1-N 2.81Å; E231-R262 IonicContact OE1-NE 3.32Å; E231-R262 PolarHBondContact OE1-NE 2.93Å; E231-R262 IonicContact OE1-NH2 2.9Å; E231-R262 IonicContact OE2-CZ 2.69Å; E231-R262 IonicContact OE2-NE 3.72Å; E231-R262 PolarHBondContact OE2-NE 3.39Å; E231-R262 VanDerWaalsContact OE2-NE 3.14Å; E231-R262 IonicContact OE2-NH2 3.14Å; E231-R262 PolarHBondContact OE2-NH2 3.28Å; E231-I265 HydrophobicContact CB-CG1 4.12Å; E231-I265 HydrophobicContact CB-CG2 4.41Å; E231-I265 HydrophobicContact CG-CG1 4Å
232	D	84.3	Confident	82.7	Confident	83 Å²	83	27.6 Å²	27.6	44%	0.444	14%	0.144	S	C	.	.	H	α-helix	trans	-57.4	-49.1	175.1	-51	-39.3	0	0	0	112.2	N210 S230 L234 L235 I236	N210-D232 WeakPolarHBondContact ND2-CB 3.35Å; N210-D232 VanDerWaalsContact ND2-CG 3.32Å; N210-D232 PolarHBondContact ND2-OD2 3.27Å; S230-D232 PolarHBondContact O-N 2.64Å; D232-L234 VanDerWaalsContact C-N 3.27Å; D232-L234 PolarHBondContact O-N 2.83Å; D232-L235 PolarHBondContact O-N 3.21Å; D232-I236 HydrophobicContact CB-CD1 4.27Å; D232-I236 VanDerWaalsContact O-CB 3.29Å; D232-I236 WeakPolarHBondContact O-CB 3.44Å; D232-I236 VanDerWaalsContact O-CD1 3.3Å; D232-I236 WeakPolarHBondContact O-CD1 3.36Å; D232-I236 WeakPolarHBondContact O-CG1 3.43Å; D232-I236 PolarHBondContact O-N 2.8Å
233	I	84.6	Confident	82.3	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.8	-40.6	-177.5	-72.8	166.8	0	0	0	110.2	M206 L209 N210 L213 F222 N228 L229 S230 E231 L237	M206-I233 HydrophobicContact CE-CD1 4.26Å; L209-I233 HydrophobicContact CB-CD1 4.09Å; L209-I233 HydrophobicContact CB-CG1 4.39Å; L209-I233 HydrophobicContact CD1-CD1 4.04Å; N210-I233 WeakPolarHBondContact OD1-CG1 3.49Å; L213-I233 HydrophobicContact CD1-CG1 4.4Å; L213-I233 HydrophobicContact CD1-CG2 3.93Å; F222-I233 HydrophobicContact CE1-CG2 4.32Å; N228-I233 WeakPolarHBondContact O-CD1 3.45Å; L229-I233 HydrophobicContact CD1-CB 4.5Å; L229-I233 HydrophobicContact CD1-CG2 4Å; S230-I233 PolarHBondContact O-N 3.02Å; S230-I233 WeakPolarHBondContact OG-CG1 3.49Å; S230-I233 PolarHBondContact OG-N 3.23Å; S230-I233 VanDerWaalsContact OG-N 3.15Å; E231-I233 PolarHBondContact O-N 3.44Å; I233-L237 HydrophobicContact CG2-CD1 3.81Å; I233-L237 HydrophobicContact CG2-CG 4.45Å; I233-L237 WeakPolarHBondContact O-CB 3.39Å; I233-L237 WeakPolarHBondContact O-CD1 3.42Å; I233-L237 WeakPolarHBondContact O-CG 2.93Å; I233-L237 PolarHBondContact O-N 2.86Å
234	L	86.6	Confident	82.3	Confident	1 Å²	1	32.6 Å²	32.6	1%	0.005	17%	0.167	C	C	.	.	H	α-helix	trans	-65.7	-47.4	178	-73.4	174.9	0	0	0	112.4	L229 S230 E231 D232 I236 L237 S238 L247 I261 I265 W266 V269	L229-L234 HydrophobicContact CD1-CD2 4Å; L229-L234 HydrophobicContact CD1-CG 4.03Å; L229-L234 HydrophobicContact CD2-CD1 4.32Å; L229-L234 HydrophobicContact CD2-CD2 4.39Å; L229-L234 HydrophobicContact CD2-CG 4.47Å; L229-L234 HydrophobicContact CG-CD1 4.47Å; L229-L234 HydrophobicContact CG-CG 4.31Å; S230-L234 PolarHBondContact O-N 2.79Å; E231-L234 PolarHBondContact O-N 3.47Å; D232-L234 VanDerWaalsContact C-N 3.27Å; D232-L234 PolarHBondContact O-N 2.83Å; L234-I236 PolarHBondContact O-N 2.98Å; L234-L237 PolarHBondContact O-N 3.34Å; L234-S238 PolarHBondContact O-N 3.09Å; L234-S238 PolarHBondContact O-OG 3.47Å; L234-L247 HydrophobicContact CD2-CD2 3.76Å; L234-I261 HydrophobicContact CD1-CD1 4.09Å; L234-I261 HydrophobicContact CD1-CG2 3.58Å; L234-I265 HydrophobicContact CB-CG2 4.09Å; L234-I265 HydrophobicContact CD1-CG2 4.26Å; L234-W266 HydrophobicContact CD1-CD2 4.2Å; L234-W266 HydrophobicContact CD1-CE3 4.16Å; L234-W266 HydrophobicContact CD1-CH2 3.67Å; L234-W266 HydrophobicContact CD1-CZ2 3.69Å; L234-W266 HydrophobicContact CD1-CZ3 3.91Å; L234-W266 HydrophobicContact CD2-CE3 4.46Å; L234-W266 HydrophobicContact CD2-CH2 3.75Å; L234-W266 HydrophobicContact CD2-CZ3 3.67Å; L234-W266 HydrophobicContact CG-CH2 4.37Å; L234-W266 HydrophobicContact CG-CZ3 4.47Å; L234-V269 HydrophobicContact CB-CG2 4.03Å
235	L	86.2	Confident	82.5	Confident	47 Å²	47	39.7 Å²	39.7	25%	0.246	19%	0.194	C	C	.	.	H	α-helix	trans	-59	-48.6	176.3	-68.4	172.4	0	0	0	111.2	E231 D232 L237 S238 E239 I265	E231-L235 WeakPolarHBondContact O-CG 3.5Å; E231-L235 PolarHBondContact O-N 2.7Å; D232-L235 PolarHBondContact O-N 3.21Å; L235-L237 VanDerWaalsContact C-N 3.29Å; L235-L237 PolarHBondContact O-N 2.93Å; L235-S238 WeakPolarHBondContact CA-OG 3.29Å; L235-S238 PolarHBondContact O-N 3.04Å; L235-S238 VanDerWaalsContact O-N 3.1Å; L235-S238 PolarHBondContact O-OG 3.17Å; L235-E239 WeakPolarHBondContact O-CG 3.49Å; L235-E239 PolarHBondContact O-N 3.31Å; L235-I265 HydrophobicContact CD1-CD1 4.32Å; L235-I265 HydrophobicContact CD2-CD1 4.27Å; L235-I265 HydrophobicContact CD2-CG2 4.32Å; L235-I265 HydrophobicContact CG-CD1 4.49Å; L235-I265 HydrophobicContact CG-CG2 4.33Å
236	I	82.9	Confident	82.9	Confident	12 Å²	12	42.1 Å²	42.1	6%	0.062	21%	0.206	C	C	.	.	H	α-helix	trans	-61.3	-37.7	-180	-68.4	166.8	0	0	0	111.6	N210 L213 F214 D232 L234 N240	N210-I236 HydrophobicContact CB-CD1 3.71Å; L213-I236 HydrophobicContact CB-CG2 4.2Å; F214-I236 HydrophobicContact CB-CG2 4.25Å; F214-I236 HydrophobicContact CD1-CG1 4.28Å; F214-I236 HydrophobicContact CD1-CG2 3.76Å; F214-I236 HydrophobicContact CD2-CD1 4.37Å; F214-I236 HydrophobicContact CD2-CG2 4.03Å; F214-I236 HydrophobicContact CE1-CB 4.39Å; F214-I236 HydrophobicContact CE1-CD1 4.24Å; F214-I236 HydrophobicContact CE1-CG1 3.7Å; F214-I236 HydrophobicContact CE1-CG2 4.07Å; F214-I236 HydrophobicContact CE2-CD1 3.68Å; F214-I236 HydrophobicContact CE2-CG1 4.06Å; F214-I236 HydrophobicContact CE2-CG2 4.33Å; F214-I236 HydrophobicContact CG-CG2 3.71Å; F214-I236 HydrophobicContact CZ-CD1 3.6Å; F214-I236 HydrophobicContact CZ-CG1 3.57Å; F214-I236 HydrophobicContact CZ-CG2 4.34Å; D232-I236 HydrophobicContact CB-CD1 4.27Å; D232-I236 VanDerWaalsContact O-CB 3.29Å; D232-I236 WeakPolarHBondContact O-CB 3.44Å; D232-I236 VanDerWaalsContact O-CD1 3.3Å; D232-I236 WeakPolarHBondContact O-CD1 3.36Å; D232-I236 WeakPolarHBondContact O-CG1 3.43Å; D232-I236 PolarHBondContact O-N 2.8Å; L234-I236 PolarHBondContact O-N 2.98Å; I236-N240 WeakPolarHBondContact O-CB 3.42Å; I236-N240 PolarHBondContact O-N 3.47Å; I236-N240 PolarHBondContact O-ND2 3.27Å
237	L	83.1	Confident	83.4	Confident	3 Å²	3	42.1 Å²	42.1	2%	0.016	21%	0.206	C	C	.	.	H	α-helix	trans	-66.2	-45.2	173.8	-77.4	169.2	0	0	0	111.6	L219 F222 I233 L234 L235 S241 L244	L219-L237 HydrophobicContact CD2-CD2 4.08Å; F222-L237 HydrophobicContact CD1-CD1 3.64Å; F222-L237 HydrophobicContact CD1-CD2 4.48Å; F222-L237 HydrophobicContact CE1-CD1 4.02Å; F222-L237 HydrophobicContact CG-CD1 4.5Å; I233-L237 HydrophobicContact CG2-CD1 3.81Å; I233-L237 HydrophobicContact CG2-CG 4.45Å; I233-L237 WeakPolarHBondContact O-CB 3.39Å; I233-L237 WeakPolarHBondContact O-CD1 3.42Å; I233-L237 WeakPolarHBondContact O-CG 2.93Å; I233-L237 PolarHBondContact O-N 2.86Å; L234-L237 PolarHBondContact O-N 3.34Å; L235-L237 VanDerWaalsContact C-N 3.29Å; L235-L237 PolarHBondContact O-N 2.93Å; L237-S241 VanDerWaalsContact O-CB 3.27Å; L237-S241 WeakPolarHBondContact O-CB 3.12Å; L237-S241 PolarHBondContact O-N 3.04Å; L237-S241 VanDerWaalsContact O-N 3.1Å; L237-S241 PolarHBondContact O-OG 2.98Å; L237-L244 HydrophobicContact CB-CD2 3.79Å; L237-L244 HydrophobicContact CD1-CD2 4.35Å; L237-L244 HydrophobicContact CD2-CD2 4.1Å; L237-L244 HydrophobicContact CG-CD2 4.3Å
238	S	84.3	Confident	83.8	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64.3	-42.7	177.6	53.2	0	0	0	0	113.8	L234 L235 N240 I272	L234-S238 PolarHBondContact O-N 3.09Å; L234-S238 PolarHBondContact O-OG 3.47Å; L235-S238 WeakPolarHBondContact CA-OG 3.29Å; L235-S238 PolarHBondContact O-N 3.04Å; L235-S238 VanDerWaalsContact O-N 3.1Å; L235-S238 PolarHBondContact O-OG 3.17Å; S238-N240 VanDerWaalsContact C-N 3.34Å; S238-N240 PolarHBondContact O-N 2.96Å; S238-I272 WeakPolarHBondContact O-CG2 3.45Å
239	E	81.3	Confident	84.4	Confident	122 Å²	122	40.9 Å²	40.9	57%	0.57	20%	0.198	S	C	*	.	H	α-helix	trans	-68.4	-28.7	-177.1	-74.1	179.5	166.1	0	0	114	L235	L235-E239 WeakPolarHBondContact O-CG 3.49Å; L235-E239 PolarHBondContact O-N 3.31Å
240	N	72.3	Confident	84.3	Confident	52 Å²	52	40.7 Å²	40.7	28%	0.278	20%	0.197	S	C	.	.	H	α-helix	trans	-116.2	-14.4	-166.4	-61.5	-89.3	0	0	0	114.1	F214 I236 S238	F214-N240 WeakPolarHBondContact CD1-ND2 3.32Å; F214-N240 WeakPolarHBondContact O-CB 3.3Å; F214-N240 PolarHBondContact O-OD1 3.28Å; I236-N240 WeakPolarHBondContact O-CB 3.42Å; I236-N240 PolarHBondContact O-N 3.47Å; I236-N240 PolarHBondContact O-ND2 3.27Å; S238-N240 VanDerWaalsContact C-N 3.34Å; S238-N240 PolarHBondContact O-N 2.96Å
241	S	73.1	Confident	84.1	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.19	C	C	.	.			trans	-121.5	72.2	-173.2	-49.4	0	0	0	0	111.9	L237 H243 L244	L237-S241 VanDerWaalsContact O-CB 3.27Å; L237-S241 WeakPolarHBondContact O-CB 3.12Å; L237-S241 PolarHBondContact O-N 3.04Å; L237-S241 VanDerWaalsContact O-N 3.1Å; L237-S241 PolarHBondContact O-OG 2.98Å; S241-H243 PolarHBondContact O-N 3.15Å; S241-L244 WeakPolarHBondContact O-CB 3.37Å; S241-L244 PolarHBondContact O-N 3.29Å
242	N	71.3	Confident	83.3	Confident	124 Å²	124	39 Å²	39	66%	0.663	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	0.3	173.4	-63.3	-0.2	0	0	0	114.8
243	H	82	Confident	82.3	Confident	103 Å²	103	37.3 Å²	37.3	48%	0.477	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.3	-2.1	-177.1	-60.4	-28.5	0	0	0	113.1	L219 N220 S241 R245	L219-H243 CarbonylContact O-C 3.58Å; N220-H243 WeakPolarHBondContact CA-O 3.34Å; N220-H243 PolarHBondContact OD1-O 3.01Å; S241-H243 PolarHBondContact O-N 3.15Å; H243-R245 PolarHBondContact O-N 2.83Å
244	L	87.3	Confident	81.5	Confident	4 Å²	4	40.3 Å²	40.3	2%	0.021	19%	0.194	C	C	.	.			trans	-71.9	117.8	179.5	-174	73.7	0	0	0	110.4	L219 F222 L237 S241 L273 F276	L219-L244 HydrophobicContact CG-CD1 4.29Å; L219-L244 VanDerWaalsContact O-CA 3.22Å; L219-L244 WeakPolarHBondContact O-CA 3.34Å; L219-L244 PolarHBondContact O-N 2.59Å; L219-L244 VanDerWaalsContact O-N 3.12Å; F222-L244 HydrophobicContact CB-CD1 4.03Å; L237-L244 HydrophobicContact CB-CD2 3.79Å; L237-L244 HydrophobicContact CD1-CD2 4.35Å; L237-L244 HydrophobicContact CD2-CD2 4.1Å; L237-L244 HydrophobicContact CG-CD2 4.3Å; S241-L244 WeakPolarHBondContact O-CB 3.37Å; S241-L244 PolarHBondContact O-N 3.29Å; L244-L273 HydrophobicContact CB-CD1 4.05Å; L244-L273 HydrophobicContact CD2-CD1 4.28Å; L244-F276 HydrophobicContact CD2-CD2 4.07Å; L244-F276 HydrophobicContact CD2-CE2 3.67Å; L244-F276 HydrophobicContact CG-CD2 4.05Å; L244-F276 HydrophobicContact CG-CE2 3.99Å
245	R	90.1	Very high	80.8	Confident	149 Å²	149	41 Å²	41	56%	0.562	20%	0.198	S	C	*	.			trans	-117.5	-28	-179.3	-60.4	176	-172.3	-168.6	-1.6	113.2	N220 H243 N275 C277	N220-R245 PolarHBondContact O-N 2.8Å; N220-R245 WeakPolarHBondContact OD1-CB 3.43Å; N220-R245 WeakPolarHBondContact OD1-CD 3.36Å; N220-R245 WeakPolarHBondContact OD1-CG 3.28Å; H243-R245 PolarHBondContact O-N 2.83Å; R245-N275 WeakPolarHBondContact CA-O 3.48Å; R245-C277 PolarHBondContact O-N 3.36Å
246	I	91.4	Very high	80	Confident	59 Å²	59	43.4 Å²	43.4	30%	0.303	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	118.9	-171.5	-53.1	179.6	0	0	0	110.2	N220 Q221 F222 K248 C277	N220-I246 PolarHBondContact O-N 2.94Å; N220-I246 VanDerWaalsContact O-N 3.08Å; Q221-I246 WeakPolarHBondContact CA-O 3.39Å; Q221-I246 HydrophobicContact CB-CB 4.42Å; Q221-I246 HydrophobicContact CG-CB 4.29Å; Q221-I246 HydrophobicContact CG-CG2 4.35Å; F222-I246 PolarHBondContact N-O 2.89Å; I246-K248 HydrophobicContact CG2-CG 3.91Å; I246-C277 WeakPolarHBondContact CA-O 3.41Å
247	L	92.9	Very high	79.6	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	106.7	166.3	179.1	60	0	0	0	109.8	F222 I224 L234 L249 W266 F276 C277 V278 T279	F222-L247 HydrophobicContact CB-CD1 4.24Å; F222-L247 HydrophobicContact CD1-CD1 3.71Å; F222-L247 HydrophobicContact CG-CD1 4.38Å; F222-L247 CarbonylContact O-C 3.51Å; F222-L247 WeakPolarHBondContact O-CA 3.25Å; I224-L247 HydrophobicContact CG2-CD1 4.37Å; L234-L247 HydrophobicContact CD2-CD2 3.76Å; L247-L249 HydrophobicContact CD1-CD2 3.79Å; L247-L249 HydrophobicContact CD2-CD1 4.26Å; L247-L249 HydrophobicContact CD2-CD2 3.9Å; L247-L249 HydrophobicContact CD2-CG 4.2Å; L247-L249 HydrophobicContact CG-CD1 4.47Å; L247-L249 HydrophobicContact CG-CD2 3.65Å; L247-L249 HydrophobicContact CG-CG 3.9Å; L247-W266 HydrophobicContact CD2-CH2 4.05Å; L247-W266 HydrophobicContact CD2-CZ3 4.16Å; L247-F276 HydrophobicContact CB-CE2 3.69Å; L247-F276 HydrophobicContact CB-CZ 3.58Å; L247-F276 HydrophobicContact CD2-CE2 4.49Å; L247-F276 HydrophobicContact CD2-CZ 3.73Å; L247-F276 HydrophobicContact CG-CZ 4.29Å; L247-C277 PolarHBondContact N-O 3Å; L247-V278 HydrophobicContact CB-CG2 4.34Å; L247-V278 HydrophobicContact CD2-CG2 4.46Å; L247-V278 WeakPolarHBondContact O-CA 3.47Å; L247-T279 PolarHBondContact O-N 2.8Å
248	K	90.5	Very high	79.4	Confident	25 Å²	25	47.5 Å²	47.5	11%	0.109	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	109.4	175.2	-68.1	-179.5	168.2	168	0	109.8	Q221 F222 S223 I224 I246 F250 T279 F281 C805	Q221-K248 HydrophobicContact CG-CD 4.48Å; F222-K248 PolarHBondContact O-N 3.12Å; S223-K248 CarbonylContact C-O 3.51Å; S223-K248 VanDerWaalsContact CA-O 3.27Å; S223-K248 WeakPolarHBondContact CA-O 3.43Å; I224-K248 PolarHBondContact N-O 2.85Å; I246-K248 HydrophobicContact CG2-CG 3.91Å; K248-F250 HydrophobicContact CB-CE2 3.79Å; K248-T279 CarbonylContact C-O 3.59Å; K248-T279 WeakPolarHBondContact CA-O 3.34Å; K248-F281 HydrophobicContact CB-CD2 4.48Å; K248-F281 HydrophobicContact CB-CE2 3.88Å; K248-F281 HydrophobicContact CD-CE2 4.21Å; K248-F281 HydrophobicContact CG-CE2 3.97Å; K248-C805 PolarHBondContact NZ-O 2.85Å
249	L	89.9	Confident	79.3	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	128.6	-179.1	-62.4	-176.9	0	0	0	111.3	I224 Y226 L229 L247 W266 V278 T279 L280 F281	I224-L249 HydrophobicContact CG2-CD2 3.65Å; I224-L249 WeakPolarHBondContact O-CA 3.37Å; Y226-L249 HydrophobicContact CD2-CB 4.11Å; Y226-L249 HydrophobicContact CD2-CD1 3.72Å; Y226-L249 HydrophobicContact CD2-CG 4.43Å; Y226-L249 HydrophobicContact CE2-CD1 3.82Å; L229-L249 HydrophobicContact CD2-CD1 3.91Å; L229-L249 HydrophobicContact CD2-CD2 3.89Å; L247-L249 HydrophobicContact CD1-CD2 3.79Å; L247-L249 HydrophobicContact CD2-CD1 4.26Å; L247-L249 HydrophobicContact CD2-CD2 3.9Å; L247-L249 HydrophobicContact CD2-CG 4.2Å; L247-L249 HydrophobicContact CG-CD1 4.47Å; L247-L249 HydrophobicContact CG-CD2 3.65Å; L247-L249 HydrophobicContact CG-CG 3.9Å; L249-W266 HydrophobicContact CD1-CH2 4.19Å; L249-V278 HydrophobicContact CD1-CG1 3.89Å; L249-V278 HydrophobicContact CG-CG1 4.18Å; L249-T279 PolarHBondContact N-O 3.35Å; L249-L280 HydrophobicContact CB-CD1 3.83Å; L249-F281 PolarHBondContact O-N 3.19Å
250	F	83.4	Confident	79.5	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	128.2	-178.8	-64.4	-107.5	0	0	0	110.9	I197 I224 N225 Y226 K248 F281 I283 F798	I197-F250 HydrophobicContact CD1-CD1 4.05Å; I197-F250 HydrophobicContact CD1-CD2 3.62Å; I197-F250 HydrophobicContact CD1-CE1 3.84Å; I197-F250 HydrophobicContact CD1-CE2 3.38Å; I197-F250 HydrophobicContact CD1-CG 3.96Å; I197-F250 HydrophobicContact CD1-CZ 3.5Å; I197-F250 HydrophobicContact CG1-CD2 4.25Å; I197-F250 HydrophobicContact CG1-CE2 4.32Å; I197-F250 HydrophobicContact CG2-CB 3.42Å; I197-F250 VanDerWaalsContact CG2-CB 3.42Å; I197-F250 HydrophobicContact CG2-CD1 4.19Å; I197-F250 HydrophobicContact CG2-CD2 3.66Å; I197-F250 HydrophobicContact CG2-CE2 4.48Å; I197-F250 HydrophobicContact CG2-CG 3.5Å; I197-F250 VanDerWaalsContact CG2-CG 3.5Å; I224-F250 PolarHBondContact O-N 2.98Å; N225-F250 CarbonylContact C-O 3.6Å; N225-F250 WeakPolarHBondContact CA-O 3.14Å; N225-F250 PolarHBondContact OD1-O 2.89Å; Y226-F250 PolarHBondContact N-O 3.14Å; K248-F250 HydrophobicContact CB-CE2 3.79Å; F250-F281 HydrophobicContact CD1-CB 3.62Å; F250-F281 AromaticContact CD1-CD2 3.94Å; F250-F281 HydrophobicContact CD1-CD2 3.94Å; F250-F281 AromaticContact CD1-CG 3.83Å; F250-F281 HydrophobicContact CD1-CG 3.83Å; F250-F281 HydrophobicContact CD2-CD2 4.02Å; F250-F281 HydrophobicContact CE1-CB 3.95Å; F250-F281 HydrophobicContact CE1-CD1 4.15Å; F250-F281 AromaticContact CE1-CD2 3.59Å; F250-F281 HydrophobicContact CE1-CD2 3.59Å; F250-F281 HydrophobicContact CE1-CE2 4.12Å; F250-F281 AromaticContact CE1-CG 3.62Å; F250-F281 HydrophobicContact CE1-CG 3.62Å; F250-F281 AromaticContact CE2-CD2 3.68Å; F250-F281 HydrophobicContact CE2-CD2 3.68Å; F250-F281 AromaticContact CE2-CE2 3.96Å; F250-F281 HydrophobicContact CE2-CE2 3.96Å; F250-F281 HydrophobicContact CG-CB 4.06Å; F250-F281 HydrophobicContact CG-CD2 4.13Å; F250-F281 HydrophobicContact CG-CG 4.37Å; F250-F281 AromaticContact CZ-CD2 3.45Å; F250-F281 HydrophobicContact CZ-CD2 3.45Å; F250-F281 VanDerWaalsContact CZ-CD2 3.45Å; F250-F281 AromaticContact CZ-CE2 3.62Å; F250-F281 HydrophobicContact CZ-CE2 3.62Å; F250-F281 AromaticContact CZ-CG 3.98Å; F250-F281 HydrophobicContact CZ-CG 3.98Å; F250-F281 HydrophobicContact CZ-CZ 4.28Å; F250-I283 HydrophobicContact CD1-CD1 3.91Å; F250-F798 HydrophobicContact CB-CE2 4.07Å; F250-F798 HydrophobicContact CD1-CE2 4.24Å; F250-F798 HydrophobicContact CG-CE2 4.48Å
251	V	80.8	Confident	80.2	Confident	8 Å²	8	46.2 Å²	46.2	5%	0.048	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	115.2	-175.9	-179.9	0	0	0	0	108.3	Y226 L258 L280 F281 L282 I283 L380	Y226-V251 HydrophobicContact CD2-CG2 4.04Å; Y226-V251 HydrophobicContact CG-CG2 4.04Å; V251-L258 HydrophobicContact CG1-CD1 4.01Å; V251-L258 HydrophobicContact CG1-CD2 4.45Å; V251-L280 HydrophobicContact CG2-CD1 3.82Å; V251-F281 PolarHBondContact N-O 2.86Å; V251-L282 HydrophobicContact CB-CD2 3.87Å; V251-L282 HydrophobicContact CG1-CD2 4.26Å; V251-L282 HydrophobicContact CG2-CD2 3.91Å; V251-I283 PolarHBondContact O-N 3.02Å; V251-L380 HydrophobicContact CB-CD1 4.43Å; V251-L380 HydrophobicContact CG1-CD1 3.97Å; V251-L380 HydrophobicContact CG2-CD1 3.8Å
252	Q	71.3	Confident	80.9	Confident	26 Å²	26	51.8 Å²	51.8	12%	0.121	25%	0.249	C	C	.	.			trans	-116.8	-11.8	177.9	-61.2	-171.1	-88.2	0	0	113.8	N225 F798	N225-Q252 PolarHBondContact ND2-OE1 2.82Å; Q252-F798 HydrophobicContact CG-CD2 3.35Å; Q252-F798 HydrophobicContact CG-CE2 3.6Å; Q252-F798 HydrophobicContact CG-CG 4.09Å; Q252-F798 VanDerWaalsContact NE2-CD2 3.29Å
253	N	63.8	Low	81.7	Confident	48 Å²	48	48 Å²	48	26%	0.257	23%	0.229	S	C	.	.	S	Bend	trans	-110.4	164.8	-165.6	-53.9	-27.2	0	0	0	109.9	L227 V255	L227-N253 WeakPolarHBondContact CD2-ND2 3.45Å; N253-V255 PolarHBondContact O-N 3.39Å
254	N	67.1	Low	82.1	Confident	64 Å²	64	48.3 Å²	48.3	34%	0.342	23%	0.231	S	C	.	.			trans	-59.8	136	175.7	-74.5	-2.6	0	0	0	110.4	Q256 D257 D287	N254-Q256 PolarHBondContact O-N 2.96Å; N254-D257 PolarHBondContact O-N 3.22Å; N254-D287 PolarHBondContact ND2-OD2 2.97Å; N254-D287 WeakPolarHBondContact OD1-CB 3.42Å; N254-D287 PolarHBondContact OD1-OD2 3.41Å
255	V	71.3	Confident	82.3	Confident	14 Å²	14	48.9 Å²	48.9	9%	0.085	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-59.8	-25	-172.3	-173.5	0	0	0	0	111.6	N253 D257 L258 L288 L375 K379 L380	N253-V255 PolarHBondContact O-N 3.39Å; V255-D257 VanDerWaalsContact C-N 3.31Å; V255-D257 PolarHBondContact O-N 3.44Å; V255-L258 HydrophobicContact CG1-CD1 4.22Å; V255-L258 PolarHBondContact O-N 3.45Å; V255-L288 HydrophobicContact CG2-CD2 4.31Å; V255-L375 HydrophobicContact CB-CD1 4.48Å; V255-L375 HydrophobicContact CB-CD2 4.14Å; V255-L375 HydrophobicContact CB-CG 4.18Å; V255-L375 HydrophobicContact CG1-CD1 4.02Å; V255-L375 HydrophobicContact CG1-CD2 4.28Å; V255-L375 HydrophobicContact CG1-CG 3.76Å; V255-K379 HydrophobicContact CG1-CB 4.12Å; V255-K379 WeakPolarHBondContact O-CD 3.35Å; V255-L380 HydrophobicContact CG1-CB 4.04Å; V255-L380 HydrophobicContact CG2-CD2 4.4Å
256	Q	70.1	Confident	82.4	Confident	98 Å²	98	41.8 Å²	41.8	46%	0.458	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-61.5	-30.7	172.7	-69.1	-172.8	-21.1	0	0	114.2	N254 S291 L375 K379	N254-Q256 PolarHBondContact O-N 2.96Å; Q256-S291 PolarHBondContact NE2-O 3.16Å; Q256-L375 HydrophobicContact CG-CD1 4.49Å; Q256-K379 PolarHBondContact O-NZ 2.87Å
257	D	74.6	Confident	82.4	Confident	100 Å²	100	45.5 Å²	45.5	54%	0.535	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-81.8	-14.8	-178.6	-62.7	-48	0	0	0	113.3	L227 N254 V255	L227-D257 HydrophobicContact CD1-CB 4.48Å; L227-D257 WeakPolarHBondContact CD1-O 3.12Å; N254-D257 PolarHBondContact O-N 3.22Å; V255-D257 VanDerWaalsContact C-N 3.31Å; V255-D257 PolarHBondContact O-N 3.44Å
258	L	78.6	Confident	82.3	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	24%	0.235	C	C	.	.	S	Bend	trans	-68.8	143.4	-173.3	-59.4	-178.1	0	0	0	112.3	Y226 V251 V255 K379 L380	Y226-L258 HydrophobicContact CD1-CB 4.05Å; Y226-L258 HydrophobicContact CD1-CD1 4.05Å; Y226-L258 HydrophobicContact CD1-CD2 4.03Å; Y226-L258 HydrophobicContact CD1-CG 4.26Å; Y226-L258 HydrophobicContact CE1-CB 4.14Å; Y226-L258 HydrophobicContact CE1-CD1 4.32Å; V251-L258 HydrophobicContact CG1-CD1 4.01Å; V251-L258 HydrophobicContact CG1-CD2 4.45Å; V255-L258 HydrophobicContact CG1-CD1 4.22Å; V255-L258 PolarHBondContact O-N 3.45Å; L258-K379 HydrophobicContact CB-CB 4.48Å; L258-K379 PolarHBondContact O-NZ 2.97Å; L258-L380 HydrophobicContact CD1-CD1 3.55Å
259	P	82.1	Confident	82.2	Confident	36 Å²	36	48.3 Å²	48.3	23%	0.234	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-62.1	141.1	173.7	26	-34.3	0	0	0	111	Y226 L229	Y226-P259 HydrophobicContact CD1-CG 4.26Å; Y226-P259 HydrophobicContact CE1-CG 4.34Å; Y226-P259 WeakPolarHBondContact O-CG 3.37Å; L229-P259 WeakPolarHBondContact O-CG 3.09Å
260	I	85.3	Confident	82.1	Confident	107 Å²	107	52.2 Å²	52.2	55%	0.549	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-82.7	126.4	171.5	-64.2	167	0	0	0	107.6	K379	I260-K379 HydrophobicContact CG1-CD 4.47Å; I260-K379 HydrophobicContact CG1-CG 3.92Å
261	I	87	Confident	82.4	Confident	4 Å²	4	58.7 Å²	58.7	2%	0.021	28%	0.279	C	S	.	.			trans	-123.3	117.8	177.7	-60.8	175.4	0	0	0	107	L229 E231 L234 W266	L229-I261 HydrophobicContact CB-CD1 4.14Å; L229-I261 HydrophobicContact CD2-CD1 3.49Å; L229-I261 VanDerWaalsContact CD2-CD1 3.49Å; L229-I261 HydrophobicContact CG-CD1 3.64Å; E231-I261 HydrophobicContact CG-CG2 4.23Å; L234-I261 HydrophobicContact CD1-CD1 4.09Å; L234-I261 HydrophobicContact CD1-CG2 3.58Å; I261-W266 HydrophobicContact CD1-CZ2 4.23Å; I261-W266 HydrophobicContact CG2-CZ2 4.16Å; I261-W266 VanDerWaalsContact CG2-NE1 3.27Å
262	R	88	Confident	82.8	Confident	117 Å²	117	61.4 Å²	61.4	44%	0.442	29%	0.292	S	S	.	.			trans	-67.9	143.1	-171.8	-67.4	171.7	-67.5	142.4	-9.4	111.8	E231 Q264 I265 W266	E231-R262 WeakPolarHBondContact OE1-CB 3.35Å; E231-R262 VanDerWaalsContact OE1-CG 3.27Å; E231-R262 WeakPolarHBondContact OE1-CG 3.37Å; E231-R262 IonicContact OE1-CZ 3.78Å; E231-R262 PolarHBondContact OE1-N 2.81Å; E231-R262 IonicContact OE1-NE 3.32Å; E231-R262 PolarHBondContact OE1-NE 2.93Å; E231-R262 IonicContact OE1-NH2 2.9Å; E231-R262 IonicContact OE2-CZ 2.69Å; E231-R262 IonicContact OE2-NE 3.72Å; E231-R262 PolarHBondContact OE2-NE 3.39Å; E231-R262 VanDerWaalsContact OE2-NE 3.14Å; E231-R262 IonicContact OE2-NH2 3.14Å; E231-R262 PolarHBondContact OE2-NH2 3.28Å; R262-Q264 PolarHBondContact O-N 3.01Å; R262-I265 HydrophobicContact CB-CG1 4.44Å; R262-I265 PolarHBondContact O-N 3.46Å; R262-W266 PolarHBondContact O-N 3.09Å
263	N	88.6	Confident	83.7	Confident	46 Å²	46	60.6 Å²	60.6	25%	0.246	29%	0.289	C	S	.	.	H	α-helix	trans	-48.8	-34.8	170.6	-95	-17.4	0	0	0	113.3	I265 W266 R267 P382 S383 A384	N263-I265 VanDerWaalsContact C-N 3.32Å; N263-I265 PolarHBondContact O-N 2.81Å; N263-W266 PolarHBondContact O-N 2.81Å; N263-R267 WeakPolarHBondContact O-CG 3.35Å; N263-R267 PolarHBondContact O-N 3.04Å; N263-P382 WeakPolarHBondContact OD1-CB 3.35Å; N263-S383 PolarHBondContact ND2-OG 3.46Å; N263-S383 PolarHBondContact OD1-N 3.36Å; N263-S383 VanDerWaalsContact OD1-N 3.14Å; N263-A384 HydrophobicContact CB-CB 4.01Å; N263-A384 WeakPolarHBondContact O-CB 3.42Å; N263-A384 VanDerWaalsContact OD1-CB 3.32Å; N263-A384 WeakPolarHBondContact OD1-CB 3.27Å; N263-A384 PolarHBondContact OD1-N 2.92Å
264	Q	90.7	Very high	84.7	Confident	109 Å²	109	62.6 Å²	62.6	51%	0.509	31%	0.305	S	S	.	.	H	α-helix	trans	-59.1	-38.8	176.5	-68.9	167.8	-16.4	0	0	112.8	R262 H268	R262-Q264 PolarHBondContact O-N 3.01Å; Q264-H268 WeakPolarHBondContact O-CB 3.23Å; Q264-H268 PolarHBondContact O-N 3.17Å; Q264-H268 VanDerWaalsContact O-N 3.08Å
265	I	91.3	Very high	85.6	Confident	15 Å²	15	65.4 Å²	65.4	8%	0.077	32%	0.32	C	S	.	.	H	α-helix	trans	-71.7	-43.9	179.6	-57.3	-59.3	0	0	0	110.5	E231 L234 L235 R262 N263 R267 H268 V269	E231-I265 HydrophobicContact CB-CG1 4.12Å; E231-I265 HydrophobicContact CB-CG2 4.41Å; E231-I265 HydrophobicContact CG-CG1 4Å; L234-I265 HydrophobicContact CB-CG2 4.09Å; L234-I265 HydrophobicContact CD1-CG2 4.26Å; L235-I265 HydrophobicContact CD1-CD1 4.32Å; L235-I265 HydrophobicContact CD2-CD1 4.27Å; L235-I265 HydrophobicContact CD2-CG2 4.32Å; L235-I265 HydrophobicContact CG-CD1 4.49Å; L235-I265 HydrophobicContact CG-CG2 4.33Å; R262-I265 HydrophobicContact CB-CG1 4.44Å; R262-I265 PolarHBondContact O-N 3.46Å; N263-I265 VanDerWaalsContact C-N 3.32Å; N263-I265 PolarHBondContact O-N 2.81Å; I265-R267 PolarHBondContact O-N 3.08Å; I265-H268 PolarHBondContact O-N 2.83Å; I265-V269 HydrophobicContact CG2-CG2 4.38Å; I265-V269 VanDerWaalsContact O-CG2 3.29Å; I265-V269 WeakPolarHBondContact O-CG2 3.36Å; I265-V269 PolarHBondContact O-N 2.91Å
266	W	91.9	Very high	86.6	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-61.8	-41.3	176.3	-69.9	115	0	0	0	112.8	L229 L234 L247 L249 I261 R262 N263 H270 F276 V278 A384 L385	L229-W266 HydrophobicContact CD2-CH2 3.96Å; L229-W266 HydrophobicContact CD2-CZ2 4.07Å; L234-W266 HydrophobicContact CD1-CD2 4.2Å; L234-W266 HydrophobicContact CD1-CE3 4.16Å; L234-W266 HydrophobicContact CD1-CH2 3.67Å; L234-W266 HydrophobicContact CD1-CZ2 3.69Å; L234-W266 HydrophobicContact CD1-CZ3 3.91Å; L234-W266 HydrophobicContact CD2-CE3 4.46Å; L234-W266 HydrophobicContact CD2-CH2 3.75Å; L234-W266 HydrophobicContact CD2-CZ3 3.67Å; L234-W266 HydrophobicContact CG-CH2 4.37Å; L234-W266 HydrophobicContact CG-CZ3 4.47Å; L247-W266 HydrophobicContact CD2-CH2 4.05Å; L247-W266 HydrophobicContact CD2-CZ3 4.16Å; L249-W266 HydrophobicContact CD1-CH2 4.19Å; I261-W266 HydrophobicContact CD1-CZ2 4.23Å; I261-W266 HydrophobicContact CG2-CZ2 4.16Å; I261-W266 VanDerWaalsContact CG2-NE1 3.27Å; R262-W266 PolarHBondContact O-N 3.09Å; N263-W266 PolarHBondContact O-N 2.81Å; W266-H270 WeakPolarHBondContact O-CB 3.21Å; W266-H270 PolarHBondContact O-N 3.08Å; W266-H270 VanDerWaalsContact O-N 3.08Å; W266-F276 HydrophobicContact CZ3-CE1 4.13Å; W266-V278 HydrophobicContact CH2-CG2 4.44Å; W266-V278 HydrophobicContact CZ3-CG2 4.02Å; W266-A384 HydrophobicContact CB-CB 3.85Å; W266-A384 WeakPolarHBondContact CB-O 3.31Å; W266-L385 HydrophobicContact CD2-CD1 3.76Å; W266-L385 HydrophobicContact CE3-CD1 3.81Å; W266-L385 HydrophobicContact CH2-CD1 3.5Å; W266-L385 HydrophobicContact CZ2-CD1 3.43Å; W266-L385 VanDerWaalsContact CZ2-CD1 3.43Å; W266-L385 HydrophobicContact CZ3-CD1 3.69Å
267	R	90.6	Very high	87.6	Confident	137 Å²	137	62.4 Å²	62.4	52%	0.517	31%	0.309	S	S	.	.	H	α-helix	trans	-58.8	-50.2	172	-70.2	180	-172	151	3.1	111.2	N263 I265 V269 H270 E271 A384	N263-R267 WeakPolarHBondContact O-CG 3.35Å; N263-R267 PolarHBondContact O-N 3.04Å; I265-R267 PolarHBondContact O-N 3.08Å; R267-V269 PolarHBondContact O-N 3.11Å; R267-H270 CarbonylContact O-C 3.35Å; R267-H270 PolarHBondContact O-N 3.4Å; R267-H270 VanDerWaalsContact O-N 3.11Å; R267-E271 VanDerWaalsContact O-CG 3.29Å; R267-E271 WeakPolarHBondContact O-CG 3.24Å; R267-E271 PolarHBondContact O-N 2.81Å; R267-A384 HydrophobicContact CG-CB 3.65Å
268	H	90.9	Very high	88.5	Confident	82 Å²	82	57.7 Å²	57.7	38%	0.38	28%	0.284	S	S	.	.	H	α-helix	trans	-62.2	-40.6	-177.8	-168	50.5	0	0	0	113.1	Q264 I265 H270 E271 I272	Q264-H268 WeakPolarHBondContact O-CB 3.23Å; Q264-H268 PolarHBondContact O-N 3.17Å; Q264-H268 VanDerWaalsContact O-N 3.08Å; I265-H268 PolarHBondContact O-N 2.83Å; H268-H270 VanDerWaalsContact C-N 3.34Å; H268-H270 PolarHBondContact O-N 2.72Å; H268-E271 IonicContact ND1-OE2 3.34Å; H268-E271 PolarHBondContact O-N 2.71Å; H268-I272 WeakPolarHBondContact O-CG1 3.29Å; H268-I272 PolarHBondContact O-N 2.8Å; H268-I272 VanDerWaalsContact O-N 3.11Å
269	V	90	Very high	89.2	Confident	3 Å²	3	58.2 Å²	58.2	2%	0.018	29%	0.287	C	S	.	.	H	α-helix	trans	-61	-42.6	173.6	169.1	0	0	0	0	111.3	L234 I265 R267 I272 L273 F276	L234-V269 HydrophobicContact CB-CG2 4.03Å; I265-V269 HydrophobicContact CG2-CG2 4.38Å; I265-V269 VanDerWaalsContact O-CG2 3.29Å; I265-V269 WeakPolarHBondContact O-CG2 3.36Å; I265-V269 PolarHBondContact O-N 2.91Å; R267-V269 PolarHBondContact O-N 3.11Å; V269-I272 PolarHBondContact O-N 2.82Å; V269-L273 WeakPolarHBondContact O-CB 3.44Å; V269-L273 PolarHBondContact O-N 3Å; V269-F276 HydrophobicContact CG1-CD1 3.79Å; V269-F276 HydrophobicContact CG1-CE1 3.67Å; V269-F276 HydrophobicContact CG1-CG 4.4Å; V269-F276 HydrophobicContact CG1-CZ 4.17Å
270	H	87.9	Confident	89.6	Confident	82 Å²	82	56.5 Å²	56.5	38%	0.38	28%	0.276	S	S	.	.	H	α-helix	trans	-74.2	-29.5	179.2	-173.8	-89.6	0	0	0	113.2	W266 R267 H268 L273 P274	W266-H270 WeakPolarHBondContact O-CB 3.21Å; W266-H270 PolarHBondContact O-N 3.08Å; W266-H270 VanDerWaalsContact O-N 3.08Å; R267-H270 CarbonylContact O-C 3.35Å; R267-H270 PolarHBondContact O-N 3.4Å; R267-H270 VanDerWaalsContact O-N 3.11Å; H268-H270 VanDerWaalsContact C-N 3.34Å; H268-H270 PolarHBondContact O-N 2.72Å; H270-L273 CarbonylContact O-C 3.43Å; H270-L273 VanDerWaalsContact O-C 3.29Å; H270-P274 WeakPolarHBondContact O-CA 3.41Å
271	E	89.2	Confident	89.6	Confident	136 Å²	136	51.5 Å²	51.5	64%	0.636	25%	0.25	S	S	*	.	H	α-helix	trans	-64.3	-38.7	170.3	-74.3	161.1	-168.5	0	0	111.7	R267 H268	R267-E271 VanDerWaalsContact O-CG 3.29Å; R267-E271 WeakPolarHBondContact O-CG 3.24Å; R267-E271 PolarHBondContact O-N 2.81Å; H268-E271 IonicContact ND1-OE2 3.34Å; H268-E271 PolarHBondContact O-N 2.71Å
272	I	89.2	Confident	89.3	Confident	64 Å²	64	51.4 Å²	51.4	33%	0.328	25%	0.25	S	C	.	.	H	α-helix	trans	-77.3	-40.3	176.2	-63	164.2	0	0	0	111.2	S238 H268 V269 P274	S238-I272 WeakPolarHBondContact O-CG2 3.45Å; H268-I272 WeakPolarHBondContact O-CG1 3.29Å; H268-I272 PolarHBondContact O-N 2.8Å; H268-I272 VanDerWaalsContact O-N 3.11Å; V269-I272 PolarHBondContact O-N 2.82Å; I272-P274 WeakPolarHBondContact O-CD 3.16Å
273	L	88.8	Confident	88.5	Confident	10 Å²	10	46 Å²	46	5%	0.052	23%	0.229	C	C	.	.			trans	-119.8	80.4	-176.6	-58	-180	0	0	0	111.3	L244 V269 H270 N275 F276	L244-L273 HydrophobicContact CB-CD1 4.05Å; L244-L273 HydrophobicContact CD2-CD1 4.28Å; V269-L273 WeakPolarHBondContact O-CB 3.44Å; V269-L273 PolarHBondContact O-N 3Å; H270-L273 CarbonylContact O-C 3.43Å; H270-L273 VanDerWaalsContact O-C 3.29Å; L273-N275 PolarHBondContact O-N 3.06Å; L273-F276 HydrophobicContact CB-CB 3.64Å; L273-F276 HydrophobicContact CB-CG 4.43Å; L273-F276 HydrophobicContact CD1-CB 4.45Å; L273-F276 HydrophobicContact CD1-CD2 4.26Å; L273-F276 WeakPolarHBondContact O-CB 3.48Å; L273-F276 PolarHBondContact O-N 3.24Å
274	P	85.8	Confident	87.2	Confident	90 Å²	90	44.6 Å²	44.6	58%	0.584	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	1	-174.9	28.8	-37.4	0	0	0	115.3	H270 I272	H270-P274 WeakPolarHBondContact O-CA 3.41Å; I272-P274 WeakPolarHBondContact O-CD 3.16Å
275	N	86.9	Confident	85.4	Confident	123 Å²	123	40.3 Å²	40.3	66%	0.658	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-117.3	23.3	173.1	-61.9	-82.5	0	0	0	111.4	R245 L273	R245-N275 WeakPolarHBondContact CA-O 3.48Å; L273-N275 PolarHBondContact O-N 3.06Å
276	F	90.4	Very high	83.4	Confident	3 Å²	3	42 Å²	42	1%	0.013	21%	0.214	C	C	.	.			trans	-94.6	119.6	-178.2	174.7	-100.9	0	0	0	111.1	L244 L247 W266 V269 L273 V278 P386	L244-F276 HydrophobicContact CD2-CD2 4.07Å; L244-F276 HydrophobicContact CD2-CE2 3.67Å; L244-F276 HydrophobicContact CG-CD2 4.05Å; L244-F276 HydrophobicContact CG-CE2 3.99Å; L247-F276 HydrophobicContact CB-CE2 3.69Å; L247-F276 HydrophobicContact CB-CZ 3.58Å; L247-F276 HydrophobicContact CD2-CE2 4.49Å; L247-F276 HydrophobicContact CD2-CZ 3.73Å; L247-F276 HydrophobicContact CG-CZ 4.29Å; W266-F276 HydrophobicContact CZ3-CE1 4.13Å; V269-F276 HydrophobicContact CG1-CD1 3.79Å; V269-F276 HydrophobicContact CG1-CE1 3.67Å; V269-F276 HydrophobicContact CG1-CG 4.4Å; V269-F276 HydrophobicContact CG1-CZ 4.17Å; L273-F276 HydrophobicContact CB-CB 3.64Å; L273-F276 HydrophobicContact CB-CG 4.43Å; L273-F276 HydrophobicContact CD1-CB 4.45Å; L273-F276 HydrophobicContact CD1-CD2 4.26Å; L273-F276 WeakPolarHBondContact O-CB 3.48Å; L273-F276 PolarHBondContact O-N 3.24Å; F276-V278 HydrophobicContact CE1-CG2 4.09Å; F276-V278 HydrophobicContact CZ-CG2 4.4Å; F276-P386 HydrophobicContact CD1-CG 3.72Å; F276-P386 HydrophobicContact CE1-CG 4.03Å; F276-P386 WeakPolarHBondContact O-CB 3.34Å; F276-P386 WeakPolarHBondContact O-CG 3.41Å
277	C	91.8	Very high	81.4	Confident	46 Å²	46	43.6 Å²	43.6	31%	0.311	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	144.9	-177.9	-63	0	0	0	0	111	R245 I246 L247 P386 N388	R245-C277 PolarHBondContact O-N 3.36Å; I246-C277 WeakPolarHBondContact CA-O 3.41Å; L247-C277 PolarHBondContact N-O 3Å; C277-P386 WeakPolarHBondContact CA-O 3.27Å; C277-N388 HydrophobicContact CB-CB 3.97Å
278	V	93.6	Very high	79.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133	173.1	177.2	0	0	0	0	109.9	L247 L249 W266 F276 L385 P386 L387 N388 S389	L247-V278 HydrophobicContact CB-CG2 4.34Å; L247-V278 HydrophobicContact CD2-CG2 4.46Å; L247-V278 WeakPolarHBondContact O-CA 3.47Å; L249-V278 HydrophobicContact CD1-CG1 3.89Å; L249-V278 HydrophobicContact CG-CG1 4.18Å; W266-V278 HydrophobicContact CH2-CG2 4.44Å; W266-V278 HydrophobicContact CZ3-CG2 4.02Å; F276-V278 HydrophobicContact CE1-CG2 4.09Å; F276-V278 HydrophobicContact CZ-CG2 4.4Å; V278-L385 HydrophobicContact CB-CD1 4.25Å; V278-L385 HydrophobicContact CB-CG 4.32Å; V278-L385 HydrophobicContact CG1-CD1 4.17Å; V278-L385 HydrophobicContact CG1-CD2 4.41Å; V278-L385 HydrophobicContact CG1-CG 4.38Å; V278-L385 HydrophobicContact CG2-CD1 3.83Å; V278-L385 HydrophobicContact CG2-CG 4.32Å; V278-P386 HydrophobicContact CG2-CG 4.18Å; V278-P386 PolarHBondContact N-O 3.15Å; V278-L387 HydrophobicContact CG1-CD1 4.47Å; V278-N388 PolarHBondContact O-N 3.23Å; V278-N388 VanDerWaalsContact O-N 3.12Å; V278-S389 PolarHBondContact O-N 3.16Å
279	T	92.7	Very high	77.3	Confident	13 Å²	13	37.8 Å²	37.8	8%	0.08	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	122.1	164.9	-54.9	0	0	0	0	108.2	L247 K248 L249 F281 S389 Y391	L247-T279 PolarHBondContact O-N 2.8Å; K248-T279 CarbonylContact C-O 3.59Å; K248-T279 WeakPolarHBondContact CA-O 3.34Å; L249-T279 PolarHBondContact N-O 3.35Å; T279-F281 HydrophobicContact CG2-CD2 4.13Å; T279-F281 HydrophobicContact CG2-CE1 4.26Å; T279-F281 HydrophobicContact CG2-CE2 3.37Å; T279-F281 HydrophobicContact CG2-CZ 3.44Å; T279-F281 VanDerWaalsContact CG2-CZ 3.44Å; T279-S389 WeakPolarHBondContact CA-O 3.48Å; T279-Y391 HydrophobicContact CG2-CD2 3.78Å; T279-Y391 HydrophobicContact CG2-CE2 3.58Å
280	L	91.2	Very high	75.1	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	121.3	-178.1	-172.6	64.5	0	0	0	111.3	Y226 L249 V251 L282 L380 L381 L387 S389 I390 Y391	Y226-L280 HydrophobicContact CD2-CD1 4.24Å; L249-L280 HydrophobicContact CB-CD1 3.83Å; V251-L280 HydrophobicContact CG2-CD1 3.82Å; L280-L282 HydrophobicContact CD1-CD2 4.22Å; L280-L282 HydrophobicContact CD2-CD2 3.79Å; L280-L282 HydrophobicContact CD2-CG 4.26Å; L280-L282 HydrophobicContact CG-CD2 3.77Å; L280-L282 HydrophobicContact CG-CG 4.22Å; L280-L380 HydrophobicContact CD2-CG 4.5Å; L280-L381 HydrophobicContact CD2-CD2 3.47Å; L280-L381 VanDerWaalsContact CD2-CD2 3.47Å; L280-L381 HydrophobicContact CD2-CG 4.3Å; L280-L387 HydrophobicContact CB-CD1 3.75Å; L280-S389 PolarHBondContact N-O 2.98Å; L280-I390 HydrophobicContact CB-CG1 4.32Å; L280-I390 HydrophobicContact CD2-CD1 4.32Å; L280-I390 WeakPolarHBondContact O-CA 3.48Å; L280-Y391 PolarHBondContact O-N 2.9Å
281	F	86.1	Confident	72.8	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.009	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	98.4	175.1	-60.9	-86.3	0	0	0	109	K248 L249 F250 V251 T279 I283 Y391 Y393 I801 C805	K248-F281 HydrophobicContact CB-CD2 4.48Å; K248-F281 HydrophobicContact CB-CE2 3.88Å; K248-F281 HydrophobicContact CD-CE2 4.21Å; K248-F281 HydrophobicContact CG-CE2 3.97Å; L249-F281 PolarHBondContact O-N 3.19Å; F250-F281 HydrophobicContact CD1-CB 3.62Å; F250-F281 AromaticContact CD1-CD2 3.94Å; F250-F281 HydrophobicContact CD1-CD2 3.94Å; F250-F281 AromaticContact CD1-CG 3.83Å; F250-F281 HydrophobicContact CD1-CG 3.83Å; F250-F281 HydrophobicContact CD2-CD2 4.02Å; F250-F281 HydrophobicContact CE1-CB 3.95Å; F250-F281 HydrophobicContact CE1-CD1 4.15Å; F250-F281 AromaticContact CE1-CD2 3.59Å; F250-F281 HydrophobicContact CE1-CD2 3.59Å; F250-F281 HydrophobicContact CE1-CE2 4.12Å; F250-F281 AromaticContact CE1-CG 3.62Å; F250-F281 HydrophobicContact CE1-CG 3.62Å; F250-F281 AromaticContact CE2-CD2 3.68Å; F250-F281 HydrophobicContact CE2-CD2 3.68Å; F250-F281 AromaticContact CE2-CE2 3.96Å; F250-F281 HydrophobicContact CE2-CE2 3.96Å; F250-F281 HydrophobicContact CG-CB 4.06Å; F250-F281 HydrophobicContact CG-CD2 4.13Å; F250-F281 HydrophobicContact CG-CG 4.37Å; F250-F281 AromaticContact CZ-CD2 3.45Å; F250-F281 HydrophobicContact CZ-CD2 3.45Å; F250-F281 VanDerWaalsContact CZ-CD2 3.45Å; F250-F281 AromaticContact CZ-CE2 3.62Å; F250-F281 HydrophobicContact CZ-CE2 3.62Å; F250-F281 AromaticContact CZ-CG 3.98Å; F250-F281 HydrophobicContact CZ-CG 3.98Å; F250-F281 HydrophobicContact CZ-CZ 4.28Å; V251-F281 PolarHBondContact N-O 2.86Å; T279-F281 HydrophobicContact CG2-CD2 4.13Å; T279-F281 HydrophobicContact CG2-CE1 4.26Å; T279-F281 HydrophobicContact CG2-CE2 3.37Å; T279-F281 HydrophobicContact CG2-CZ 3.44Å; T279-F281 VanDerWaalsContact CG2-CZ 3.44Å; F281-I283 HydrophobicContact CB-CD1 4.12Å; F281-I283 HydrophobicContact CB-CG1 4.34Å; F281-Y391 HydrophobicContact CD1-CD1 4.35Å; F281-Y391 AromaticContact CD1-CD2 3.86Å; F281-Y391 HydrophobicContact CD1-CD2 3.86Å; F281-Y391 AromaticContact CD1-CG 3.71Å; F281-Y391 HydrophobicContact CD1-CG 3.71Å; F281-Y391 AromaticContact CE1-CD1 3.92Å; F281-Y391 HydrophobicContact CE1-CD1 3.92Å; F281-Y391 AromaticContact CE1-CD2 3.42Å; F281-Y391 HydrophobicContact CE1-CD2 3.42Å; F281-Y391 VanDerWaalsContact CE1-CD2 3.42Å; F281-Y391 HydrophobicContact CE1-CE1 4.23Å; F281-Y391 AromaticContact CE1-CE2 3.77Å; F281-Y391 HydrophobicContact CE1-CE2 3.77Å; F281-Y391 AromaticContact CE1-CG 3.52Å; F281-Y391 HydrophobicContact CE1-CG 3.52Å; F281-Y391 AromaticContact CZ-CD2 3.95Å; F281-Y391 HydrophobicContact CZ-CD2 3.95Å; F281-Y391 AromaticContact CZ-CE2 3.99Å; F281-Y391 HydrophobicContact CZ-CE2 3.99Å; F281-Y391 HydrophobicContact CZ-CG 4.47Å; F281-Y393 HydrophobicContact CD1-CE2 4.24Å; F281-I801 HydrophobicContact CD1-CG2 4.41Å; F281-C805 HydrophobicContact CE1-CB 4.04Å; F281-C805 WeakPolarHBondContact CE1-SG 3.26Å; F281-C805 HydrophobicContact CZ-CB 4.1Å
282	L	81	Confident	70.7	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	114.5	171.9	-58.8	-172	0	0	0	108.7	V251 L280 V285 L380 I390 Y391 I392 Y393 L403	V251-L282 HydrophobicContact CB-CD2 3.87Å; V251-L282 HydrophobicContact CG1-CD2 4.26Å; V251-L282 HydrophobicContact CG2-CD2 3.91Å; L280-L282 HydrophobicContact CD1-CD2 4.22Å; L280-L282 HydrophobicContact CD2-CD2 3.79Å; L280-L282 HydrophobicContact CD2-CG 4.26Å; L280-L282 HydrophobicContact CG-CD2 3.77Å; L280-L282 HydrophobicContact CG-CG 4.22Å; L282-V285 HydrophobicContact CB-CG2 4.15Å; L282-V285 HydrophobicContact CD1-CG2 4.44Å; L282-L380 HydrophobicContact CD1-CD2 4.18Å; L282-L380 HydrophobicContact CD2-CD1 3.81Å; L282-L380 HydrophobicContact CD2-CD2 3.93Å; L282-L380 HydrophobicContact CD2-CG 4.19Å; L282-I390 HydrophobicContact CD1-CD1 3.98Å; L282-I390 HydrophobicContact CG-CD1 4.38Å; L282-Y391 PolarHBondContact N-O 3.01Å; L282-I392 HydrophobicContact CD1-CG1 4.44Å; L282-Y393 PolarHBondContact O-N 2.83Å; L282-L403 HydrophobicContact CD1-CD2 3.89Å
283	I	71	Confident	68.4	Low	3 Å²	3	37.4 Å²	37.4	2%	0.015	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	102	-172.5	-57.2	171.4	0	0	0	108.3	F250 V251 F281 Y393 F798 I801	F250-I283 HydrophobicContact CD1-CD1 3.91Å; V251-I283 PolarHBondContact O-N 3.02Å; F281-I283 HydrophobicContact CB-CD1 4.12Å; F281-I283 HydrophobicContact CB-CG1 4.34Å; I283-Y393 HydrophobicContact CG1-CD2 4.1Å; I283-F798 HydrophobicContact CD1-CB 4.45Å; I283-F798 HydrophobicContact CD1-CD2 3.63Å; I283-F798 HydrophobicContact CD1-CE2 4.42Å; I283-F798 HydrophobicContact CD1-CG 4.44Å; I283-F798 HydrophobicContact CG2-CB 3.96Å; I283-I801 HydrophobicContact CD1-CB 4.35Å; I283-I801 HydrophobicContact CD1-CD1 4.02Å; I283-I801 HydrophobicContact CD1-CG2 3.91Å; I283-I801 HydrophobicContact CG1-CD1 3.95Å; I283-I801 HydrophobicContact CG2-CD1 3.86Å
284	C	60.2	Low	66.1	Low	18 Å²	18	43.9 Å²	43.9	12%	0.122	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	65.3	88.1	-173.9	178.3	0	0	0	0	115.8	N286 Y393 Y394 P794	C284-N286 VanDerWaalsContact C-N 3.33Å; C284-N286 PolarHBondContact O-N 3.4Å; C284-N286 VanDerWaalsContact O-N 3.12Å; C284-N286 PolarHBondContact SG-ND2 2.74Å; C284-Y393 WeakPolarHBondContact CA-O 3.32Å; C284-Y393 PolarHBondContact N-O 3.31Å; C284-Y394 HydrophobicContact CB-CD1 4.03Å; C284-Y394 VanDerWaalsContact SG-CD1 3.52Å; C284-P794 HydrophobicContact CB-CB 3.54Å; C284-P794 HydrophobicContact CB-CG 3.61Å; C284-P794 WeakPolarHBondContact SG-CG 3.42Å
285	V	53.5	Low	63.7	Low	18 Å²	18	42.7 Å²	42.7	11%	0.109	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	71.6	171.5	-168.4	0	0	0	0	110.3	L282 L288 Y394	L282-V285 HydrophobicContact CB-CG2 4.15Å; L282-V285 HydrophobicContact CD1-CG2 4.44Å; V285-L288 HydrophobicContact CG1-CB 4.45Å; V285-L288 HydrophobicContact CG1-CD1 3.5Å; V285-L288 HydrophobicContact CG1-CG 3.71Å; V285-Y394 PolarHBondContact N-O 3.36Å
286	N	49.6	Very low	61.2	Low	51 Å²	51	43.9 Å²	43.9	27%	0.273	24%	0.237	S	C	.	.			trans	-75.8	-32.1	-173	-130.1	-45.3	0	0	0	113.8	C284 Y394 K396	C284-N286 VanDerWaalsContact C-N 3.33Å; C284-N286 PolarHBondContact O-N 3.4Å; C284-N286 VanDerWaalsContact O-N 3.12Å; C284-N286 PolarHBondContact SG-ND2 2.74Å; N286-Y394 HydrophobicContact CB-CE1 4.35Å; N286-K396 PolarHBondContact O-NZ 2.86Å; N286-K396 WeakPolarHBondContact OD1-CE 3.3Å; N286-K396 PolarHBondContact OD1-NZ 3.11Å
287	D	50.3	Low	58.5	Low	33 Å²	33	51.2 Å²	51.2	18%	0.176	28%	0.275	C	S	.	.			trans	-122.3	13.2	-152.4	-78.9	0.5	0	0	0	116.2	N254 K289 Q290 S291	N254-D287 PolarHBondContact ND2-OD2 2.97Å; N254-D287 WeakPolarHBondContact OD1-CB 3.42Å; N254-D287 PolarHBondContact OD1-OD2 3.41Å; D287-K289 PolarHBondContact O-N 3.02Å; D287-Q290 HydrophobicContact CB-CB 4.05Å; D287-Q290 HydrophobicContact CB-CG 4.43Å; D287-Q290 PolarHBondContact O-N 3.33Å; D287-Q290 PolarHBondContact OD1-NE2 3.18Å; D287-S291 PolarHBondContact O-N 2.95Å; D287-S291 PolarHBondContact O-OG 2.79Å
288	L	49.7	Very low	55.5	Low	5 Å²	5	54.3 Å²	54.3	3%	0.026	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-17	175	-86.3	176.8	0	0	0	114.3	V255 V285 S291 L375 P399	V255-L288 HydrophobicContact CG2-CD2 4.31Å; V285-L288 HydrophobicContact CG1-CB 4.45Å; V285-L288 HydrophobicContact CG1-CD1 3.5Å; V285-L288 HydrophobicContact CG1-CG 3.71Å; L288-S291 VanDerWaalsContact C-OG 3.32Å; L288-S291 PolarHBondContact O-OG 3.37Å; L288-L375 HydrophobicContact CD2-CD2 3.93Å; L288-P399 HydrophobicContact CB-CB 3.91Å; L288-P399 HydrophobicContact CD1-CB 3.65Å; L288-P399 HydrophobicContact CG-CB 4.42Å
289	K	44.4	Very low	52.5	Low	93 Å²	93	62.3 Å²	62.3	40%	0.404	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.8	-33.3	167	-77.9	-170.3	165.9	-176.9	0	113.9	D287 S291 I292 D398	D287-K289 PolarHBondContact O-N 3.02Å; K289-S291 PolarHBondContact O-N 2.94Å; K289-I292 WeakPolarHBondContact O-CB 3.33Å; K289-I292 PolarHBondContact O-N 3.19Å; K289-I292 VanDerWaalsContact O-N 3.14Å; K289-D398 HydrophobicContact CD-CB 4.49Å; K289-D398 WeakPolarHBondContact CE-OD2 3.44Å; K289-D398 IonicContact NZ-OD2 3.3Å; K289-D398 PolarHBondContact NZ-OD2 2.86Å
290	Q	43.4	Very low	49.6	Very low	115 Å²	115	69.7 Å²	69.7	54%	0.537	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-64.6	-29.4	176.9	-64.2	-154.2	65.4	0	0	111.9	D287 I292 V293	D287-Q290 HydrophobicContact CB-CB 4.05Å; D287-Q290 HydrophobicContact CB-CG 4.43Å; D287-Q290 PolarHBondContact O-N 3.33Å; D287-Q290 PolarHBondContact OD1-NE2 3.18Å; Q290-I292 PolarHBondContact O-N 2.93Å; Q290-V293 PolarHBondContact O-N 3.3Å
291	S	41.3	Very low	46.7	Very low	20 Å²	20	80.2 Å²	80.2	14%	0.14	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-58.2	-17	173.3	40.3	0	0	0	0	115.5	Q256 D287 L288 K289	Q256-S291 PolarHBondContact NE2-O 3.16Å; D287-S291 PolarHBondContact O-N 2.95Å; D287-S291 PolarHBondContact O-OG 2.79Å; L288-S291 VanDerWaalsContact C-OG 3.32Å; L288-S291 PolarHBondContact O-OG 3.37Å; K289-S291 PolarHBondContact O-N 2.94Å
292	I	44.5	Very low	44	Very low	33 Å²	33	88.6 Å²	88.6	17%	0.169	45%	0.45	C	S	.	.	G	3₁₀ helix	trans	-91	-28.4	-177.4	-52.8	177.4	0	0	0	111.4	K289 Q290 H294 S295 E368	K289-I292 WeakPolarHBondContact O-CB 3.33Å; K289-I292 PolarHBondContact O-N 3.19Å; K289-I292 VanDerWaalsContact O-N 3.14Å; Q290-I292 PolarHBondContact O-N 2.93Å; I292-H294 VanDerWaalsContact C-N 3.3Å; I292-H294 PolarHBondContact O-N 3.3Å; I292-S295 PolarHBondContact O-OG 2.65Å; I292-E368 HydrophobicContact CD1-CB 4.03Å; I292-E368 HydrophobicContact CD1-CG 4.02Å
293	V	40.5	Very low	41.5	Very low	108 Å²	108	93 Å²	93	66%	0.655	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-2.5	-172.3	-170.7	0	0	0	0	113	Q290	Q290-V293 PolarHBondContact O-N 3.3Å
294	H	39.6	Very low	39.6	Very low	146 Å²	146	100.4 Å²	100.4	68%	0.676	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.8	8.1	-179.5	-72.8	-12.9	0	0	0	114.5	I292	I292-H294 VanDerWaalsContact C-N 3.3Å; I292-H294 PolarHBondContact O-N 3.3Å
295	S	36.4	Very low	38.3	Very low	66 Å²	66	104.4 Å²	104.4	46%	0.462	53%	0.533	S	S	.	.	G	3₁₀ helix	trans	-82	-8.8	178.6	39.9	0	0	0	0	116	I292 L297	I292-S295 PolarHBondContact O-OG 2.65Å; S295-L297 PolarHBondContact O-N 3.21Å
296	D	34.8	Very low	37.2	Very low	148 Å²	148	111.2 Å²	111.2	79%	0.791	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-67.3	-2.6	-179.5	-75	-20.3	0	0	0	114.5
297	L	32.4	Very low	36.4	Very low	156 Å²	156	113.5 Å²	113.5	82%	0.817	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-112.8	45.5	-177.8	-78.5	164.9	0	0	0	114.1	S295	S295-L297 PolarHBondContact O-N 3.21Å
298	T	30.1	Very low	35.7	Very low	111 Å²	111	116.9 Å²	116.9	68%	0.681	60%	0.597	S	S	*	*			trans	-167.5	100.3	144	11.5	0	0	0	0	114.6	Q300	T298-Q300 PolarHBondContact O-N 2.86Å
299	N	29.6	Very low	35	Very low	169 Å²	169	121.5 Å²	121.5	90%	0.904	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	54.7	173.6	-82.4	-57.6	0	0	0	113.8
300	Q	32.4	Very low	34.6	Very low	167 Å²	167	123 Å²	123	78%	0.78	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-139.5	6	-173.3	-82.1	-165.8	-14.1	0	0	117.5	T298	T298-Q300 PolarHBondContact O-N 2.86Å
301	R	30	Very low	34.4	Very low	222 Å²	222	124.1 Å²	124.1	84%	0.838	64%	0.64	S	S	*	*			trans	-120.1	7.7	-174.9	-79.9	-175.3	164.7	177.8	-4.2	117.8	S303	R301-S303 PolarHBondContact O-N 2.97Å
302	M	29.1	Very low	34.2	Very low	178 Å²	178	129.8 Å²	129.8	88%	0.877	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	15.4	178.8	-82.7	-82.4	-82.4	0	0	116
303	S	29.1	Very low	33.7	Very low	93 Å²	93	134.7 Å²	134.7	65%	0.65	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110	-5.8	-174.4	54.6	0	0	0	0	115.6	R301	R301-S303 PolarHBondContact O-N 2.97Å
304	F	30.6	Very low	33.4	Very low	159 Å²	159	134.7 Å²	134.7	70%	0.697	69%	0.69	S	S	*	*	S	Bend	trans	-96	-5.2	-174.4	-104.7	-94.7	0	0	0	115.5	Q306	F304-Q306 PolarHBondContact O-N 2.94Å
305	I	32.7	Very low	33.1	Very low	102 Å²	102	135.9 Å²	135.9	52%	0.523	70%	0.696	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.5	-12	-166.7	-67.7	173.4	0	0	0	113.6
306	Q	31.6	Very low	32.9	Very low	160 Å²	160	140.5 Å²	140.5	75%	0.748	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-14.5	179.9	-72.3	-175.2	-48.5	0	0	115.1	F304	F304-Q306 PolarHBondContact O-N 2.94Å
307	N	31.9	Very low	32.7	Very low	100 Å²	100	138.3 Å²	138.3	54%	0.535	71%	0.711	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.7	-33.6	-171.9	-70.6	4.3	0	0	0	113.8	T309 Q310	N307-T309 PolarHBondContact O-N 3.24Å; N307-Q310 PolarHBondContact O-N 3.43Å
308	T	35.1	Very low	32.6	Very low	103 Å²	103	137 Å²	137	63%	0.632	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-21.3	-174.3	31.8	0	0	0	0	114.6
309	T	35.6	Very low	32.6	Very low	103 Å²	103	136.9 Å²	136.9	63%	0.632	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-17.5	170.3	41.8	0	0	0	0	112.8	N307	N307-T309 PolarHBondContact O-N 3.24Å
310	Q	36.8	Very low	32.6	Very low	124 Å²	124	133.6 Å²	133.6	58%	0.579	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.4	-12.2	-175.8	-155.9	167.7	32.7	0	0	113.8	N307 N314	N307-Q310 PolarHBondContact O-N 3.43Å; Q310-N314 PolarHBondContact O-ND2 2.84Å
311	E	37.9	Very low	32.6	Very low	138 Å²	138	135.7 Å²	135.7	65%	0.645	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-17.6	173.8	-72.9	-167	129.6	0	0	114.1
312	L	36.5	Very low	32.8	Very low	139 Å²	139	130 Å²	130	73%	0.728	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-30.9	-173.3	-93.3	148.7	0	0	0	114.6
313	D	34.3	Very low	32.9	Very low	136 Å²	136	126.8 Å²	126.8	73%	0.727	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-13.4	-178.9	-73.5	-40.8	0	0	0	114.3
314	N	35	Very low	33.3	Very low	108 Å²	108	130.6 Å²	130.6	58%	0.578	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	13.3	-166.6	-78	-67.3	0	0	0	116	Q310	Q310-N314 PolarHBondContact O-ND2 2.84Å
315	Q	34.2	Very low	33.5	Very low	171 Å²	171	127.8 Å²	127.8	80%	0.799	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.6	8.2	-178.6	-71	-68.2	-19.2	0	0	114.6
316	L	31.4	Very low	33.5	Very low	164 Å²	164	128 Å²	128	86%	0.859	72%	0.718	S	S	*	*	S	Bend	trans	-123.7	19.6	-173.9	-83.8	167.5	0	0	0	115.4
317	S	29.8	Very low	33.4	Very low	101 Å²	101	125.6 Å²	125.6	71%	0.706	72%	0.72	S	S	*	*			trans	-153.5	76	177.7	64.2	0	0	0	0	116.1
318	S	31.7	Very low	33.3	Very low	128 Å²	128	126.3 Å²	126.3	90%	0.895	73%	0.731	S	S	*	*			trans	-168.4	109.4	144.1	40.1	0	0	0	0	112.1
319	S	28.9	Very low	33.1	Very low	109 Å²	109	126.6 Å²	126.6	76%	0.762	74%	0.737	S	S	*	*			trans	-102.8	133.2	175.8	52.2	0	0	0	0	112
320	S	29.2	Very low	33.1	Very low	101 Å²	101	128.1 Å²	128.1	71%	0.706	75%	0.746	S	S	*	*			trans	76.6	155	151.1	-50.4	0	0	0	0	120.5
321	Y	33.1	Very low	32.9	Very low	210 Å²	210	127.9 Å²	127.9	82%	0.824	75%	0.753	S	S	*	*			trans	76.4	88.8	162.3	-67.1	-68.9	0	0	0	121.4
322	S	33.8	Very low	32.7	Very low	104 Å²	104	125.4 Å²	125.4	73%	0.727	75%	0.751	S	S	*	*				50.2	119.5	121.1	62.3	0	0	0	0	120.6
323	S	32.6	Very low	32.7	Very low	109 Å²	109	125.1 Å²	125.1	76%	0.762	76%	0.756	S	S	*	*			trans	-70.8	133.7	168.1	46.6	0	0	0	0	114.6
324	M	36.2	Very low	32.9	Very low	174 Å²	174	123.2 Å²	123.2	86%	0.857	75%	0.753	S	S	*	*			trans	-170.6	154.7	130.6	-98.1	-72.5	110.5	0	0	109.1
325	P	34.5	Very low	33.1	Very low	100 Å²	100	123.2 Å²	123.2	65%	0.649	76%	0.761	S	S	*	*			trans	-115.2	166.1	-152.3	41.9	-36.2	0	0	0	117.5
326	S	33	Very low	33.3	Very low	105 Å²	105	120.3 Å²	120.3	73%	0.734	76%	0.76	S	S	*	*			trans	89.4	139.1	141.1	76.4	0	0	0	0	122.2
327	S	29.5	Very low	33.8	Very low	111 Å²	111	118.5 Å²	118.5	78%	0.776	76%	0.758	S	S	*	*			trans	100	147.8	150.2	79.3	0	0	0	0	120.9
328	C	31.1	Very low	34.2	Very low	115 Å²	115	120 Å²	120	78%	0.777	76%	0.763	S	S	*	*			trans	73.2	76.3	161	-62	0	0	0	0	120.6
329	S	31.1	Very low	34.5	Very low	109 Å²	109	118.9 Å²	118.9	76%	0.762	76%	0.755	S	S	*	*			trans	-8.4	149.7	130.7	56.9	0	0	0	0	120.3
330	V	34.4	Very low	34.9	Very low	135 Å²	135	118.8 Å²	118.8	82%	0.818	76%	0.755	S	S	*	*				-170.6	163.5	115.6	141.2	0	0	0	0	111.7
331	T	32.9	Very low	35.3	Very low	119 Å²	119	119.7 Å²	119.7	73%	0.73	76%	0.761	S	S	*	*			trans	-69.2	-179.7	-174.3	53	0	0	0	0	114
332	S	33.5	Very low	35.3	Very low	86 Å²	86	114.9 Å²	114.9	60%	0.601	76%	0.758	S	S	*	*			cis	-171.8	163.4	34.4	-27.6	0	0	0	0	114.8
333	T	36.4	Very low	35.7	Very low	133 Å²	133	114.9 Å²	114.9	82%	0.816	76%	0.756	S	S	*	*			trans	64.2	149	146.3	49.3	0	0	0	0	121
334	S	37.9	Very low	35.9	Very low	96 Å²	96	118.8 Å²	118.8	67%	0.671	76%	0.761	S	S	*	*			cis	-170.9	169.8	-9.1	47.6	0	0	0	0	113.1
335	S	40.3	Very low	35.8	Very low	108 Å²	108	117.7 Å²	117.7	76%	0.755	76%	0.757	S	S	*	*			trans	67.5	145.5	155.9	51.7	0	0	0	0	120
336	S	38.7	Very low	35.8	Very low	110 Å²	110	118.4 Å²	118.4	77%	0.769	76%	0.762	S	S	*	*			cis	-171.8	144.4	-15.2	47.5	0	0	0	0	112.1
337	P	41.4	Very low	35.7	Very low	125 Å²	125	119.6 Å²	119.6	81%	0.812	76%	0.764	S	S	*	*			trans	-118.6	161.9	177.8	40.8	-31.8	0	0	0	115.8
338	T	38.4	Very low	36	Very low	134 Å²	134	123 Å²	123	82%	0.822	77%	0.768	S	S	*	*			trans	-155.5	128	172.9	18.2	0	0	0	0	115.4
339	S	37.6	Very low	35.9	Very low	104 Å²	104	123.7 Å²	123.7	73%	0.727	77%	0.773	S	S	*	*			trans	27.7	154.4	134.5	61.6	0	0	0	0	123.2
340	S	37.2	Very low	36	Very low	107 Å²	107	129.5 Å²	129.5	75%	0.748	78%	0.778	S	S	*	*			cis	-174.2	156	-13.9	53.5	0	0	0	0	108.4
341	S	37.3	Very low	36.1	Very low	120 Å²	120	129.9 Å²	129.9	84%	0.839	78%	0.775	S	S	*	*				162.7	-177.3	92	51.9	0	0	0	0	110.3
342	S	32.9	Very low	36.2	Very low	109 Å²	109	131.6 Å²	131.6	76%	0.762	78%	0.775	S	S	*	*			trans	-122.2	-162.8	-157	-158.6	0	0	0	0	113.7
343	P	42.1	Very low	36.3	Very low	104 Å²	104	133.6 Å²	133.6	68%	0.675	78%	0.779	S	S	*	*				-121.8	173.8	-93.2	40.2	-26.7	0	0	0	114.8
344	H	37.7	Very low	36.2	Very low	191 Å²	191	133.7 Å²	133.7	88%	0.884	77%	0.77	S	S	*	*			trans	-156.6	148.5	153	-112.4	-78.1	0	0	0	113
345	I	34.5	Very low	36	Very low	151 Å²	151	138.7 Å²	138.7	77%	0.774	77%	0.774	S	S	*	*			trans	-121.6	138.3	173.6	-62	165.8	0	0	0	107.9
346	P	34.3	Very low	35.7	Very low	114 Å²	114	139.5 Å²	139.5	74%	0.74	77%	0.766	S	S	*	*				-142.8	128.2	125.9	33.3	-17.2	0	0	0	115
347	V	31.5	Very low	35.5	Very low	130 Å²	130	140.8 Å²	140.8	79%	0.788	76%	0.76	S	S	*	*			trans	46	99.9	137.2	-169.1	0	0	0	0	119
348	Q	35.9	Very low	35	Very low	182 Å²	182	141.6 Å²	141.6	85%	0.85	75%	0.752	S	S	*	*			trans	-143.2	19.3	142.9	-157.3	145.4	-7.9	0	0	114.7	R350	Q348-R350 PolarHBondContact O-N 3.44Å
349	C	29	Very low	34.8	Very low	131 Å²	131	141.2 Å²	141.2	89%	0.885	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	84.3	178.5	-54.6	0	0	0	0	112.7
350	R	33.3	Very low	34.4	Very low	231 Å²	231	145.2 Å²	145.2	87%	0.872	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-159.8	7.7	162.4	-133.1	178	177.6	160.1	1.3	119.4	Q348	Q348-R350 PolarHBondContact O-N 3.44Å
351	L	35.8	Very low	34	Very low	143 Å²	143	147.6 Å²	147.6	75%	0.749	74%	0.743	S	S	*	*	S	Bend	trans	-130.1	-1.7	-173.4	-93.9	164.9	0	0	0	116.7
352	E	35.3	Very low	33.6	Very low	155 Å²	155	151 Å²	151	72%	0.724	74%	0.738	S	S	*	*	S	Bend	trans	-101.6	-36.8	-176.5	-68.3	172.4	141.9	0	0	112.5	E354 R355 E356	E352-E354 VanDerWaalsContact C-N 3.32Å; E352-E354 PolarHBondContact O-N 2.77Å; E352-R355 WeakPolarHBondContact O-CB 3.44Å; E352-R355 PolarHBondContact O-N 2.74Å; E352-E356 PolarHBondContact O-N 3.09Å
353	N	35.2	Very low	33.7	Very low	128 Å²	128	154.8 Å²	154.8	68%	0.684	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-29.5	-179.3	-70.1	25.6	0	0	0	114.6	R355 Q357	N353-R355 VanDerWaalsContact C-N 3.31Å; N353-Q357 WeakPolarHBondContact O-CG 3.38Å; N353-Q357 PolarHBondContact O-N 3.02Å
354	E	34.1	Very low	33.2	Very low	135 Å²	135	156.7 Å²	156.7	63%	0.631	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-24.2	176.8	-68.2	177	177.4	0	0	111.6	E352 H358	E352-E354 VanDerWaalsContact C-N 3.32Å; E352-E354 PolarHBondContact O-N 2.77Å; E354-H358 PolarHBondContact O-N 2.73Å
355	R	33.3	Very low	33.6	Very low	201 Å²	201	151.1 Å²	151.1	76%	0.758	72%	0.724	S	S	*	*	H	α-helix	trans	-80.9	-33.4	177.2	-148.2	171.3	-170.5	170.3	1.8	112.1	E352 N353 Q357 L359	E352-R355 WeakPolarHBondContact O-CB 3.44Å; E352-R355 PolarHBondContact O-N 2.74Å; N353-R355 VanDerWaalsContact C-N 3.31Å; R355-Q357 VanDerWaalsContact C-N 3.3Å; R355-L359 PolarHBondContact O-N 3.48Å
356	E	34.8	Very low	34.1	Very low	124 Å²	124	151.2 Å²	151.2	58%	0.579	72%	0.716	S	S	*	*	H	α-helix	trans	-75.4	-12.6	171.6	-69.3	-160.1	157.1	0	0	114.5	E352 R360	E352-E356 PolarHBondContact O-N 3.09Å; E356-R360 WeakPolarHBondContact O-CG 3.38Å; E356-R360 PolarHBondContact O-NE 3.34Å
357	Q	34.9	Very low	34.7	Very low	138 Å²	138	147.9 Å²	147.9	65%	0.645	70%	0.702	S	S	*	*	H	α-helix	trans	-87.3	-42.2	173.7	-76	-174.8	-23.6	0	0	112.1	N353 R355 L359 R360	N353-Q357 WeakPolarHBondContact O-CG 3.38Å; N353-Q357 PolarHBondContact O-N 3.02Å; R355-Q357 VanDerWaalsContact C-N 3.3Å; Q357-L359 PolarHBondContact O-N 3.44Å; Q357-R360 PolarHBondContact O-N 2.95Å; Q357-R360 VanDerWaalsContact O-N 3.13Å
358	H	30.9	Very low	36	Very low	141 Å²	141	145.5 Å²	145.5	65%	0.653	68%	0.682	S	S	*	*	H	α-helix	trans	-69.1	-11.9	173	-85.9	-61.6	0	0	0	114.9	E354	E354-H358 PolarHBondContact O-N 2.73Å
359	L	32.5	Very low	37.1	Very low	126 Å²	126	139.4 Å²	139.4	66%	0.66	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-0.6	171.4	-82.3	166.7	0	0	0	114.2	R355 Q357	R355-L359 PolarHBondContact O-N 3.48Å; Q357-L359 PolarHBondContact O-N 3.44Å
360	R	30.4	Very low	38.7	Very low	189 Å²	189	138.1 Å²	138.1	71%	0.713	64%	0.638	S	S	*	*	S	Bend	trans	-94.6	-8	-178.8	-71.7	176.4	-175.4	-122.6	-0.6	115.2	E356 Q357	E356-R360 WeakPolarHBondContact O-CG 3.38Å; E356-R360 PolarHBondContact O-NE 3.34Å; Q357-R360 PolarHBondContact O-N 2.95Å; Q357-R360 VanDerWaalsContact O-N 3.13Å
361	E	29	Very low	40.4	Very low	156 Å²	156	131.3 Å²	131.3	73%	0.729	62%	0.616	S	S	*	*	S	Bend	trans	-92.9	-7	179.5	-65.7	-177.2	130.8	0	0	113.4	H363	E361-H363 PolarHBondContact O-N 3.26Å
362	Y	28.7	Very low	41.9	Very low	191 Å²	191	124.8 Å²	124.8	75%	0.749	58%	0.582	S	S	*	*	S	Bend	trans	-86.5	92.8	168.2	-77.2	-87	0	0	0	110.5	H364	Y362-H364 PolarHBondContact O-N 3.39Å
363	H	33.6	Very low	43.8	Very low	189 Å²	189	119.4 Å²	119.4	88%	0.875	56%	0.555	S	S	*	*			trans	-63	102.3	168.7	-88.3	-87.7	0	0	0	110.5	E361	E361-H363 PolarHBondContact O-N 3.26Å
364	H	32.5	Very low	45.8	Very low	145 Å²	145	118.5 Å²	118.5	67%	0.671	55%	0.547	S	S	*	.			trans	-67.7	136.5	176.5	-103.1	-23.5	0	0	0	111.8	Y362 Y366 G367	Y362-H364 PolarHBondContact O-N 3.39Å; H364-Y366 HydrophobicContact CB-CD2 4.41Å; H364-Y366 PolarHBondContact O-N 3.1Å; H364-Y366 VanDerWaalsContact O-N 3.07Å; H364-G367 PolarHBondContact O-N 2.88Å
365	P	46	Very low	47.8	Very low	74 Å²	74	113.5 Å²	113.5	48%	0.481	52%	0.524	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-13	-176.2	27	-35.4	0	0	0	114.4	G367 E368 Q369	P365-G367 PolarHBondContact O-N 3.4Å; P365-E368 PolarHBondContact O-N 3.05Å; P365-E368 VanDerWaalsContact O-N 3.12Å; P365-Q369 PolarHBondContact O-N 3.23Å
366	Y	45.7	Very low	50.1	Low	153 Å²	153	104 Å²	104	60%	0.6	49%	0.488	S	S	*	.	H	α-helix	trans	-52.3	-26.6	174.1	-79.2	-73.9	0	0	0	114.2	H364 N370	H364-Y366 HydrophobicContact CB-CD2 4.41Å; H364-Y366 PolarHBondContact O-N 3.1Å; H364-Y366 VanDerWaalsContact O-N 3.07Å; Y366-N370 PolarHBondContact O-N 3.47Å; Y366-N370 PolarHBondContact O-ND2 3.15Å
367	G	46.5	Very low	52.3	Low	43 Å²	43	99.9 Å²	99.9	44%	0.443	47%	0.474	S	S	.	.	H	α-helix	trans	-65.5	-51.5	175.1	0	0	0	0	0	112.7	H364 P365 Q371	H364-G367 PolarHBondContact O-N 2.88Å; P365-G367 PolarHBondContact O-N 3.4Å; G367-Q371 WeakPolarHBondContact O-CG 3.39Å; G367-Q371 PolarHBondContact O-N 3Å
368	E	57.7	Low	54.5	Low	80 Å²	80	96.3 Å²	96.3	37%	0.374	46%	0.462	S	S	.	.	H	α-helix	trans	-69.1	-43.1	-177.5	-59.4	-170	167.9	0	0	111.8	I292 P365 N370 Q371 I372	I292-E368 HydrophobicContact CD1-CB 4.03Å; I292-E368 HydrophobicContact CD1-CG 4.02Å; P365-E368 PolarHBondContact O-N 3.05Å; P365-E368 VanDerWaalsContact O-N 3.12Å; E368-N370 VanDerWaalsContact C-N 3.32Å; E368-N370 PolarHBondContact O-N 2.86Å; E368-Q371 PolarHBondContact O-N 2.87Å; E368-Q371 VanDerWaalsContact O-N 3.12Å; E368-I372 WeakPolarHBondContact O-CG1 3.19Å; E368-I372 PolarHBondContact O-N 2.93Å
369	Q	60.2	Low	56.9	Low	54 Å²	54	91.5 Å²	91.5	25%	0.252	44%	0.439	S	S	.	.	H	α-helix	trans	-56.8	-45.8	178.9	-179.5	172.9	14.5	0	0	111.7	P365 Q371 I372 Y373 Y402	P365-Q369 PolarHBondContact O-N 3.23Å; Q369-Q371 VanDerWaalsContact C-N 3.34Å; Q369-Q371 PolarHBondContact O-N 3.1Å; Q369-I372 PolarHBondContact O-N 3.42Å; Q369-Y373 HydrophobicContact CG-CD2 3.95Å; Q369-Y373 HydrophobicContact CG-CE2 3.94Å; Q369-Y373 WeakPolarHBondContact O-CB 3.29Å; Q369-Y373 VanDerWaalsContact O-CD2 3.29Å; Q369-Y373 WeakPolarHBondContact O-CD2 3.46Å; Q369-Y373 PolarHBondContact O-N 2.96Å; Q369-Y402 HydrophobicContact CB-CD1 4.19Å; Q369-Y402 HydrophobicContact CB-CE1 3.72Å; Q369-Y402 HydrophobicContact CG-CD1 3.68Å; Q369-Y402 HydrophobicContact CG-CE1 3.6Å
370	N	62.3	Low	59.3	Low	104 Å²	104	85.7 Å²	85.7	56%	0.556	41%	0.408	S	S	*	.	H	α-helix	trans	-63.7	-37.6	178.4	-81.8	-59.5	0	0	0	112.4	Y366 E368 Q374	Y366-N370 PolarHBondContact O-N 3.47Å; Y366-N370 PolarHBondContact O-ND2 3.15Å; E368-N370 VanDerWaalsContact C-N 3.32Å; E368-N370 PolarHBondContact O-N 2.86Å; N370-Q374 VanDerWaalsContact O-CB 3.29Å; N370-Q374 WeakPolarHBondContact O-CB 3.41Å; N370-Q374 PolarHBondContact O-N 3.2Å
371	Q	68	Low	61.9	Low	89 Å²	89	76.7 Å²	76.7	42%	0.416	37%	0.374	S	S	.	.	H	α-helix	trans	-68	-42.6	176.2	-68	179.1	17.4	0	0	112.1	G367 E368 Q369 Q374 L375	G367-Q371 WeakPolarHBondContact O-CG 3.39Å; G367-Q371 PolarHBondContact O-N 3Å; E368-Q371 PolarHBondContact O-N 2.87Å; E368-Q371 VanDerWaalsContact O-N 3.12Å; Q369-Q371 VanDerWaalsContact C-N 3.34Å; Q369-Q371 PolarHBondContact O-N 3.1Å; Q371-Q374 PolarHBondContact O-N 2.69Å; Q371-L375 WeakPolarHBondContact O-CB 3.49Å; Q371-L375 PolarHBondContact O-N 2.99Å
372	I	69.1	Low	64.7	Low	5 Å²	5	69.4 Å²	69.4	3%	0.026	34%	0.34	C	S	.	.	H	α-helix	trans	-63.4	-45.7	175.6	-68.2	171.4	0	0	0	110.2	E368 Q369 Q374 L375 L376 Y402	E368-I372 WeakPolarHBondContact O-CG1 3.19Å; E368-I372 PolarHBondContact O-N 2.93Å; Q369-I372 PolarHBondContact O-N 3.42Å; I372-Q374 VanDerWaalsContact C-N 3.35Å; I372-Q374 PolarHBondContact O-N 2.93Å; I372-L375 PolarHBondContact O-N 3.46Å; I372-L376 HydrophobicContact CG2-CD1 3.95Å; I372-L376 HydrophobicContact CG2-CG 4.3Å; I372-L376 WeakPolarHBondContact O-CB 3.44Å; I372-L376 VanDerWaalsContact O-CG 3.3Å; I372-L376 WeakPolarHBondContact O-CG 3.22Å; I372-L376 PolarHBondContact O-N 2.92Å; I372-Y402 HydrophobicContact CD1-CD2 4.17Å
373	Y	74.1	Confident	67.5	Low	43 Å²	43	63.4 Å²	63.4	17%	0.169	33%	0.326	C	S	.	.	H	α-helix	trans	-60.4	-42.4	175.6	-90.4	-127.9	0	0	0	112.2	Q369 S377 Y402 Q405 Y406	Q369-Y373 HydrophobicContact CG-CD2 3.95Å; Q369-Y373 HydrophobicContact CG-CE2 3.94Å; Q369-Y373 WeakPolarHBondContact O-CB 3.29Å; Q369-Y373 VanDerWaalsContact O-CD2 3.29Å; Q369-Y373 WeakPolarHBondContact O-CD2 3.46Å; Q369-Y373 PolarHBondContact O-N 2.96Å; Y373-S377 VanDerWaalsContact O-CB 3.24Å; Y373-S377 WeakPolarHBondContact O-CB 3.26Å; Y373-S377 PolarHBondContact O-N 3.17Å; Y373-S377 PolarHBondContact O-OG 3.26Å; Y373-Y402 HydrophobicContact CE2-CD1 4.36Å; Y373-Q405 WeakPolarHBondContact OH-CB 3.5Å; Y373-Q405 WeakPolarHBondContact OH-CG 3.46Å; Y373-Y406 AromaticContact CD1-CD2 3.7Å; Y373-Y406 HydrophobicContact CD1-CD2 3.7Å; Y373-Y406 HydrophobicContact CD1-CE2 4.3Å; Y373-Y406 AromaticContact CE1-CD2 3.85Å; Y373-Y406 HydrophobicContact CE1-CD2 3.85Å; Y373-Y406 HydrophobicContact CG-CD2 4.08Å; Y373-Y406 PolarHBondContact OH-N 2.89Å
374	Q	76.4	Confident	70.1	Confident	109 Å²	109	55.3 Å²	55.3	51%	0.509	29%	0.292	S	S	.	.	H	α-helix	trans	-64.6	-41	175.7	-169.7	175.2	21.7	0	0	111.5	N370 Q371 I372 S377 T378	N370-Q374 VanDerWaalsContact O-CB 3.29Å; N370-Q374 WeakPolarHBondContact O-CB 3.41Å; N370-Q374 PolarHBondContact O-N 3.2Å; Q371-Q374 PolarHBondContact O-N 2.69Å; I372-Q374 VanDerWaalsContact C-N 3.35Å; I372-Q374 PolarHBondContact O-N 2.93Å; Q374-S377 WeakPolarHBondContact CA-OG 3.11Å; Q374-S377 PolarHBondContact O-OG 3.42Å; Q374-T378 HydrophobicContact CG-CG2 4.29Å; Q374-T378 VanDerWaalsContact O-CB 3.31Å; Q374-T378 WeakPolarHBondContact O-CB 3.46Å; Q374-T378 VanDerWaalsContact O-CG2 3.25Å; Q374-T378 WeakPolarHBondContact O-CG2 3.46Å; Q374-T378 PolarHBondContact O-N 2.51Å; Q374-T378 PolarHBondContact O-OG1 2.98Å
375	L	77.8	Confident	72.9	Confident	29 Å²	29	48.6 Å²	48.6	15%	0.152	26%	0.261	C	S	.	.	H	α-helix	trans	-67.5	-44.1	178.3	-175.8	60	0	0	0	112	V255 Q256 L288 Q371 I372 K379	V255-L375 HydrophobicContact CB-CD1 4.48Å; V255-L375 HydrophobicContact CB-CD2 4.14Å; V255-L375 HydrophobicContact CB-CG 4.18Å; V255-L375 HydrophobicContact CG1-CD1 4.02Å; V255-L375 HydrophobicContact CG1-CD2 4.28Å; V255-L375 HydrophobicContact CG1-CG 3.76Å; Q256-L375 HydrophobicContact CG-CD1 4.49Å; L288-L375 HydrophobicContact CD2-CD2 3.93Å; Q371-L375 WeakPolarHBondContact O-CB 3.49Å; Q371-L375 PolarHBondContact O-N 2.99Å; I372-L375 PolarHBondContact O-N 3.46Å; L375-K379 HydrophobicContact CD1-CD 3.99Å; L375-K379 HydrophobicContact CD1-CG 4.44Å; L375-K379 WeakPolarHBondContact O-CB 3.34Å; L375-K379 PolarHBondContact O-N 2.71Å; L375-K379 VanDerWaalsContact O-N 3.13Å
376	L	80.7	Confident	75	Confident	1 Å²	1	46 Å²	46	1%	0.005	24%	0.244	C	C	.	.	I	π-helix	trans	-59.8	-56.2	174.3	-69.8	174.4	0	0	0	110.8	I372 T378 K379 L380 L381 L403 Y406	I372-L376 HydrophobicContact CG2-CD1 3.95Å; I372-L376 HydrophobicContact CG2-CG 4.3Å; I372-L376 WeakPolarHBondContact O-CB 3.44Å; I372-L376 VanDerWaalsContact O-CG 3.3Å; I372-L376 WeakPolarHBondContact O-CG 3.22Å; I372-L376 PolarHBondContact O-N 2.92Å; L376-T378 VanDerWaalsContact C-N 3.31Å; L376-T378 PolarHBondContact O-N 2.92Å; L376-K379 PolarHBondContact O-N 3.24Å; L376-L380 HydrophobicContact CD2-CB 4.41Å; L376-L380 HydrophobicContact CD2-CD2 3.64Å; L376-L380 PolarHBondContact O-N 3.39Å; L376-L381 PolarHBondContact O-N 3.41Å; L376-L403 HydrophobicContact CD1-CD1 4.29Å; L376-L403 HydrophobicContact CD2-CD1 4.12Å; L376-Y406 HydrophobicContact CB-CD1 4.25Å; L376-Y406 HydrophobicContact CB-CE1 4.43Å; L376-Y406 HydrophobicContact CB-CG 4.43Å; L376-Y406 HydrophobicContact CD1-CD1 4.4Å; L376-Y406 HydrophobicContact CD1-CG 4.11Å
377	S	82.1	Confident	77.2	Confident	39 Å²	39	38.7 Å²	38.7	27%	0.273	22%	0.215	S	C	.	.	I	π-helix	trans	-66.2	-24.7	-175.7	60.3	0	0	0	0	115	Y373 Q374 P382 Y406	Y373-S377 VanDerWaalsContact O-CB 3.24Å; Y373-S377 WeakPolarHBondContact O-CB 3.26Å; Y373-S377 PolarHBondContact O-N 3.17Å; Y373-S377 PolarHBondContact O-OG 3.26Å; Q374-S377 WeakPolarHBondContact CA-OG 3.11Å; Q374-S377 PolarHBondContact O-OG 3.42Å; S377-P382 WeakPolarHBondContact O-CA 3.46Å; S377-Y406 WeakPolarHBondContact CA-OH 3.3Å; S377-Y406 WeakPolarHBondContact CB-OH 3.41Å
378	T	80.2	Confident	79.3	Confident	63 Å²	63	37.8 Å²	37.8	39%	0.387	20%	0.201	S	C	.	.	I	π-helix	trans	-96.1	-22	179.7	59.2	0	0	0	0	114.6	Q374 L376	Q374-T378 HydrophobicContact CG-CG2 4.29Å; Q374-T378 VanDerWaalsContact O-CB 3.31Å; Q374-T378 WeakPolarHBondContact O-CB 3.46Å; Q374-T378 VanDerWaalsContact O-CG2 3.25Å; Q374-T378 WeakPolarHBondContact O-CG2 3.46Å; Q374-T378 PolarHBondContact O-N 2.51Å; Q374-T378 PolarHBondContact O-OG1 2.98Å; L376-T378 VanDerWaalsContact C-N 3.31Å; L376-T378 PolarHBondContact O-N 2.92Å
379	K	81.7	Confident	81	Confident	40 Å²	40	34.4 Å²	34.4	17%	0.174	19%	0.186	C	C	.	.	I	π-helix	trans	-126	-32.4	-173.3	-71.9	-162.7	169.3	-128.4	0	116.6	Y226 V255 Q256 L258 I260 L375 L376	Y226-K379 VanDerWaalsContact CE1-O 3.23Å; Y226-K379 WeakPolarHBondContact CE1-O 3.32Å; Y226-K379 PolarHBondContact OH-O 3.45Å; V255-K379 HydrophobicContact CG1-CB 4.12Å; V255-K379 WeakPolarHBondContact O-CD 3.35Å; Q256-K379 PolarHBondContact O-NZ 2.87Å; L258-K379 HydrophobicContact CB-CB 4.48Å; L258-K379 PolarHBondContact O-NZ 2.97Å; I260-K379 HydrophobicContact CG1-CD 4.47Å; I260-K379 HydrophobicContact CG1-CG 3.92Å; L375-K379 HydrophobicContact CD1-CD 3.99Å; L375-K379 HydrophobicContact CD1-CG 4.44Å; L375-K379 WeakPolarHBondContact O-CB 3.34Å; L375-K379 PolarHBondContact O-N 2.71Å; L375-K379 VanDerWaalsContact O-N 3.13Å; L376-K379 PolarHBondContact O-N 3.24Å
380	L	82.3	Confident	82.4	Confident	3 Å²	3	31.8 Å²	31.8	2%	0.016	17%	0.174	C	C	.	.	I	π-helix	trans	-114	-43.6	-168.5	-169.1	69.4	0	0	0	113.4	V251 V255 L258 L280 L282 L376 P382	V251-L380 HydrophobicContact CB-CD1 4.43Å; V251-L380 HydrophobicContact CG1-CD1 3.97Å; V251-L380 HydrophobicContact CG2-CD1 3.8Å; V255-L380 HydrophobicContact CG1-CB 4.04Å; V255-L380 HydrophobicContact CG2-CD2 4.4Å; L258-L380 HydrophobicContact CD1-CD1 3.55Å; L280-L380 HydrophobicContact CD2-CG 4.5Å; L282-L380 HydrophobicContact CD1-CD2 4.18Å; L282-L380 HydrophobicContact CD2-CD1 3.81Å; L282-L380 HydrophobicContact CD2-CD2 3.93Å; L282-L380 HydrophobicContact CD2-CG 4.19Å; L376-L380 HydrophobicContact CD2-CB 4.41Å; L376-L380 HydrophobicContact CD2-CD2 3.64Å; L376-L380 PolarHBondContact O-N 3.39Å; L380-P382 VanDerWaalsContact C-CD 3.45Å
381	L	85.6	Confident	83.7	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.156	C	C	.	.			trans	-133.2	60.8	-172.4	-69.9	175.4	0	0	0	110.2	L280 L376 S383 L385 L387 L403 Y406 L407 F411	L280-L381 HydrophobicContact CD2-CD2 3.47Å; L280-L381 VanDerWaalsContact CD2-CD2 3.47Å; L280-L381 HydrophobicContact CD2-CG 4.3Å; L376-L381 PolarHBondContact O-N 3.41Å; L381-S383 PolarHBondContact O-N 2.92Å; L381-L385 HydrophobicContact CD2-CD2 4.13Å; L381-L387 HydrophobicContact CD2-CD2 3.94Å; L381-L403 HydrophobicContact CD1-CD1 3.71Å; L381-Y406 HydrophobicContact CB-CD1 4.15Å; L381-Y406 HydrophobicContact CB-CE1 3.65Å; L381-Y406 HydrophobicContact CD1-CD1 3.93Å; L381-Y406 HydrophobicContact CD1-CE1 4.3Å; L381-Y406 WeakPolarHBondContact O-CE1 3.39Å; L381-Y406 PolarHBondContact O-OH 2.84Å; L381-L407 HydrophobicContact CD1-CD2 3.83Å; L381-L407 HydrophobicContact CD1-CG 4.38Å; L381-L407 HydrophobicContact CD2-CD2 4.41Å; L381-F411 HydrophobicContact CB-CE2 3.94Å; L381-F411 HydrophobicContact CB-CZ 4.16Å; L381-F411 HydrophobicContact CD1-CE2 4.5Å; L381-F411 HydrophobicContact CD2-CE2 4.1Å; L381-F411 HydrophobicContact CD2-CZ 4.42Å; L381-F411 HydrophobicContact CG-CE2 4.42Å
382	P	88.3	Confident	84.4	Confident	3 Å²	3	24.8 Å²	24.8	2%	0.019	14%	0.136	C	C	.	.			trans	-60.3	136.6	175	25.6	-31.9	0	0	0	110.4	N263 S377 L380 A384 L385	N263-P382 WeakPolarHBondContact OD1-CB 3.35Å; S377-P382 WeakPolarHBondContact O-CA 3.46Å; L380-P382 VanDerWaalsContact C-CD 3.45Å; P382-A384 PolarHBondContact O-N 3.06Å; P382-L385 HydrophobicContact CG-CB 4.27Å; P382-L385 WeakPolarHBondContact O-CB 3.41Å; P382-L385 PolarHBondContact O-N 2.99Å
383	S	86.9	Confident	84.5	Confident	65 Å²	65	26 Å²	26	46%	0.455	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-6.5	-168.5	56.5	0	0	0	0	116.4	N263 L381	N263-S383 PolarHBondContact ND2-OG 3.46Å; N263-S383 PolarHBondContact OD1-N 3.36Å; N263-S383 VanDerWaalsContact OD1-N 3.14Å; L381-S383 PolarHBondContact O-N 2.92Å
384	A	89	Confident	84.1	Confident	19 Å²	19	25.1 Å²	25.1	16%	0.157	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-0.4	169.5	0	0	0	0	0	114.1	N263 W266 R267 P382 P386	N263-A384 HydrophobicContact CB-CB 4.01Å; N263-A384 WeakPolarHBondContact O-CB 3.42Å; N263-A384 VanDerWaalsContact OD1-CB 3.32Å; N263-A384 WeakPolarHBondContact OD1-CB 3.27Å; N263-A384 PolarHBondContact OD1-N 2.92Å; W266-A384 HydrophobicContact CB-CB 3.85Å; W266-A384 WeakPolarHBondContact CB-O 3.31Å; R267-A384 HydrophobicContact CG-CB 3.65Å; P382-A384 PolarHBondContact O-N 3.06Å; A384-P386 WeakPolarHBondContact O-CD 3.17Å
385	L	89.7	Confident	83.2	Confident	5 Å²	5	20 Å²	20	3%	0.026	11%	0.113	C	C	.	.			trans	-62.5	123.5	174.8	-172	73.5	0	0	0	109.5	W266 V278 L381 P382 L387 F411	W266-L385 HydrophobicContact CD2-CD1 3.76Å; W266-L385 HydrophobicContact CE3-CD1 3.81Å; W266-L385 HydrophobicContact CH2-CD1 3.5Å; W266-L385 HydrophobicContact CZ2-CD1 3.43Å; W266-L385 VanDerWaalsContact CZ2-CD1 3.43Å; W266-L385 HydrophobicContact CZ3-CD1 3.69Å; V278-L385 HydrophobicContact CB-CD1 4.25Å; V278-L385 HydrophobicContact CB-CG 4.32Å; V278-L385 HydrophobicContact CG1-CD1 4.17Å; V278-L385 HydrophobicContact CG1-CD2 4.41Å; V278-L385 HydrophobicContact CG1-CG 4.38Å; V278-L385 HydrophobicContact CG2-CD1 3.83Å; V278-L385 HydrophobicContact CG2-CG 4.32Å; L381-L385 HydrophobicContact CD2-CD2 4.13Å; P382-L385 HydrophobicContact CG-CB 4.27Å; P382-L385 WeakPolarHBondContact O-CB 3.41Å; P382-L385 PolarHBondContact O-N 2.99Å; L385-L387 HydrophobicContact CD2-CB 4.21Å; L385-L387 HydrophobicContact CD2-CD1 4.3Å; L385-L387 HydrophobicContact CG-CB 4.4Å; L385-L387 PolarHBondContact O-N 3.28Å; L385-F411 HydrophobicContact CB-CE1 4.14Å; L385-F411 HydrophobicContact CB-CZ 4.4Å; L385-F411 VanDerWaalsContact O-CE1 3.31Å; L385-F411 WeakPolarHBondContact O-CE1 3.36Å
386	P	90.3	Very high	82.3	Confident	18 Å²	18	22.3 Å²	22.3	12%	0.117	12%	0.122	C	C	.	.			trans	-79.2	65.5	176.8	30.9	-31.4	0	0	0	110.4	F276 C277 V278 A384 N388	F276-P386 HydrophobicContact CD1-CG 3.72Å; F276-P386 HydrophobicContact CE1-CG 4.03Å; F276-P386 WeakPolarHBondContact O-CB 3.34Å; F276-P386 WeakPolarHBondContact O-CG 3.41Å; C277-P386 WeakPolarHBondContact CA-O 3.27Å; V278-P386 HydrophobicContact CG2-CG 4.18Å; V278-P386 PolarHBondContact N-O 3.15Å; A384-P386 WeakPolarHBondContact O-CD 3.17Å; P386-N388 PolarHBondContact O-N 2.69Å
387	L	92	Very high	81.2	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	116.1	-179	-174.4	74	0	0	0	110.4	V278 L280 L381 L385 S389 L407 F411 S414 L415	V278-L387 HydrophobicContact CG1-CD1 4.47Å; L280-L387 HydrophobicContact CB-CD1 3.75Å; L381-L387 HydrophobicContact CD2-CD2 3.94Å; L385-L387 HydrophobicContact CD2-CB 4.21Å; L385-L387 HydrophobicContact CD2-CD1 4.3Å; L385-L387 HydrophobicContact CG-CB 4.4Å; L385-L387 PolarHBondContact O-N 3.28Å; L387-S389 WeakPolarHBondContact CD1-O 2.95Å; L387-L407 HydrophobicContact CD2-CD2 3.74Å; L387-F411 HydrophobicContact CB-CD1 3.84Å; L387-F411 HydrophobicContact CB-CE1 4.09Å; L387-F411 HydrophobicContact CB-CG 4.21Å; L387-F411 HydrophobicContact CD2-CB 4.45Å; L387-F411 HydrophobicContact CD2-CD1 4.4Å; L387-F411 HydrophobicContact CD2-CD2 3.9Å; L387-F411 HydrophobicContact CD2-CE2 4.25Å; L387-F411 HydrophobicContact CD2-CG 3.98Å; L387-S414 CarbonylContact O-C 3.59Å; L387-S414 WeakPolarHBondContact O-CB 3.42Å; L387-S414 PolarHBondContact O-OG 3.18Å; L387-L415 HydrophobicContact CD2-CD1 4.36Å; L387-L415 HydrophobicContact CG-CD1 4.49Å
388	N	91.7	Very high	80.2	Confident	25 Å²	25	25.1 Å²	25.1	13%	0.134	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	-33.7	173.1	170.6	-81.9	0	0	0	112.3	C277 V278 P386 S414 E416 H417	C277-N388 HydrophobicContact CB-CB 3.97Å; V278-N388 PolarHBondContact O-N 3.23Å; V278-N388 VanDerWaalsContact O-N 3.12Å; P386-N388 PolarHBondContact O-N 2.69Å; N388-S414 WeakPolarHBondContact CA-O 3.27Å; N388-E416 VanDerWaalsContact ND2-CB 3.31Å; N388-E416 WeakPolarHBondContact ND2-CB 3.09Å; N388-E416 PolarHBondContact ND2-OE2 3.43Å; N388-E416 PolarHBondContact O-N 3.34Å; N388-H417 PolarHBondContact O-N 2.8Å; N388-H417 VanDerWaalsContact O-N 3.09Å; N388-H417 PolarHBondContact OD1-CE1 2.8Å; N388-H417 PolarHBondContact OD1-ND1 2.72Å
389	S	92.6	Very high	79.5	Confident	8 Å²	8	22.5 Å²	22.5	6%	0.056	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	133.9	-174.7	-55.3	0	0	0	0	111.2	V278 T279 L280 L387 H417	V278-S389 PolarHBondContact O-N 3.16Å; T279-S389 WeakPolarHBondContact CA-O 3.48Å; L280-S389 PolarHBondContact N-O 2.98Å; L387-S389 WeakPolarHBondContact CD1-O 2.95Å; S389-H417 WeakPolarHBondContact CA-O 3.44Å; S389-H417 PolarHBondContact OG-ND1 3.32Å
390	I	90.8	Very high	79.2	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	135.4	167.8	-162.9	169.8	0	0	0	111.5	L280 L282 I392 L407 L415 H417 F418 Y419	L280-I390 HydrophobicContact CB-CG1 4.32Å; L280-I390 HydrophobicContact CD2-CD1 4.32Å; L280-I390 WeakPolarHBondContact O-CA 3.48Å; L282-I390 HydrophobicContact CD1-CD1 3.98Å; L282-I390 HydrophobicContact CG-CD1 4.38Å; I390-I392 HydrophobicContact CD1-CD1 4.34Å; I390-I392 HydrophobicContact CD1-CG1 4.19Å; I390-I392 HydrophobicContact CG1-CG1 4.05Å; I390-L407 HydrophobicContact CD1-CD1 3.98Å; I390-L407 HydrophobicContact CD1-CD2 3.97Å; I390-L407 HydrophobicContact CG2-CD1 4.32Å; I390-L415 HydrophobicContact CB-CD1 4.48Å; I390-L415 HydrophobicContact CG2-CD1 4.06Å; I390-H417 PolarHBondContact N-O 3.42Å; I390-F418 HydrophobicContact CG2-CD2 3.57Å; I390-F418 HydrophobicContact CG2-CE2 4.12Å; I390-F418 HydrophobicContact CG2-CG 4.4Å; I390-Y419 PolarHBondContact O-N 2.86Å
391	Y	88.6	Confident	78.7	Confident	45 Å²	45	22 Å²	22	18%	0.176	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	121.1	173.8	-64.4	-109.7	0	0	0	108.1	T279 L280 F281 L282 Y393 Y419	T279-Y391 HydrophobicContact CG2-CD2 3.78Å; T279-Y391 HydrophobicContact CG2-CE2 3.58Å; L280-Y391 PolarHBondContact O-N 2.9Å; F281-Y391 HydrophobicContact CD1-CD1 4.35Å; F281-Y391 AromaticContact CD1-CD2 3.86Å; F281-Y391 HydrophobicContact CD1-CD2 3.86Å; F281-Y391 AromaticContact CD1-CG 3.71Å; F281-Y391 HydrophobicContact CD1-CG 3.71Å; F281-Y391 AromaticContact CE1-CD1 3.92Å; F281-Y391 HydrophobicContact CE1-CD1 3.92Å; F281-Y391 AromaticContact CE1-CD2 3.42Å; F281-Y391 HydrophobicContact CE1-CD2 3.42Å; F281-Y391 VanDerWaalsContact CE1-CD2 3.42Å; F281-Y391 HydrophobicContact CE1-CE1 4.23Å; F281-Y391 AromaticContact CE1-CE2 3.77Å; F281-Y391 HydrophobicContact CE1-CE2 3.77Å; F281-Y391 AromaticContact CE1-CG 3.52Å; F281-Y391 HydrophobicContact CE1-CG 3.52Å; F281-Y391 AromaticContact CZ-CD2 3.95Å; F281-Y391 HydrophobicContact CZ-CD2 3.95Å; F281-Y391 AromaticContact CZ-CE2 3.99Å; F281-Y391 HydrophobicContact CZ-CE2 3.99Å; F281-Y391 HydrophobicContact CZ-CG 4.47Å; L282-Y391 PolarHBondContact N-O 3.01Å; Y391-Y393 HydrophobicContact CD1-CE2 4.32Å; Y391-Y393 HydrophobicContact CG-CE2 4.4Å; Y391-Y419 CarbonylContact C-O 3.58Å; Y391-Y419 WeakPolarHBondContact CA-O 3.01Å; Y391-Y419 HydrophobicContact CD1-CD1 4.28Å; Y391-Y419 AromaticContact CD1-CD2 3.43Å; Y391-Y419 HydrophobicContact CD1-CD2 3.43Å; Y391-Y419 VanDerWaalsContact CD1-CD2 3.43Å; Y391-Y419 HydrophobicContact CD1-CE2 4.1Å; Y391-Y419 AromaticContact CD1-CG 3.54Å; Y391-Y419 HydrophobicContact CD1-CG 3.54Å; Y391-Y419 AromaticContact CD2-CD2 3.97Å; Y391-Y419 HydrophobicContact CD2-CD2 3.97Å; Y391-Y419 HydrophobicContact CD2-CE2 4.42Å; Y391-Y419 AromaticContact CE1-CD1 3.95Å; Y391-Y419 HydrophobicContact CE1-CD1 3.95Å; Y391-Y419 AromaticContact CE1-CD2 3.22Å; Y391-Y419 HydrophobicContact CE1-CD2 3.22Å; Y391-Y419 HydrophobicContact CE1-CE1 4.14Å; Y391-Y419 AromaticContact CE1-CE2 3.4Å; Y391-Y419 HydrophobicContact CE1-CE2 3.4Å; Y391-Y419 VanDerWaalsContact CE1-CE2 3.4Å; Y391-Y419 AromaticContact CE1-CG 3.53Å; Y391-Y419 HydrophobicContact CE1-CG 3.53Å; Y391-Y419 AromaticContact CE1-CZ 3.9Å; Y391-Y419 AromaticContact CE2-CD2 3.78Å; Y391-Y419 HydrophobicContact CE2-CD2 3.78Å; Y391-Y419 AromaticContact CE2-CE2 3.77Å; Y391-Y419 HydrophobicContact CE2-CE2 3.77Å; Y391-Y419 AromaticContact CG-CD2 3.79Å; Y391-Y419 HydrophobicContact CG-CD2 3.79Å; Y391-Y419 HydrophobicContact CG-CG 4.21Å; Y391-Y419 AromaticContact CZ-CD2 3.4Å; Y391-Y419 VanDerWaalsContact CZ-CD2 3.4Å; Y391-Y419 AromaticContact CZ-CE2 3.2Å; Y391-Y419 AromaticContact CZ-CZ 3.88Å; Y391-Y419 VanDerWaalsContact OH-CE2 3.27Å; Y391-Y419 WeakPolarHBondContact OH-CE2 3.47Å
392	I	82.5	Confident	78.1	Confident	1 Å²	1	24.3 Å²	24.3	1%	0.005	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	110.8	-176.8	-52.3	172.9	0	0	0	107.7	L282 I390 C395 L400 L403 F418 Y419 L420 I421	L282-I392 HydrophobicContact CD1-CG1 4.44Å; I390-I392 HydrophobicContact CD1-CD1 4.34Å; I390-I392 HydrophobicContact CD1-CG1 4.19Å; I390-I392 HydrophobicContact CG1-CG1 4.05Å; I392-C395 HydrophobicContact CG2-CB 3.99Å; I392-L400 HydrophobicContact CD1-CD1 4.37Å; I392-L403 HydrophobicContact CD1-CD2 3.82Å; I392-F418 HydrophobicContact CD1-CE2 3.88Å; I392-F418 HydrophobicContact CD1-CZ 4.03Å; I392-Y419 PolarHBondContact N-O 2.87Å; I392-L420 HydrophobicContact CB-CD1 3.78Å; I392-L420 HydrophobicContact CG2-CD1 3.68Å; I392-L420 WeakPolarHBondContact O-CA 3.41Å; I392-I421 PolarHBondContact O-N 3.09Å
393	Y	72.1	Confident	77.8	Confident	30 Å²	30	24.3 Å²	24.3	12%	0.118	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	118.6	176.7	-61.2	-92.2	0	0	0	109	F281 L282 I283 C284 Y391 I421 I801	F281-Y393 HydrophobicContact CD1-CE2 4.24Å; L282-Y393 PolarHBondContact O-N 2.83Å; I283-Y393 HydrophobicContact CG1-CD2 4.1Å; C284-Y393 WeakPolarHBondContact CA-O 3.32Å; C284-Y393 PolarHBondContact N-O 3.31Å; Y391-Y393 HydrophobicContact CD1-CE2 4.32Å; Y391-Y393 HydrophobicContact CG-CE2 4.4Å; Y393-I421 WeakPolarHBondContact CA-O 3.47Å; Y393-I421 HydrophobicContact CD1-CB 4.01Å; Y393-I421 HydrophobicContact CD1-CD1 4.36Å; Y393-I421 HydrophobicContact CD1-CG2 4.49Å; Y393-I421 HydrophobicContact CE1-CB 4.36Å; Y393-I421 HydrophobicContact CE1-CD1 3.83Å; Y393-I421 HydrophobicContact CE1-CG1 4.41Å; Y393-I801 HydrophobicContact CD1-CD1 3.47Å; Y393-I801 VanDerWaalsContact CD1-CD1 3.47Å; Y393-I801 HydrophobicContact CD1-CG1 3.7Å; Y393-I801 HydrophobicContact CD2-CD1 3.53Å; Y393-I801 HydrophobicContact CD2-CG1 4.1Å; Y393-I801 HydrophobicContact CD2-CG2 4.17Å; Y393-I801 HydrophobicContact CE1-CD1 3.9Å; Y393-I801 HydrophobicContact CE1-CG1 3.59Å; Y393-I801 HydrophobicContact CE1-CG2 4.46Å; Y393-I801 HydrophobicContact CE2-CB 4.44Å; Y393-I801 HydrophobicContact CE2-CD1 3.94Å; Y393-I801 HydrophobicContact CE2-CG1 3.99Å; Y393-I801 HydrophobicContact CE2-CG2 3.55Å; Y393-I801 HydrophobicContact CG-CD1 3.25Å; Y393-I801 HydrophobicContact CG-CG1 3.94Å
394	Y	65	Low	77.6	Confident	25 Å²	25	21.2 Å²	21.2	10%	0.098	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	54.8	108.2	-169	-176.7	-98.9	0	0	0	114.7	C284 V285 N286 K396 I421 F424	C284-Y394 HydrophobicContact CB-CD1 4.03Å; C284-Y394 VanDerWaalsContact SG-CD1 3.52Å; V285-Y394 PolarHBondContact N-O 3.36Å; N286-Y394 HydrophobicContact CB-CE1 4.35Å; Y394-K396 VanDerWaalsContact OH-CE 3.23Å; Y394-K396 WeakPolarHBondContact OH-CE 3.41Å; Y394-I421 PolarHBondContact N-O 2.94Å; Y394-F424 HydrophobicContact CD2-CB 4.49Å; Y394-F424 HydrophobicContact CD2-CD1 4.35Å; Y394-F424 AromaticContact CD2-CD2 3.23Å; Y394-F424 HydrophobicContact CD2-CD2 3.23Å; Y394-F424 HydrophobicContact CD2-CE1 4.39Å; Y394-F424 AromaticContact CD2-CE2 3.3Å; Y394-F424 HydrophobicContact CD2-CE2 3.3Å; Y394-F424 AromaticContact CD2-CG 3.8Å; Y394-F424 HydrophobicContact CD2-CG 3.8Å; Y394-F424 AromaticContact CD2-CZ 3.89Å; Y394-F424 HydrophobicContact CD2-CZ 3.89Å; Y394-F424 HydrophobicContact CE2-CB 4.21Å; Y394-F424 AromaticContact CE2-CD1 3.59Å; Y394-F424 HydrophobicContact CE2-CD1 3.59Å; Y394-F424 AromaticContact CE2-CD2 3.35Å; Y394-F424 HydrophobicContact CE2-CD2 3.35Å; Y394-F424 AromaticContact CE2-CE1 3.61Å; Y394-F424 HydrophobicContact CE2-CE1 3.61Å; Y394-F424 AromaticContact CE2-CE2 3.4Å; Y394-F424 HydrophobicContact CE2-CE2 3.4Å; Y394-F424 AromaticContact CE2-CG 3.44Å; Y394-F424 HydrophobicContact CE2-CG 3.44Å; Y394-F424 VanDerWaalsContact CE2-CG 3.44Å; Y394-F424 AromaticContact CE2-CZ 3.51Å; Y394-F424 HydrophobicContact CE2-CZ 3.51Å; Y394-F424 HydrophobicContact CG-CD2 4.31Å; Y394-F424 HydrophobicContact CG-CE2 4.05Å; Y394-F424 AromaticContact CZ-CZ 3.93Å
395	C	57	Low	77.3	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.007	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	137	165.2	-158.3	0	0	0	0	107.9	I392 L400 Y720	I392-C395 HydrophobicContact CG2-CB 3.99Å; C395-L400 HydrophobicContact CB-CB 4.42Å; C395-L400 HydrophobicContact CB-CD1 4.32Å; C395-Y720 PolarHBondContact O-OH 3.47Å
396	K	60.1	Low	77.2	Confident	78 Å²	78	23.9 Å²	23.9	34%	0.339	12%	0.118	S	C	.	.			trans	-66.9	150.5	166.5	-69.1	171	-172.2	156.6	0	108.5	N286 Y394 D398 P399 L400	N286-K396 PolarHBondContact O-NZ 2.86Å; N286-K396 WeakPolarHBondContact OD1-CE 3.3Å; N286-K396 PolarHBondContact OD1-NZ 3.11Å; Y394-K396 VanDerWaalsContact OH-CE 3.23Å; Y394-K396 WeakPolarHBondContact OH-CE 3.41Å; K396-D398 VanDerWaalsContact C-N 3.34Å; K396-D398 PolarHBondContact O-N 3.08Å; K396-P399 HydrophobicContact CB-CG 4.12Å; K396-P399 WeakPolarHBondContact O-CD 3.4Å; K396-P399 VanDerWaalsContact O-CG 3.29Å; K396-P399 WeakPolarHBondContact O-CG 3.46Å; K396-L400 PolarHBondContact O-N 3.41Å
397	P	56.9	Low	77	Confident	41 Å²	41	23 Å²	23	27%	0.266	11%	0.112	S	C	.	.	H	α-helix	trans	-59.5	-41.5	-176.8	20.6	-31.8	0	0	0	113	L400 P688 L690	P397-L400 WeakPolarHBondContact O-CB 3.43Å; P397-L400 PolarHBondContact O-N 3.37Å; P397-P688 HydrophobicContact CB-CB 4.1Å; P397-P688 HydrophobicContact CG-CB 4.08Å; P397-L690 HydrophobicContact CB-CD2 3.78Å; P397-L690 VanDerWaalsContact O-CD2 3.29Å; P397-L690 WeakPolarHBondContact O-CD2 3.16Å
398	D	60.3	Low	76.8	Confident	58 Å²	58	23.2 Å²	23.2	31%	0.31	11%	0.113	S	C	.	.	H	α-helix	trans	-54.6	-51.7	-177.9	-55.9	-11.5	0	0	0	114.8	K289 K396 L400 S401 Y402	K289-D398 HydrophobicContact CD-CB 4.49Å; K289-D398 WeakPolarHBondContact CE-OD2 3.44Å; K289-D398 IonicContact NZ-OD2 3.3Å; K289-D398 PolarHBondContact NZ-OD2 2.86Å; K396-D398 VanDerWaalsContact C-N 3.34Å; K396-D398 PolarHBondContact O-N 3.08Å; D398-L400 VanDerWaalsContact C-N 3.3Å; D398-L400 PolarHBondContact O-N 2.65Å; D398-S401 PolarHBondContact O-OG 3Å; D398-Y402 VanDerWaalsContact O-CD2 3.26Å; D398-Y402 WeakPolarHBondContact O-CD2 3.38Å
399	P	66.5	Low	76.5	Confident	8 Å²	8	26 Å²	26	5%	0.052	13%	0.128	C	C	.	.	H	α-helix	trans	-71.8	-19.2	175.1	25.1	-34.5	0	0	0	114.5	L288 K396 L403	L288-P399 HydrophobicContact CB-CB 3.91Å; L288-P399 HydrophobicContact CD1-CB 3.65Å; L288-P399 HydrophobicContact CG-CB 4.42Å; K396-P399 HydrophobicContact CB-CG 4.12Å; K396-P399 WeakPolarHBondContact O-CD 3.4Å; K396-P399 VanDerWaalsContact O-CG 3.29Å; K396-P399 WeakPolarHBondContact O-CG 3.46Å; P399-L403 WeakPolarHBondContact O-CB 3.16Å; P399-L403 PolarHBondContact O-N 3.12Å
400	L	74.4	Confident	76.3	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-68.6	-41.4	-174.1	179.8	64.9	0	0	0	112.3	I392 C395 K396 P397 D398 L403 I404 L420 L690 Y720	I392-L400 HydrophobicContact CD1-CD1 4.37Å; C395-L400 HydrophobicContact CB-CB 4.42Å; C395-L400 HydrophobicContact CB-CD1 4.32Å; K396-L400 PolarHBondContact O-N 3.41Å; P397-L400 WeakPolarHBondContact O-CB 3.43Å; P397-L400 PolarHBondContact O-N 3.37Å; D398-L400 VanDerWaalsContact C-N 3.3Å; D398-L400 PolarHBondContact O-N 2.65Å; L400-L403 PolarHBondContact O-N 2.97Å; L400-I404 HydrophobicContact CD1-CD1 3.88Å; L400-I404 HydrophobicContact CD1-CG1 4.04Å; L400-I404 HydrophobicContact CD2-CD1 4.29Å; L400-I404 HydrophobicContact CG-CD1 3.76Å; L400-I404 HydrophobicContact CG-CG1 4.31Å; L400-I404 WeakPolarHBondContact O-CG1 3.47Å; L400-I404 PolarHBondContact O-N 2.77Å; L400-L420 HydrophobicContact CD1-CD1 4.18Å; L400-L420 HydrophobicContact CD1-CD2 3.98Å; L400-L420 HydrophobicContact CD2-CD1 4.49Å; L400-L420 HydrophobicContact CD2-CD2 3.52Å; L400-L420 HydrophobicContact CG-CD2 4.35Å; L400-L690 HydrophobicContact CD2-CD1 4.19Å; L400-Y720 HydrophobicContact CD2-CE1 3.85Å; L400-Y720 HydrophobicContact CD2-CE2 4.21Å
401	S	71.6	Confident	76.3	Confident	33 Å²	33	27.9 Å²	27.9	23%	0.231	14%	0.139	C	C	.	.	H	α-helix	trans	-60.6	-46.8	178	55.8	0	0	0	0	111.7	D398 L403 I404 Q405	D398-S401 PolarHBondContact O-OG 3Å; S401-L403 VanDerWaalsContact C-N 3.33Å; S401-L403 PolarHBondContact O-N 3.49Å; S401-I404 PolarHBondContact O-N 3.43Å; S401-Q405 WeakPolarHBondContact O-CB 3.14Å; S401-Q405 PolarHBondContact O-N 3.17Å
402	Y	74.8	Confident	76.3	Confident	48 Å²	48	26.5 Å²	26.5	19%	0.188	14%	0.137	C	C	.	.	H	α-helix	trans	-62.3	-37.5	175.3	-61.8	-62.2	0	0	0	112.7	Q369 I372 Y373 D398 Y406	Q369-Y402 HydrophobicContact CB-CD1 4.19Å; Q369-Y402 HydrophobicContact CB-CE1 3.72Å; Q369-Y402 HydrophobicContact CG-CD1 3.68Å; Q369-Y402 HydrophobicContact CG-CE1 3.6Å; I372-Y402 HydrophobicContact CD1-CD2 4.17Å; Y373-Y402 HydrophobicContact CE2-CD1 4.36Å; D398-Y402 VanDerWaalsContact O-CD2 3.26Å; D398-Y402 WeakPolarHBondContact O-CD2 3.38Å; Y402-Y406 VanDerWaalsContact O-CB 3.28Å; Y402-Y406 WeakPolarHBondContact O-CB 3.02Å; Y402-Y406 PolarHBondContact O-N 2.93Å
403	L	81.2	Confident	76.6	Confident	3 Å²	3	33.1 Å²	33.1	2%	0.016	17%	0.169	C	C	.	.	H	α-helix	trans	-67.2	-46.1	175.8	178.3	60.1	0	0	0	111.7	L282 L376 L381 I392 P399 L400 S401 Y406 L407	L282-L403 HydrophobicContact CD1-CD2 3.89Å; L376-L403 HydrophobicContact CD1-CD1 4.29Å; L376-L403 HydrophobicContact CD2-CD1 4.12Å; L381-L403 HydrophobicContact CD1-CD1 3.71Å; I392-L403 HydrophobicContact CD1-CD2 3.82Å; P399-L403 WeakPolarHBondContact O-CB 3.16Å; P399-L403 PolarHBondContact O-N 3.12Å; L400-L403 PolarHBondContact O-N 2.97Å; S401-L403 VanDerWaalsContact C-N 3.33Å; S401-L403 PolarHBondContact O-N 3.49Å; L403-Y406 PolarHBondContact O-N 3.4Å; L403-L407 HydrophobicContact CD1-CD1 4.28Å; L403-L407 HydrophobicContact CD1-CG 4.38Å; L403-L407 HydrophobicContact CG-CD1 4.13Å; L403-L407 WeakPolarHBondContact O-CB 3.19Å; L403-L407 VanDerWaalsContact O-CG 3.22Å; L403-L407 WeakPolarHBondContact O-CG 3.2Å; L403-L407 PolarHBondContact O-N 3.19Å
404	I	83.4	Confident	77.5	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63.8	-44.5	177.6	-66.3	169.7	0	0	0	110.5	L400 S401 Y406 L407 M408 F418 P701 F702 L705	L400-I404 HydrophobicContact CD1-CD1 3.88Å; L400-I404 HydrophobicContact CD1-CG1 4.04Å; L400-I404 HydrophobicContact CD2-CD1 4.29Å; L400-I404 HydrophobicContact CG-CD1 3.76Å; L400-I404 HydrophobicContact CG-CG1 4.31Å; L400-I404 WeakPolarHBondContact O-CG1 3.47Å; L400-I404 PolarHBondContact O-N 2.77Å; S401-I404 PolarHBondContact O-N 3.43Å; I404-Y406 PolarHBondContact O-N 2.76Å; I404-L407 WeakPolarHBondContact O-CB 3.43Å; I404-L407 PolarHBondContact O-N 3.09Å; I404-M408 HydrophobicContact CG2-CE 4.21Å; I404-M408 HydrophobicContact CG2-CG 4.48Å; I404-M408 WeakPolarHBondContact O-CG 3.25Å; I404-M408 PolarHBondContact O-N 2.94Å; I404-F418 HydrophobicContact CD1-CZ 4.36Å; I404-F418 HydrophobicContact CG1-CE2 4.43Å; I404-F418 HydrophobicContact CG1-CZ 4.23Å; I404-P701 HydrophobicContact CG2-CB 4.07Å; I404-F702 HydrophobicContact CD1-CD1 4.14Å; I404-F702 HydrophobicContact CD1-CE1 3.55Å; I404-F702 HydrophobicContact CD1-CZ 4.03Å; I404-L705 HydrophobicContact CG2-CD1 4.35Å
405	Q	82.9	Confident	78.8	Confident	63 Å²	63	32.3 Å²	32.3	29%	0.294	17%	0.172	S	C	.	.	H	α-helix	trans	-62.5	-43.2	176.3	-173.4	61.4	52.5	0	0	111.5	Y373 S401 L407 M408 D409	Y373-Q405 WeakPolarHBondContact OH-CB 3.5Å; Y373-Q405 WeakPolarHBondContact OH-CG 3.46Å; S401-Q405 WeakPolarHBondContact O-CB 3.14Å; S401-Q405 PolarHBondContact O-N 3.17Å; Q405-L407 VanDerWaalsContact C-N 3.33Å; Q405-L407 PolarHBondContact O-N 3.37Å; Q405-M408 HydrophobicContact CB-CE 4.39Å; Q405-M408 PolarHBondContact O-N 3.13Å; Q405-D409 WeakPolarHBondContact CG-OD2 3.45Å; Q405-D409 VanDerWaalsContact NE2-CG 3.27Å; Q405-D409 PolarHBondContact NE2-OD1 3.36Å; Q405-D409 VanDerWaalsContact NE2-OD1 3.09Å; Q405-D409 PolarHBondContact NE2-OD2 3Å; Q405-D409 PolarHBondContact O-N 3.47Å; Q405-D409 VanDerWaalsContact O-OD2 3.14Å
406	Y	85.9	Confident	80.6	Confident	16 Å²	16	34.5 Å²	34.5	6%	0.063	18%	0.182	C	C	.	.	H	α-helix	trans	-60.7	-40.1	174.1	-171.6	-94.8	0	0	0	112.9	Y373 L376 S377 L381 Y402 L403 I404 D409 T410 F411	Y373-Y406 AromaticContact CD1-CD2 3.7Å; Y373-Y406 HydrophobicContact CD1-CD2 3.7Å; Y373-Y406 HydrophobicContact CD1-CE2 4.3Å; Y373-Y406 AromaticContact CE1-CD2 3.85Å; Y373-Y406 HydrophobicContact CE1-CD2 3.85Å; Y373-Y406 HydrophobicContact CG-CD2 4.08Å; Y373-Y406 PolarHBondContact OH-N 2.89Å; L376-Y406 HydrophobicContact CB-CD1 4.25Å; L376-Y406 HydrophobicContact CB-CE1 4.43Å; L376-Y406 HydrophobicContact CB-CG 4.43Å; L376-Y406 HydrophobicContact CD1-CD1 4.4Å; L376-Y406 HydrophobicContact CD1-CG 4.11Å; S377-Y406 WeakPolarHBondContact CA-OH 3.3Å; S377-Y406 WeakPolarHBondContact CB-OH 3.41Å; L381-Y406 HydrophobicContact CB-CD1 4.15Å; L381-Y406 HydrophobicContact CB-CE1 3.65Å; L381-Y406 HydrophobicContact CD1-CD1 3.93Å; L381-Y406 HydrophobicContact CD1-CE1 4.3Å; L381-Y406 WeakPolarHBondContact O-CE1 3.39Å; L381-Y406 PolarHBondContact O-OH 2.84Å; Y402-Y406 VanDerWaalsContact O-CB 3.28Å; Y402-Y406 WeakPolarHBondContact O-CB 3.02Å; Y402-Y406 PolarHBondContact O-N 2.93Å; L403-Y406 PolarHBondContact O-N 3.4Å; I404-Y406 PolarHBondContact O-N 2.76Å; Y406-D409 PolarHBondContact O-N 3.43Å; Y406-T410 HydrophobicContact CE1-CG2 4.23Å; Y406-T410 WeakPolarHBondContact CE1-OG1 3.33Å; Y406-T410 VanDerWaalsContact O-CB 3.23Å; Y406-T410 WeakPolarHBondContact O-CB 3.37Å; Y406-T410 PolarHBondContact O-N 3.49Å; Y406-T410 PolarHBondContact O-OG1 2.85Å; Y406-T410 PolarHBondContact OH-OG1 2.88Å; Y406-F411 HydrophobicContact CE1-CE2 4.12Å
407	L	87.6	Confident	82.1	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64	-41.8	175	-70.8	164.5	0	0	0	111.8	L381 L387 I390 L403 I404 Q405 T410 F411 F418	L381-L407 HydrophobicContact CD1-CD2 3.83Å; L381-L407 HydrophobicContact CD1-CG 4.38Å; L381-L407 HydrophobicContact CD2-CD2 4.41Å; L387-L407 HydrophobicContact CD2-CD2 3.74Å; I390-L407 HydrophobicContact CD1-CD1 3.98Å; I390-L407 HydrophobicContact CD1-CD2 3.97Å; I390-L407 HydrophobicContact CG2-CD1 4.32Å; L403-L407 HydrophobicContact CD1-CD1 4.28Å; L403-L407 HydrophobicContact CD1-CG 4.38Å; L403-L407 HydrophobicContact CG-CD1 4.13Å; L403-L407 WeakPolarHBondContact O-CB 3.19Å; L403-L407 VanDerWaalsContact O-CG 3.22Å; L403-L407 WeakPolarHBondContact O-CG 3.2Å; L403-L407 PolarHBondContact O-N 3.19Å; I404-L407 WeakPolarHBondContact O-CB 3.43Å; I404-L407 PolarHBondContact O-N 3.09Å; Q405-L407 VanDerWaalsContact C-N 3.33Å; Q405-L407 PolarHBondContact O-N 3.37Å; L407-T410 PolarHBondContact O-N 2.86Å; L407-F411 HydrophobicContact CD2-CD2 3.91Å; L407-F411 HydrophobicContact CD2-CE2 4.4Å; L407-F411 WeakPolarHBondContact O-CA 3.49Å; L407-F411 PolarHBondContact O-N 3.04Å; L407-F418 HydrophobicContact CD1-CE2 4.21Å
408	M	87.1	Confident	83.8	Confident	5 Å²	5	30.3 Å²	30.3	3%	0.025	16%	0.16	C	C	.	.	H	α-helix	trans	-67.5	-35.2	175.9	-73.3	-167.6	-62.7	0	0	113.6	I404 Q405 A412 M704 L705	I404-M408 HydrophobicContact CG2-CE 4.21Å; I404-M408 HydrophobicContact CG2-CG 4.48Å; I404-M408 WeakPolarHBondContact O-CG 3.25Å; I404-M408 PolarHBondContact O-N 2.94Å; Q405-M408 HydrophobicContact CB-CE 4.39Å; Q405-M408 PolarHBondContact O-N 3.13Å; M408-A412 WeakPolarHBondContact O-CB 3.48Å; M408-M704 HydrophobicContact CE-CB 3.9Å; M408-M704 HydrophobicContact SD-CB 3.48Å; M408-M704 WeakPolarHBondContact SD-CB 3.27Å; M408-L705 HydrophobicContact CG-CD1 3.88Å; M408-L705 HydrophobicContact SD-CB 4.39Å; M408-L705 PolarHBondContact SD-N 3.03Å
409	D	86.3	Confident	85.2	Confident	84 Å²	84	29.2 Å²	29.2	45%	0.449	15%	0.151	S	C	.	.	H	α-helix	trans	-78.6	-22.9	178.6	-68.7	-39.1	0	0	0	112.4	Q405 Y406 R708	Q405-D409 WeakPolarHBondContact CG-OD2 3.45Å; Q405-D409 VanDerWaalsContact NE2-CG 3.27Å; Q405-D409 PolarHBondContact NE2-OD1 3.36Å; Q405-D409 VanDerWaalsContact NE2-OD1 3.09Å; Q405-D409 PolarHBondContact NE2-OD2 3Å; Q405-D409 PolarHBondContact O-N 3.47Å; Q405-D409 VanDerWaalsContact O-OD2 3.14Å; Y406-D409 PolarHBondContact O-N 3.43Å; D409-R708 IonicContact OD1-CZ 2.73Å; D409-R708 IonicContact OD1-NH1 2.69Å; D409-R708 PolarHBondContact OD1-NH1 3.08Å; D409-R708 IonicContact OD1-NH2 3.17Å
410	T	88.3	Confident	86.2	Confident	40 Å²	40	28.8 Å²	28.8	25%	0.245	15%	0.149	C	C	.	.	H	α-helix	trans	-111.9	-36.8	-170.9	-46.2	0	0	0	0	114.5	Y406 L407	Y406-T410 HydrophobicContact CE1-CG2 4.23Å; Y406-T410 WeakPolarHBondContact CE1-OG1 3.33Å; Y406-T410 VanDerWaalsContact O-CB 3.23Å; Y406-T410 WeakPolarHBondContact O-CB 3.37Å; Y406-T410 PolarHBondContact O-N 3.49Å; Y406-T410 PolarHBondContact O-OG1 2.85Å; Y406-T410 PolarHBondContact OH-OG1 2.88Å; L407-T410 PolarHBondContact O-N 2.86Å
411	F	90.3	Very high	86.4	Confident	6 Å²	6	29.6 Å²	29.6	3%	0.026	15%	0.153	C	C	.	.	S	Bend	trans	-125.4	14.9	-169.9	-52.6	-76.4	0	0	0	114.4	L381 L385 L387 Y406 L407 M413 S414 L415	L381-F411 HydrophobicContact CB-CE2 3.94Å; L381-F411 HydrophobicContact CB-CZ 4.16Å; L381-F411 HydrophobicContact CD1-CE2 4.5Å; L381-F411 HydrophobicContact CD2-CE2 4.1Å; L381-F411 HydrophobicContact CD2-CZ 4.42Å; L381-F411 HydrophobicContact CG-CE2 4.42Å; L385-F411 HydrophobicContact CB-CE1 4.14Å; L385-F411 HydrophobicContact CB-CZ 4.4Å; L385-F411 VanDerWaalsContact O-CE1 3.31Å; L385-F411 WeakPolarHBondContact O-CE1 3.36Å; L387-F411 HydrophobicContact CB-CD1 3.84Å; L387-F411 HydrophobicContact CB-CE1 4.09Å; L387-F411 HydrophobicContact CB-CG 4.21Å; L387-F411 HydrophobicContact CD2-CB 4.45Å; L387-F411 HydrophobicContact CD2-CD1 4.4Å; L387-F411 HydrophobicContact CD2-CD2 3.9Å; L387-F411 HydrophobicContact CD2-CE2 4.25Å; L387-F411 HydrophobicContact CD2-CG 3.98Å; Y406-F411 HydrophobicContact CE1-CE2 4.12Å; L407-F411 HydrophobicContact CD2-CD2 3.91Å; L407-F411 HydrophobicContact CD2-CE2 4.4Å; L407-F411 WeakPolarHBondContact O-CA 3.49Å; L407-F411 PolarHBondContact O-N 3.04Å; F411-M413 PolarHBondContact O-N 3.4Å; F411-S414 PolarHBondContact O-N 3.09Å; F411-S414 PolarHBondContact O-OG 3.07Å; F411-L415 WeakPolarHBondContact O-CB 3.2Å; F411-L415 PolarHBondContact O-N 2.78Å
412	A	88.4	Confident	86.5	Confident	17 Å²	17	28.3 Å²	28.3	14%	0.14	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-29.5	177.8	0	0	0	0	0	114.6	M408 R708 C709 Q710	M408-A412 WeakPolarHBondContact O-CB 3.48Å; A412-R708 HydrophobicContact CB-CB 4.21Å; A412-R708 WeakPolarHBondContact CB-O 3.41Å; A412-C709 VanDerWaalsContact O-CA 3.3Å; A412-C709 WeakPolarHBondContact O-CA 3.26Å; A412-Q710 PolarHBondContact O-N 3.36Å
413	M	88.2	Confident	85.6	Confident	140 Å²	140	26.3 Å²	26.3	69%	0.69	14%	0.136	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89	-6.1	-179.8	-62.1	-54.8	-60	0	0	114.7	F411 Q711	F411-M413 PolarHBondContact O-N 3.4Å; M413-Q711 PolarHBondContact O-NE2 3.3Å; M413-Q711 VanDerWaalsContact O-NE2 3.11Å
414	S	91.6	Very high	84.2	Confident	38 Å²	38	30.4 Å²	30.4	27%	0.266	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-128.8	-19.3	-175.8	67.7	0	0	0	0	115.2	L387 N388 F411 E416	L387-S414 CarbonylContact O-C 3.59Å; L387-S414 WeakPolarHBondContact O-CB 3.42Å; L387-S414 PolarHBondContact O-OG 3.18Å; N388-S414 WeakPolarHBondContact CA-O 3.27Å; F411-S414 PolarHBondContact O-N 3.09Å; F411-S414 PolarHBondContact O-OG 3.07Å; S414-E416 PolarHBondContact O-N 3.03Å
415	L	92.4	Very high	82.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.171	C	C	.	.			trans	-72.9	109.9	-178.1	-170	71.4	0	0	0	111.2	L387 I390 F411 F418 L705 Q711 L712	L387-L415 HydrophobicContact CD2-CD1 4.36Å; L387-L415 HydrophobicContact CG-CD1 4.49Å; I390-L415 HydrophobicContact CB-CD1 4.48Å; I390-L415 HydrophobicContact CG2-CD1 4.06Å; F411-L415 WeakPolarHBondContact O-CB 3.2Å; F411-L415 PolarHBondContact O-N 2.78Å; L415-F418 HydrophobicContact CD2-CD2 4.37Å; L415-L705 HydrophobicContact CD2-CD1 4.14Å; L415-Q711 CarbonylContact O-C 3.33Å; L415-L712 PolarHBondContact O-N 3.25Å
416	E	93.7	Very high	80.4	Confident	46 Å²	46	32.3 Å²	32.3	22%	0.215	17%	0.168	C	C	.	.			trans	-100.6	-30.7	177.9	-178.9	178	-165.4	0	0	112.5	N388 S414 Q711 S713 H714 K739	N388-E416 VanDerWaalsContact ND2-CB 3.31Å; N388-E416 WeakPolarHBondContact ND2-CB 3.09Å; N388-E416 PolarHBondContact ND2-OE2 3.43Å; N388-E416 PolarHBondContact O-N 3.34Å; S414-E416 PolarHBondContact O-N 3.03Å; E416-Q711 WeakPolarHBondContact CA-O 3.41Å; E416-S713 WeakPolarHBondContact CG-OG 3.33Å; E416-S713 PolarHBondContact O-N 2.83Å; E416-S713 PolarHBondContact OE1-OG 3.38Å; E416-S713 VanDerWaalsContact OE1-OG 3.14Å; E416-H714 PolarHBondContact O-N 2.97Å; E416-H714 VanDerWaalsContact O-N 3.11Å; E416-K739 IonicContact OE1-NZ 2.74Å; E416-K739 PolarHBondContact OE1-NZ 3.48Å
417	H	93.5	Very high	78.1	Confident	31 Å²	31	34 Å²	34	14%	0.144	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	127.6	-175.6	-45.9	76.1	0	0	0	112.2	N388 S389 I390 Y419 H714	N388-H417 PolarHBondContact O-N 2.8Å; N388-H417 VanDerWaalsContact O-N 3.09Å; N388-H417 PolarHBondContact OD1-CE1 2.8Å; N388-H417 PolarHBondContact OD1-ND1 2.72Å; S389-H417 WeakPolarHBondContact CA-O 3.44Å; S389-H417 PolarHBondContact OG-ND1 3.32Å; I390-H417 PolarHBondContact N-O 3.42Å; H417-Y419 HydrophobicContact CB-CD2 4.45Å; H417-Y419 HydrophobicContact CB-CE2 3.68Å; H417-H714 WeakPolarHBondContact CA-O 3.41Å; H417-H714 HydrophobicContact CB-CB 4.22Å; H417-H714 AromaticContact CD2-CE1 3.75Å; H417-H714 AromaticContact CD2-CG 3.39Å; H417-H714 AromaticContact CD2-ND1 3.16Å; H417-H714 PolarHBondContact CD2-ND1 2.76Å; H417-H714 AromaticContact NE2-CE1 3.49Å; H417-H714 PolarHBondContact NE2-CE1 3.06Å; H417-H714 AromaticContact NE2-CG 3.96Å; H417-H714 AromaticContact NE2-ND1 3.29Å; H417-H714 PolarHBondContact NE2-ND1 3.36Å
418	F	92.1	Very high	75.2	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	123.2	175	-177.5	-86.1	0	0	0	110.7	I390 I392 I404 L407 L415 L420 F702 L705 L712 H714 F715 T716	I390-F418 HydrophobicContact CG2-CD2 3.57Å; I390-F418 HydrophobicContact CG2-CE2 4.12Å; I390-F418 HydrophobicContact CG2-CG 4.4Å; I392-F418 HydrophobicContact CD1-CE2 3.88Å; I392-F418 HydrophobicContact CD1-CZ 4.03Å; I404-F418 HydrophobicContact CD1-CZ 4.36Å; I404-F418 HydrophobicContact CG1-CE2 4.43Å; I404-F418 HydrophobicContact CG1-CZ 4.23Å; L407-F418 HydrophobicContact CD1-CE2 4.21Å; L415-F418 HydrophobicContact CD2-CD2 4.37Å; F418-L420 HydrophobicContact CE1-CB 3.67Å; F418-L420 HydrophobicContact CE1-CD2 4.43Å; F418-L420 HydrophobicContact CZ-CB 4.13Å; F418-L420 HydrophobicContact CZ-CD2 4.47Å; F418-F702 HydrophobicContact CE1-CD1 4.36Å; F418-F702 HydrophobicContact CE1-CE1 4.06Å; F418-F702 HydrophobicContact CZ-CE1 4.29Å; F418-L705 HydrophobicContact CB-CD2 4.15Å; F418-L705 HydrophobicContact CD1-CD2 4.05Å; F418-L705 HydrophobicContact CD2-CD2 3.89Å; F418-L705 HydrophobicContact CE1-CD2 4.42Å; F418-L705 HydrophobicContact CE2-CD2 4.28Å; F418-L705 HydrophobicContact CG-CD2 3.77Å; F418-L712 HydrophobicContact CB-CD1 3.94Å; F418-H714 PolarHBondContact N-O 2.75Å; F418-F715 HydrophobicContact CB-CD2 4.26Å; F418-F715 AromaticContact CD1-CD2 3.68Å; F418-F715 HydrophobicContact CD1-CD2 3.68Å; F418-F715 AromaticContact CD1-CE2 3.54Å; F418-F715 HydrophobicContact CD1-CE2 3.54Å; F418-F715 HydrophobicContact CE1-CD2 4.49Å; F418-F715 AromaticContact CE1-CE2 3.9Å; F418-F715 HydrophobicContact CE1-CE2 3.9Å; F418-F715 HydrophobicContact CG-CD2 4.34Å; F418-F715 HydrophobicContact CG-CE2 4.46Å; F418-F715 CarbonylContact O-C 3.53Å; F418-F715 WeakPolarHBondContact O-CA 3.28Å; F418-T716 PolarHBondContact O-N 2.81Å
419	Y	89.8	Confident	72.5	Confident	35 Å²	35	41.3 Å²	41.3	14%	0.137	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	127.2	175.1	-53.8	-100.6	0	0	0	109.2	I390 Y391 I392 H417 T716	I390-Y419 PolarHBondContact O-N 2.86Å; Y391-Y419 CarbonylContact C-O 3.58Å; Y391-Y419 WeakPolarHBondContact CA-O 3.01Å; Y391-Y419 HydrophobicContact CD1-CD1 4.28Å; Y391-Y419 AromaticContact CD1-CD2 3.43Å; Y391-Y419 HydrophobicContact CD1-CD2 3.43Å; Y391-Y419 VanDerWaalsContact CD1-CD2 3.43Å; Y391-Y419 HydrophobicContact CD1-CE2 4.1Å; Y391-Y419 AromaticContact CD1-CG 3.54Å; Y391-Y419 HydrophobicContact CD1-CG 3.54Å; Y391-Y419 AromaticContact CD2-CD2 3.97Å; Y391-Y419 HydrophobicContact CD2-CD2 3.97Å; Y391-Y419 HydrophobicContact CD2-CE2 4.42Å; Y391-Y419 AromaticContact CE1-CD1 3.95Å; Y391-Y419 HydrophobicContact CE1-CD1 3.95Å; Y391-Y419 AromaticContact CE1-CD2 3.22Å; Y391-Y419 HydrophobicContact CE1-CD2 3.22Å; Y391-Y419 HydrophobicContact CE1-CE1 4.14Å; Y391-Y419 AromaticContact CE1-CE2 3.4Å; Y391-Y419 HydrophobicContact CE1-CE2 3.4Å; Y391-Y419 VanDerWaalsContact CE1-CE2 3.4Å; Y391-Y419 AromaticContact CE1-CG 3.53Å; Y391-Y419 HydrophobicContact CE1-CG 3.53Å; Y391-Y419 AromaticContact CE1-CZ 3.9Å; Y391-Y419 AromaticContact CE2-CD2 3.78Å; Y391-Y419 HydrophobicContact CE2-CD2 3.78Å; Y391-Y419 AromaticContact CE2-CE2 3.77Å; Y391-Y419 HydrophobicContact CE2-CE2 3.77Å; Y391-Y419 AromaticContact CG-CD2 3.79Å; Y391-Y419 HydrophobicContact CG-CD2 3.79Å; Y391-Y419 HydrophobicContact CG-CG 4.21Å; Y391-Y419 AromaticContact CZ-CD2 3.4Å; Y391-Y419 VanDerWaalsContact CZ-CD2 3.4Å; Y391-Y419 AromaticContact CZ-CE2 3.2Å; Y391-Y419 AromaticContact CZ-CZ 3.88Å; Y391-Y419 VanDerWaalsContact OH-CE2 3.27Å; Y391-Y419 WeakPolarHBondContact OH-CE2 3.47Å; I392-Y419 PolarHBondContact N-O 2.87Å; H417-Y419 HydrophobicContact CB-CD2 4.45Å; H417-Y419 HydrophobicContact CB-CE2 3.68Å; Y419-T716 WeakPolarHBondContact CA-O 3.46Å; Y419-T716 HydrophobicContact CD1-CG2 4.28Å; Y419-T716 VanDerWaalsContact CD1-OG1 3.32Å; Y419-T716 WeakPolarHBondContact CD1-OG1 3.31Å
420	L	86.6	Confident	69.6	Low	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	121.9	173.8	173.4	60.5	0	0	0	109.4	I392 L400 F418 F702 T716 L717 I718 Y720	I392-L420 HydrophobicContact CB-CD1 3.78Å; I392-L420 HydrophobicContact CG2-CD1 3.68Å; I392-L420 WeakPolarHBondContact O-CA 3.41Å; L400-L420 HydrophobicContact CD1-CD1 4.18Å; L400-L420 HydrophobicContact CD1-CD2 3.98Å; L400-L420 HydrophobicContact CD2-CD1 4.49Å; L400-L420 HydrophobicContact CD2-CD2 3.52Å; L400-L420 HydrophobicContact CG-CD2 4.35Å; F418-L420 HydrophobicContact CE1-CB 3.67Å; F418-L420 HydrophobicContact CE1-CD2 4.43Å; F418-L420 HydrophobicContact CZ-CB 4.13Å; F418-L420 HydrophobicContact CZ-CD2 4.47Å; L420-F702 HydrophobicContact CD2-CE1 3.89Å; L420-F702 HydrophobicContact CD2-CZ 3.82Å; L420-T716 PolarHBondContact N-O 2.92Å; L420-L717 HydrophobicContact CB-CD1 3.93Å; L420-L717 HydrophobicContact CD2-CD1 3.55Å; L420-L717 HydrophobicContact CG-CD1 3.85Å; L420-L717 WeakPolarHBondContact O-CA 3.34Å; L420-I718 PolarHBondContact O-N 2.75Å; L420-Y720 HydrophobicContact CD1-CE2 3.85Å; L420-Y720 HydrophobicContact CD2-CD2 3.8Å; L420-Y720 HydrophobicContact CD2-CE2 3.59Å; L420-Y720 HydrophobicContact CG-CD2 3.95Å; L420-Y720 HydrophobicContact CG-CE2 3.64Å
421	I	79.1	Confident	66.6	Low	17 Å²	17	45.7 Å²	45.7	9%	0.087	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	106.1	-180	-57.4	-175.3	0	0	0	108	I392 Y393 Y394 T423 I718 V786	I392-I421 PolarHBondContact O-N 3.09Å; Y393-I421 WeakPolarHBondContact CA-O 3.47Å; Y393-I421 HydrophobicContact CD1-CB 4.01Å; Y393-I421 HydrophobicContact CD1-CD1 4.36Å; Y393-I421 HydrophobicContact CD1-CG2 4.49Å; Y393-I421 HydrophobicContact CE1-CB 4.36Å; Y393-I421 HydrophobicContact CE1-CD1 3.83Å; Y393-I421 HydrophobicContact CE1-CG1 4.41Å; Y394-I421 PolarHBondContact N-O 2.94Å; I421-T423 HydrophobicContact CG2-CG2 4.23Å; I421-I718 WeakPolarHBondContact CA-O 3.27Å; I421-I718 HydrophobicContact CB-CB 4.44Å; I421-I718 HydrophobicContact CD1-CD1 4.01Å; I421-I718 HydrophobicContact CG1-CB 4.14Å; I421-I718 HydrophobicContact CG1-CD1 4.15Å; I421-I718 HydrophobicContact CG1-CG1 4.32Å; I421-I718 HydrophobicContact CG2-CB 4.21Å; I421-I718 HydrophobicContact CG2-CG2 4.31Å; I421-V786 HydrophobicContact CG2-CG2 4.04Å
422	D	72.5	Confident	63.6	Low	6 Å²	6	52 Å²	52	3%	0.032	29%	0.286	C	S	.	.			trans	-90.4	136.2	162	-177.9	28.3	0	0	0	109.8	F424 N425 I718 Y720	D422-F424 PolarHBondContact OD1-N 3.22Å; D422-N425 PolarHBondContact OD2-N 3.08Å; D422-N425 PolarHBondContact OD2-ND2 2.93Å; D422-I718 PolarHBondContact N-O 3.15Å; D422-Y720 HydrophobicContact CB-CD2 4.18Å; D422-Y720 HydrophobicContact CB-CE2 3.55Å
423	T	57.5	Low	60.7	Low	5 Å²	5	58.3 Å²	58.3	3%	0.031	32%	0.318	C	S	.	.	S	Bend	trans	-109.7	-0.6	179.9	52.8	0	0	0	0	112.3	I421 V426 A785 P792	I421-T423 HydrophobicContact CG2-CG2 4.23Å; T423-V426 WeakPolarHBondContact O-CG2 3.48Å; T423-A785 WeakPolarHBondContact CB-O 3.46Å; T423-A785 HydrophobicContact CG2-CB 4.15Å; T423-A785 VanDerWaalsContact CG2-O 3.27Å; T423-A785 WeakPolarHBondContact CG2-O 3.48Å; T423-P792 HydrophobicContact CG2-CG 4.26Å; T423-P792 WeakPolarHBondContact OG1-CG 3.43Å
424	F	51.5	Low	57.8	Low	90 Å²	90	56.1 Å²	56.1	40%	0.395	32%	0.316	S	S	.	.	S	Bend	trans	-96.1	-33.6	-175.1	-79	-127.4	0	0	0	112.4	Y394 D422 V426 P791	Y394-F424 HydrophobicContact CD2-CB 4.49Å; Y394-F424 HydrophobicContact CD2-CD1 4.35Å; Y394-F424 AromaticContact CD2-CD2 3.23Å; Y394-F424 HydrophobicContact CD2-CD2 3.23Å; Y394-F424 HydrophobicContact CD2-CE1 4.39Å; Y394-F424 AromaticContact CD2-CE2 3.3Å; Y394-F424 HydrophobicContact CD2-CE2 3.3Å; Y394-F424 AromaticContact CD2-CG 3.8Å; Y394-F424 HydrophobicContact CD2-CG 3.8Å; Y394-F424 AromaticContact CD2-CZ 3.89Å; Y394-F424 HydrophobicContact CD2-CZ 3.89Å; Y394-F424 HydrophobicContact CE2-CB 4.21Å; Y394-F424 AromaticContact CE2-CD1 3.59Å; Y394-F424 HydrophobicContact CE2-CD1 3.59Å; Y394-F424 AromaticContact CE2-CD2 3.35Å; Y394-F424 HydrophobicContact CE2-CD2 3.35Å; Y394-F424 AromaticContact CE2-CE1 3.61Å; Y394-F424 HydrophobicContact CE2-CE1 3.61Å; Y394-F424 AromaticContact CE2-CE2 3.4Å; Y394-F424 HydrophobicContact CE2-CE2 3.4Å; Y394-F424 AromaticContact CE2-CG 3.44Å; Y394-F424 HydrophobicContact CE2-CG 3.44Å; Y394-F424 VanDerWaalsContact CE2-CG 3.44Å; Y394-F424 AromaticContact CE2-CZ 3.51Å; Y394-F424 HydrophobicContact CE2-CZ 3.51Å; Y394-F424 HydrophobicContact CG-CD2 4.31Å; Y394-F424 HydrophobicContact CG-CE2 4.05Å; Y394-F424 AromaticContact CZ-CZ 3.93Å; D422-F424 PolarHBondContact OD1-N 3.22Å; F424-V426 PolarHBondContact O-N 3.15Å; F424-P791 HydrophobicContact CD1-CB 3.96Å; F424-P791 HydrophobicContact CD2-CB 4.28Å; F424-P791 HydrophobicContact CE1-CB 3.4Å; F424-P791 HydrophobicContact CE1-CG 4.38Å; F424-P791 HydrophobicContact CE2-CB 3.75Å; F424-P791 HydrophobicContact CG-CB 4.39Å; F424-P791 HydrophobicContact CZ-CB 3.29Å
425	N	47.5	Very low	54.8	Low	67 Å²	67	62.2 Å²	62.2	36%	0.358	35%	0.345	S	S	.	.			trans	-79.1	57	168.4	-70.2	-65.9	0	0	0	111.4	D422 I427 G719	D422-N425 PolarHBondContact OD2-N 3.08Å; D422-N425 PolarHBondContact OD2-ND2 2.93Å; N425-I427 PolarHBondContact O-N 2.91Å; N425-G719 WeakPolarHBondContact CB-O 3.37Å
426	V	39.4	Very low	51.7	Low	36 Å²	36	65.3 Å²	65.3	22%	0.218	38%	0.377	C	S	.	.			trans	-64	109.8	167.5	-174	0	0	0	0	107.3	T423 F424 S428 V786	T423-V426 WeakPolarHBondContact O-CG2 3.48Å; F424-V426 PolarHBondContact O-N 3.15Å; V426-S428 PolarHBondContact O-N 2.82Å; V426-S428 VanDerWaalsContact O-N 3.14Å; V426-V786 WeakPolarHBondContact CG2-O 3.48Å
427	I	36.5	Very low	48.6	Very low	51 Å²	51	70.6 Å²	70.6	26%	0.262	41%	0.405	S	S	.	.			trans	-61.6	121.5	-176.3	-64.4	169.5	0	0	0	107.8	N425 V429 C746	N425-I427 PolarHBondContact O-N 2.91Å; I427-V429 HydrophobicContact CB-CG2 4.4Å; I427-V429 HydrophobicContact CG2-CG2 3.77Å; I427-V429 PolarHBondContact O-N 2.86Å; I427-C746 HydrophobicContact CD1-CB 3.62Å; I427-C746 WeakPolarHBondContact CD1-O 3.31Å
428	S	26.8	Very low	45.5	Very low	60 Å²	60	76.2 Å²	76.2	42%	0.42	44%	0.436	S	S	.	.			trans	-72.1	78.5	168.7	-170.2	0	0	0	0	107.9	V426 M430	V426-S428 PolarHBondContact O-N 2.82Å; V426-S428 VanDerWaalsContact O-N 3.14Å; S428-M430 PolarHBondContact O-N 2.83Å
429	V	30.7	Very low	42.4	Very low	99 Å²	99	84 Å²	84	60%	0.6	47%	0.472	S	S	*	.			trans	-67.8	77.8	160.7	-174.7	0	0	0	0	105.9	I427 S431	I427-V429 HydrophobicContact CB-CG2 4.4Å; I427-V429 HydrophobicContact CG2-CG2 3.77Å; I427-V429 PolarHBondContact O-N 2.86Å; V429-S431 PolarHBondContact O-N 2.89Å
430	M	26.2	Very low	39.5	Very low	113 Å²	113	89.9 Å²	89.9	56%	0.557	51%	0.506	S	S	*	.			trans	-54.3	125.5	162.8	-82.3	-167.2	153.1	0	0	107.1	S428 N432 L683	S428-M430 PolarHBondContact O-N 2.83Å; M430-N432 PolarHBondContact O-N 2.87Å; M430-L683 HydrophobicContact CE-CD1 3.44Å; M430-L683 VanDerWaalsContact CE-CD1 3.44Å; M430-L683 HydrophobicContact SD-CD1 3.9Å
431	S	25.5	Very low	36.6	Very low	103 Å²	103	96.5 Å²	96.5	72%	0.72	54%	0.54	S	S	*	.			trans	-58.6	103.2	162.5	38.5	0	0	0	0	107.7	V429 N433	V429-S431 PolarHBondContact O-N 2.89Å; S431-N433 PolarHBondContact O-N 2.69Å
432	N	26.5	Very low	34.2	Very low	139 Å²	139	100.7 Å²	100.7	74%	0.743	57%	0.57	S	S	*	*			trans	-71.6	48	174.5	-89.2	-26.4	0	0	0	111.7	M430 S434	M430-N432 PolarHBondContact O-N 2.87Å; N432-S434 PolarHBondContact O-N 3.14Å
433	N	26.4	Very low	32	Very low	149 Å²	149	107.9 Å²	107.9	80%	0.797	60%	0.603	S	S	*	*			trans	-87	59.2	160.3	-78	-5.6	0	0	0	108.7	S431 N435	S431-N433 PolarHBondContact O-N 2.69Å; N433-N435 PolarHBondContact O-N 2.9Å
434	S	27.7	Very low	30.6	Very low	93 Å²	93	117.3 Å²	117.3	65%	0.65	64%	0.64	S	S	*	*			trans	-74.8	71.2	176.2	40.1	0	0	0	0	111.3	N432	N432-S434 PolarHBondContact O-N 3.14Å
435	N	28.1	Very low	29.7	Very low	166 Å²	166	118.1 Å²	118.1	89%	0.888	65%	0.652	S	S	*	*			trans	-166.7	127.4	159.4	-93.2	-43.8	0	0	0	111.5	N433	N433-N435 PolarHBondContact O-N 2.9Å
436	G	28.1	Very low	28.7	Very low	65 Å²	65	123.6 Å²	123.6	67%	0.67	68%	0.676	S	S	*	*			trans	105.1	71.2	178.5	0	0	0	0	0	113.8
437	I	28.7	Very low	28.2	Very low	157 Å²	157	130.9 Å²	130.9	81%	0.805	70%	0.701	S	S	*	*				78.6	120.3	83.6	-66.4	171.8	0	0	0	113.5
438	L	28.8	Very low	27.8	Very low	149 Å²	149	134.5 Å²	134.5	78%	0.78	73%	0.725	S	S	*	*			trans	68.3	105	176.2	-61.6	164.9	0	0	0	115.8
439	H	27.6	Very low	27.7	Very low	165 Å²	165	137.6 Å²	137.6	76%	0.764	74%	0.742	S	S	*	*				50.3	104.1	80.3	-79.8	-88.7	0	0	0	114.9
440	N	27.8	Very low	27.5	Very low	158 Å²	158	141 Å²	141	85%	0.845	76%	0.755	S	S	*	*				-155.8	164.4	93.5	-138.8	-13.5	0	0	0	113.1
441	I	26.5	Very low	27.5	Very low	139 Å²	139	141 Å²	141	71%	0.713	76%	0.762	S	S	*	*			trans	-120.3	128.3	-175.9	-62.6	163.5	0	0	0	109.7
442	S	28.2	Very low	27.6	Very low	104 Å²	104	142.4 Å²	142.4	73%	0.727	77%	0.766	S	S	*	*			trans	-172.8	135.4	140.3	51.1	0	0	0	0	114.9
443	H	27.1	Very low	27.9	Very low	157 Å²	157	140.3 Å²	140.3	73%	0.727	76%	0.762	S	S	*	*			trans	-6.9	135	154.5	-55.7	-88.4	0	0	0	119.9
444	Y	28.1	Very low	28.3	Very low	203 Å²	203	138.2 Å²	138.2	80%	0.796	76%	0.759	S	S	*	*			trans	-117.7	106	141.5	-99.9	-95.6	0	0	0	110	Y447	Y444-Y447 HydrophobicContact CD1-CD2 4.17Å; Y444-Y447 AromaticContact CD1-CE2 3.78Å; Y444-Y447 HydrophobicContact CD1-CE2 3.78Å; Y444-Y447 HydrophobicContact CE1-CD2 4.22Å; Y444-Y447 AromaticContact CE1-CE2 3.53Å; Y444-Y447 HydrophobicContact CE1-CE2 3.53Å
445	T	30.8	Very low	28.8	Very low	107 Å²	107	139.7 Å²	139.7	66%	0.656	76%	0.76	S	S	*	*			trans	-90.1	174.5	168.7	43.2	0	0	0	0	111.1	Y447	T445-Y447 PolarHBondContact O-N 3.16Å
446	E	26.6	Very low	29.2	Very low	183 Å²	183	137.5 Å²	137.5	86%	0.855	75%	0.748	S	S	*	*			trans	-47.2	128.2	-177.8	-60.7	166.7	116.8	0	0	114	T448	E446-T448 PolarHBondContact O-N 3.28Å
447	Y	29.3	Very low	29.6	Very low	189 Å²	189	140.7 Å²	140.7	74%	0.741	75%	0.749	S	S	*	*			trans	-97.3	82.2	169.6	-97.1	-94.2	0	0	0	111.3	Y444 T445 T449	Y444-Y447 HydrophobicContact CD1-CD2 4.17Å; Y444-Y447 AromaticContact CD1-CE2 3.78Å; Y444-Y447 HydrophobicContact CD1-CE2 3.78Å; Y444-Y447 HydrophobicContact CE1-CD2 4.22Å; Y444-Y447 AromaticContact CE1-CE2 3.53Å; Y444-Y447 HydrophobicContact CE1-CE2 3.53Å; T445-Y447 PolarHBondContact O-N 3.16Å; Y447-T449 PolarHBondContact O-N 3.5Å
448	T	28.8	Very low	30.1	Very low	126 Å²	126	138.2 Å²	138.2	77%	0.773	75%	0.746	S	S	*	*			trans	-70.7	121.6	158.5	-53.7	0	0	0	0	108.2	E446	E446-T448 PolarHBondContact O-N 3.28Å
449	T	23.8	Very low	30.4	Very low	125 Å²	125	135.6 Å²	135.6	77%	0.767	74%	0.741	S	S	*	*			trans	-69.1	132.1	-178.1	45	0	0	0	0	112.9	Y447	Y447-T449 PolarHBondContact O-N 3.5Å
450	I	27.8	Very low	30.8	Very low	171 Å²	171	134.2 Å²	134.2	88%	0.877	74%	0.739	S	S	*	*			trans	-160.7	153.3	139.3	-101.5	149.6	0	0	0	110
451	T	24.5	Very low	31.2	Very low	114 Å²	114	131.7 Å²	131.7	70%	0.699	73%	0.734	S	S	*	*			trans	-83.3	174.8	-157.5	48	0	0	0	0	117.2
452	T	29.5	Very low	31.6	Very low	131 Å²	131	131.6 Å²	131.6	80%	0.804	74%	0.735	S	S	*	*			trans	81.7	145.8	161.9	70.3	0	0	0	0	117.4
453	S	32.5	Very low	31.9	Very low	95 Å²	95	133.4 Å²	133.4	66%	0.664	74%	0.736	S	S	*	*			cis	-173.5	148.9	-21.9	49.6	0	0	0	0	111.3
454	S	35.2	Very low	32.2	Very low	105 Å²	105	132.9 Å²	132.9	73%	0.734	74%	0.739	S	S	*	*			trans	65	154.4	159.1	73	0	0	0	0	117.4
455	N	36.6	Very low	32.4	Very low	125 Å²	125	130.3 Å²	130.3	67%	0.668	74%	0.739	S	S	*	*			cis	-163.9	159.7	-9.8	-121.1	41.9	0	0	0	110.4
456	D	36.9	Very low	32.5	Very low	119 Å²	119	133.7 Å²	133.7	64%	0.636	75%	0.752	S	S	*	*			trans	61.3	153.7	147	-55.6	-26.1	0	0	0	121.4
457	N	37.3	Very low	32.8	Very low	132 Å²	132	127.8 Å²	127.8	71%	0.706	74%	0.741	S	S	*	*			cis	-169.1	177.8	-25.2	-99.5	-31.4	0	0	0	110.7
458	S	37.6	Very low	32.9	Very low	106 Å²	106	126.1 Å²	126.1	74%	0.741	75%	0.745	S	S	*	*			trans	66.3	122.3	169.9	40.2	0	0	0	0	117.2
459	S	35.7	Very low	32.9	Very low	94 Å²	94	126.5 Å²	126.5	66%	0.657	74%	0.741	S	S	*	*			cis	92	148.4	49.2	83.3	0	0	0	0	112.5
460	D	36.1	Very low	33.1	Very low	136 Å²	136	126 Å²	126	73%	0.727	73%	0.733	S	S	*	*			cis	-150.8	154.6	20	-87.1	-72.3	0	0	0	113.8
461	S	36.2	Very low	32.9	Very low	105 Å²	105	127.2 Å²	127.2	73%	0.734	73%	0.726	S	S	*	*			trans	68.3	157.8	148.8	83.5	0	0	0	0	119.3
462	N	35.4	Very low	32.9	Very low	137 Å²	137	129.6 Å²	129.6	73%	0.733	73%	0.727	S	S	*	*			cis	-160.7	166.4	-9.2	-125.3	-14.2	0	0	0	112.6
463	N	34.7	Very low	32.8	Very low	142 Å²	142	128.8 Å²	128.8	76%	0.759	72%	0.716	S	S	*	*			trans	67.8	95	156.1	-66.3	-12.7	0	0	0	121.9
464	N	32.3	Very low	32.5	Very low	146 Å²	146	128 Å²	128	78%	0.781	72%	0.716	S	S	*	*			trans	-28.3	138.3	145.9	-47.9	-19.2	0	0	0	116.8
465	N	32.4	Very low	32.2	Very low	149 Å²	149	130.5 Å²	130.5	80%	0.797	72%	0.721	S	S	*	*				167.1	97	106.3	-88.1	-24.1	0	0	0	111.8
466	N	34.3	Very low	31.7	Very low	177 Å²	177	130.9 Å²	130.9	95%	0.947	73%	0.728	S	S	*	*			trans	-96.9	149.5	164.3	-73	-5.2	0	0	0	110.2
467	G	31.7	Very low	31.3	Very low	60 Å²	60	131.1 Å²	131.1	62%	0.619	74%	0.736	S	S	*	*			cis	152.4	38.9	-2.9	0	0	0	0	0	116.7
468	N	31.9	Very low	31	Very low	154 Å²	154	131.1 Å²	131.1	82%	0.824	74%	0.741	S	S	*	*			trans	65.7	168.4	166.7	-65.2	-11.8	0	0	0	117.8
469	I	27.8	Very low	30.6	Very low	134 Å²	134	132.3 Å²	132.3	69%	0.687	74%	0.744	S	S	*	*				-174.2	142.2	-51	-117.9	168.4	0	0	0	108
470	I	27.7	Very low	30.3	Very low	115 Å²	115	132.7 Å²	132.7	59%	0.59	75%	0.747	S	S	*	*			trans	67.8	118.7	161.4	-75.7	172.6	0	0	0	116.3	F472	I470-F472 HydrophobicContact CG2-CD2 4.03Å; I470-F472 HydrophobicContact CG2-CE2 3.31Å; I470-F472 HydrophobicContact CG2-CZ 3.73Å
471	R	24.3	Very low	30	Very low	196 Å²	196	136 Å²	136	74%	0.74	75%	0.751	S	S	*	*				67.1	153	84.1	-70.5	174.6	176.4	178.1	-1.2	113.3	I473	R471-I473 HydrophobicContact CB-CD1 4.38Å; R471-I473 HydrophobicContact CG-CD1 4.01Å
472	F	25.3	Very low	29.7	Very low	163 Å²	163	138 Å²	138	72%	0.715	75%	0.753	S	S	*	*			cis	-141.2	150.7	40	-69.2	-93.1	0	0	0	110.8	I470	I470-F472 HydrophobicContact CG2-CD2 4.03Å; I470-F472 HydrophobicContact CG2-CE2 3.31Å; I470-F472 HydrophobicContact CG2-CZ 3.73Å
473	I	27.4	Very low	29.4	Very low	114 Å²	114	135.2 Å²	135.2	59%	0.585	75%	0.749	S	S	*	*			cis	79.3	99.6	49.5	-60.2	172.6	0	0	0	114.2	R471	R471-I473 HydrophobicContact CB-CD1 4.38Å; R471-I473 HydrophobicContact CG-CD1 4.01Å
474	A	26	Very low	29.2	Very low	80 Å²	80	134.7 Å²	134.7	66%	0.661	75%	0.751	S	S	*	*			trans	53.4	157	140.2	0	0	0	0	0	122.5
475	N	28.1	Very low	29.1	Very low	157 Å²	157	133 Å²	133	84%	0.84	75%	0.745	S	S	*	*				-174.4	133.8	109.5	-88	-28.8	0	0	0	113.3
476	T	26.5	Very low	29	Very low	132 Å²	132	132.1 Å²	132.1	81%	0.81	74%	0.74	S	S	*	*			trans	-93.3	155.5	148.4	42.9	0	0	0	0	108.9
477	P	27.9	Very low	29	Very low	125 Å²	125	133.2 Å²	133.2	81%	0.812	73%	0.733	S	S	*	*			trans	-92	131.3	-149.8	32.3	-35.5	0	0	0	115.8
478	T	32.9	Very low	29	Very low	131 Å²	131	135.6 Å²	135.6	80%	0.804	73%	0.731	S	S	*	*			trans	-133.9	104.6	156.6	52	0	0	0	0	111.9
479	T	28.3	Very low	29.2	Very low	131 Å²	131	133 Å²	133	80%	0.804	72%	0.718	S	S	*	*			trans	28.9	131.7	145.7	57.3	0	0	0	0	121.4
480	S	29.1	Very low	29.4	Very low	103 Å²	103	136.8 Å²	136.8	72%	0.72	73%	0.725	S	S	*	*			trans	118.1	103.8	131.9	81.4	0	0	0	0	119
481	Y	30.1	Very low	29.7	Very low	206 Å²	206	137.4 Å²	137.4	81%	0.808	73%	0.729	S	S	*	*			trans	60.2	133	137.1	-74.2	-84.7	0	0	0	122.7
482	D	29.3	Very low	30.1	Very low	146 Å²	146	133.4 Å²	133.4	78%	0.781	73%	0.73	S	S	*	*			trans	69.7	137.7	146.2	-60.3	-19.1	0	0	0	120
483	A	30.4	Very low	30.5	Very low	78 Å²	78	131.6 Å²	131.6	65%	0.645	73%	0.732	S	S	*	*			cis	-164.6	153.7	-8.2	0	0	0	0	0	112.8
484	V	29.3	Very low	30.8	Very low	132 Å²	132	132.5 Å²	132.5	80%	0.8	74%	0.738	S	S	*	*			trans	39.8	115.4	134.3	-177.4	0	0	0	0	117.3
485	V	31.2	Very low	31.1	Very low	109 Å²	109	132.6 Å²	132.6	66%	0.661	73%	0.734	S	S	*	*				-158.8	145.5	65.7	174	0	0	0	0	108.3	Y487	V485-Y487 HydrophobicContact CG1-CD2 3.77Å; V485-Y487 HydrophobicContact CG1-CE2 4Å
486	N	29.3	Very low	31.3	Very low	131 Å²	131	131.6 Å²	131.6	70%	0.701	73%	0.729	S	S	*	*			cis	90.7	76.2	11.2	-154.1	111	0	0	0	119.2
487	Y	33.5	Very low	31.6	Very low	201 Å²	201	136.1 Å²	136.1	79%	0.788	73%	0.733	S	S	*	*			trans	-139.6	113.1	154.2	-89.8	-82.7	0	0	0	107.2	V485	V485-Y487 HydrophobicContact CG1-CD2 3.77Å; V485-Y487 HydrophobicContact CG1-CE2 4Å
488	D	33.4	Very low	31.7	Very low	109 Å²	109	137.8 Å²	137.8	58%	0.583	73%	0.729	S	S	*	*				86.8	140.6	80.5	-79.4	25.3	0	0	0	111.5
489	N	34.5	Very low	31.4	Very low	101 Å²	101	136.4 Å²	136.4	54%	0.54	73%	0.725	S	S	.	*			cis	-156.3	-179.4	6.8	-136.4	-45.4	0	0	0	112.4
490	Y	33.9	Very low	31.6	Very low	213 Å²	213	137.7 Å²	137.7	84%	0.835	72%	0.724	S	S	*	*			trans	76.1	134.5	174.7	-55.1	-76.2	0	0	0	117.7
491	D	32.9	Very low	31.8	Very low	127 Å²	127	140.9 Å²	140.9	68%	0.679	73%	0.725	S	S	*	*			cis	164.3	161.5	-37.4	-101.8	-36.9	0	0	0	107.1
492	C	33.1	Very low	31.7	Very low	113 Å²	113	135.5 Å²	135.5	76%	0.764	72%	0.718	S	S	*	*			trans	82.8	113.2	169.3	-64.3	0	0	0	0	116.8
493	V	33.6	Very low	31.6	Very low	125 Å²	125	133.2 Å²	133.2	76%	0.758	71%	0.713	S	S	*	*				80.4	125.4	66.1	163.1	0	0	0	0	110.2
494	D	34.1	Very low	31.7	Very low	132 Å²	132	140.6 Å²	140.6	71%	0.706	73%	0.726	S	S	*	*			cis	-151.8	142.7	10.9	-127.2	-6.1	0	0	0	110.7
495	S	31.1	Very low	31.6	Very low	83 Å²	83	138.8 Å²	138.8	58%	0.58	72%	0.719	S	S	*	*				72.8	136.1	105.7	82.2	0	0	0	0	119.2
496	D	32.1	Very low	31.5	Very low	135 Å²	135	137.8 Å²	137.8	72%	0.722	72%	0.717	S	S	*	*			trans	61.5	127.3	154.9	-62.3	-16.2	0	0	0	119.3
497	Y	33.4	Very low	31.8	Very low	228 Å²	228	140.1 Å²	140.1	89%	0.894	72%	0.723	S	S	*	*				-148.7	150	72.4	-119.9	-93.2	0	0	0	115.5
498	Q	29.8	Very low	31.7	Very low	159 Å²	159	138 Å²	138	74%	0.743	72%	0.72	S	S	*	*			trans	-87.1	146.9	-179.2	-64.8	-176.4	-5	0	0	114.1
499	S	28	Very low	31.5	Very low	103 Å²	103	137 Å²	137	72%	0.72	72%	0.722	S	S	*	*			trans	64.9	140.8	143.9	74.2	0	0	0	0	120.3
500	M	31.6	Very low	31.3	Very low	157 Å²	157	139.5 Å²	139.5	77%	0.773	73%	0.734	S	S	*	*				-163.2	139.4	112.9	-102.4	-172.8	-175.3	0	0	111.6
501	F	32.7	Very low	31.1	Very low	171 Å²	171	136 Å²	136	75%	0.75	73%	0.729	S	S	*	*			trans	25.7	112.6	163.8	-48.6	-65.8	0	0	0	119.8
502	S	28.6	Very low	30.8	Very low	93 Å²	93	137.3 Å²	137.3	65%	0.65	74%	0.736	S	S	*	*			cis	83	116.6	47.4	81.1	0	0	0	0	116.5
503	S	27	Very low	30.7	Very low	97 Å²	97	139.4 Å²	139.4	68%	0.678	74%	0.739	S	S	*	*			trans	52.6	129.8	143.1	63.2	0	0	0	0	121.2
504	Y	33	Very low	30.5	Very low	233 Å²	233	137.5 Å²	137.5	91%	0.914	73%	0.731	S	S	*	*				-153.4	160.8	107.4	-108.8	-72.7	0	0	0	110.7
505	S	26.9	Very low	30.4	Very low	94 Å²	94	137.1 Å²	137.1	66%	0.657	73%	0.734	S	S	*	*			trans	-127.1	169.3	-166.2	64.6	0	0	0	0	114.1
506	S	29.1	Very low	30.2	Very low	88 Å²	88	137.5 Å²	137.5	62%	0.615	74%	0.736	S	S	*	*			trans	59.1	111	147.3	58.8	0	0	0	0	119.4
507	H	35	Very low	30.1	Very low	181 Å²	181	137.4 Å²	137.4	84%	0.838	74%	0.736	S	S	*	*				-175.5	148.9	116.6	-87.4	-66.2	0	0	0	107.4
508	H	32.3	Very low	29.8	Very low	156 Å²	156	135 Å²	135	72%	0.722	73%	0.731	S	S	*	*			cis	176.3	149.5	-21.9	-152.7	-76.2	0	0	0	104
509	S	28.4	Very low	29.7	Very low	89 Å²	89	132.1 Å²	132.1	62%	0.622	72%	0.72	S	S	*	*			trans	74.6	112.2	157.6	-63.3	0	0	0	0	121.8
510	L	30.5	Very low	29.7	Very low	152 Å²	152	133.2 Å²	133.2	80%	0.796	72%	0.717	S	S	*	*				107.5	122.5	122.7	-73.8	167.3	0	0	0	121.7
511	L	29.7	Very low	29.4	Very low	139 Å²	139	133 Å²	133	73%	0.728	72%	0.718	S	S	*	*			trans	84.1	102.8	148.6	-64.6	162.7	0	0	0	119.9
512	L	27.4	Very low	29.2	Very low	156 Å²	156	130 Å²	130	82%	0.817	72%	0.718	S	S	*	*				36.2	117.1	128.4	-52.9	172	0	0	0	116.3
513	D	29.7	Very low	29.1	Very low	157 Å²	157	130.6 Å²	130.6	84%	0.84	72%	0.721	S	S	*	*				-139.9	-168.7	68	-138.1	-45.6	0	0	0	115.5
514	S	30.2	Very low	29.2	Very low	85 Å²	85	134 Å²	134	59%	0.594	73%	0.732	S	S	*	*			trans	-97.1	152.2	-150.9	40.6	0	0	0	0	117.5
515	T	31	Very low	29	Very low	124 Å²	124	128.2 Å²	128.2	76%	0.761	73%	0.726	S	S	*	*			trans	62.2	126.3	158.4	48.4	0	0	0	0	118.5
516	S	27.3	Very low	29.1	Very low	90 Å²	90	129 Å²	129	63%	0.629	73%	0.731	S	S	*	*			cis	61.7	133.4	8.9	110.2	0	0	0	0	114.8
517	D	30.6	Very low	29.3	Very low	134 Å²	134	135.9 Å²	135.9	72%	0.717	75%	0.745	S	S	*	*			cis	-133.6	151.2	21.2	-59.9	-44.2	0	0	0	109.9
518	F	26.9	Very low	29.1	Very low	178 Å²	178	134 Å²	134	78%	0.781	74%	0.741	S	S	*	*				60.3	155.9	75.8	-87.8	-83.8	0	0	0	117.2	I520	F518-I520 HydrophobicContact CD1-CD1 4.48Å
519	D	29	Very low	29.1	Very low	97 Å²	97	133.2 Å²	133.2	52%	0.519	74%	0.741	S	S	.	*			trans	85	115.6	-175.9	-54.5	-21.4	0	0	0	116.8	R2	R2-D519 IonicContact CZ-OD2 3.47Å; R2-D519 IonicContact NH1-OD2 2.71Å; R2-D519 PolarHBondContact NH1-OD2 2.76Å; R2-D519 IonicContact NH2-OD2 2.68Å; R2-D519 PolarHBondContact NH2-OD2 3.33Å
520	I	26.4	Very low	29.2	Very low	126 Å²	126	138.3 Å²	138.3	65%	0.646	75%	0.753	S	S	*	*			cis	85.5	117.8	27.2	-52.2	179.4	0	0	0	115	F518	F518-I520 HydrophobicContact CD1-CD1 4.48Å
521	L	26	Very low	29.3	Very low	152 Å²	152	136.3 Å²	136.3	80%	0.796	74%	0.743	S	S	*	*			trans	60.3	119.7	160.9	-70	168.2	0	0	0	121.7
522	S	27.4	Very low	29.5	Very low	108 Å²	108	140.1 Å²	140.1	76%	0.755	75%	0.749	S	S	*	*			trans	160.4	112.7	139.1	60.2	0	0	0	0	106.6
523	C	26.9	Very low	29.7	Very low	107 Å²	107	140 Å²	140	72%	0.723	74%	0.744	S	S	*	*			cis	49.7	99.3	47.4	-55.7	0	0	0	0	112.2
524	D	29.6	Very low	30	Very low	169 Å²	169	139.3 Å²	139.3	90%	0.904	74%	0.741	S	S	*	*				-161.1	163.8	109.4	-101.4	-18.7	0	0	0	111.9
525	S	28.1	Very low	30.1	Very low	111 Å²	111	142.7 Å²	142.7	78%	0.776	75%	0.745	S	S	*	*			trans	-106.8	152.9	-170.7	55	0	0	0	0	112.9
526	S	30.4	Very low	30.1	Very low	111 Å²	111	141.9 Å²	141.9	78%	0.776	75%	0.745	S	S	*	*			trans	-158.1	80	154.2	56.6	0	0	0	0	111.7
527	Y	31.7	Very low	30.2	Very low	232 Å²	232	144.1 Å²	144.1	91%	0.91	76%	0.758	S	S	*	*			trans	-78.7	104.5	150.7	-91.3	-91.3	0	0	0	107.5
528	D	31.5	Very low	30.1	Very low	141 Å²	141	142.2 Å²	142.2	75%	0.754	76%	0.756	S	S	*	*			trans	-96.4	102.4	165.3	-95.3	-33.8	0	0	0	109.3	F530	D528-F530 HydrophobicContact CB-CE2 4.47Å
529	L	31.6	Very low	30.2	Very low	139 Å²	139	140.2 Å²	140.2	73%	0.728	75%	0.753	S	S	*	*			trans	-87.8	113.9	176	-173.9	81.7	0	0	0	109.5
530	F	31.8	Very low	30.2	Very low	196 Å²	196	142.3 Å²	142.3	86%	0.86	76%	0.764	S	S	*	*			trans	-105.6	91.8	168.9	-80.1	-77.6	0	0	0	110.3	D528	D528-F530 HydrophobicContact CB-CE2 4.47Å
531	D	31.9	Very low	30.2	Very low	111 Å²	111	142.5 Å²	142.5	59%	0.594	77%	0.767	S	S	*	*			trans	-106.2	160.8	171.5	-96.9	-41.3	0	0	0	111.7
532	Y	34.2	Very low	30.2	Very low	218 Å²	218	145 Å²	145	86%	0.855	77%	0.767	S	S	*	*			trans	69.8	148.6	176.3	-63.5	-78.7	0	0	0	117.1
533	E	32.5	Very low	30.2	Very low	153 Å²	153	151.2 Å²	151.2	72%	0.715	78%	0.776	S	S	*	*			cis	-117.1	148.5	8.2	-68.6	-163.5	147.2	0	0	115	K535	E533-K535 IonicContact OE1-NZ 3.92Å; E533-K535 PolarHBondContact OE1-NZ 3Å; E533-K535 IonicContact OE2-NZ 3.74Å; E533-K535 PolarHBondContact OE2-NZ 3.08Å
534	D	34.5	Very low	30.2	Very low	143 Å²	143	149.1 Å²	149.1	77%	0.765	76%	0.762	S	S	*	*			trans	-67.9	138	155.4	-103.1	-50.7	0	0	0	112.2
535	K	33.4	Very low	30.1	Very low	156 Å²	156	145.2 Å²	145.2	68%	0.678	76%	0.762	S	S	*	*			trans	-166.2	104.5	143.5	-97.1	132	-154.4	157.6	0	112.9	E533	E533-K535 IonicContact OE1-NZ 3.92Å; E533-K535 PolarHBondContact OE1-NZ 3Å; E533-K535 IonicContact OE2-NZ 3.74Å; E533-K535 PolarHBondContact OE2-NZ 3.08Å
536	S	29.7	Very low	30.1	Very low	108 Å²	108	145 Å²	145	76%	0.755	75%	0.752	S	S	*	*			trans	9.1	112.5	143.9	60.4	0	0	0	0	118.8
537	C	30.1	Very low	30.1	Very low	136 Å²	136	148.7 Å²	148.7	92%	0.919	75%	0.754	S	S	*	*			trans	-154.9	155.4	134.4	-132.5	0	0	0	0	111.2
538	S	28.3	Very low	29.9	Very low	95 Å²	95	145.1 Å²	145.1	66%	0.664	75%	0.75	S	S	*	*			trans	-85.9	158.7	-170.4	52.5	0	0	0	0	114.5
539	N	28.7	Very low	29.8	Very low	136 Å²	136	144.7 Å²	144.7	73%	0.727	75%	0.747	S	S	*	*			trans	84.7	127.6	165.3	-55.6	-30.3	0	0	0	118.9
540	N	28.4	Very low	29.8	Very low	141 Å²	141	143.8 Å²	143.8	75%	0.754	75%	0.749	S	S	*	*			trans	77.4	127.9	151.5	-57.6	-20.1	0	0	0	120.1
541	N	27.5	Very low	29.4	Very low	129 Å²	129	140.4 Å²	140.4	69%	0.69	75%	0.745	S	S	*	*			trans	77.9	115	144.4	-63.6	-12.4	0	0	0	120.6
542	Y	25.8	Very low	29.4	Very low	204 Å²	204	140.5 Å²	140.5	80%	0.8	75%	0.754	S	S	*	*			trans	40.2	108	135.4	-63.2	-86.6	0	0	0	119.1
543	Y	28	Very low	28.9	Very low	240 Å²	240	136.7 Å²	136.7	94%	0.941	75%	0.753	S	S	*	*			trans	-132.1	112.9	138.8	-102.3	-82.2	0	0	0	110.9
544	S	27.4	Very low	28.8	Very low	63 Å²	63	134.8 Å²	134.8	44%	0.441	76%	0.757	S	S	.	*			trans	-103.5	141.8	174.1	50.4	0	0	0	0	110.3	N546	S544-N546 WeakPolarHBondContact CB-OD1 3.38Å; S544-N546 PolarHBondContact O-N 2.88Å; S544-N546 PolarHBondContact OG-ND2 2.99Å; S544-N546 VanDerWaalsContact OG-ND2 3.08Å; S544-N546 PolarHBondContact OG-OD1 2.85Å
545	G	26.3	Very low	28.3	Very low	87 Å²	87	136.3 Å²	136.3	90%	0.897	76%	0.764	S	S	*	*			trans	-72.9	63.9	172.6	0	0	0	0	0	112	F547	G545-F547 PolarHBondContact O-N 2.93Å
546	N	29	Very low	28.2	Very low	107 Å²	107	134.7 Å²	134.7	57%	0.572	77%	0.773	S	S	*	*			trans	-65.3	125.8	-171.3	-64.7	-40.7	0	0	0	112.5	S544 L548	S544-N546 WeakPolarHBondContact CB-OD1 3.38Å; S544-N546 PolarHBondContact O-N 2.88Å; S544-N546 PolarHBondContact OG-ND2 2.99Å; S544-N546 VanDerWaalsContact OG-ND2 3.08Å; S544-N546 PolarHBondContact OG-OD1 2.85Å; N546-L548 HydrophobicContact CB-CD2 4.46Å; N546-L548 PolarHBondContact O-N 3.35Å; N546-L548 VanDerWaalsContact O-N 3.09Å
547	F	30.4	Very low	28	Very low	187 Å²	187	137.1 Å²	137.1	82%	0.82	78%	0.777	S	S	*	*			trans	-59	110.2	148.6	-96.6	-89.4	0	0	0	108.3	G545 L549	G545-F547 PolarHBondContact O-N 2.93Å; F547-L549 PolarHBondContact O-N 3Å
548	L	27.4	Very low	28.1	Very low	158 Å²	158	137 Å²	137	83%	0.827	77%	0.772	S	S	*	*			trans	-71.2	94.6	-176.1	-72.7	174.7	0	0	0	111.8	N546	N546-L548 HydrophobicContact CB-CD2 4.46Å; N546-L548 PolarHBondContact O-N 3.35Å; N546-L548 VanDerWaalsContact O-N 3.09Å
549	L	28.6	Very low	28.2	Very low	132 Å²	132	137.5 Å²	137.5	69%	0.691	78%	0.775	S	S	*	*			trans	-59.8	125.1	169.1	-70.8	168.2	0	0	0	111	F547 V551	F547-L549 PolarHBondContact O-N 3Å; L549-V551 PolarHBondContact O-N 3.31Å
550	P	31.4	Very low	28.4	Very low	119 Å²	119	135.7 Å²	135.7	77%	0.773	77%	0.773	S	S	*	*			trans	-79.9	88	173.9	31.8	-33.5	0	0	0	111	S552	P550-S552 PolarHBondContact O-N 3.2Å
551	V	24.9	Very low	28.6	Very low	126 Å²	126	134.1 Å²	134.1	76%	0.764	77%	0.773	S	S	*	*			trans	-74	115	165.8	178.5	0	0	0	0	109.1	L549	L549-V551 PolarHBondContact O-N 3.31Å
552	S	30.3	Very low	28.9	Very low	112 Å²	112	132.9 Å²	132.9	78%	0.783	78%	0.775	S	S	*	*			trans	-138.4	90.3	175.2	-69.4	0	0	0	0	111.4	P550	P550-S552 PolarHBondContact O-N 3.2Å
553	T	24.8	Very low	29.3	Very low	138 Å²	138	127.9 Å²	127.9	85%	0.847	77%	0.77	S	S	*	*			trans	-80.8	129.1	165.7	42.3	0	0	0	0	110.5
554	S	30.5	Very low	29.5	Very low	114 Å²	114	124.7 Å²	124.7	80%	0.797	77%	0.768	S	S	*	*			trans	-151.2	101.3	165.2	62.9	0	0	0	0	111.2
555	L	24.5	Very low	30	Very low	174 Å²	174	126.9 Å²	126.9	91%	0.911	78%	0.78	S	S	*	*			trans	-76.7	139.6	166.8	-78.6	158.8	0	0	0	110
556	S	29.8	Very low	30.3	Very low	122 Å²	122	129 Å²	129	85%	0.853	78%	0.776	S	S	*	*			trans	-142.8	108.1	158.9	52.7	0	0	0	0	110.5
557	L	25.4	Very low	30.5	Very low	160 Å²	160	129.6 Å²	129.6	84%	0.838	79%	0.785	S	S	*	*			trans	-82.6	144.1	173.1	-73.6	155.5	0	0	0	110.4
558	T	32.7	Very low	30.6	Very low	133 Å²	133	126.5 Å²	126.5	82%	0.816	79%	0.787	S	S	*	*			trans	-163.4	129.4	141	20	0	0	0	0	111.4
559	S	30.1	Very low	30.8	Very low	105 Å²	105	122.1 Å²	122.1	73%	0.734	78%	0.78	S	S	*	*			trans	26	141.4	142.4	54.2	0	0	0	0	121.6
560	S	33.9	Very low	31	Very low	98 Å²	98	121.4 Å²	121.4	69%	0.685	79%	0.786	S	S	*	*			cis	-177.9	159.5	1.3	43.7	0	0	0	0	111.8
561	S	31.8	Very low	30.9	Very low	108 Å²	108	120.8 Å²	120.8	76%	0.755	78%	0.783	S	S	*	*			trans	54.5	137.6	149.5	54	0	0	0	0	120.4
562	S	33.5	Very low	31.3	Very low	104 Å²	104	122.4 Å²	122.4	73%	0.727	79%	0.787	S	S	*	*			cis	-166.5	168.3	5.9	45.9	0	0	0	0	112.3
563	S	33.9	Very low	31.4	Very low	99 Å²	99	122 Å²	122	69%	0.692	78%	0.784	S	S	*	*			trans	52.2	102.2	157.3	53.3	0	0	0	0	118
564	L	32.5	Very low	31.8	Very low	173 Å²	173	121.3 Å²	121.3	91%	0.906	78%	0.775	S	S	*	*				66.8	146.8	65.8	-67.5	175.7	0	0	0	115.7
565	P	38	Very low	31.9	Very low	108 Å²	108	121 Å²	121	70%	0.701	77%	0.765	S	S	*	*			trans	-129.1	-166.8	-139.5	45	-30.6	0	0	0	114.3
566	V	32.3	Very low	32.3	Very low	132 Å²	132	120.1 Å²	120.1	80%	0.8	76%	0.756	S	S	*	*			trans	-171.6	139.2	138.5	138.3	0	0	0	0	110.6
567	P	33.3	Very low	32.5	Very low	119 Å²	119	121.1 Å²	121.1	77%	0.773	75%	0.75	S	S	*	*			trans	-109.1	158.1	171.3	38.8	-31.6	0	0	0	113.7
568	S	33.7	Very low	32.9	Very low	123 Å²	123	119.8 Å²	119.8	86%	0.86	74%	0.74	S	S	*	*			trans	-160.9	144.5	172.3	56.4	0	0	0	0	114.8
569	G	32	Very low	32.8	Very low	66 Å²	66	121.3 Å²	121.3	68%	0.68	74%	0.737	S	S	*	*			trans	88.6	120.7	171.4	0	0	0	0	0	114.9
570	S	31.1	Very low	32.7	Very low	116 Å²	116	120.8 Å²	120.8	81%	0.811	73%	0.734	S	S	*	*			cis	75.6	127.6	44.5	86.1	0	0	0	0	112.5
571	C	31.1	Very low	32.3	Very low	106 Å²	106	123.7 Å²	123.7	72%	0.716	74%	0.741	S	S	*	*			cis	-150.5	171.9	29	-81.3	0	0	0	0	113.8
572	L	32.9	Very low	32.3	Very low	160 Å²	160	125.4 Å²	125.4	84%	0.838	75%	0.746	S	S	*	*			trans	17.7	149.7	131.5	-50.1	168.6	0	0	0	119.5
573	S	31.6	Very low	32	Very low	104 Å²	104	124.4 Å²	124.4	73%	0.727	74%	0.744	S	S	*	*			cis	-179.9	-170.6	-10.4	56.2	0	0	0	0	106.5
574	D	32.6	Very low	32.2	Very low	124 Å²	124	125.4 Å²	125.4	66%	0.663	75%	0.749	S	S	*	*			cis	-160.9	172.6	0.9	-158.2	4.2	0	0	0	110.6
575	N	34.2	Very low	32.2	Very low	106 Å²	106	124 Å²	124	57%	0.567	75%	0.747	S	S	*	*			trans	62.2	121.5	160.6	-64	-52.8	0	0	0	119.2
576	Q	32.1	Very low	31.8	Very low	156 Å²	156	123.5 Å²	123.5	73%	0.729	75%	0.746	S	S	*	*				63.6	134.3	75.9	-61	-176	39.2	0	0	113
577	I	34.4	Very low	31.7	Very low	144 Å²	144	123.7 Å²	123.7	74%	0.738	74%	0.742	S	S	*	*				-163.2	138.1	67.8	-86.1	176.1	0	0	0	111.9
578	H	33.2	Very low	31.7	Very low	132 Å²	132	125.2 Å²	125.2	61%	0.611	74%	0.738	S	S	*	*			trans	42.8	124.6	145.8	-70.9	-112.1	0	0	0	122.3
579	Q	29.8	Very low	31.7	Very low	164 Å²	164	126.6 Å²	126.6	77%	0.766	73%	0.729	S	S	*	*				69.7	145.9	98.5	-66.2	178.9	-19.6	0	0	116.2
580	S	28.6	Very low	31.5	Very low	94 Å²	94	130 Å²	130	66%	0.657	73%	0.728	S	S	*	*			cis	-166.6	170.6	-8.3	45.9	0	0	0	0	110.9
581	L	25.6	Very low	31.6	Very low	159 Å²	159	130.9 Å²	130.9	83%	0.832	72%	0.723	S	S	*	*			trans	18.6	132.6	146.1	-62.1	160.7	0	0	0	118.3
582	V	32.1	Very low	31.7	Very low	144 Å²	144	132.7 Å²	132.7	87%	0.873	72%	0.721	S	S	*	*				-162.3	159.6	79.8	149.1	0	0	0	0	111
583	A	27.9	Very low	31.6	Very low	83 Å²	83	132.3 Å²	132.3	69%	0.686	72%	0.715	S	S	*	*			trans	-111.6	-153.4	-179.5	0	0	0	0	0	112.7
584	P	38.1	Very low	31.7	Very low	121 Å²	121	132.6 Å²	132.6	79%	0.786	71%	0.713	S	S	*	*				-121.1	-179	-109.3	40.2	-24.5	0	0	0	114.6
585	V	32.3	Very low	31.6	Very low	143 Å²	143	134.8 Å²	134.8	87%	0.867	72%	0.719	S	S	*	*			trans	-169	160.7	144.2	131.6	0	0	0	0	112.5
586	S	29.2	Very low	31.5	Very low	97 Å²	97	135.3 Å²	135.3	68%	0.678	73%	0.729	S	S	*	*			trans	-53.3	-179.6	179.2	-42.8	0	0	0	0	116.4
587	L	29.8	Very low	31.3	Very low	136 Å²	136	132.4 Å²	132.4	71%	0.712	73%	0.727	S	S	*	*			cis	-171	149.1	33.1	-167.6	82.6	0	0	0	113.1
588	H	32.9	Very low	31.3	Very low	151 Å²	151	130 Å²	130	70%	0.699	72%	0.723	S	S	*	*			trans	64	159.5	154.7	-84.9	-8.5	0	0	0	119
589	K	34.9	Very low	31	Very low	152 Å²	152	131.1 Å²	131.1	66%	0.661	73%	0.733	S	S	*	*			cis	-157.4	145	-4.9	-133.8	-179.6	-178	-174.2	0	112.5
590	M	28.3	Very low	31.2	Very low	138 Å²	138	128.8 Å²	128.8	68%	0.68	74%	0.735	S	S	*	*			trans	62.4	151.8	139	-88.6	173.5	72.9	0	0	124
591	L	32.7	Very low	31.3	Very low	134 Å²	134	132.2 Å²	132.2	70%	0.702	74%	0.74	S	S	*	*			trans	72.6	139.7	164.4	-57.4	152.6	0	0	0	117
592	E	32.9	Very low	31.5	Very low	145 Å²	145	131 Å²	131	68%	0.678	73%	0.734	S	S	*	*			cis	-161.2	178.8	-21.5	-126.8	-176	155	0	0	111.6
593	Q	31.3	Very low	31.5	Very low	151 Å²	151	132.2 Å²	132.2	71%	0.706	73%	0.733	S	S	*	*			trans	-1.9	141	160	-50.3	164	32.7	0	0	118.2
594	T	32.7	Very low	31.7	Very low	110 Å²	110	133.1 Å²	133.1	68%	0.675	74%	0.735	S	S	*	*				-161.4	139.3	52.3	41.5	0	0	0	0	111.9
595	E	31.1	Very low	31.6	Very low	171 Å²	171	137.2 Å²	137.2	80%	0.799	74%	0.74	S	S	*	*				84.5	148.1	100.5	-63.8	-169.3	137.1	0	0	119.2
596	C	31.8	Very low	31.5	Very low	116 Å²	116	137 Å²	137	78%	0.784	73%	0.734	S	S	*	*			trans	64.3	153.7	163.2	-64.8	0	0	0	0	120.5
597	S	27.8	Very low	31.9	Very low	96 Å²	96	140.1 Å²	140.1	67%	0.671	74%	0.743	S	S	*	*				179.7	162.8	-55	48.9	0	0	0	0	110
598	S	33.5	Very low	32	Very low	93 Å²	93	140.4 Å²	140.4	65%	0.65	75%	0.745	S	S	*	*			trans	62.1	103.4	154.6	50.4	0	0	0	0	121.6
599	N	28.5	Very low	32.1	Very low	155 Å²	155	140.5 Å²	140.5	83%	0.829	75%	0.751	S	S	*	*				71.1	160.9	116.7	-60.5	-3.2	0	0	0	123.2
600	S	34.1	Very low	32	Very low	115 Å²	115	138.6 Å²	138.6	80%	0.804	76%	0.757	S	S	*	*			trans	75.5	152.5	174.6	76.1	0	0	0	0	117.4
601	E	30.5	Very low	31.9	Very low	166 Å²	166	139.4 Å²	139.4	78%	0.776	76%	0.763	S	S	*	*				-164.6	155.6	-50.6	-118.8	-169.6	142.4	0	0	108.4
602	I	29.7	Very low	31.9	Very low	135 Å²	135	138.4 Å²	138.4	69%	0.692	77%	0.767	S	S	*	*			trans	28.3	116.4	152.1	-44.4	167	0	0	0	118.9
603	I	32.7	Very low	31.7	Very low	169 Å²	169	137.8 Å²	137.8	87%	0.867	77%	0.767	S	S	*	*				-170.9	143.2	119.4	-97.9	156.4	0	0	0	110.1
604	S	30.6	Very low	31.7	Very low	102 Å²	102	137.2 Å²	137.2	71%	0.713	77%	0.768	S	S	*	*			trans	-91.8	155.8	-176.6	53.2	0	0	0	0	113.7
605	K	36	Very low	31.6	Very low	206 Å²	206	141 Å²	141	90%	0.896	78%	0.775	S	S	*	*			trans	-155.7	144	143.4	-111.6	164.7	-173.6	177.6	0	110.4
606	N	31.3	Very low	31.3	Very low	139 Å²	139	138 Å²	138	74%	0.743	77%	0.772	S	S	*	*			trans	-79.4	160.8	173.1	-57.3	-24.5	0	0	0	109.7
607	D	37.5	Very low	31.1	Very low	163 Å²	163	136.7 Å²	136.7	87%	0.872	77%	0.77	S	S	*	*				-156.1	161.6	111.9	-93.3	-33.7	0	0	0	110
608	N	30.7	Very low	31.3	Very low	141 Å²	141	139.7 Å²	139.7	75%	0.754	78%	0.778	S	S	*	*			trans	-92.9	158.3	-179.6	-54.8	-75.6	0	0	0	110.4
609	D	35.6	Very low	31	Very low	153 Å²	153	140.1 Å²	140.1	82%	0.818	78%	0.78	S	S	*	*				-169.5	143.1	108.3	-110.7	-24.1	0	0	0	117.1
610	S	32.6	Very low	30.9	Very low	113 Å²	113	140.7 Å²	140.7	79%	0.79	78%	0.778	S	S	*	*			trans	46.5	138	151.4	70.3	0	0	0	0	123.7
611	L	26.1	Very low	30.7	Very low	154 Å²	154	143.1 Å²	143.1	81%	0.806	78%	0.776	S	S	*	*			trans	-121	143	173.3	-100.2	159.8	0	0	0	111.5	I613	L611-I613 HydrophobicContact CB-CD1 4.2Å; L611-I613 HydrophobicContact CB-CG1 4.37Å; L611-I613 HydrophobicContact CD2-CG1 4.49Å
612	S	33.2	Very low	30.6	Very low	113 Å²	113	140.4 Å²	140.4	79%	0.79	78%	0.776	S	S	*	*			trans	-152.8	118.1	156.9	48.3	0	0	0	0	107.1
613	I	29.1	Very low	30.7	Very low	132 Å²	132	137.7 Å²	137.7	68%	0.677	77%	0.773	S	S	*	*			cis	70.7	141.6	33.1	-35.5	170.7	0	0	0	112.7	L611	L611-I613 HydrophobicContact CB-CD1 4.2Å; L611-I613 HydrophobicContact CB-CG1 4.37Å; L611-I613 HydrophobicContact CD2-CG1 4.49Å
614	I	30.2	Very low	30.9	Very low	139 Å²	139	136.8 Å²	136.8	71%	0.713	77%	0.768	S	S	*	*			trans	86.1	130.1	168.7	-59.8	-172.8	0	0	0	114.6
615	K	30.5	Very low	31.1	Very low	190 Å²	190	138.4 Å²	138.4	83%	0.826	77%	0.769	S	S	*	*			cis	-155.7	-174.6	-5.1	-120.2	175.2	-155.7	169.5	0	111.8
616	S	25.9	Very low	31.1	Very low	107 Å²	107	138.3 Å²	138.3	75%	0.748	77%	0.769	S	S	*	*			trans	-130	158	-170.8	56.8	0	0	0	0	115.7
617	A	27.4	Very low	31.2	Very low	90 Å²	90	135.7 Å²	135.7	74%	0.744	78%	0.775	S	S	*	*			trans	79.1	169.3	146	0	0	0	0	0	121.6
618	L	30.8	Very low	31	Very low	159 Å²	159	131.3 Å²	131.3	83%	0.832	77%	0.768	S	S	*	*			trans	89.8	123.5	-177.6	-55.7	171.6	0	0	0	114.5
619	C	27.5	Very low	31.1	Very low	101 Å²	101	130.6 Å²	130.6	68%	0.682	77%	0.773	S	S	*	*				75.8	134.2	56.6	-71.3	0	0	0	0	112.4
620	E	27.3	Very low	31.1	Very low	168 Å²	168	127.8 Å²	127.8	79%	0.785	77%	0.765	S	S	*	*			cis	-164.3	-175.9	-8.7	-138.4	160.4	153.5	0	0	111.1
621	E	28.7	Very low	31.1	Very low	166 Å²	166	128.9 Å²	128.9	78%	0.776	76%	0.762	S	S	*	*			trans	50.3	107.1	155.4	-70.2	-153.1	112.2	0	0	123.3
622	S	29.2	Very low	31.3	Very low	109 Å²	109	127 Å²	127	76%	0.762	76%	0.757	S	S	*	*				96.7	162.7	112.2	83.6	0	0	0	0	122.8
623	A	32.5	Very low	31.1	Very low	78 Å²	78	126.5 Å²	126.5	65%	0.645	75%	0.754	S	S	*	*			trans	98.7	103	148.9	0	0	0	0	0	122.2
624	I	36.5	Very low	31	Very low	149 Å²	149	127.6 Å²	127.6	76%	0.764	76%	0.76	S	S	*	*				93	93.1	121.9	-69.7	173.3	0	0	0	120.6
625	N	34	Very low	30.9	Very low	136 Å²	136	126.7 Å²	126.7	73%	0.727	76%	0.761	S	S	*	*				96.2	139.4	118.4	-85.8	-17.7	0	0	0	125.7
626	K	37.5	Very low	30.8	Very low	204 Å²	204	121.9 Å²	121.9	89%	0.887	75%	0.751	S	S	*	*			trans	77.9	132.7	164.6	-61.4	155.8	-177.1	178	0	115.9
627	G	33	Very low	31.2	Very low	84 Å²	84	124.2 Å²	124.2	87%	0.866	75%	0.75	S	S	*	*			cis	145.6	153.2	0.6	0	0	0	0	0	109.8
628	G	32.7	Very low	31.5	Very low	71 Å²	71	127.4 Å²	127.4	73%	0.732	75%	0.75	S	S	*	*			cis	-179.7	-168.8	0.1	0	0	0	0	0	110.5
629	C	33.2	Very low	31.6	Very low	127 Å²	127	124.1 Å²	124.1	86%	0.858	75%	0.745	S	S	*	*			trans	68.2	126.3	179.9	-59	0	0	0	0	116.2
630	S	34.8	Very low	31.8	Very low	94 Å²	94	126.4 Å²	126.4	66%	0.657	75%	0.75	S	S	*	*				93.9	142.7	52.6	99.1	0	0	0	0	112.3
631	D	33.3	Very low	32.1	Very low	135 Å²	135	125.5 Å²	125.5	72%	0.722	75%	0.749	S	S	*	*			cis	-151.9	160	10.6	-98.7	-48.9	0	0	0	114.8
632	T	30.9	Very low	32.3	Very low	115 Å²	115	122.3 Å²	122.3	71%	0.706	75%	0.745	S	S	*	*			trans	33.4	127.3	149.1	64.6	0	0	0	0	125.3
633	S	27.9	Very low	32.6	Very low	103 Å²	103	122.3 Å²	122.3	72%	0.72	74%	0.741	S	S	*	*				94.8	138.9	122.8	75	0	0	0	0	125
634	L	28	Very low	32.9	Very low	154 Å²	154	126.4 Å²	126.4	81%	0.806	75%	0.746	S	S	*	*			trans	57	110.9	146.4	-89.7	83.9	0	0	0	124.3
635	V	27.9	Very low	32.9	Very low	121 Å²	121	125.7 Å²	125.7	73%	0.733	74%	0.744	S	S	*	*				76.6	127.8	115.7	170.5	0	0	0	0	122.7
636	S	28.4	Very low	32.8	Very low	89 Å²	89	123.5 Å²	123.5	62%	0.622	74%	0.739	S	S	*	*			trans	94.4	150.9	144.6	71.8	0	0	0	0	123.7
637	H	34.3	Very low	32.7	Very low	156 Å²	156	120.4 Å²	120.4	72%	0.722	73%	0.731	S	S	*	*			trans	66.8	154.1	167.4	-59.6	-68.4	0	0	0	119.9
638	Q	32.4	Very low	32.8	Very low	157 Å²	157	124 Å²	124	73%	0.734	73%	0.73	S	S	*	*			cis	156.2	125.4	-35.4	-103.7	-174.1	-32.2	0	0	109.4
639	A	34.6	Very low	32.6	Very low	90 Å²	90	126.5 Å²	126.5	74%	0.744	73%	0.731	S	S	*	*			trans	-167.6	130.6	145.9	0	0	0	0	0	106.4
640	L	30.6	Very low	32.6	Very low	148 Å²	148	127.3 Å²	127.3	78%	0.775	73%	0.732	S	S	*	*			cis	69.8	136.5	47.8	-55.8	170.9	0	0	0	111.1
641	I	34.8	Very low	32.3	Very low	149 Å²	149	131 Å²	131	76%	0.764	75%	0.745	S	S	*	*			cis	-153.2	131.2	46.3	-79.8	177.7	0	0	0	113
642	S	32.6	Very low	32.2	Very low	99 Å²	99	128.8 Å²	128.8	69%	0.692	75%	0.745	S	S	*	*			trans	41.8	173.4	144.7	77.6	0	0	0	0	123.2
643	T	35.2	Very low	32	Very low	110 Å²	110	131 Å²	131	68%	0.675	75%	0.752	S	S	*	*			cis	-143.6	142.9	14.8	51.2	0	0	0	0	115
644	H	38	Very low	32.3	Very low	164 Å²	164	130.8 Å²	130.8	76%	0.759	75%	0.747	S	S	*	*			trans	53.8	151.5	137.4	-73.6	-99.4	0	0	0	121.6
645	D	36	Very low	32.2	Very low	134 Å²	134	129.9 Å²	129.9	72%	0.717	74%	0.743	S	S	*	*			cis	-143	175.3	19.2	-131.2	-29.3	0	0	0	117.5
646	S	33	Very low	32.4	Very low	89 Å²	89	130.9 Å²	130.9	62%	0.622	74%	0.744	S	S	*	*			trans	-79.4	174.6	-173.9	49.5	0	0	0	0	115.7
647	I	36	Very low	32.4	Very low	140 Å²	140	134.5 Å²	134.5	72%	0.718	75%	0.749	S	S	*	*			cis	-163.8	142.7	-15.9	-104.5	162.3	0	0	0	107.5
648	N	33.9	Very low	32.2	Very low	159 Å²	159	132.6 Å²	132.6	85%	0.85	75%	0.752	S	S	*	*				-174.9	156.3	129.9	-108.4	-41.8	0	0	0	113.6
649	T	29.3	Very low	31.9	Very low	123 Å²	123	131 Å²	131	76%	0.755	75%	0.748	S	S	*	*			trans	-112.8	137.1	-166.4	53	0	0	0	0	114.4
650	T	33.1	Very low	31.8	Very low	144 Å²	144	137.4 Å²	137.4	88%	0.883	76%	0.755	S	S	*	*			trans	-151.3	137.4	145.1	14.1	0	0	0	0	109.8
651	N	27.8	Very low	31.8	Very low	173 Å²	173	137 Å²	137	93%	0.925	75%	0.752	S	S	*	*			trans	-80.3	128.9	174.1	-71.1	-22.1	0	0	0	110
652	A	32.2	Very low	31.6	Very low	88 Å²	88	135.5 Å²	135.5	73%	0.727	75%	0.752	S	S	*	*			trans	-140.9	103.2	166	0	0	0	0	0	109.5
653	N	26.8	Very low	31.6	Very low	160 Å²	160	141.6 Å²	141.6	86%	0.856	76%	0.762	S	S	*	*			trans	-68.6	127.1	158.2	-84.3	-13.2	0	0	0	107.3
654	V	32.9	Very low	31.4	Very low	100 Å²	100	143.6 Å²	143.6	61%	0.606	77%	0.769	S	S	*	*			trans	-122.5	87.3	166	-177.4	0	0	0	0	107.8	D656	V654-D656 VanDerWaalsContact C-N 3.34Å; V654-D656 HydrophobicContact CG1-CB 4.17Å; V654-D656 WeakPolarHBondContact CG1-OD1 3.46Å; V654-D656 VanDerWaalsContact CG1-OD2 3.26Å; V654-D656 WeakPolarHBondContact CG1-OD2 3.45Å; V654-D656 PolarHBondContact O-N 2.98Å
655	N	27.4	Very low	31	Very low	135 Å²	135	145.7 Å²	145.7	72%	0.722	77%	0.77	S	S	*	*			trans	-82.3	83.4	160.8	-74.1	-16	0	0	0	107.3	F657	N655-F657 VanDerWaalsContact C-N 3.29Å; N655-F657 PolarHBondContact O-N 3.47Å
656	D	31.2	Very low	30.6	Very low	141 Å²	141	146.3 Å²	146.3	75%	0.754	77%	0.773	S	S	*	*			trans	-81.5	83	170.8	-79.7	-16.5	0	0	0	109.7	V654 C658	V654-D656 VanDerWaalsContact C-N 3.34Å; V654-D656 HydrophobicContact CG1-CB 4.17Å; V654-D656 WeakPolarHBondContact CG1-OD1 3.46Å; V654-D656 VanDerWaalsContact CG1-OD2 3.26Å; V654-D656 WeakPolarHBondContact CG1-OD2 3.45Å; V654-D656 PolarHBondContact O-N 2.98Å; D656-C658 PolarHBondContact O-N 3.02Å
657	F	27.4	Very low	30.6	Very low	166 Å²	166	152.1 Å²	152.1	73%	0.728	78%	0.783	S	S	*	*			trans	-65.8	116.8	156.5	-91.1	-118.6	0	0	0	108.3	N655 D659	N655-F657 VanDerWaalsContact C-N 3.29Å; N655-F657 PolarHBondContact O-N 3.47Å; F657-D659 VanDerWaalsContact C-N 3.31Å; F657-D659 PolarHBondContact O-N 3.24Å; F657-D659 VanDerWaalsContact O-N 3.13Å
658	C	30.4	Very low	30.5	Very low	116 Å²	116	155.8 Å²	155.8	78%	0.784	79%	0.789	S	S	*	*			trans	-79.3	86.5	159.9	-72.4	0	0	0	0	108.5	D656 Y660	D656-C658 PolarHBondContact O-N 3.02Å; C658-Y660 PolarHBondContact O-N 3.39Å
659	D	27.2	Very low	30.4	Very low	122 Å²	122	152.7 Å²	152.7	65%	0.652	78%	0.778	S	S	*	*			trans	-62.4	100.6	176.2	-75.6	-33.9	0	0	0	110.9	F657 L661	F657-D659 VanDerWaalsContact C-N 3.31Å; F657-D659 PolarHBondContact O-N 3.24Å; F657-D659 VanDerWaalsContact O-N 3.13Å; D659-L661 VanDerWaalsContact C-N 3.28Å; D659-L661 PolarHBondContact O-N 2.65Å
660	Y	32.2	Very low	30.4	Very low	225 Å²	225	153.4 Å²	153.4	88%	0.882	78%	0.777	S	S	*	*			trans	-71.3	90.3	161.5	-94.2	-89.8	0	0	0	108.6	C658	C658-Y660 PolarHBondContact O-N 3.39Å
661	L	30.8	Very low	30.4	Very low	139 Å²	139	157 Å²	157	73%	0.728	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-52.3	133.8	173.8	-66.3	172.2	0	0	0	110.1	D659 Y663	D659-L661 VanDerWaalsContact C-N 3.28Å; D659-L661 PolarHBondContact O-N 2.65Å; L661-Y663 PolarHBondContact O-N 3.03Å
662	P	29.5	Very low	30.6	Very low	118 Å²	118	153.4 Å²	153.4	77%	0.766	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-66	118.7	170.3	28.5	-32.2	0	0	0	108.1	D664	P662-D664 PolarHBondContact O-N 3.47Å; P662-D664 VanDerWaalsContact O-N 3.17Å
663	Y	33.7	Very low	30.6	Very low	227 Å²	227	158.5 Å²	158.5	89%	0.89	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-62.4	121.2	175	-113.5	-83.7	0	0	0	109.4	L661	L661-Y663 PolarHBondContact O-N 3.03Å
664	D	31.5	Very low	30.8	Very low	153 Å²	153	155.6 Å²	155.6	82%	0.818	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-73.1	151.7	-159.6	-150.9	-11	0	0	0	112.5	P662	P662-D664 PolarHBondContact O-N 3.47Å; P662-D664 VanDerWaalsContact O-N 3.17Å
665	R	28.8	Very low	30.8	Very low	208 Å²	208	156.7 Å²	156.7	79%	0.785	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-85.9	152.3	169.7	-75.4	-177.4	171.5	179.9	-2.7	109.2
666	N	28.6	Very low	30.8	Very low	146 Å²	146	159.4 Å²	159.4	78%	0.781	79%	0.794	S	S	*	*			trans	84.1	71.3	164	-35.8	-62.2	0	0	0	118.1
667	Y	32.9	Very low	30.8	Very low	212 Å²	212	158 Å²	158	83%	0.831	80%	0.795	S	S	*	*			trans	-148.3	131.5	142.4	-93.2	-86	0	0	0	105.9
668	Y	33.1	Very low	30.8	Very low	217 Å²	217	155 Å²	155	85%	0.851	79%	0.794	S	S	*	*			cis	-121.9	161.5	19.1	-87	-106.5	0	0	0	114.1
669	P	31.4	Very low	30.8	Very low	93 Å²	93	155.7 Å²	155.7	60%	0.604	80%	0.795	S	S	*	*			trans	-101.8	168.4	177	40.1	-35.3	0	0	0	114.7
670	N	30.1	Very low	30.8	Very low	139 Å²	139	154.2 Å²	154.2	74%	0.743	79%	0.794	S	S	*	*			trans	58	101.7	154.6	-60.2	-10.7	0	0	0	119.6
671	F	33.3	Very low	30.5	Very low	218 Å²	218	149.4 Å²	149.4	96%	0.956	79%	0.794	S	S	*	*				-127.7	135.4	126.6	-107.4	-88.3	0	0	0	109.1
672	S	30.6	Very low	30.4	Very low	98 Å²	98	149.1 Å²	149.1	69%	0.685	79%	0.793	S	S	*	*			trans	-105.9	175.8	-177	-66.2	0	0	0	0	111.3
673	E	33.2	Very low	30.3	Very low	196 Å²	196	148.1 Å²	148.1	92%	0.916	78%	0.781	S	S	*	*			trans	78.2	88.6	164.4	-53.5	-171.8	170.3	0	0	118.2
674	A	31.6	Very low	29.9	Very low	99 Å²	99	142.4 Å²	142.4	82%	0.818	77%	0.769	S	S	*	*				-160.4	137.6	120.6	0	0	0	0	0	110.5
675	P	31.9	Very low	29.9	Very low	123 Å²	123	140.7 Å²	140.7	80%	0.799	76%	0.755	S	S	*	*			trans	-95.6	142.7	-176.1	35.4	-34	0	0	0	114.9
676	Q	28.2	Very low	29.9	Very low	192 Å²	192	140.4 Å²	140.4	90%	0.897	76%	0.755	S	S	*	*			trans	18.7	111.6	148.5	-59.1	-178.3	-2.8	0	0	119.6
677	S	31.3	Very low	30	Very low	110 Å²	110	135.4 Å²	135.4	77%	0.769	73%	0.732	S	S	*	*				-164.3	114.3	127.9	44	0	0	0	0	113.9
678	S	27.6	Very low	30.1	Very low	103 Å²	103	126.9 Å²	126.9	72%	0.72	70%	0.702	S	S	*	*			trans	45	137.5	143.4	63.3	0	0	0	0	123.6
679	T	28.6	Very low	30.5	Very low	131 Å²	131	121 Å²	121	80%	0.804	69%	0.685	S	S	*	*			trans	91.8	143.1	155.9	72.3	0	0	0	0	120.1
680	S	28.3	Very low	31.3	Very low	91 Å²	91	118.2 Å²	118.2	64%	0.636	67%	0.665	S	S	*	*			trans	53.5	115	170.8	44.3	0	0	0	0	119.3	N682	S680-N682 VanDerWaalsContact C-N 3.34Å; S680-N682 PolarHBondContact O-N 2.84Å
681	S	26.3	Very low	31.8	Very low	125 Å²	125	119.4 Å²	119.4	87%	0.874	66%	0.66	S	S	*	*			trans	-74.2	77.9	170.6	-54.8	0	0	0	0	112	L683	S681-L683 PolarHBondContact O-N 2.92Å; S681-L683 VanDerWaalsContact O-N 3.07Å
682	N	28.6	Very low	32.2	Very low	132 Å²	132	113.8 Å²	113.8	71%	0.706	64%	0.636	S	S	*	*			trans	-72.4	99.6	173.9	-71.1	-12	0	0	0	110.5	S680 V684	S680-N682 VanDerWaalsContact C-N 3.34Å; S680-N682 PolarHBondContact O-N 2.84Å; N682-V684 PolarHBondContact O-N 3.41Å
683	L	25.8	Very low	32.6	Very low	98 Å²	98	111.6 Å²	111.6	51%	0.513	62%	0.623	S	S	.	*			trans	-68.1	99.4	164.8	-82	166.2	0	0	0	109	M430 S681 F685	M430-L683 HydrophobicContact CE-CD1 3.44Å; M430-L683 VanDerWaalsContact CE-CD1 3.44Å; M430-L683 HydrophobicContact SD-CD1 3.9Å; S681-L683 PolarHBondContact O-N 2.92Å; S681-L683 VanDerWaalsContact O-N 3.07Å; L683-F685 HydrophobicContact CB-CD2 4.24Å; L683-F685 HydrophobicContact CB-CE2 3.64Å; L683-F685 HydrophobicContact CB-CZ 3.91Å; L683-F685 HydrophobicContact CD1-CE2 4.45Å; L683-F685 HydrophobicContact CD1-CZ 4.09Å; L683-F685 VanDerWaalsContact O-CD2 3.28Å; L683-F685 WeakPolarHBondContact O-CD2 3.18Å; L683-F685 PolarHBondContact O-N 3.01Å
684	V	27.3	Very low	33.2	Very low	107 Å²	107	108.6 Å²	108.6	65%	0.648	62%	0.621	S	S	*	*			trans	-74.1	93.3	173.6	-179.7	0	0	0	0	108.6	N682 Y686	N682-V684 PolarHBondContact O-N 3.41Å; V684-Y686 HydrophobicContact CG1-CD2 4.43Å; V684-Y686 HydrophobicContact CG1-CE2 4.18Å; V684-Y686 PolarHBondContact O-N 3.01Å
685	F	29.8	Very low	34.1	Very low	117 Å²	117	111 Å²	111	51%	0.513	62%	0.62	S	S	.	*			trans	-72.5	108.6	170.6	-67	-76.4	0	0	0	109.6	L683 S687	L683-F685 HydrophobicContact CB-CD2 4.24Å; L683-F685 HydrophobicContact CB-CE2 3.64Å; L683-F685 HydrophobicContact CB-CZ 3.91Å; L683-F685 HydrophobicContact CD1-CE2 4.45Å; L683-F685 HydrophobicContact CD1-CZ 4.09Å; L683-F685 VanDerWaalsContact O-CD2 3.28Å; L683-F685 WeakPolarHBondContact O-CD2 3.18Å; L683-F685 PolarHBondContact O-N 3.01Å; F685-S687 PolarHBondContact O-N 2.74Å
686	Y	28.4	Very low	35.1	Very low	202 Å²	202	108.7 Å²	108.7	79%	0.792	60%	0.601	S	S	*	*			trans	-71.6	96.6	170.3	-75	-92.5	0	0	0	109.2	V684 P688	V684-Y686 HydrophobicContact CG1-CD2 4.43Å; V684-Y686 HydrophobicContact CG1-CE2 4.18Å; V684-Y686 PolarHBondContact O-N 3.01Å; Y686-P688 WeakPolarHBondContact O-CD 3.33Å
687	S	31.8	Very low	36.5	Very low	41 Å²	41	106.2 Å²	106.2	29%	0.287	60%	0.598	S	S	.	*			trans	-63.1	124.4	167.5	-175.5	0	0	0	0	109	F685 N689	F685-S687 PolarHBondContact O-N 2.74Å; S687-N689 WeakPolarHBondContact CB-OD1 3.35Å; S687-N689 PolarHBondContact O-N 2.81Å; S687-N689 PolarHBondContact OG-OD1 3.01Å
688	P	35.2	Very low	38.2	Very low	33 Å²	33	106.1 Å²	106.1	21%	0.214	59%	0.59	C	S	.	*			trans	-77.3	55.7	171.5	35.2	-35.7	0	0	0	110.2	P397 Y686 L690	P397-P688 HydrophobicContact CB-CB 4.1Å; P397-P688 HydrophobicContact CG-CB 4.08Å; Y686-P688 WeakPolarHBondContact O-CD 3.33Å; P688-L690 PolarHBondContact O-N 3.33Å; P688-L690 VanDerWaalsContact O-N 3.09Å
689	N	40.6	Very low	40.5	Very low	93 Å²	93	104.7 Å²	104.7	50%	0.497	58%	0.578	S	S	.	*			trans	-55.7	116.4	166.3	-73.8	5.9	0	0	0	107.1	S687 Y691 K692	S687-N689 WeakPolarHBondContact CB-OD1 3.35Å; S687-N689 PolarHBondContact O-N 2.81Å; S687-N689 PolarHBondContact OG-OD1 3.01Å; N689-Y691 PolarHBondContact O-N 2.75Å; N689-K692 HydrophobicContact CB-CB 4.49Å
690	L	48	Very low	43	Very low	35 Å²	35	99.6 Å²	99.6	18%	0.183	55%	0.546	C	S	.	.	S	Bend	trans	-68.3	81	-179.5	-69.8	167.2	0	0	0	110.1	P397 L400 P688 K692 P701 F702	P397-L690 HydrophobicContact CB-CD2 3.78Å; P397-L690 VanDerWaalsContact O-CD2 3.29Å; P397-L690 WeakPolarHBondContact O-CD2 3.16Å; L400-L690 HydrophobicContact CD2-CD1 4.19Å; P688-L690 PolarHBondContact O-N 3.33Å; P688-L690 VanDerWaalsContact O-N 3.09Å; L690-K692 PolarHBondContact O-N 3.38Å; L690-P701 HydrophobicContact CD1-CG 3.86Å; L690-F702 HydrophobicContact CD1-CE2 4.4Å
691	Y	40.5	Very low	45.7	Very low	163 Å²	163	96.4 Å²	96.4	64%	0.639	52%	0.523	S	S	*	.	S	Bend	trans	54.4	44.2	178.7	-76.3	-94.9	0	0	0	115.9	N689 A693	N689-Y691 PolarHBondContact O-N 2.75Å; Y691-A693 PolarHBondContact O-N 2.99Å; Y691-A693 VanDerWaalsContact O-N 3.11Å
692	K	42.8	Very low	48.7	Very low	101 Å²	101	90.7 Å²	90.7	44%	0.439	48%	0.482	S	S	.	.			trans	-80.4	75.6	153.8	-74.3	-172.7	-178.3	174.6	0	109.7	N689 L690 D726	N689-K692 HydrophobicContact CB-CB 4.49Å; L690-K692 PolarHBondContact O-N 3.38Å; K692-D726 IonicContact NZ-OD2 2.71Å; K692-D726 PolarHBondContact NZ-OD2 2.75Å
693	A	39	Very low	51.7	Low	51 Å²	51	85.3 Å²	85.3	42%	0.421	45%	0.454	S	S	.	.			trans	-67.5	144.1	153.9	0	0	0	0	0	107.9	Y691 D695 D696	Y691-A693 PolarHBondContact O-N 2.99Å; Y691-A693 VanDerWaalsContact O-N 3.11Å; A693-D695 PolarHBondContact O-N 3.45Å; A693-D696 HydrophobicContact CB-CB 4.23Å; A693-D696 PolarHBondContact O-N 3.1Å
694	P	44.8	Very low	54.7	Low	133 Å²	133	82.5 Å²	82.5	86%	0.864	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-17.5	-167.4	24.1	-34.5	0	0	0	115
695	D	50.7	Low	57.7	Low	150 Å²	150	77.4 Å²	77.4	80%	0.802	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-2.9	178.7	-53.7	-60.3	0	0	0	113.7	A693	A693-D695 PolarHBondContact O-N 3.45Å
696	D	53.9	Low	60.7	Low	74 Å²	74	71.8 Å²	71.8	40%	0.396	38%	0.383	S	S	.	.			trans	-89.8	116	-173.5	-162.4	-11.9	0	0	0	111.7	A693 N698	A693-D696 HydrophobicContact CB-CB 4.23Å; A693-D696 PolarHBondContact O-N 3.1Å; D696-N698 PolarHBondContact O-N 3.1Å; D696-N698 PolarHBondContact OD1-N 3.31Å; D696-N698 PolarHBondContact OD1-ND2 3.34Å; D696-N698 PolarHBondContact OD2-ND2 3.49Å
697	V	57.2	Low	63.8	Low	140 Å²	140	69 Å²	69	85%	0.848	37%	0.371	S	S	*	.			trans	-82.5	14	-173.3	-165.9	0	0	0	0	111.9	P699	V697-P699 WeakPolarHBondContact O-CD 3.45Å
698	N	66.1	Low	66.7	Low	109 Å²	109	71.2 Å²	71.2	58%	0.583	37%	0.373	S	S	*	.	P	Polyproline II helix	trans	-65.6	123	177.8	-88.6	-58.1	0	0	0	111.5	D696	D696-N698 PolarHBondContact O-N 3.1Å; D696-N698 PolarHBondContact OD1-N 3.31Å; D696-N698 PolarHBondContact OD1-ND2 3.34Å; D696-N698 PolarHBondContact OD2-ND2 3.49Å
699	P	76	Confident	69.4	Low	72 Å²	72	69.6 Å²	69.6	47%	0.468	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-68.1	149.7	177	28.7	-34.9	0	0	0	111.3	V697 M704	V697-P699 WeakPolarHBondContact O-CD 3.45Å; P699-M704 HydrophobicContact CB-CG 3.82Å; P699-M704 HydrophobicContact CB-SD 3.85Å; P699-M704 HydrophobicContact CG-CE 4.04Å; P699-M704 HydrophobicContact CG-CG 3.56Å; P699-M704 HydrophobicContact CG-SD 3.44Å; P699-M704 WeakPolarHBondContact CG-SD 3.45Å
700	D	81.7	Confident	71.8	Confident	25 Å²	25	70 Å²	70	13%	0.134	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-55.8	131.6	-179.5	177.4	-78.9	0	0	0	111.6	F702 V703 M704 D726	D700-F702 VanDerWaalsContact C-N 3.25Å; D700-F702 PolarHBondContact O-N 3.26Å; D700-F702 WeakPolarHBondContact OD1-CA 3.45Å; D700-F702 VanDerWaalsContact OD1-CB 3.3Å; D700-F702 WeakPolarHBondContact OD1-CB 3.42Å; D700-F702 PolarHBondContact OD1-N 2.75Å; D700-V703 HydrophobicContact CB-CB 4.16Å; D700-V703 HydrophobicContact CB-CG2 3.86Å; D700-V703 PolarHBondContact O-N 3.06Å; D700-V703 VanDerWaalsContact O-N 3.13Å; D700-V703 PolarHBondContact OD1-N 2.91Å; D700-V703 VanDerWaalsContact OD1-N 3.09Å; D700-M704 WeakPolarHBondContact O-CG 3.31Å; D700-M704 PolarHBondContact O-N 3.4Å; D700-D726 HydrophobicContact CB-CB 4.39Å
701	P	84.5	Confident	73.9	Confident	24 Å²	24	73.2 Å²	73.2	16%	0.156	38%	0.376	C	S	.	.	H	α-helix	trans	-66.4	-23.9	-172.6	26.2	-34.9	0	0	0	113.4	I404 L690 L705	I404-P701 HydrophobicContact CG2-CB 4.07Å; L690-P701 HydrophobicContact CD1-CG 3.86Å; P701-L705 WeakPolarHBondContact O-CB 3.41Å; P701-L705 PolarHBondContact O-N 3.31Å
702	F	90.1	Very high	76.5	Confident	5 Å²	5	65.4 Å²	65.4	2%	0.022	35%	0.345	C	S	.	.	H	α-helix	trans	-80.1	-36	173.7	-53.6	-68.6	0	0	0	111.6	I404 F418 L420 L690 D700 M704 L705 A706 F715 L717 F722 F730	I404-F702 HydrophobicContact CD1-CD1 4.14Å; I404-F702 HydrophobicContact CD1-CE1 3.55Å; I404-F702 HydrophobicContact CD1-CZ 4.03Å; F418-F702 HydrophobicContact CE1-CD1 4.36Å; F418-F702 HydrophobicContact CE1-CE1 4.06Å; F418-F702 HydrophobicContact CZ-CE1 4.29Å; L420-F702 HydrophobicContact CD2-CE1 3.89Å; L420-F702 HydrophobicContact CD2-CZ 3.82Å; L690-F702 HydrophobicContact CD1-CE2 4.4Å; D700-F702 VanDerWaalsContact C-N 3.25Å; D700-F702 PolarHBondContact O-N 3.26Å; D700-F702 WeakPolarHBondContact OD1-CA 3.45Å; D700-F702 VanDerWaalsContact OD1-CB 3.3Å; D700-F702 WeakPolarHBondContact OD1-CB 3.42Å; D700-F702 PolarHBondContact OD1-N 2.75Å; F702-M704 VanDerWaalsContact C-N 3.32Å; F702-L705 WeakPolarHBondContact O-CB 3.42Å; F702-L705 PolarHBondContact O-N 3.26Å; F702-A706 PolarHBondContact O-N 3.13Å; F702-F715 HydrophobicContact CB-CE2 4.4Å; F702-F715 HydrophobicContact CB-CZ 4.07Å; F702-F715 AromaticContact CD1-CE2 3.85Å; F702-F715 HydrophobicContact CD1-CE2 3.85Å; F702-F715 AromaticContact CD1-CZ 3.73Å; F702-F715 HydrophobicContact CD1-CZ 3.73Å; F702-F715 HydrophobicContact CE1-CZ 4.42Å; F702-F715 HydrophobicContact CG-CE2 4.45Å; F702-F715 HydrophobicContact CG-CZ 4.03Å; F702-L717 HydrophobicContact CD2-CD2 4.21Å; F702-L717 HydrophobicContact CE1-CD1 4.1Å; F702-L717 HydrophobicContact CE2-CD1 4.43Å; F702-L717 HydrophobicContact CE2-CD2 3.98Å; F702-L717 HydrophobicContact CZ-CD1 3.83Å; F702-L717 HydrophobicContact CZ-CD2 4.16Å; F702-F722 HydrophobicContact CB-CE1 4.45Å; F702-F722 HydrophobicContact CB-CE2 4.01Å; F702-F722 HydrophobicContact CB-CZ 3.81Å; F702-F722 HydrophobicContact CD2-CD2 4.43Å; F702-F722 HydrophobicContact CD2-CE2 4.33Å; F702-F730 HydrophobicContact CB-CD2 4.33Å; F702-F730 HydrophobicContact CB-CE2 4.31Å; F702-F730 WeakPolarHBondContact O-CD2 3.43Å; F702-F730 VanDerWaalsContact O-CE2 3.22Å; F702-F730 WeakPolarHBondContact O-CE2 3.5Å
703	V	91	Very high	79	Confident	19 Å²	19	60.9 Å²	60.9	12%	0.115	33%	0.326	C	S	.	.	H	α-helix	trans	-62.6	-42	170.5	179.2	0	0	0	0	110.6	D700 L705 A706 W707 F722 D726 A729 L733	D700-V703 HydrophobicContact CB-CB 4.16Å; D700-V703 HydrophobicContact CB-CG2 3.86Å; D700-V703 PolarHBondContact O-N 3.06Å; D700-V703 VanDerWaalsContact O-N 3.13Å; D700-V703 PolarHBondContact OD1-N 2.91Å; D700-V703 VanDerWaalsContact OD1-N 3.09Å; V703-L705 VanDerWaalsContact C-N 3.33Å; V703-L705 PolarHBondContact O-N 3.3Å; V703-A706 PolarHBondContact O-N 3.48Å; V703-W707 PolarHBondContact O-N 3.02Å; V703-F722 HydrophobicContact CG2-CE2 4.48Å; V703-D726 HydrophobicContact CG2-CB 3.64Å; V703-D726 WeakPolarHBondContact CG2-O 3.09Å; V703-A729 HydrophobicContact CG1-CB 3.97Å; V703-A729 HydrophobicContact CG2-CB 4.33Å; V703-L733 HydrophobicContact CG1-CD1 3.77Å
704	M	89.9	Confident	81.6	Confident	38 Å²	38	59.6 Å²	59.6	19%	0.187	31%	0.311	C	S	.	.	H	α-helix	trans	-64.2	-36.8	173.3	-68.4	-65.6	-77	0	0	112.4	M408 P699 D700 F702 W707 R708	M408-M704 HydrophobicContact CE-CB 3.9Å; M408-M704 HydrophobicContact SD-CB 3.48Å; M408-M704 WeakPolarHBondContact SD-CB 3.27Å; P699-M704 HydrophobicContact CB-CG 3.82Å; P699-M704 HydrophobicContact CB-SD 3.85Å; P699-M704 HydrophobicContact CG-CE 4.04Å; P699-M704 HydrophobicContact CG-CG 3.56Å; P699-M704 HydrophobicContact CG-SD 3.44Å; P699-M704 WeakPolarHBondContact CG-SD 3.45Å; D700-M704 WeakPolarHBondContact O-CG 3.31Å; D700-M704 PolarHBondContact O-N 3.4Å; F702-M704 VanDerWaalsContact C-N 3.32Å; M704-W707 HydrophobicContact CE-CE3 3.87Å; M704-W707 HydrophobicContact CE-CZ3 3.86Å; M704-W707 PolarHBondContact O-N 2.84Å; M704-W707 HydrophobicContact SD-CE3 3.86Å; M704-W707 HydrophobicContact SD-CZ3 4.32Å; M704-R708 WeakPolarHBondContact O-CB 3.43Å; M704-R708 PolarHBondContact O-N 3.28Å
705	L	90.5	Very high	84	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-60.3	-46.9	172.6	-169.7	80.6	0	0	0	110.6	I404 M408 L415 F418 P701 F702 V703 W707 R708 C709 L712 F715	I404-L705 HydrophobicContact CG2-CD1 4.35Å; M408-L705 HydrophobicContact CG-CD1 3.88Å; M408-L705 HydrophobicContact SD-CB 4.39Å; M408-L705 PolarHBondContact SD-N 3.03Å; L415-L705 HydrophobicContact CD2-CD1 4.14Å; F418-L705 HydrophobicContact CB-CD2 4.15Å; F418-L705 HydrophobicContact CD1-CD2 4.05Å; F418-L705 HydrophobicContact CD2-CD2 3.89Å; F418-L705 HydrophobicContact CE1-CD2 4.42Å; F418-L705 HydrophobicContact CE2-CD2 4.28Å; F418-L705 HydrophobicContact CG-CD2 3.77Å; P701-L705 WeakPolarHBondContact O-CB 3.41Å; P701-L705 PolarHBondContact O-N 3.31Å; F702-L705 WeakPolarHBondContact O-CB 3.42Å; F702-L705 PolarHBondContact O-N 3.26Å; V703-L705 VanDerWaalsContact C-N 3.33Å; V703-L705 PolarHBondContact O-N 3.3Å; L705-W707 VanDerWaalsContact C-N 3.34Å; L705-W707 PolarHBondContact O-N 2.66Å; L705-R708 PolarHBondContact O-N 3.4Å; L705-C709 VanDerWaalsContact CD1-SG 3.51Å; L705-C709 WeakPolarHBondContact O-CA 3.35Å; L705-C709 WeakPolarHBondContact O-CB 3.36Å; L705-C709 PolarHBondContact O-N 2.81Å; L705-L712 HydrophobicContact CD2-CD2 4.06Å; L705-L712 HydrophobicContact CG-CD2 4.17Å; L705-F715 HydrophobicContact CD2-CD2 4.2Å; L705-F715 HydrophobicContact CD2-CE2 4.03Å
706	A	92.9	Very high	85.9	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.1	-36.5	176.4	0	0	0	0	0	113.5	F702 V703 F730 L733 R734	F702-A706 PolarHBondContact O-N 3.13Å; V703-A706 PolarHBondContact O-N 3.48Å; A706-F730 HydrophobicContact CB-CB 4.42Å; A706-F730 HydrophobicContact CB-CD1 4.1Å; A706-F730 HydrophobicContact CB-CD2 3.58Å; A706-F730 HydrophobicContact CB-CE1 4.2Å; A706-F730 HydrophobicContact CB-CE2 3.72Å; A706-F730 HydrophobicContact CB-CG 3.77Å; A706-F730 HydrophobicContact CB-CZ 4.01Å; A706-L733 HydrophobicContact CB-CB 4.17Å; A706-L733 HydrophobicContact CB-CD1 4.26Å; A706-R734 HydrophobicContact CB-CG 3.98Å; A706-R734 WeakPolarHBondContact O-CD 3.45Å; A706-R734 PolarHBondContact O-NH1 3.23Å
707	W	92.7	Very high	87.6	Confident	144 Å²	144	43 Å²	43	55%	0.545	22%	0.216	S	C	.	.	H	α-helix	trans	-71.4	-40.2	178	-179.5	51.2	0	0	0	112.9	V703 M704 L705 Q710 L733	V703-W707 PolarHBondContact O-N 3.02Å; M704-W707 HydrophobicContact CE-CE3 3.87Å; M704-W707 HydrophobicContact CE-CZ3 3.86Å; M704-W707 PolarHBondContact O-N 2.84Å; M704-W707 HydrophobicContact SD-CE3 3.86Å; M704-W707 HydrophobicContact SD-CZ3 4.32Å; L705-W707 VanDerWaalsContact C-N 3.34Å; L705-W707 PolarHBondContact O-N 2.66Å; W707-Q710 PolarHBondContact O-NE2 3.29Å; W707-L733 HydrophobicContact CB-CD1 4.05Å; W707-L733 HydrophobicContact CB-CD2 4.24Å; W707-L733 HydrophobicContact CG-CD2 4.41Å
708	R	92.2	Very high	88.8	Confident	86 Å²	86	36.6 Å²	36.6	33%	0.325	18%	0.177	S	C	.	.	H	α-helix	trans	-88.6	-42.6	-176.9	-74.5	-176.4	159	-155.4	2.5	113.8	D409 A412 M704 L705 Q710	D409-R708 IonicContact OD1-CZ 2.73Å; D409-R708 IonicContact OD1-NH1 2.69Å; D409-R708 PolarHBondContact OD1-NH1 3.08Å; D409-R708 IonicContact OD1-NH2 3.17Å; A412-R708 HydrophobicContact CB-CB 4.21Å; A412-R708 WeakPolarHBondContact CB-O 3.41Å; M704-R708 WeakPolarHBondContact O-CB 3.43Å; M704-R708 PolarHBondContact O-N 3.28Å; L705-R708 PolarHBondContact O-N 3.4Å; R708-Q710 VanDerWaalsContact C-N 3.34Å; R708-Q710 PolarHBondContact O-N 2.82Å
709	C	92.5	Very high	89.3	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.152	C	C	.	.			trans	-77.5	82.4	-176.4	-64.7	0	0	0	0	110.9	A412 L705 Q711 L712 R734	A412-C709 VanDerWaalsContact O-CA 3.3Å; A412-C709 WeakPolarHBondContact O-CA 3.26Å; L705-C709 VanDerWaalsContact CD1-SG 3.51Å; L705-C709 WeakPolarHBondContact O-CA 3.35Å; L705-C709 WeakPolarHBondContact O-CB 3.36Å; L705-C709 PolarHBondContact O-N 2.81Å; C709-Q711 PolarHBondContact O-N 3.32Å; C709-Q711 VanDerWaalsContact O-N 3.12Å; C709-L712 HydrophobicContact CB-CB 3.87Å; C709-L712 HydrophobicContact CB-CD2 4.44Å; C709-L712 WeakPolarHBondContact O-CB 3.25Å; C709-L712 PolarHBondContact O-N 2.6Å; C709-R734 PolarHBondContact O-NH1 2.96Å
710	Q	90.7	Very high	89.4	Confident	102 Å²	102	28.6 Å²	28.6	48%	0.477	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-11.6	-169.8	-74.4	-61.5	-20	0	0	115	A412 W707 R708 R734	A412-Q710 PolarHBondContact O-N 3.36Å; W707-Q710 PolarHBondContact O-NE2 3.29Å; R708-Q710 VanDerWaalsContact C-N 3.34Å; R708-Q710 PolarHBondContact O-N 2.82Å; Q710-R734 PolarHBondContact O-NH2 3.22Å
711	Q	92.9	Very high	89.4	Confident	101 Å²	101	33.5 Å²	33.5	47%	0.472	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-4.6	171.4	-62.2	-169.4	-5.2	0	0	113.7	M413 L415 E416 C709 S713	M413-Q711 PolarHBondContact O-NE2 3.3Å; M413-Q711 VanDerWaalsContact O-NE2 3.11Å; L415-Q711 CarbonylContact O-C 3.33Å; E416-Q711 WeakPolarHBondContact CA-O 3.41Å; C709-Q711 PolarHBondContact O-N 3.32Å; C709-Q711 VanDerWaalsContact O-N 3.12Å; Q711-S713 PolarHBondContact O-N 3.15Å
712	L	94.6	Very high	89.5	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	14%	0.141	C	C	.	.			trans	-61.3	109.9	-173.4	-171.8	67.3	0	0	0	111.1	L415 F418 L705 C709 F730 R734	L415-L712 PolarHBondContact O-N 3.25Å; F418-L712 HydrophobicContact CB-CD1 3.94Å; L705-L712 HydrophobicContact CD2-CD2 4.06Å; L705-L712 HydrophobicContact CG-CD2 4.17Å; C709-L712 HydrophobicContact CB-CB 3.87Å; C709-L712 HydrophobicContact CB-CD2 4.44Å; C709-L712 WeakPolarHBondContact O-CB 3.25Å; C709-L712 PolarHBondContact O-N 2.6Å; L712-F730 HydrophobicContact CD2-CE2 4.47Å; L712-F730 HydrophobicContact CD2-CZ 3.77Å; L712-R734 PolarHBondContact O-NE 3.22Å; L712-R734 PolarHBondContact O-NH2 3.38Å
713	S	94.8	Very high	89.4	Confident	5 Å²	5	32.7 Å²	32.7	4%	0.035	14%	0.143	C	C	.	.			trans	-119.4	-16.7	-178.6	70.2	0	0	0	0	113.7	E416 Q711 S737 L738 K739 S740	E416-S713 WeakPolarHBondContact CG-OG 3.33Å; E416-S713 PolarHBondContact O-N 2.83Å; E416-S713 PolarHBondContact OE1-OG 3.38Å; E416-S713 VanDerWaalsContact OE1-OG 3.14Å; Q711-S713 PolarHBondContact O-N 3.15Å; S713-S737 WeakPolarHBondContact CA-O 3.22Å; S713-S737 WeakPolarHBondContact CB-O 3.37Å; S713-L738 CarbonylContact O-C 3.54Å; S713-K739 PolarHBondContact O-N 2.92Å; S713-K739 PolarHBondContact OG-NZ 3.05Å; S713-S740 PolarHBondContact O-N 3.01Å
714	H	94.4	Very high	89.2	Confident	24 Å²	24	32 Å²	32	11%	0.111	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	123.8	173.1	-58.4	75.6	0	0	0	110.5	E416 H417 F418 S740	E416-H714 PolarHBondContact O-N 2.97Å; E416-H714 VanDerWaalsContact O-N 3.11Å; H417-H714 WeakPolarHBondContact CA-O 3.41Å; H417-H714 HydrophobicContact CB-CB 4.22Å; H417-H714 AromaticContact CD2-CE1 3.75Å; H417-H714 AromaticContact CD2-CG 3.39Å; H417-H714 AromaticContact CD2-ND1 3.16Å; H417-H714 PolarHBondContact CD2-ND1 2.76Å; H417-H714 AromaticContact NE2-CE1 3.49Å; H417-H714 PolarHBondContact NE2-CE1 3.06Å; H417-H714 AromaticContact NE2-CG 3.96Å; H417-H714 AromaticContact NE2-ND1 3.29Å; H417-H714 PolarHBondContact NE2-ND1 3.36Å; F418-H714 PolarHBondContact N-O 2.75Å; H714-S740 CarbonylContact C-O 3.6Å; H714-S740 WeakPolarHBondContact CA-O 3.26Å; H714-S740 WeakPolarHBondContact CD2-CB 3.5Å
715	F	94	Very high	89.1	Confident	0 Å²	0	34 Å²	34	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	128	175.2	-179.3	-93.5	0	0	0	110.5	F418 F702 L705 L717 F722 F730 L738 S740 F741 R742	F418-F715 HydrophobicContact CB-CD2 4.26Å; F418-F715 AromaticContact CD1-CD2 3.68Å; F418-F715 HydrophobicContact CD1-CD2 3.68Å; F418-F715 AromaticContact CD1-CE2 3.54Å; F418-F715 HydrophobicContact CD1-CE2 3.54Å; F418-F715 HydrophobicContact CE1-CD2 4.49Å; F418-F715 AromaticContact CE1-CE2 3.9Å; F418-F715 HydrophobicContact CE1-CE2 3.9Å; F418-F715 HydrophobicContact CG-CD2 4.34Å; F418-F715 HydrophobicContact CG-CE2 4.46Å; F418-F715 CarbonylContact O-C 3.53Å; F418-F715 WeakPolarHBondContact O-CA 3.28Å; F702-F715 HydrophobicContact CB-CE2 4.4Å; F702-F715 HydrophobicContact CB-CZ 4.07Å; F702-F715 AromaticContact CD1-CE2 3.85Å; F702-F715 HydrophobicContact CD1-CE2 3.85Å; F702-F715 AromaticContact CD1-CZ 3.73Å; F702-F715 HydrophobicContact CD1-CZ 3.73Å; F702-F715 HydrophobicContact CE1-CZ 4.42Å; F702-F715 HydrophobicContact CG-CE2 4.45Å; F702-F715 HydrophobicContact CG-CZ 4.03Å; L705-F715 HydrophobicContact CD2-CD2 4.2Å; L705-F715 HydrophobicContact CD2-CE2 4.03Å; F715-L717 HydrophobicContact CE1-CB 3.66Å; F715-L717 HydrophobicContact CE1-CD2 4.3Å; F715-L717 HydrophobicContact CZ-CB 3.94Å; F715-L717 HydrophobicContact CZ-CD2 4.18Å; F715-F722 HydrophobicContact CE1-CD1 4.37Å; F715-F722 AromaticContact CE1-CE1 3.96Å; F715-F722 HydrophobicContact CE1-CE1 3.96Å; F715-F722 HydrophobicContact CZ-CE1 4.32Å; F715-F730 HydrophobicContact CB-CE1 4Å; F715-F730 HydrophobicContact CB-CZ 3.68Å; F715-F730 HydrophobicContact CD1-CE1 4.25Å; F715-F730 HydrophobicContact CD1-CE2 4.22Å; F715-F730 AromaticContact CD1-CZ 3.81Å; F715-F730 HydrophobicContact CD1-CZ 3.81Å; F715-F730 HydrophobicContact CD2-CE1 4.49Å; F715-F730 AromaticContact CD2-CE2 3.78Å; F715-F730 HydrophobicContact CD2-CE2 3.78Å; F715-F730 AromaticContact CD2-CZ 3.44Å; F715-F730 HydrophobicContact CD2-CZ 3.44Å; F715-F730 VanDerWaalsContact CD2-CZ 3.44Å; F715-F730 HydrophobicContact CE1-CE2 4.19Å; F715-F730 HydrophobicContact CE1-CZ 4.25Å; F715-F730 AromaticContact CE2-CE2 3.75Å; F715-F730 HydrophobicContact CE2-CE2 3.75Å; F715-F730 AromaticContact CE2-CZ 3.93Å; F715-F730 HydrophobicContact CE2-CZ 3.93Å; F715-F730 HydrophobicContact CG-CE1 4.01Å; F715-F730 HydrophobicContact CG-CE2 4Å; F715-F730 AromaticContact CG-CZ 3.35Å; F715-F730 HydrophobicContact CG-CZ 3.35Å; F715-F730 AromaticContact CZ-CE2 3.96Å; F715-F730 HydrophobicContact CZ-CE2 3.96Å; F715-F730 HydrophobicContact CZ-CZ 4.3Å; F715-L738 HydrophobicContact CB-CD1 4.24Å; F715-S740 PolarHBondContact N-O 2.89Å; F715-F741 HydrophobicContact CB-CD2 4.22Å; F715-F741 AromaticContact CD1-CD2 3.73Å; F715-F741 HydrophobicContact CD1-CD2 3.73Å; F715-F741 AromaticContact CD1-CE2 3.6Å; F715-F741 HydrophobicContact CD1-CE2 3.6Å; F715-F741 HydrophobicContact CE1-CE2 4.09Å; F715-F741 HydrophobicContact CG-CD2 4.4Å; F715-F741 HydrophobicContact CG-CE2 4.47Å; F715-F741 WeakPolarHBondContact O-CA 3.43Å; F715-R742 PolarHBondContact O-N 3.4Å
716	T	91.4	Very high	89.1	Confident	9 Å²	9	35.4 Å²	35.4	6%	0.055	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	131.3	173.8	-59.5	0	0	0	0	110.1	F418 Y419 L420 I718 R742	F418-T716 PolarHBondContact O-N 2.81Å; Y419-T716 WeakPolarHBondContact CA-O 3.46Å; Y419-T716 HydrophobicContact CD1-CG2 4.28Å; Y419-T716 VanDerWaalsContact CD1-OG1 3.32Å; Y419-T716 WeakPolarHBondContact CD1-OG1 3.31Å; L420-T716 PolarHBondContact N-O 2.92Å; T716-I718 HydrophobicContact CG2-CD1 4.09Å; T716-I718 HydrophobicContact CG2-CG1 4.07Å; T716-R742 VanDerWaalsContact CA-O 3.3Å; T716-R742 WeakPolarHBondContact CA-O 3.26Å; T716-R742 HydrophobicContact CG2-CB 4.09Å
717	L	89	Confident	89	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	117.9	179.4	-177.8	64	0	0	0	109.7	L420 F702 F715 Y720 F722 R742 I743 P744	L420-L717 HydrophobicContact CB-CD1 3.93Å; L420-L717 HydrophobicContact CD2-CD1 3.55Å; L420-L717 HydrophobicContact CG-CD1 3.85Å; L420-L717 WeakPolarHBondContact O-CA 3.34Å; F702-L717 HydrophobicContact CD2-CD2 4.21Å; F702-L717 HydrophobicContact CE1-CD1 4.1Å; F702-L717 HydrophobicContact CE2-CD1 4.43Å; F702-L717 HydrophobicContact CE2-CD2 3.98Å; F702-L717 HydrophobicContact CZ-CD1 3.83Å; F702-L717 HydrophobicContact CZ-CD2 4.16Å; F715-L717 HydrophobicContact CE1-CB 3.66Å; F715-L717 HydrophobicContact CE1-CD2 4.3Å; F715-L717 HydrophobicContact CZ-CB 3.94Å; F715-L717 HydrophobicContact CZ-CD2 4.18Å; L717-Y720 HydrophobicContact CD1-CD2 3.8Å; L717-Y720 HydrophobicContact CD1-CG 4.15Å; L717-F722 HydrophobicContact CD2-CB 3.8Å; L717-F722 HydrophobicContact CD2-CD1 3.77Å; L717-F722 HydrophobicContact CD2-CG 3.91Å; L717-R742 PolarHBondContact N-O 3.39Å; L717-I743 HydrophobicContact CB-CG1 4.35Å; L717-P744 WeakPolarHBondContact O-CD 3.34Å
718	I	83.8	Confident	89	Confident	5 Å²	5	30.7 Å²	30.7	3%	0.026	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	138.5	-178.6	-56.5	-179.6	0	0	0	108.7	L420 I421 D422 T716 Y720 P744 L782 V786	L420-I718 PolarHBondContact O-N 2.75Å; I421-I718 WeakPolarHBondContact CA-O 3.27Å; I421-I718 HydrophobicContact CB-CB 4.44Å; I421-I718 HydrophobicContact CD1-CD1 4.01Å; I421-I718 HydrophobicContact CG1-CB 4.14Å; I421-I718 HydrophobicContact CG1-CD1 4.15Å; I421-I718 HydrophobicContact CG1-CG1 4.32Å; I421-I718 HydrophobicContact CG2-CB 4.21Å; I421-I718 HydrophobicContact CG2-CG2 4.31Å; D422-I718 PolarHBondContact N-O 3.15Å; T716-I718 HydrophobicContact CG2-CD1 4.09Å; T716-I718 HydrophobicContact CG2-CG1 4.07Å; I718-Y720 VanDerWaalsContact C-N 3.33Å; I718-P744 HydrophobicContact CB-CG 4.2Å; I718-P744 HydrophobicContact CG1-CG 3.85Å; I718-P744 HydrophobicContact CG2-CG 4.02Å; I718-L782 HydrophobicContact CD1-CD2 4.22Å; I718-L782 HydrophobicContact CG2-CD2 4.45Å; I718-V786 HydrophobicContact CG2-CG1 3.77Å; I718-V786 HydrophobicContact CG2-CG2 3.91Å
719	G	75.7	Confident	89	Confident	7 Å²	7	28.2 Å²	28.2	7%	0.072	14%	0.141	C	C	.	.	S	Bend	trans	83.3	2.5	-180	0	0	0	0	0	115	N425 C747	N425-G719 WeakPolarHBondContact CB-O 3.37Å; G719-C747 PolarHBondContact N-SG 2.97Å
720	Y	78.2	Confident	89.1	Confident	7 Å²	7	28.2 Å²	28.2	3%	0.027	14%	0.141	C	C	.	.	S	Bend	trans	-122.2	141.7	173.4	-69.9	-88.8	0	0	0	110.5	C395 L400 L420 D422 L717 I718 C747	C395-Y720 PolarHBondContact O-OH 3.47Å; L400-Y720 HydrophobicContact CD2-CE1 3.85Å; L400-Y720 HydrophobicContact CD2-CE2 4.21Å; L420-Y720 HydrophobicContact CD1-CE2 3.85Å; L420-Y720 HydrophobicContact CD2-CD2 3.8Å; L420-Y720 HydrophobicContact CD2-CE2 3.59Å; L420-Y720 HydrophobicContact CG-CD2 3.95Å; L420-Y720 HydrophobicContact CG-CE2 3.64Å; D422-Y720 HydrophobicContact CB-CD2 4.18Å; D422-Y720 HydrophobicContact CB-CE2 3.55Å; L717-Y720 HydrophobicContact CD1-CD2 3.8Å; L717-Y720 HydrophobicContact CD1-CG 4.15Å; I718-Y720 VanDerWaalsContact C-N 3.33Å; Y720-C747 WeakPolarHBondContact O-CB 3.48Å
721	W	81.8	Confident	89.3	Confident	127 Å²	127	23.4 Å²	23.4	48%	0.481	12%	0.119	S	C	.	.			trans	-76.4	124	171.8	-72.9	14.9	0	0	0	109.9	C747	W721-C747 CarbonylContact C-O 3.59Å; W721-C747 WeakPolarHBondContact CA-O 3.48Å
722	F	86.3	Confident	89.4	Confident	1 Å²	1	21.5 Å²	21.5	0%	0.004	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	124.3	177.7	-165.8	-166.1	0	0	0	109.5	F702 V703 F715 L717 D726 M727 F730 F741 I743 C747 S749	F702-F722 HydrophobicContact CB-CE1 4.45Å; F702-F722 HydrophobicContact CB-CE2 4.01Å; F702-F722 HydrophobicContact CB-CZ 3.81Å; F702-F722 HydrophobicContact CD2-CD2 4.43Å; F702-F722 HydrophobicContact CD2-CE2 4.33Å; V703-F722 HydrophobicContact CG2-CE2 4.48Å; F715-F722 HydrophobicContact CE1-CD1 4.37Å; F715-F722 AromaticContact CE1-CE1 3.96Å; F715-F722 HydrophobicContact CE1-CE1 3.96Å; F715-F722 HydrophobicContact CZ-CE1 4.32Å; L717-F722 HydrophobicContact CD2-CB 3.8Å; L717-F722 HydrophobicContact CD2-CD1 3.77Å; L717-F722 HydrophobicContact CD2-CG 3.91Å; F722-D726 HydrophobicContact CD2-CB 4.17Å; F722-D726 HydrophobicContact CE2-CB 3.7Å; F722-M727 HydrophobicContact CB-CG 4.3Å; F722-M727 HydrophobicContact CB-SD 4.3Å; F722-M727 HydrophobicContact CD1-CG 3.43Å; F722-M727 VanDerWaalsContact CD1-CG 3.43Å; F722-M727 HydrophobicContact CD1-SD 4.21Å; F722-M727 HydrophobicContact CD2-CG 4.19Å; F722-M727 HydrophobicContact CE1-CG 3.67Å; F722-M727 HydrophobicContact CE2-CG 4.4Å; F722-M727 HydrophobicContact CG-CG 3.69Å; F722-M727 HydrophobicContact CG-SD 4.33Å; F722-M727 HydrophobicContact CZ-CG 4.15Å; F722-F730 HydrophobicContact CE1-CD2 4.22Å; F722-F730 HydrophobicContact CE1-CG 4.5Å; F722-F730 HydrophobicContact CZ-CB 4.15Å; F722-F730 AromaticContact CZ-CD2 3.87Å; F722-F730 HydrophobicContact CZ-CD2 3.87Å; F722-F730 HydrophobicContact CZ-CG 4.29Å; F722-F741 HydrophobicContact CE1-CE2 4.42Å; F722-F741 HydrophobicContact CE1-CZ 4.28Å; F722-I743 HydrophobicContact CD1-CD1 3.57Å; F722-I743 HydrophobicContact CD1-CG1 4.4Å; F722-I743 HydrophobicContact CE1-CD1 3.99Å; F722-C747 PolarHBondContact N-O 3.36Å; F722-S749 VanDerWaalsContact C-OG 3.3Å; F722-S749 PolarHBondContact O-N 3.02Å; F722-S749 PolarHBondContact O-OG 3.42Å
723	N	87.3	Confident	89.4	Confident	12 Å²	12	24.8 Å²	24.8	6%	0.064	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	135.7	-170.8	-178.7	-63.9	0	0	0	111	V725 D726 M727 S749 D751	N723-V725 PolarHBondContact O-N 3.31Å; N723-V725 VanDerWaalsContact O-N 3.17Å; N723-V725 VanDerWaalsContact OD1-CB 3.27Å; N723-V725 WeakPolarHBondContact OD1-CB 3.3Å; N723-V725 PolarHBondContact OD1-N 2.85Å; N723-D726 HydrophobicContact CB-CB 4.15Å; N723-D726 CarbonylContact O-C 3.56Å; N723-D726 PolarHBondContact O-N 2.86Å; N723-M727 WeakPolarHBondContact O-CG 3.49Å; N723-M727 PolarHBondContact O-N 2.92Å; N723-S749 WeakPolarHBondContact CA-O 3.33Å; N723-S749 VanDerWaalsContact CA-OG 3.26Å; N723-S749 WeakPolarHBondContact CA-OG 3.37Å; N723-S749 PolarHBondContact N-OG 3.01Å; N723-D751 PolarHBondContact ND2-OD1 3.45Å; N723-D751 VanDerWaalsContact ND2-OD1 3.09Å; N723-D751 PolarHBondContact ND2-OD2 3.13Å
724	I	88.1	Confident	89.4	Confident	4 Å²	4	25.5 Å²	25.5	2%	0.021	14%	0.14	C	C	.	.	H	α-helix	trans	-60.8	-26.8	-176.7	-164.1	157.7	0	0	0	114.2	K728 V748 S749 I750 F757 L759 N762 M766	I724-K728 WeakPolarHBondContact O-CG 3.41Å; I724-K728 PolarHBondContact O-N 3.45Å; I724-V748 HydrophobicContact CB-CG1 4.1Å; I724-V748 HydrophobicContact CD1-CG1 4.19Å; I724-V748 HydrophobicContact CG1-CG1 4.4Å; I724-S749 PolarHBondContact N-O 2.8Å; I724-I750 HydrophobicContact CG2-CG1 4.35Å; I724-F757 HydrophobicContact CD1-CE1 4.42Å; I724-F757 HydrophobicContact CG2-CE1 4.11Å; I724-F757 HydrophobicContact CG2-CZ 4.03Å; I724-L759 HydrophobicContact CD1-CD1 4.13Å; I724-N762 HydrophobicContact CD1-CB 3.71Å; I724-N762 HydrophobicContact CG1-CB 4.23Å; I724-M766 HydrophobicContact CG1-CE 4.36Å
725	V	87.3	Confident	89.4	Confident	80 Å²	80	25.2 Å²	25.2	49%	0.485	14%	0.143	S	C	.	.	H	α-helix	trans	-73.2	-44.5	172.9	-175.2	0	0	0	0	110.7	N723 M727 K728 A729	N723-V725 PolarHBondContact O-N 3.31Å; N723-V725 VanDerWaalsContact O-N 3.17Å; N723-V725 VanDerWaalsContact OD1-CB 3.27Å; N723-V725 WeakPolarHBondContact OD1-CB 3.3Å; N723-V725 PolarHBondContact OD1-N 2.85Å; V725-M727 VanDerWaalsContact C-N 3.3Å; V725-M727 PolarHBondContact O-N 2.88Å; V725-K728 WeakPolarHBondContact O-CB 3.24Å; V725-K728 PolarHBondContact O-N 2.79Å; V725-A729 PolarHBondContact O-N 3.38Å
726	D	90.4	Very high	89.3	Confident	30 Å²	30	30.7 Å²	30.7	16%	0.16	18%	0.177	C	C	.	.	H	α-helix	trans	-65.3	-34.1	175.5	-69.7	-43.2	0	0	0	110.8	K692 D700 V703 F722 N723 A729 F730	K692-D726 IonicContact NZ-OD2 2.71Å; K692-D726 PolarHBondContact NZ-OD2 2.75Å; D700-D726 HydrophobicContact CB-CB 4.39Å; V703-D726 HydrophobicContact CG2-CB 3.64Å; V703-D726 WeakPolarHBondContact CG2-O 3.09Å; F722-D726 HydrophobicContact CD2-CB 4.17Å; F722-D726 HydrophobicContact CE2-CB 3.7Å; N723-D726 HydrophobicContact CB-CB 4.15Å; N723-D726 CarbonylContact O-C 3.56Å; N723-D726 PolarHBondContact O-N 2.86Å; D726-A729 PolarHBondContact O-N 2.89Å; D726-F730 WeakPolarHBondContact O-CB 3.29Å; D726-F730 PolarHBondContact O-N 2.87Å
727	M	92	Very high	89.4	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-66.4	-39.2	170.9	-70.1	172.6	54.9	0	0	113.5	F722 N723 V725 F730 T731 F741 I743 V748 M766 W774	F722-M727 HydrophobicContact CB-CG 4.3Å; F722-M727 HydrophobicContact CB-SD 4.3Å; F722-M727 HydrophobicContact CD1-CG 3.43Å; F722-M727 VanDerWaalsContact CD1-CG 3.43Å; F722-M727 HydrophobicContact CD1-SD 4.21Å; F722-M727 HydrophobicContact CD2-CG 4.19Å; F722-M727 HydrophobicContact CE1-CG 3.67Å; F722-M727 HydrophobicContact CE2-CG 4.4Å; F722-M727 HydrophobicContact CG-CG 3.69Å; F722-M727 HydrophobicContact CG-SD 4.33Å; F722-M727 HydrophobicContact CZ-CG 4.15Å; N723-M727 WeakPolarHBondContact O-CG 3.49Å; N723-M727 PolarHBondContact O-N 2.92Å; V725-M727 VanDerWaalsContact C-N 3.3Å; V725-M727 PolarHBondContact O-N 2.88Å; M727-F730 PolarHBondContact O-N 3.45Å; M727-T731 WeakPolarHBondContact O-CG2 3.27Å; M727-T731 PolarHBondContact O-N 2.93Å; M727-T731 PolarHBondContact O-OG1 3.03Å; M727-F741 HydrophobicContact CB-CZ 4.41Å; M727-F741 HydrophobicContact CE-CE1 4.26Å; M727-F741 HydrophobicContact CG-CZ 4.4Å; M727-I743 HydrophobicContact CE-CD1 3.62Å; M727-I743 HydrophobicContact CG-CD1 4.04Å; M727-I743 HydrophobicContact SD-CD1 3.95Å; M727-V748 HydrophobicContact CE-CG1 4.49Å; M727-V748 HydrophobicContact CE-CG2 3.96Å; M727-V748 HydrophobicContact SD-CB 4.43Å; M727-V748 HydrophobicContact SD-CG1 3.97Å; M727-V748 HydrophobicContact SD-CG2 4Å; M727-M766 HydrophobicContact CB-SD 3.89Å; M727-M766 HydrophobicContact CE-CE 4.23Å; M727-M766 HydrophobicContact CE-SD 3.85Å; M727-W774 HydrophobicContact CE-CH2 3.55Å; M727-W774 HydrophobicContact CE-CZ2 4.21Å; M727-W774 HydrophobicContact CE-CZ3 4.1Å
728	K	91	Very high	89.7	Confident	45 Å²	45	32.4 Å²	32.4	20%	0.196	19%	0.189	C	C	.	.	H	α-helix	trans	-61.1	-46	170.8	-77.6	-178.3	-178.8	-161.7	0	111	I724 V725 F730 T731 A732 N762 E765 M766	I724-K728 WeakPolarHBondContact O-CG 3.41Å; I724-K728 PolarHBondContact O-N 3.45Å; V725-K728 WeakPolarHBondContact O-CB 3.24Å; V725-K728 PolarHBondContact O-N 2.79Å; K728-F730 PolarHBondContact O-N 2.83Å; K728-T731 PolarHBondContact O-N 3.02Å; K728-T731 PolarHBondContact O-OG1 2.97Å; K728-T731 VanDerWaalsContact O-OG1 3.04Å; K728-A732 VanDerWaalsContact O-CB 3.28Å; K728-A732 WeakPolarHBondContact O-CB 3.16Å; K728-A732 PolarHBondContact O-N 3.41Å; K728-N762 WeakPolarHBondContact CE-OD1 3.42Å; K728-N762 PolarHBondContact NZ-OD1 3.42Å; K728-E765 WeakPolarHBondContact CE-OE2 3.39Å; K728-E765 IonicContact NZ-OE2 2.67Å; K728-E765 PolarHBondContact NZ-OE2 2.97Å; K728-M766 HydrophobicContact CG-CG 4.25Å
729	A	92.1	Very high	90.2	Very high	34 Å²	34	38.1 Å²	38.1	28%	0.281	21%	0.214	S	C	.	.	H	α-helix	trans	-59.7	-46.8	175.9	0	0	0	0	0	111.6	V703 V725 D726 T731 A732 L733	V703-A729 HydrophobicContact CG1-CB 3.97Å; V703-A729 HydrophobicContact CG2-CB 4.33Å; V725-A729 PolarHBondContact O-N 3.38Å; D726-A729 PolarHBondContact O-N 2.89Å; A729-T731 PolarHBondContact O-N 3.07Å; A729-A732 PolarHBondContact O-N 2.98Å; A729-L733 WeakPolarHBondContact O-CB 3.45Å; A729-L733 WeakPolarHBondContact O-CD1 3.36Å; A729-L733 WeakPolarHBondContact O-CG 3.48Å; A729-L733 PolarHBondContact O-N 2.9Å
730	F	94.8	Very high	91	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-56.7	-51.1	176.8	-168.6	-70.4	0	0	0	112.2	F702 A706 L712 F715 F722 D726 M727 K728 L733 R734 L738 F741	F702-F730 HydrophobicContact CB-CD2 4.33Å; F702-F730 HydrophobicContact CB-CE2 4.31Å; F702-F730 WeakPolarHBondContact O-CD2 3.43Å; F702-F730 VanDerWaalsContact O-CE2 3.22Å; F702-F730 WeakPolarHBondContact O-CE2 3.5Å; A706-F730 HydrophobicContact CB-CB 4.42Å; A706-F730 HydrophobicContact CB-CD1 4.1Å; A706-F730 HydrophobicContact CB-CD2 3.58Å; A706-F730 HydrophobicContact CB-CE1 4.2Å; A706-F730 HydrophobicContact CB-CE2 3.72Å; A706-F730 HydrophobicContact CB-CG 3.77Å; A706-F730 HydrophobicContact CB-CZ 4.01Å; L712-F730 HydrophobicContact CD2-CE2 4.47Å; L712-F730 HydrophobicContact CD2-CZ 3.77Å; F715-F730 HydrophobicContact CB-CE1 4Å; F715-F730 HydrophobicContact CB-CZ 3.68Å; F715-F730 HydrophobicContact CD1-CE1 4.25Å; F715-F730 HydrophobicContact CD1-CE2 4.22Å; F715-F730 AromaticContact CD1-CZ 3.81Å; F715-F730 HydrophobicContact CD1-CZ 3.81Å; F715-F730 HydrophobicContact CD2-CE1 4.49Å; F715-F730 AromaticContact CD2-CE2 3.78Å; F715-F730 HydrophobicContact CD2-CE2 3.78Å; F715-F730 AromaticContact CD2-CZ 3.44Å; F715-F730 HydrophobicContact CD2-CZ 3.44Å; F715-F730 VanDerWaalsContact CD2-CZ 3.44Å; F715-F730 HydrophobicContact CE1-CE2 4.19Å; F715-F730 HydrophobicContact CE1-CZ 4.25Å; F715-F730 AromaticContact CE2-CE2 3.75Å; F715-F730 HydrophobicContact CE2-CE2 3.75Å; F715-F730 AromaticContact CE2-CZ 3.93Å; F715-F730 HydrophobicContact CE2-CZ 3.93Å; F715-F730 HydrophobicContact CG-CE1 4.01Å; F715-F730 HydrophobicContact CG-CE2 4Å; F715-F730 AromaticContact CG-CZ 3.35Å; F715-F730 HydrophobicContact CG-CZ 3.35Å; F715-F730 AromaticContact CZ-CE2 3.96Å; F715-F730 HydrophobicContact CZ-CE2 3.96Å; F715-F730 HydrophobicContact CZ-CZ 4.3Å; F722-F730 HydrophobicContact CE1-CD2 4.22Å; F722-F730 HydrophobicContact CE1-CG 4.5Å; F722-F730 HydrophobicContact CZ-CB 4.15Å; F722-F730 AromaticContact CZ-CD2 3.87Å; F722-F730 HydrophobicContact CZ-CD2 3.87Å; F722-F730 HydrophobicContact CZ-CG 4.29Å; D726-F730 WeakPolarHBondContact O-CB 3.29Å; D726-F730 PolarHBondContact O-N 2.87Å; M727-F730 PolarHBondContact O-N 3.45Å; K728-F730 PolarHBondContact O-N 2.83Å; F730-L733 PolarHBondContact O-N 3.16Å; F730-R734 HydrophobicContact CD1-CG 4.44Å; F730-R734 HydrophobicContact CE1-CG 4.17Å; F730-R734 PolarHBondContact O-N 3.09Å; F730-L738 HydrophobicContact CD1-CD2 3.89Å; F730-L738 HydrophobicContact CE1-CD1 4.08Å; F730-L738 HydrophobicContact CE1-CD2 3.7Å; F730-F741 HydrophobicContact CD1-CD2 4.1Å; F730-F741 AromaticContact CD1-CE2 3.43Å; F730-F741 HydrophobicContact CD1-CE2 3.43Å; F730-F741 VanDerWaalsContact CD1-CE2 3.43Å; F730-F741 AromaticContact CD1-CZ 3.97Å; F730-F741 HydrophobicContact CD1-CZ 3.97Å; F730-F741 AromaticContact CE1-CD2 3.94Å; F730-F741 HydrophobicContact CE1-CD2 3.94Å; F730-F741 AromaticContact CE1-CE2 3.61Å; F730-F741 HydrophobicContact CE1-CE2 3.61Å; F730-F741 HydrophobicContact CG-CE2 4.04Å; F730-F741 HydrophobicContact CG-CZ 4.34Å; F730-F741 HydrophobicContact CZ-CE2 4.31Å
731	T	95.3	Very high	91.7	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-66.7	-38.6	-179.4	53.6	0	0	0	0	112.2	M727 K728 A729 G735 L738 F741 M766 N769 V770	M727-T731 WeakPolarHBondContact O-CG2 3.27Å; M727-T731 PolarHBondContact O-N 2.93Å; M727-T731 PolarHBondContact O-OG1 3.03Å; K728-T731 PolarHBondContact O-N 3.02Å; K728-T731 PolarHBondContact O-OG1 2.97Å; K728-T731 VanDerWaalsContact O-OG1 3.04Å; A729-T731 PolarHBondContact O-N 3.07Å; T731-G735 WeakPolarHBondContact O-CA 3.44Å; T731-G735 PolarHBondContact O-N 3.23Å; T731-L738 HydrophobicContact CG2-CD2 4.44Å; T731-F741 HydrophobicContact CG2-CD1 3.67Å; T731-F741 HydrophobicContact CG2-CE1 3.35Å; T731-F741 HydrophobicContact CG2-CG 4.46Å; T731-F741 HydrophobicContact CG2-CZ 3.89Å; T731-M766 HydrophobicContact CG2-CB 4.28Å; T731-M766 HydrophobicContact CG2-CG 4.21Å; T731-N769 PolarHBondContact OG1-ND2 3.32Å; T731-V770 HydrophobicContact CG2-CG1 3.76Å
732	A	94.4	Very high	92.2	Very high	62 Å²	62	36.8 Å²	36.8	51%	0.512	21%	0.208	S	C	.	.	H	α-helix	trans	-66	-37.7	175.1	0	0	0	0	0	112.7	K728 A729	K728-A732 VanDerWaalsContact O-CB 3.28Å; K728-A732 WeakPolarHBondContact O-CB 3.16Å; K728-A732 PolarHBondContact O-N 3.41Å; A729-A732 PolarHBondContact O-N 2.98Å
733	L	95.2	Very high	92.3	Very high	69 Å²	69	36.8 Å²	36.8	36%	0.361	21%	0.208	S	C	.	.	H	α-helix	trans	-67.7	-34.8	178.8	-78.4	166.2	0	0	0	113.5	V703 A706 W707 A729 F730	V703-L733 HydrophobicContact CG1-CD1 3.77Å; A706-L733 HydrophobicContact CB-CB 4.17Å; A706-L733 HydrophobicContact CB-CD1 4.26Å; W707-L733 HydrophobicContact CB-CD1 4.05Å; W707-L733 HydrophobicContact CB-CD2 4.24Å; W707-L733 HydrophobicContact CG-CD2 4.41Å; A729-L733 WeakPolarHBondContact O-CB 3.45Å; A729-L733 WeakPolarHBondContact O-CD1 3.36Å; A729-L733 WeakPolarHBondContact O-CG 3.48Å; A729-L733 PolarHBondContact O-N 2.9Å; F730-L733 PolarHBondContact O-N 3.16Å
734	R	94.3	Very high	92.3	Very high	20 Å²	20	36.2 Å²	36.2	8%	0.075	21%	0.205	C	C	.	.	H	α-helix	trans	-92	-30	177.9	-60.4	-48.9	-50.3	144	7.7	113.7	A706 C709 Q710 L712 F730 S737 L738	A706-R734 HydrophobicContact CB-CG 3.98Å; A706-R734 WeakPolarHBondContact O-CD 3.45Å; A706-R734 PolarHBondContact O-NH1 3.23Å; C709-R734 PolarHBondContact O-NH1 2.96Å; Q710-R734 PolarHBondContact O-NH2 3.22Å; L712-R734 PolarHBondContact O-NE 3.22Å; L712-R734 PolarHBondContact O-NH2 3.38Å; F730-R734 HydrophobicContact CD1-CG 4.44Å; F730-R734 HydrophobicContact CE1-CG 4.17Å; F730-R734 PolarHBondContact O-N 3.09Å; R734-S737 PolarHBondContact NH2-OG 2.91Å; R734-S737 WeakPolarHBondContact O-CB 3.32Å; R734-S737 PolarHBondContact O-N 3.12Å; R734-S737 PolarHBondContact O-OG 2.88Å; R734-L738 HydrophobicContact CB-CB 3.75Å; R734-L738 HydrophobicContact CB-CD2 4.18Å; R734-L738 HydrophobicContact CB-CG 4.39Å; R734-L738 HydrophobicContact CG-CB 4.49Å; R734-L738 HydrophobicContact CG-CD1 4.42Å; R734-L738 HydrophobicContact CG-CD2 4.38Å
735	G	94.1	Very high	92	Very high	18 Å²	18	38.7 Å²	38.7	19%	0.186	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	52	-143.3	-174.1	0	0	0	0	0	112.9	T731 S737 L738 N769	T731-G735 WeakPolarHBondContact O-CA 3.44Å; T731-G735 PolarHBondContact O-N 3.23Å; G735-S737 PolarHBondContact O-N 3.06Å; G735-L738 PolarHBondContact O-N 3.42Å; G735-L738 VanDerWaalsContact O-N 3.16Å; G735-N769 CarbonylContact C-O 3.18Å; G735-N769 WeakPolarHBondContact CA-O 2.93Å
736	T	93.9	Very high	91.7	Very high	115 Å²	115	36.4 Å²	36.4	71%	0.706	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-67.2	-0.2	179.8	60.7	0	0	0	0	115.4	L738 N769 V770	T736-L738 VanDerWaalsContact C-N 3.32Å; T736-N769 PolarHBondContact N-O 3.3Å; T736-V770 WeakPolarHBondContact CA-O 3.43Å
737	S	93.4	Very high	91.4	Very high	45 Å²	45	35.1 Å²	35.1	32%	0.315	20%	0.203	S	C	.	.	G	3₁₀ helix	trans	-77.4	-18.7	170.4	75.1	0	0	0	0	113.1	S713 R734 G735 K739	S713-S737 WeakPolarHBondContact CA-O 3.22Å; S713-S737 WeakPolarHBondContact CB-O 3.37Å; R734-S737 PolarHBondContact NH2-OG 2.91Å; R734-S737 WeakPolarHBondContact O-CB 3.32Å; R734-S737 PolarHBondContact O-N 3.12Å; R734-S737 PolarHBondContact O-OG 2.88Å; G735-S737 PolarHBondContact O-N 3.06Å; S737-K739 VanDerWaalsContact C-N 3.3Å; S737-K739 PolarHBondContact O-N 3.3Å
738	L	94.5	Very high	91.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.212	C	C	.	.			trans	-82.3	68.3	-177.3	-169.3	59.5	0	0	0	112	S713 F715 F730 T731 R734 G735 T736 S740 F741 V770 Y772	S713-L738 CarbonylContact O-C 3.54Å; F715-L738 HydrophobicContact CB-CD1 4.24Å; F730-L738 HydrophobicContact CD1-CD2 3.89Å; F730-L738 HydrophobicContact CE1-CD1 4.08Å; F730-L738 HydrophobicContact CE1-CD2 3.7Å; T731-L738 HydrophobicContact CG2-CD2 4.44Å; R734-L738 HydrophobicContact CB-CB 3.75Å; R734-L738 HydrophobicContact CB-CD2 4.18Å; R734-L738 HydrophobicContact CB-CG 4.39Å; R734-L738 HydrophobicContact CG-CB 4.49Å; R734-L738 HydrophobicContact CG-CD1 4.42Å; R734-L738 HydrophobicContact CG-CD2 4.38Å; G735-L738 PolarHBondContact O-N 3.42Å; G735-L738 VanDerWaalsContact O-N 3.16Å; T736-L738 VanDerWaalsContact C-N 3.32Å; L738-S740 PolarHBondContact O-N 2.97Å; L738-F741 HydrophobicContact CD2-CB 3.85Å; L738-F741 HydrophobicContact CD2-CD2 3.75Å; L738-F741 HydrophobicContact CD2-CE2 4.38Å; L738-F741 HydrophobicContact CD2-CG 3.85Å; L738-F741 HydrophobicContact CG-CB 4.08Å; L738-V770 HydrophobicContact CB-CG1 4.44Å; L738-V770 HydrophobicContact CD2-CG1 4.12Å; L738-Y772 WeakPolarHBondContact O-CE1 2.97Å; L738-Y772 PolarHBondContact O-OH 2.85Å
739	K	94	Very high	90.7	Very high	124 Å²	124	35.5 Å²	35.5	54%	0.539	21%	0.21	S	C	.	.	S	Bend	trans	-43.8	-36.5	178.2	-57.6	167.4	-165.6	156.4	0	113.7	E416 S713 S737	E416-K739 IonicContact OE1-NZ 2.74Å; E416-K739 PolarHBondContact OE1-NZ 3.48Å; S713-K739 PolarHBondContact O-N 2.92Å; S713-K739 PolarHBondContact OG-NZ 3.05Å; S737-K739 VanDerWaalsContact C-N 3.3Å; S737-K739 PolarHBondContact O-N 3.3Å
740	S	92.3	Very high	89.9	Confident	10 Å²	10	37.6 Å²	37.6	7%	0.07	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	122.1	-179.7	-166.7	0	0	0	0	111.9	S713 H714 F715 L738 R742	S713-S740 PolarHBondContact O-N 3.01Å; H714-S740 CarbonylContact C-O 3.6Å; H714-S740 WeakPolarHBondContact CA-O 3.26Å; H714-S740 WeakPolarHBondContact CD2-CB 3.5Å; F715-S740 PolarHBondContact N-O 2.89Å; L738-S740 PolarHBondContact O-N 2.97Å; S740-R742 PolarHBondContact OG-NE 3.23Å
741	F	93.9	Very high	88.6	Confident	7 Å²	7	41.5 Å²	41.5	3%	0.031	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	109.9	173.9	-169.8	-132.5	0	0	0	107.7	F715 F722 M727 F730 T731 L738 I743 Y772 W774	F715-F741 HydrophobicContact CB-CD2 4.22Å; F715-F741 AromaticContact CD1-CD2 3.73Å; F715-F741 HydrophobicContact CD1-CD2 3.73Å; F715-F741 AromaticContact CD1-CE2 3.6Å; F715-F741 HydrophobicContact CD1-CE2 3.6Å; F715-F741 HydrophobicContact CE1-CE2 4.09Å; F715-F741 HydrophobicContact CG-CD2 4.4Å; F715-F741 HydrophobicContact CG-CE2 4.47Å; F715-F741 WeakPolarHBondContact O-CA 3.43Å; F722-F741 HydrophobicContact CE1-CE2 4.42Å; F722-F741 HydrophobicContact CE1-CZ 4.28Å; M727-F741 HydrophobicContact CB-CZ 4.41Å; M727-F741 HydrophobicContact CE-CE1 4.26Å; M727-F741 HydrophobicContact CG-CZ 4.4Å; F730-F741 HydrophobicContact CD1-CD2 4.1Å; F730-F741 AromaticContact CD1-CE2 3.43Å; F730-F741 HydrophobicContact CD1-CE2 3.43Å; F730-F741 VanDerWaalsContact CD1-CE2 3.43Å; F730-F741 AromaticContact CD1-CZ 3.97Å; F730-F741 HydrophobicContact CD1-CZ 3.97Å; F730-F741 AromaticContact CE1-CD2 3.94Å; F730-F741 HydrophobicContact CE1-CD2 3.94Å; F730-F741 AromaticContact CE1-CE2 3.61Å; F730-F741 HydrophobicContact CE1-CE2 3.61Å; F730-F741 HydrophobicContact CG-CE2 4.04Å; F730-F741 HydrophobicContact CG-CZ 4.34Å; F730-F741 HydrophobicContact CZ-CE2 4.31Å; T731-F741 HydrophobicContact CG2-CD1 3.67Å; T731-F741 HydrophobicContact CG2-CE1 3.35Å; T731-F741 HydrophobicContact CG2-CG 4.46Å; T731-F741 HydrophobicContact CG2-CZ 3.89Å; L738-F741 HydrophobicContact CD2-CB 3.85Å; L738-F741 HydrophobicContact CD2-CD2 3.75Å; L738-F741 HydrophobicContact CD2-CE2 4.38Å; L738-F741 HydrophobicContact CD2-CG 3.85Å; L738-F741 HydrophobicContact CG-CB 4.08Å; F741-I743 HydrophobicContact CD1-CD1 4.37Å; F741-I743 HydrophobicContact CD2-CD1 4.28Å; F741-I743 HydrophobicContact CE1-CD1 3.69Å; F741-I743 HydrophobicContact CE2-CD1 3.61Å; F741-I743 HydrophobicContact CZ-CD1 3.28Å; F741-Y772 PolarHBondContact N-OH 3.33Å; F741-W774 AromaticContact CD1-CD1 3.92Å; F741-W774 HydrophobicContact CD1-CD2 4.28Å; F741-W774 AromaticContact CD1-CE2 3.64Å; F741-W774 HydrophobicContact CD1-CG 4.45Å; F741-W774 HydrophobicContact CD1-CZ2 4.03Å; F741-W774 AromaticContact CD1-NE1 3.41Å; F741-W774 HydrophobicContact CE1-CZ2 4.28Å; F741-W774 AromaticContact CG-NE1 3.93Å; F741-W774 PolarHBondContact O-NE1 3.19Å
742	R	90.8	Very high	86.8	Confident	97 Å²	97	48 Å²	48	37%	0.366	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	106.5	-174.2	-62.1	-175.2	-175.7	172.7	4.9	110.9	F715 T716 L717 S740 D812	F715-R742 PolarHBondContact O-N 3.4Å; T716-R742 VanDerWaalsContact CA-O 3.3Å; T716-R742 WeakPolarHBondContact CA-O 3.26Å; T716-R742 HydrophobicContact CG2-CB 4.09Å; L717-R742 PolarHBondContact N-O 3.39Å; S740-R742 PolarHBondContact OG-NE 3.23Å; R742-D812 PolarHBondContact NH1-O 2.77Å; R742-D812 PolarHBondContact NH2-O 3.41Å; R742-D812 PolarHBondContact NH2-OXT 3.42Å
743	I	89.2	Confident	84.9	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	29%	0.29	C	S	.	.			trans	-130.8	128.7	177.1	-62.3	158.4	0	0	0	107.5	L717 F722 M727 F741 C747 V748 W774 P776 L777	L717-I743 HydrophobicContact CB-CG1 4.35Å; F722-I743 HydrophobicContact CD1-CD1 3.57Å; F722-I743 HydrophobicContact CD1-CG1 4.4Å; F722-I743 HydrophobicContact CE1-CD1 3.99Å; M727-I743 HydrophobicContact CE-CD1 3.62Å; M727-I743 HydrophobicContact CG-CD1 4.04Å; M727-I743 HydrophobicContact SD-CD1 3.95Å; F741-I743 HydrophobicContact CD1-CD1 4.37Å; F741-I743 HydrophobicContact CD2-CD1 4.28Å; F741-I743 HydrophobicContact CE1-CD1 3.69Å; F741-I743 HydrophobicContact CE2-CD1 3.61Å; F741-I743 HydrophobicContact CZ-CD1 3.28Å; I743-C747 HydrophobicContact CG2-CB 3.98Å; I743-V748 HydrophobicContact CG2-CG2 4.06Å; I743-W774 HydrophobicContact CB-CZ2 4.32Å; I743-P776 CarbonylContact O-C 3.52Å; I743-P776 WeakPolarHBondContact O-CA 3.49Å; I743-L777 PolarHBondContact O-N 2.92Å
744	P	86.5	Confident	82.9	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-61.7	149.3	177.8	-22.9	31.9	0	0	0	113.3	L717 I718 C746 C747 L777 L782	L717-P744 WeakPolarHBondContact O-CD 3.34Å; I718-P744 HydrophobicContact CB-CG 4.2Å; I718-P744 HydrophobicContact CG1-CG 3.85Å; I718-P744 HydrophobicContact CG2-CG 4.02Å; P744-C746 VanDerWaalsContact C-N 3.28Å; P744-C746 PolarHBondContact O-N 3.11Å; P744-C747 HydrophobicContact CB-CB 3.99Å; P744-C747 HydrophobicContact CG-CB 4.06Å; P744-C747 PolarHBondContact O-N 3.26Å; P744-L777 CarbonylContact C-O 3.6Å; P744-L777 VanDerWaalsContact CA-O 3.28Å; P744-L777 WeakPolarHBondContact CA-O 3.46Å; P744-L782 HydrophobicContact CB-CD1 4.3Å; P744-L782 HydrophobicContact CB-CD2 3.87Å; P744-L782 HydrophobicContact CG-CD1 4.47Å; P744-L782 HydrophobicContact CG-CD2 3.53Å
745	S	83.9	Confident	80.6	Confident	56 Å²	56	60.8 Å²	60.8	39%	0.392	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-51.7	-46.6	172.2	20.5	0	0	0	0	112.5	C747 V748 L777 D779	S745-C747 PolarHBondContact O-N 2.93Å; S745-V748 PolarHBondContact O-N 3.49Å; S745-L777 PolarHBondContact N-O 3.21Å; S745-L777 PolarHBondContact OG-O 3.47Å; S745-D779 PolarHBondContact OG-OD1 2.87Å
746	C	79.5	Confident	78.6	Confident	33 Å²	33	65.6 Å²	65.6	22%	0.223	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-67.8	-15.4	177.7	56.5	0	0	0	0	114.8	I427 P744 D779	I427-C746 HydrophobicContact CD1-CB 3.62Å; I427-C746 WeakPolarHBondContact CD1-O 3.31Å; P744-C746 VanDerWaalsContact C-N 3.28Å; P744-C746 PolarHBondContact O-N 3.11Å; C746-D779 WeakPolarHBondContact CB-OD2 3.36Å; C746-D779 PolarHBondContact N-OD1 3.13Å; C746-D779 VanDerWaalsContact SG-CG 3.6Å; C746-D779 PolarHBondContact SG-OD1 3.42Å; C746-D779 PolarHBondContact SG-OD2 3Å; C746-D779 VanDerWaalsContact SG-OD2 3.39Å
747	C	84.3	Confident	76.8	Confident	2 Å²	2	62.9 Å²	62.9	1%	0.014	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-93.9	-2.7	-179.6	-70.3	0	0	0	0	114	G719 Y720 W721 F722 I743 P744 S745	G719-C747 PolarHBondContact N-SG 2.97Å; Y720-C747 WeakPolarHBondContact O-CB 3.48Å; W721-C747 CarbonylContact C-O 3.59Å; W721-C747 WeakPolarHBondContact CA-O 3.48Å; F722-C747 PolarHBondContact N-O 3.36Å; I743-C747 HydrophobicContact CG2-CB 3.98Å; P744-C747 HydrophobicContact CB-CB 3.99Å; P744-C747 HydrophobicContact CG-CB 4.06Å; P744-C747 PolarHBondContact O-N 3.26Å; S745-C747 PolarHBondContact O-N 2.93Å
748	V	85.6	Confident	75.8	Confident	32 Å²	32	64.1 Å²	64.1	19%	0.194	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	114.9	176.1	-177.8	0	0	0	0	109.5	I724 M727 I743 S745	I724-V748 HydrophobicContact CB-CG1 4.1Å; I724-V748 HydrophobicContact CD1-CG1 4.19Å; I724-V748 HydrophobicContact CG1-CG1 4.4Å; M727-V748 HydrophobicContact CE-CG1 4.49Å; M727-V748 HydrophobicContact CE-CG2 3.96Å; M727-V748 HydrophobicContact SD-CB 4.43Å; M727-V748 HydrophobicContact SD-CG1 3.97Å; M727-V748 HydrophobicContact SD-CG2 4Å; I743-V748 HydrophobicContact CG2-CG2 4.06Å; S745-V748 PolarHBondContact O-N 3.49Å
749	S	83.3	Confident	74.7	Confident	22 Å²	22	68.2 Å²	68.2	15%	0.154	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	146.9	173.3	57.9	0	0	0	0	112.4	F722 N723 I724	F722-S749 VanDerWaalsContact C-OG 3.3Å; F722-S749 PolarHBondContact O-N 3.02Å; F722-S749 PolarHBondContact O-OG 3.42Å; N723-S749 WeakPolarHBondContact CA-O 3.33Å; N723-S749 VanDerWaalsContact CA-OG 3.26Å; N723-S749 WeakPolarHBondContact CA-OG 3.37Å; N723-S749 PolarHBondContact N-OG 3.01Å; I724-S749 PolarHBondContact N-O 2.8Å
750	I	75.3	Confident	74	Confident	78 Å²	78	67.5 Å²	67.5	40%	0.4	35%	0.35	S	S	.	.			trans	-127.1	115.7	-172.8	-81.3	174.5	0	0	0	106.9	I724 F757	I724-I750 HydrophobicContact CG2-CG1 4.35Å; I750-F757 HydrophobicContact CB-CE1 4.34Å; I750-F757 HydrophobicContact CB-CE2 4.44Å; I750-F757 HydrophobicContact CB-CZ 3.94Å; I750-F757 HydrophobicContact CD1-CD1 4.11Å; I750-F757 HydrophobicContact CD1-CE1 3.72Å; I750-F757 HydrophobicContact CD1-CZ 4.21Å; I750-F757 HydrophobicContact CG1-CD1 4.49Å; I750-F757 HydrophobicContact CG1-CE1 3.63Å; I750-F757 HydrophobicContact CG1-CZ 3.71Å; I750-F757 HydrophobicContact CG2-CD2 4.05Å; I750-F757 HydrophobicContact CG2-CE1 3.97Å; I750-F757 HydrophobicContact CG2-CE2 3.39Å; I750-F757 HydrophobicContact CG2-CZ 3.35Å
751	D	67.4	Low	73.6	Confident	81 Å²	81	71.7 Å²	71.7	43%	0.433	37%	0.368	S	S	.	.			trans	-79.5	131	173.6	-71.4	-20.5	0	0	0	109.9	N723 Q753 S754	N723-D751 PolarHBondContact ND2-OD1 3.45Å; N723-D751 VanDerWaalsContact ND2-OD1 3.09Å; N723-D751 PolarHBondContact ND2-OD2 3.13Å; D751-Q753 PolarHBondContact O-N 3.45Å; D751-S754 PolarHBondContact O-N 2.88Å; D751-S754 PolarHBondContact O-OG 3.17Å
752	D	56.9	Low	73.1	Confident	136 Å²	136	72.3 Å²	72.3	73%	0.727	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-55.9	-18.7	176.1	-68.4	-46.4	0	0	0	113.8	S754 W755	D752-S754 VanDerWaalsContact C-N 3.31Å; D752-W755 VanDerWaalsContact O-CD1 3.23Å
753	Q	54.4	Low	72.9	Confident	192 Å²	192	69.2 Å²	69.2	90%	0.897	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-78.8	-9.8	176.3	-58.7	-170.9	26.2	0	0	114	D751	D751-Q753 PolarHBondContact O-N 3.45Å
754	S	53.8	Low	72.8	Confident	41 Å²	41	73.1 Å²	73.1	29%	0.287	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-97.4	21.6	-179.8	53.3	0	0	0	0	114.2	D751 D752 F757	D751-S754 PolarHBondContact O-N 2.88Å; D751-S754 PolarHBondContact O-OG 3.17Å; D752-S754 VanDerWaalsContact C-N 3.31Å; S754-F757 WeakPolarHBondContact O-CD2 3.26Å; S754-F757 WeakPolarHBondContact O-CE2 3.38Å; S754-F757 WeakPolarHBondContact OG-CE2 3.41Å; S754-F757 WeakPolarHBondContact OG-CZ 3.48Å
755	W	45.5	Very low	73	Confident	187 Å²	187	76.1 Å²	76.1	71%	0.708	40%	0.397	S	S	*	.			trans	-71.4	151.6	168.3	-84.9	71.9	0	0	0	112.7	D752 F757	D752-W755 VanDerWaalsContact O-CD1 3.23Å; W755-F757 HydrophobicContact CG-CD2 4.36Å
756	P	51.5	Low	73.4	Confident	119 Å²	119	73.5 Å²	73.5	77%	0.773	38%	0.379	S	S	*	.	S	Bend	cis	-81.2	131.4	0.4	31.8	-33	0	0	0	112.3	N758	P756-N758 PolarHBondContact O-N 3.25Å
757	F	57.7	Low	74	Confident	58 Å²	58	72.8 Å²	72.8	25%	0.254	37%	0.374	S	S	.	.			trans	-74.1	111.8	-174.7	-104.6	-91.3	0	0	0	113.3	I724 I750 S754 W755	I724-F757 HydrophobicContact CD1-CE1 4.42Å; I724-F757 HydrophobicContact CG2-CE1 4.11Å; I724-F757 HydrophobicContact CG2-CZ 4.03Å; I750-F757 HydrophobicContact CB-CE1 4.34Å; I750-F757 HydrophobicContact CB-CE2 4.44Å; I750-F757 HydrophobicContact CB-CZ 3.94Å; I750-F757 HydrophobicContact CD1-CD1 4.11Å; I750-F757 HydrophobicContact CD1-CE1 3.72Å; I750-F757 HydrophobicContact CD1-CZ 4.21Å; I750-F757 HydrophobicContact CG1-CD1 4.49Å; I750-F757 HydrophobicContact CG1-CE1 3.63Å; I750-F757 HydrophobicContact CG1-CZ 3.71Å; I750-F757 HydrophobicContact CG2-CD2 4.05Å; I750-F757 HydrophobicContact CG2-CE1 3.97Å; I750-F757 HydrophobicContact CG2-CE2 3.39Å; I750-F757 HydrophobicContact CG2-CZ 3.35Å; S754-F757 WeakPolarHBondContact O-CD2 3.26Å; S754-F757 WeakPolarHBondContact O-CE2 3.38Å; S754-F757 WeakPolarHBondContact OG-CE2 3.41Å; S754-F757 WeakPolarHBondContact OG-CZ 3.48Å; W755-F757 HydrophobicContact CG-CD2 4.36Å
758	N	70.5	Confident	74.5	Confident	72 Å²	72	80.7 Å²	80.7	39%	0.385	40%	0.403	S	S	.	.			trans	-102.5	86.2	161	-170.2	-5.2	0	0	0	109	P756 D760 E761 N762	P756-N758 PolarHBondContact O-N 3.25Å; N758-D760 VanDerWaalsContact C-N 3.28Å; N758-D760 PolarHBondContact O-N 2.94Å; N758-E761 HydrophobicContact CB-CB 3.81Å; N758-E761 VanDerWaalsContact ND2-CB 3.25Å; N758-E761 WeakPolarHBondContact ND2-CB 3.28Å; N758-E761 PolarHBondContact ND2-OE2 3.32Å; N758-E761 PolarHBondContact O-N 3.4Å; N758-E761 VanDerWaalsContact O-N 3.13Å; N758-E761 PolarHBondContact OD1-N 3.2Å; N758-N762 PolarHBondContact O-N 2.93Å; N758-N762 VanDerWaalsContact O-N 3.08Å
759	L	73.1	Confident	74.9	Confident	86 Å²	86	81.1 Å²	81.1	45%	0.45	40%	0.404	S	S	.	.	H	α-helix	trans	-58.3	-42.5	-177.8	-176.6	65.9	0	0	0	111.2	I724 E761 N762 L763	I724-L759 HydrophobicContact CD1-CD1 4.13Å; L759-E761 VanDerWaalsContact C-N 3.31Å; L759-E761 PolarHBondContact O-N 3.47Å; L759-N762 WeakPolarHBondContact O-CB 3.33Å; L759-N762 PolarHBondContact O-N 2.96Å; L759-L763 HydrophobicContact CG-CD1 4.15Å; L759-L763 HydrophobicContact CG-CG 4.37Å; L759-L763 VanDerWaalsContact O-CG 3.3Å; L759-L763 WeakPolarHBondContact O-CG 3.32Å; L759-L763 PolarHBondContact O-N 3.31Å
760	D	79	Confident	75.4	Confident	109 Å²	109	80.2 Å²	80.2	58%	0.583	40%	0.398	S	S	*	.	H	α-helix	trans	-60.6	-38.9	176.9	-72.2	-42.6	0	0	0	112	N758 L763 N764	N758-D760 VanDerWaalsContact C-N 3.28Å; N758-D760 PolarHBondContact O-N 2.94Å; D760-L763 PolarHBondContact O-N 2.92Å; D760-N764 WeakPolarHBondContact O-CB 3.2Å; D760-N764 VanDerWaalsContact O-CG 3.29Å; D760-N764 PolarHBondContact O-N 3.44Å; D760-N764 PolarHBondContact O-ND2 3.08Å
761	E	83.6	Confident	76.2	Confident	98 Å²	98	79.1 Å²	79.1	46%	0.458	41%	0.406	S	S	.	.	H	α-helix	trans	-67.1	-39.7	175.6	178.9	162.8	-154.9	0	0	112.4	N758 L759 N764 E765	N758-E761 HydrophobicContact CB-CB 3.81Å; N758-E761 VanDerWaalsContact ND2-CB 3.25Å; N758-E761 WeakPolarHBondContact ND2-CB 3.28Å; N758-E761 PolarHBondContact ND2-OE2 3.32Å; N758-E761 PolarHBondContact O-N 3.4Å; N758-E761 VanDerWaalsContact O-N 3.13Å; N758-E761 PolarHBondContact OD1-N 3.2Å; L759-E761 VanDerWaalsContact C-N 3.31Å; L759-E761 PolarHBondContact O-N 3.47Å; E761-N764 PolarHBondContact O-N 3.08Å; E761-E765 WeakPolarHBondContact O-CB 3.32Å; E761-E765 PolarHBondContact O-N 3.46Å
762	N	83.8	Confident	77.4	Confident	19 Å²	19	79 Å²	79	10%	0.102	40%	0.401	C	S	.	.	H	α-helix	trans	-62.8	-43.3	173.7	-63.7	-25.1	0	0	0	112	I724 K728 N758 L759 E765 M766	I724-N762 HydrophobicContact CD1-CB 3.71Å; I724-N762 HydrophobicContact CG1-CB 4.23Å; K728-N762 WeakPolarHBondContact CE-OD1 3.42Å; K728-N762 PolarHBondContact NZ-OD1 3.42Å; N758-N762 PolarHBondContact O-N 2.93Å; N758-N762 VanDerWaalsContact O-N 3.08Å; L759-N762 WeakPolarHBondContact O-CB 3.33Å; L759-N762 PolarHBondContact O-N 2.96Å; N762-E765 PolarHBondContact O-N 3.45Å; N762-M766 WeakPolarHBondContact O-CE 3.15Å; N762-M766 WeakPolarHBondContact O-CG 3.46Å; N762-M766 PolarHBondContact O-N 2.77Å; N762-M766 VanDerWaalsContact O-N 3.07Å
763	L	85.3	Confident	79.1	Confident	33 Å²	33	80.7 Å²	80.7	17%	0.173	40%	0.401	C	S	.	.	H	α-helix	trans	-66.3	-40.8	175.8	-67.7	178.2	0	0	0	112.3	L759 D760 M766 S767 W774 P776	L759-L763 HydrophobicContact CG-CD1 4.15Å; L759-L763 HydrophobicContact CG-CG 4.37Å; L759-L763 VanDerWaalsContact O-CG 3.3Å; L759-L763 WeakPolarHBondContact O-CG 3.32Å; L759-L763 PolarHBondContact O-N 3.31Å; D760-L763 PolarHBondContact O-N 2.92Å; L763-M766 HydrophobicContact CD2-CE 3.98Å; L763-S767 WeakPolarHBondContact O-CB 3.41Å; L763-S767 PolarHBondContact O-N 3.23Å; L763-S767 PolarHBondContact O-OG 3.01Å; L763-W774 HydrophobicContact CD2-CE3 3.84Å; L763-W774 HydrophobicContact CD2-CZ3 3.56Å; L763-P776 HydrophobicContact CD2-CG 4.04Å
764	N	88.1	Confident	80.9	Confident	82 Å²	82	72 Å²	72	44%	0.439	36%	0.36	S	S	.	.	H	α-helix	trans	-66.7	-38.4	175.4	-82.3	-65.1	0	0	0	111.7	D760 E761 S767 R768	D760-N764 WeakPolarHBondContact O-CB 3.2Å; D760-N764 VanDerWaalsContact O-CG 3.29Å; D760-N764 PolarHBondContact O-N 3.44Å; D760-N764 PolarHBondContact O-ND2 3.08Å; E761-N764 PolarHBondContact O-N 3.08Å; N764-S767 PolarHBondContact O-N 3.2Å; N764-R768 WeakPolarHBondContact O-CG 3.43Å; N764-R768 PolarHBondContact O-N 3.04Å
765	E	90.9	Very high	82.6	Confident	63 Å²	63	74.4 Å²	74.4	29%	0.294	37%	0.369	S	S	.	.	H	α-helix	trans	-64.3	-49.5	175.7	-169.6	-175.9	152.2	0	0	111.4	K728 E761 N762 S767 R768 N769	K728-E765 WeakPolarHBondContact CE-OE2 3.39Å; K728-E765 IonicContact NZ-OE2 2.67Å; K728-E765 PolarHBondContact NZ-OE2 2.97Å; E761-E765 WeakPolarHBondContact O-CB 3.32Å; E761-E765 PolarHBondContact O-N 3.46Å; N762-E765 PolarHBondContact O-N 3.45Å; E765-S767 VanDerWaalsContact C-N 3.28Å; E765-S767 PolarHBondContact O-N 2.93Å; E765-R768 WeakPolarHBondContact O-CB 3.33Å; E765-R768 PolarHBondContact O-N 2.98Å; E765-R768 VanDerWaalsContact O-N 3.13Å; E765-N769 VanDerWaalsContact O-CG 3.24Å; E765-N769 PolarHBondContact O-N 3.27Å; E765-N769 PolarHBondContact O-OD1 3.09Å
766	M	91.1	Very high	84.6	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-58.6	-40.6	174.4	-71.2	-174.1	-73.7	0	0	111.8	I724 M727 K728 T731 N762 L763 N769 V770 W774	I724-M766 HydrophobicContact CG1-CE 4.36Å; M727-M766 HydrophobicContact CB-SD 3.89Å; M727-M766 HydrophobicContact CE-CE 4.23Å; M727-M766 HydrophobicContact CE-SD 3.85Å; K728-M766 HydrophobicContact CG-CG 4.25Å; T731-M766 HydrophobicContact CG2-CB 4.28Å; T731-M766 HydrophobicContact CG2-CG 4.21Å; N762-M766 WeakPolarHBondContact O-CE 3.15Å; N762-M766 WeakPolarHBondContact O-CG 3.46Å; N762-M766 PolarHBondContact O-N 2.77Å; N762-M766 VanDerWaalsContact O-N 3.07Å; L763-M766 HydrophobicContact CD2-CE 3.98Å; M766-N769 PolarHBondContact O-N 3.4Å; M766-V770 WeakPolarHBondContact O-CG2 3.46Å; M766-V770 PolarHBondContact O-N 2.81Å; M766-W774 HydrophobicContact CB-CE3 4.36Å; M766-W774 HydrophobicContact CE-CE3 3.87Å; M766-W774 HydrophobicContact CE-CZ3 3.56Å; M766-W774 HydrophobicContact SD-CE3 4.31Å; M766-W774 HydrophobicContact SD-CZ3 4.19Å
767	S	93.6	Very high	86.2	Confident	17 Å²	17	63.2 Å²	63.2	12%	0.119	32%	0.318	C	S	.	.	H	α-helix	trans	-62.1	-41.5	174.5	-61.2	0	0	0	0	113.2	L763 N764 E765 N769 G771 Y772 W774	L763-S767 WeakPolarHBondContact O-CB 3.41Å; L763-S767 PolarHBondContact O-N 3.23Å; L763-S767 PolarHBondContact O-OG 3.01Å; N764-S767 PolarHBondContact O-N 3.2Å; E765-S767 VanDerWaalsContact C-N 3.28Å; E765-S767 PolarHBondContact O-N 2.93Å; S767-N769 VanDerWaalsContact C-N 3.34Å; S767-G771 PolarHBondContact O-N 2.83Å; S767-Y772 CarbonylContact C-O 3.57Å; S767-Y772 VanDerWaalsContact CA-O 3.27Å; S767-Y772 WeakPolarHBondContact CA-O 3.48Å; S767-Y772 WeakPolarHBondContact CB-O 3.41Å; S767-Y772 PolarHBondContact O-N 3.03Å; S767-Y772 VanDerWaalsContact O-O 3.08Å; S767-W774 PolarHBondContact OG-N 3.32Å; S767-W774 PolarHBondContact OG-O 3.01Å
768	R	93.6	Very high	87.2	Confident	168 Å²	168	66 Å²	66	63%	0.634	33%	0.332	S	S	*	.	H	α-helix	trans	-63.1	-41.4	174.6	-69.8	165.1	-156.7	155.9	4.3	111.1	N764 E765	N764-R768 WeakPolarHBondContact O-CG 3.43Å; N764-R768 PolarHBondContact O-N 3.04Å; E765-R768 WeakPolarHBondContact O-CB 3.33Å; E765-R768 PolarHBondContact O-N 2.98Å; E765-R768 VanDerWaalsContact O-N 3.13Å
769	N	94.5	Very high	87.3	Confident	41 Å²	41	64.3 Å²	64.3	22%	0.219	32%	0.323	C	S	.	.	H	α-helix	trans	-63.2	-49.9	-179.6	-66.7	-15.1	0	0	0	111.4	T731 G735 T736 E765 M766 S767	T731-N769 PolarHBondContact OG1-ND2 3.32Å; G735-N769 CarbonylContact C-O 3.18Å; G735-N769 WeakPolarHBondContact CA-O 2.93Å; T736-N769 PolarHBondContact N-O 3.3Å; E765-N769 VanDerWaalsContact O-CG 3.24Å; E765-N769 PolarHBondContact O-N 3.27Å; E765-N769 PolarHBondContact O-OD1 3.09Å; M766-N769 PolarHBondContact O-N 3.4Å; S767-N769 VanDerWaalsContact C-N 3.34Å
770	V	93.7	Very high	87.1	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.018	34%	0.34	C	S	.	.	H	α-helix	trans	-81.4	-13.2	-177.4	-53.9	0	0	0	0	114.1	T731 T736 L738 M766 Y772 W774	T731-V770 HydrophobicContact CG2-CG1 3.76Å; T736-V770 WeakPolarHBondContact CA-O 3.43Å; L738-V770 HydrophobicContact CB-CG1 4.44Å; L738-V770 HydrophobicContact CD2-CG1 4.12Å; M766-V770 WeakPolarHBondContact O-CG2 3.46Å; M766-V770 PolarHBondContact O-N 2.81Å; V770-Y772 VanDerWaalsContact C-N 3.33Å; V770-Y772 HydrophobicContact CB-CD1 4.04Å; V770-Y772 HydrophobicContact CB-CE1 3.56Å; V770-Y772 HydrophobicContact CG2-CD1 3.68Å; V770-Y772 HydrophobicContact CG2-CD2 3.94Å; V770-Y772 HydrophobicContact CG2-CE1 3.49Å; V770-Y772 VanDerWaalsContact CG2-CE1 3.49Å; V770-Y772 HydrophobicContact CG2-CE2 3.76Å; V770-Y772 HydrophobicContact CG2-CG 3.9Å; V770-Y772 VanDerWaalsContact O-CD1 3.29Å; V770-Y772 WeakPolarHBondContact O-CD1 3.32Å; V770-Y772 PolarHBondContact O-N 3.3Å; V770-W774 HydrophobicContact CG2-CB 4.22Å
771	G	92.9	Very high	86.8	Confident	56 Å²	56	67.2 Å²	67.2	58%	0.577	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.7	6.5	175.9	0	0	0	0	0	115.6	S767	S767-G771 PolarHBondContact O-N 2.83Å
772	Y	92.4	Very high	86	Confident	79 Å²	79	63.3 Å²	63.3	31%	0.31	32%	0.32	S	S	.	.	S	Bend	trans	-135.2	163.7	172.2	55.8	-89.9	0	0	0	109.9	L738 F741 S767 V770 W774	L738-Y772 WeakPolarHBondContact O-CE1 2.97Å; L738-Y772 PolarHBondContact O-OH 2.85Å; F741-Y772 PolarHBondContact N-OH 3.33Å; S767-Y772 CarbonylContact C-O 3.57Å; S767-Y772 VanDerWaalsContact CA-O 3.27Å; S767-Y772 WeakPolarHBondContact CA-O 3.48Å; S767-Y772 WeakPolarHBondContact CB-O 3.41Å; S767-Y772 PolarHBondContact O-N 3.03Å; S767-Y772 VanDerWaalsContact O-O 3.08Å; V770-Y772 VanDerWaalsContact C-N 3.33Å; V770-Y772 HydrophobicContact CB-CD1 4.04Å; V770-Y772 HydrophobicContact CB-CE1 3.56Å; V770-Y772 HydrophobicContact CG2-CD1 3.68Å; V770-Y772 HydrophobicContact CG2-CD2 3.94Å; V770-Y772 HydrophobicContact CG2-CE1 3.49Å; V770-Y772 VanDerWaalsContact CG2-CE1 3.49Å; V770-Y772 HydrophobicContact CG2-CE2 3.76Å; V770-Y772 HydrophobicContact CG2-CG 3.9Å; V770-Y772 VanDerWaalsContact O-CD1 3.29Å; V770-Y772 WeakPolarHBondContact O-CD1 3.32Å; V770-Y772 PolarHBondContact O-N 3.3Å; Y772-W774 PolarHBondContact O-N 3.2Å
773	K	92.5	Very high	85	Confident	170 Å²	170	65 Å²	65	74%	0.739	33%	0.332	S	S	*	.			trans	-67.6	103.9	175.9	-171.7	-172.4	179.5	-168.9	0	109.2	I775	K773-I775 HydrophobicContact CD-CD1 4.15Å; K773-I775 HydrophobicContact CD-CG1 4.43Å; K773-I775 HydrophobicContact CG-CG1 4.32Å
774	W	91.8	Very high	83.7	Confident	9 Å²	9	67 Å²	67	3%	0.034	35%	0.348	C	S	.	.			trans	-85.1	140.1	173.3	-169.5	77.7	0	0	0	110.7	M727 F741 I743 L763 M766 S767 V770 Y772 P776	M727-W774 HydrophobicContact CE-CH2 3.55Å; M727-W774 HydrophobicContact CE-CZ2 4.21Å; M727-W774 HydrophobicContact CE-CZ3 4.1Å; F741-W774 AromaticContact CD1-CD1 3.92Å; F741-W774 HydrophobicContact CD1-CD2 4.28Å; F741-W774 AromaticContact CD1-CE2 3.64Å; F741-W774 HydrophobicContact CD1-CG 4.45Å; F741-W774 HydrophobicContact CD1-CZ2 4.03Å; F741-W774 AromaticContact CD1-NE1 3.41Å; F741-W774 HydrophobicContact CE1-CZ2 4.28Å; F741-W774 AromaticContact CG-NE1 3.93Å; F741-W774 PolarHBondContact O-NE1 3.19Å; I743-W774 HydrophobicContact CB-CZ2 4.32Å; L763-W774 HydrophobicContact CD2-CE3 3.84Å; L763-W774 HydrophobicContact CD2-CZ3 3.56Å; M766-W774 HydrophobicContact CB-CE3 4.36Å; M766-W774 HydrophobicContact CE-CE3 3.87Å; M766-W774 HydrophobicContact CE-CZ3 3.56Å; M766-W774 HydrophobicContact SD-CE3 4.31Å; M766-W774 HydrophobicContact SD-CZ3 4.19Å; S767-W774 PolarHBondContact OG-N 3.32Å; S767-W774 PolarHBondContact OG-O 3.01Å; V770-W774 HydrophobicContact CG2-CB 4.22Å; Y772-W774 PolarHBondContact O-N 3.2Å; W774-P776 HydrophobicContact CH2-CB 4.04Å; W774-P776 HydrophobicContact CH2-CG 3.71Å; W774-P776 HydrophobicContact CZ3-CG 3.73Å
775	I	89.4	Confident	82.1	Confident	93 Å²	93	63.6 Å²	63.6	48%	0.477	33%	0.332	S	S	.	.			trans	-142.3	140.5	175.5	-50.1	179.6	0	0	0	105.8	K773	K773-I775 HydrophobicContact CD-CD1 4.15Å; K773-I775 HydrophobicContact CD-CG1 4.43Å; K773-I775 HydrophobicContact CG-CG1 4.32Å
776	P	87.1	Confident	80.7	Confident	27 Å²	27	61.2 Å²	61.2	18%	0.175	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-54.3	146.2	169.2	-22	31.9	0	0	0	110.7	I743 L763 W774 E778	I743-P776 CarbonylContact O-C 3.52Å; I743-P776 WeakPolarHBondContact O-CA 3.49Å; L763-P776 HydrophobicContact CD2-CG 4.04Å; W774-P776 HydrophobicContact CH2-CB 4.04Å; W774-P776 HydrophobicContact CH2-CG 3.71Å; W774-P776 HydrophobicContact CZ3-CG 3.73Å; P776-E778 PolarHBondContact O-N 3.49Å
777	L	85	Confident	79.1	Confident	44 Å²	44	66.1 Å²	66.1	23%	0.23	34%	0.34	C	S	.	.	B	Isolated β-bridge	trans	-66.4	116.9	174.4	-179.7	62.5	0	0	0	108.2	I743 P744 S745 D779 N781 L782	I743-L777 PolarHBondContact O-N 2.92Å; P744-L777 CarbonylContact C-O 3.6Å; P744-L777 VanDerWaalsContact CA-O 3.28Å; P744-L777 WeakPolarHBondContact CA-O 3.46Å; S745-L777 PolarHBondContact N-O 3.21Å; S745-L777 PolarHBondContact OG-O 3.47Å; L777-D779 PolarHBondContact O-N 3.31Å; L777-N781 HydrophobicContact CD1-CB 3.66Å; L777-N781 HydrophobicContact CG-CB 4.37Å; L777-L782 HydrophobicContact CD2-CD2 3.68Å; L777-L782 HydrophobicContact CG-CD2 4.13Å
778	E	79.8	Confident	77.1	Confident	116 Å²	116	69.1 Å²	69.1	54%	0.542	36%	0.355	S	S	.	.	P	Polyproline II helix	trans	-60	137.9	177.3	-52.3	174.3	154.7	0	0	109.5	P776 L780 N781	P776-E778 PolarHBondContact O-N 3.49Å; E778-L780 PolarHBondContact O-N 2.76Å; E778-L780 VanDerWaalsContact O-N 3.1Å; E778-N781 WeakPolarHBondContact O-CB 3.38Å; E778-N781 PolarHBondContact O-N 2.83Å; E778-N781 PolarHBondContact OE2-ND2 2.6Å; E778-N781 VanDerWaalsContact OE2-ND2 3.14Å
779	D	71.5	Confident	74.9	Confident	37 Å²	37	68.8 Å²	68.8	20%	0.198	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-50.8	-37.2	-178.6	-75.8	26.2	0	0	0	112.6	S745 C746 L777 N781 L782 W787	S745-D779 PolarHBondContact OG-OD1 2.87Å; C746-D779 WeakPolarHBondContact CB-OD2 3.36Å; C746-D779 PolarHBondContact N-OD1 3.13Å; C746-D779 VanDerWaalsContact SG-CG 3.6Å; C746-D779 PolarHBondContact SG-OD1 3.42Å; C746-D779 PolarHBondContact SG-OD2 3Å; C746-D779 VanDerWaalsContact SG-OD2 3.39Å; L777-D779 PolarHBondContact O-N 3.31Å; D779-N781 PolarHBondContact O-N 2.92Å; D779-N781 VanDerWaalsContact O-N 3.12Å; D779-L782 WeakPolarHBondContact O-CB 3.44Å; D779-L782 VanDerWaalsContact O-CG 3.25Å; D779-L782 WeakPolarHBondContact O-CG 3.28Å; D779-L782 PolarHBondContact O-N 2.77Å; D779-L782 VanDerWaalsContact O-N 3.1Å; D779-W787 HydrophobicContact CB-CH2 4.12Å; D779-W787 HydrophobicContact CB-CZ2 3.8Å; D779-W787 WeakPolarHBondContact O-CZ2 3.44Å; D779-W787 PolarHBondContact O-NE1 3.28Å; D779-W787 VanDerWaalsContact O-NE1 3.16Å
780	L	69.4	Low	72.7	Confident	157 Å²	157	73.6 Å²	73.6	82%	0.822	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-61.3	-19.6	176.1	-66.7	173.6	0	0	0	114.7	E778	E778-L780 PolarHBondContact O-N 2.76Å; E778-L780 VanDerWaalsContact O-N 3.1Å
781	N	72.2	Confident	70.6	Confident	99 Å²	99	77.3 Å²	77.3	53%	0.529	41%	0.406	S	S	.	.	G	3₁₀ helix	trans	-97.7	7.3	179.4	-62.6	-64.5	0	0	0	113.1	L777 E778 D779	L777-N781 HydrophobicContact CD1-CB 3.66Å; L777-N781 HydrophobicContact CG-CB 4.37Å; E778-N781 WeakPolarHBondContact O-CB 3.38Å; E778-N781 PolarHBondContact O-N 2.83Å; E778-N781 PolarHBondContact OE2-ND2 2.6Å; E778-N781 VanDerWaalsContact OE2-ND2 3.14Å; D779-N781 PolarHBondContact O-N 2.92Å; D779-N781 VanDerWaalsContact O-N 3.12Å
782	L	67.1	Low	68.5	Low	15 Å²	15	75.5 Å²	75.5	8%	0.079	38%	0.384	C	S	.	.	S	Bend	trans	-74.7	144.2	174.5	-56.9	175.6	0	0	0	111.6	I718 P744 L777 D779 V786 W787	I718-L782 HydrophobicContact CD1-CD2 4.22Å; I718-L782 HydrophobicContact CG2-CD2 4.45Å; P744-L782 HydrophobicContact CB-CD1 4.3Å; P744-L782 HydrophobicContact CB-CD2 3.87Å; P744-L782 HydrophobicContact CG-CD1 4.47Å; P744-L782 HydrophobicContact CG-CD2 3.53Å; L777-L782 HydrophobicContact CD2-CD2 3.68Å; L777-L782 HydrophobicContact CG-CD2 4.13Å; D779-L782 WeakPolarHBondContact O-CB 3.44Å; D779-L782 VanDerWaalsContact O-CG 3.25Å; D779-L782 WeakPolarHBondContact O-CG 3.28Å; D779-L782 PolarHBondContact O-N 2.77Å; D779-L782 VanDerWaalsContact O-N 3.1Å; L782-V786 HydrophobicContact CB-CB 4.36Å; L782-V786 HydrophobicContact CD1-CG1 4.26Å; L782-W787 HydrophobicContact CD1-CZ2 3.95Å
783	P	62.3	Low	66.8	Low	55 Å²	55	73.2 Å²	73.2	36%	0.357	38%	0.377	S	S	.	.			trans	-55.8	146.3	174.6	-24.4	33.4	0	0	0	112.8	A785 V786	P783-A785 PolarHBondContact O-N 2.96Å; P783-A785 VanDerWaalsContact O-N 3.12Å; P783-V786 HydrophobicContact CB-CG2 4.33Å; P783-V786 HydrophobicContact CG-CG2 4.48Å; P783-V786 WeakPolarHBondContact O-CB 3.42Å; P783-V786 PolarHBondContact O-N 3.26Å
784	S	57.8	Low	64.9	Low	74 Å²	74	67.3 Å²	67.3	52%	0.517	36%	0.356	S	S	.	.	H	α-helix	trans	-53.9	-33.5	178	29.3	0	0	0	0	113.5	V786 W787 N788 E800	S784-V786 PolarHBondContact O-N 3.12Å; S784-V786 VanDerWaalsContact O-N 3.11Å; S784-W787 PolarHBondContact O-N 3.08Å; S784-W787 VanDerWaalsContact O-N 3.08Å; S784-N788 PolarHBondContact O-N 3.12Å; S784-N788 PolarHBondContact O-ND2 3.1Å; S784-E800 WeakPolarHBondContact CB-OE1 3.27Å; S784-E800 PolarHBondContact N-OE1 3.05Å; S784-E800 PolarHBondContact OG-OE1 3.08Å
785	A	55.3	Low	63.3	Low	12 Å²	12	68.1 Å²	68.1	10%	0.099	36%	0.362	C	S	.	.	H	α-helix	trans	-49.4	-31.9	171	0	0	0	0	0	114.5	T423 P783 E800	T423-A785 WeakPolarHBondContact CB-O 3.46Å; T423-A785 HydrophobicContact CG2-CB 4.15Å; T423-A785 VanDerWaalsContact CG2-O 3.27Å; T423-A785 WeakPolarHBondContact CG2-O 3.48Å; P783-A785 PolarHBondContact O-N 2.96Å; P783-A785 VanDerWaalsContact O-N 3.12Å; A785-E800 PolarHBondContact N-OE1 3.07Å; A785-E800 PolarHBondContact N-OE2 3.25Å
786	V	60.9	Low	61.7	Low	13 Å²	13	64.6 Å²	64.6	8%	0.079	35%	0.347	C	S	.	.	H	α-helix	trans	-85.4	-28.2	-177.4	-170.3	0	0	0	0	111.6	I421 V426 I718 L782 P783 S784	I421-V786 HydrophobicContact CG2-CG2 4.04Å; V426-V786 WeakPolarHBondContact CG2-O 3.48Å; I718-V786 HydrophobicContact CG2-CG1 3.77Å; I718-V786 HydrophobicContact CG2-CG2 3.91Å; L782-V786 HydrophobicContact CB-CB 4.36Å; L782-V786 HydrophobicContact CD1-CG1 4.26Å; P783-V786 HydrophobicContact CB-CG2 4.33Å; P783-V786 HydrophobicContact CG-CG2 4.48Å; P783-V786 WeakPolarHBondContact O-CB 3.42Å; P783-V786 PolarHBondContact O-N 3.26Å; S784-V786 PolarHBondContact O-N 3.12Å; S784-V786 VanDerWaalsContact O-N 3.11Å
787	W	58.1	Low	60.3	Low	103 Å²	103	63.7 Å²	63.7	39%	0.39	34%	0.341	S	S	.	.	H	α-helix	trans	-82.9	-19.6	-179	-77.6	115.3	0	0	0	114.5	D779 L782 S784 H789	D779-W787 HydrophobicContact CB-CH2 4.12Å; D779-W787 HydrophobicContact CB-CZ2 3.8Å; D779-W787 WeakPolarHBondContact O-CZ2 3.44Å; D779-W787 PolarHBondContact O-NE1 3.28Å; D779-W787 VanDerWaalsContact O-NE1 3.16Å; L782-W787 HydrophobicContact CD1-CZ2 3.95Å; S784-W787 PolarHBondContact O-N 3.08Å; S784-W787 VanDerWaalsContact O-N 3.08Å; W787-H789 PolarHBondContact O-N 3.19Å; W787-H789 VanDerWaalsContact O-N 3.09Å
788	N	52.3	Low	59	Low	81 Å²	81	61.6 Å²	61.6	43%	0.433	33%	0.33	S	S	.	.			trans	-72	104.6	-177.7	-73.7	-50.6	0	0	0	111.2	S784 Q790	S784-N788 PolarHBondContact O-N 3.12Å; S784-N788 PolarHBondContact O-ND2 3.1Å; N788-Q790 CarbonylContact O-C 3.55Å; N788-Q790 PolarHBondContact O-N 2.75Å; N788-Q790 VanDerWaalsContact O-O 3.06Å
789	H	46.7	Very low	58.1	Low	160 Å²	160	56.2 Å²	56.2	74%	0.741	31%	0.305	S	S	*	.	S	Bend	trans	-59.8	-10.9	175.4	-60.4	-55.2	0	0	0	115.2	W787	W787-H789 PolarHBondContact O-N 3.19Å; W787-H789 VanDerWaalsContact O-N 3.09Å
790	Q	49.1	Very low	57.6	Low	142 Å²	142	56.8 Å²	56.8	66%	0.664	31%	0.306	S	S	*	.	S	Bend	trans	-93.3	129.9	166.8	-72	-170.3	-12.3	0	0	108.9	N788 P792	N788-Q790 CarbonylContact O-C 3.55Å; N788-Q790 PolarHBondContact O-N 2.75Å; N788-Q790 VanDerWaalsContact O-O 3.06Å; Q790-P792 WeakPolarHBondContact O-CD 2.97Å
791	P	48.6	Very low	57.1	Low	81 Å²	81	49.7 Å²	49.7	53%	0.526	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-55.8	116.1	179.6	22.8	-33.3	0	0	0	109.3	F424 D793	F424-P791 HydrophobicContact CD1-CB 3.96Å; F424-P791 HydrophobicContact CD2-CB 4.28Å; F424-P791 HydrophobicContact CE1-CB 3.4Å; F424-P791 HydrophobicContact CE1-CG 4.38Å; F424-P791 HydrophobicContact CE2-CB 3.75Å; F424-P791 HydrophobicContact CG-CB 4.39Å; F424-P791 HydrophobicContact CZ-CB 3.29Å; P791-D793 PolarHBondContact O-N 3.2Å
792	P	49.3	Very low	56.5	Low	18 Å²	18	45.1 Å²	45.1	12%	0.117	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-63.4	129.8	-175.7	23.6	-32.5	0	0	0	109.2	T423 Q790 C797	T423-P792 HydrophobicContact CG2-CG 4.26Å; T423-P792 WeakPolarHBondContact OG1-CG 3.43Å; Q790-P792 WeakPolarHBondContact O-CD 2.97Å; P792-C797 HydrophobicContact CB-CB 4.42Å; P792-C797 VanDerWaalsContact CG-SG 3.51Å
793	D	55.8	Low	56	Low	32 Å²	32	45.1 Å²	45.1	17%	0.171	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-47.7	130.9	171.1	-179.6	-30.1	0	0	0	107.9	L130 Y132 P791 T795 A796 C797	L130-D793 HydrophobicContact CB-CB 4.07Å; L130-D793 HydrophobicContact CD1-CB 4.26Å; Y132-D793 WeakPolarHBondContact CD2-OD2 3.49Å; P791-D793 PolarHBondContact O-N 3.2Å; D793-T795 CarbonylContact O-C 3.58Å; D793-T795 PolarHBondContact O-N 2.84Å; D793-T795 WeakPolarHBondContact OD1-CA 3.31Å; D793-T795 WeakPolarHBondContact OD1-CB 3.27Å; D793-T795 PolarHBondContact OD1-N 3.39Å; D793-T795 PolarHBondContact OD1-OG1 3.1Å; D793-A796 HydrophobicContact CB-CB 4.02Å; D793-A796 CarbonylContact O-C 3.45Å; D793-A796 WeakPolarHBondContact O-CA 3.32Å; D793-A796 WeakPolarHBondContact O-CB 3.44Å; D793-A796 PolarHBondContact O-N 3.07Å; D793-C797 PolarHBondContact O-N 3.19Å
794	P	54.4	Low	55.6	Low	46 Å²	46	45.5 Å²	45.5	30%	0.299	25%	0.248	S	C	.	.	H	α-helix	trans	-46	-31.1	173.6	-34.6	40.4	0	0	0	114.1	C284 F798	C284-P794 HydrophobicContact CB-CB 3.54Å; C284-P794 HydrophobicContact CB-CG 3.61Å; C284-P794 WeakPolarHBondContact SG-CG 3.42Å; P794-F798 WeakPolarHBondContact O-CB 3.45Å; P794-F798 PolarHBondContact O-N 3.42Å
795	T	56.6	Low	55.2	Low	25 Å²	25	42.9 Å²	42.9	15%	0.153	23%	0.23	C	C	.	.	H	α-helix	trans	-72	-41.8	171.6	-64	0	0	0	0	113.3	L130 R198 D793 F798 Y799	L130-T795 HydrophobicContact CD1-CG2 3.59Å; R198-T795 PolarHBondContact NH2-OG1 3.45Å; D793-T795 CarbonylContact O-C 3.58Å; D793-T795 PolarHBondContact O-N 2.84Å; D793-T795 WeakPolarHBondContact OD1-CA 3.31Å; D793-T795 WeakPolarHBondContact OD1-CB 3.27Å; D793-T795 PolarHBondContact OD1-N 3.39Å; D793-T795 PolarHBondContact OD1-OG1 3.1Å; T795-F798 WeakPolarHBondContact O-CB 3.25Å; T795-F798 PolarHBondContact O-N 2.87Å; T795-Y799 HydrophobicContact CG2-CD2 3.93Å; T795-Y799 HydrophobicContact CG2-CE2 3.27Å; T795-Y799 WeakPolarHBondContact O-CD2 3.45Å; T795-Y799 PolarHBondContact O-N 3.31Å; T795-Y799 VanDerWaalsContact O-N 3.13Å
796	A	56.2	Low	54.6	Low	19 Å²	19	42.7 Å²	42.7	16%	0.157	23%	0.229	C	C	.	.	H	α-helix	trans	-66.9	-47.6	175	0	0	0	0	0	111.4	L130 D793 F798 Y799 E800	L130-A796 HydrophobicContact CB-CB 4.24Å; L130-A796 HydrophobicContact CD1-CB 4.01Å; D793-A796 HydrophobicContact CB-CB 4.02Å; D793-A796 CarbonylContact O-C 3.45Å; D793-A796 WeakPolarHBondContact O-CA 3.32Å; D793-A796 WeakPolarHBondContact O-CB 3.44Å; D793-A796 PolarHBondContact O-N 3.07Å; A796-F798 VanDerWaalsContact C-N 3.31Å; A796-F798 PolarHBondContact O-N 3.12Å; A796-Y799 PolarHBondContact O-N 3.4Å; A796-E800 PolarHBondContact O-N 3.05Å
797	C	57.1	Low	53.3	Low	8 Å²	8	48 Å²	48	5%	0.054	26%	0.257	C	S	.	.	H	α-helix	trans	-52.7	-51	171.3	-115.5	0	0	0	0	110.1	P792 D793 Y799 E800 I801	P792-C797 HydrophobicContact CB-CB 4.42Å; P792-C797 VanDerWaalsContact CG-SG 3.51Å; D793-C797 PolarHBondContact O-N 3.19Å; C797-Y799 PolarHBondContact O-N 3.35Å; C797-Y799 VanDerWaalsContact O-N 3.16Å; C797-E800 PolarHBondContact O-N 3.15Å; C797-I801 HydrophobicContact CB-CD1 4.19Å; C797-I801 WeakPolarHBondContact O-CB 3.46Å; C797-I801 WeakPolarHBondContact O-CD1 3.29Å; C797-I801 WeakPolarHBondContact O-CG1 3.31Å; C797-I801 PolarHBondContact O-N 3.02Å
798	F	59.4	Low	52.1	Low	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-53.3	-35.9	176	171.9	-89.4	0	0	0	113.8	I197 F250 Q252 I283 P794 T795 A796 Q802	I197-F798 HydrophobicContact CB-CZ 3.82Å; I197-F798 HydrophobicContact CG2-CE2 3.73Å; I197-F798 HydrophobicContact CG2-CZ 3.51Å; F250-F798 HydrophobicContact CB-CE2 4.07Å; F250-F798 HydrophobicContact CD1-CE2 4.24Å; F250-F798 HydrophobicContact CG-CE2 4.48Å; Q252-F798 HydrophobicContact CG-CD2 3.35Å; Q252-F798 HydrophobicContact CG-CE2 3.6Å; Q252-F798 HydrophobicContact CG-CG 4.09Å; Q252-F798 VanDerWaalsContact NE2-CD2 3.29Å; I283-F798 HydrophobicContact CD1-CB 4.45Å; I283-F798 HydrophobicContact CD1-CD2 3.63Å; I283-F798 HydrophobicContact CD1-CE2 4.42Å; I283-F798 HydrophobicContact CD1-CG 4.44Å; I283-F798 HydrophobicContact CG2-CB 3.96Å; P794-F798 WeakPolarHBondContact O-CB 3.45Å; P794-F798 PolarHBondContact O-N 3.42Å; T795-F798 WeakPolarHBondContact O-CB 3.25Å; T795-F798 PolarHBondContact O-N 2.87Å; A796-F798 VanDerWaalsContact C-N 3.31Å; A796-F798 PolarHBondContact O-N 3.12Å; F798-Q802 WeakPolarHBondContact O-CB 3.46Å; F798-Q802 PolarHBondContact O-N 2.98Å
799	Y	61	Low	51	Low	3 Å²	3	49.1 Å²	49.1	1%	0.012	27%	0.27	C	S	.	.	H	α-helix	trans	-76.8	-41.5	177.8	-67	-47.6	0	0	0	113.4	P126 L128 G168 R198 T795 A796 C797 I801 Q802 N803	P126-Y799 HydrophobicContact CG-CD1 3.96Å; P126-Y799 HydrophobicContact CG-CE1 3.87Å; L128-Y799 HydrophobicContact CB-CD2 3.59Å; L128-Y799 HydrophobicContact CB-CE2 3.71Å; L128-Y799 HydrophobicContact CD1-CD2 4.09Å; L128-Y799 HydrophobicContact CD1-CE2 3.31Å; L128-Y799 HydrophobicContact CG-CD2 4.38Å; L128-Y799 HydrophobicContact CG-CE2 4.07Å; G168-Y799 VanDerWaalsContact CA-CE1 3.45Å; G168-Y799 PolarHBondContact O-OH 2.91Å; R198-Y799 PolarHBondContact NH1-OH 3.44Å; T795-Y799 HydrophobicContact CG2-CD2 3.93Å; T795-Y799 HydrophobicContact CG2-CE2 3.27Å; T795-Y799 WeakPolarHBondContact O-CD2 3.45Å; T795-Y799 PolarHBondContact O-N 3.31Å; T795-Y799 VanDerWaalsContact O-N 3.13Å; A796-Y799 PolarHBondContact O-N 3.4Å; C797-Y799 PolarHBondContact O-N 3.35Å; C797-Y799 VanDerWaalsContact O-N 3.16Å; Y799-I801 VanDerWaalsContact C-N 3.32Å; Y799-I801 PolarHBondContact O-N 3.31Å; Y799-Q802 PolarHBondContact O-N 2.91Å; Y799-N803 WeakPolarHBondContact O-CB 3.34Å; Y799-N803 PolarHBondContact O-N 3.48Å; Y799-N803 PolarHBondContact O-ND2 2.8Å; Y799-N803 PolarHBondContact O-OD1 2.78Å
800	E	59.7	Low	50.1	Low	50 Å²	50	48.2 Å²	48.2	23%	0.234	28%	0.276	C	S	.	.	H	α-helix	trans	-58.8	-47.9	172.6	-163.9	168.2	163.7	0	0	109.9	S784 A785 A796 C797 N803 S804	S784-E800 WeakPolarHBondContact CB-OE1 3.27Å; S784-E800 PolarHBondContact N-OE1 3.05Å; S784-E800 PolarHBondContact OG-OE1 3.08Å; A785-E800 PolarHBondContact N-OE1 3.07Å; A785-E800 PolarHBondContact N-OE2 3.25Å; A796-E800 PolarHBondContact O-N 3.05Å; C797-E800 PolarHBondContact O-N 3.15Å; E800-N803 PolarHBondContact O-N 3.48Å; E800-S804 PolarHBondContact O-N 2.86Å; E800-S804 PolarHBondContact O-OG 2.85Å; E800-S804 VanDerWaalsContact O-OG 3.12Å
801	I	60.4	Low	48.8	Very low	7 Å²	7	48 Å²	48	4%	0.036	28%	0.279	C	S	.	.	H	α-helix	trans	-59.4	-48.1	174.2	-61.6	159.2	0	0	0	111.6	F281 I283 Y393 C797 Y799 N803 S804 C805	F281-I801 HydrophobicContact CD1-CG2 4.41Å; I283-I801 HydrophobicContact CD1-CB 4.35Å; I283-I801 HydrophobicContact CD1-CD1 4.02Å; I283-I801 HydrophobicContact CD1-CG2 3.91Å; I283-I801 HydrophobicContact CG1-CD1 3.95Å; I283-I801 HydrophobicContact CG2-CD1 3.86Å; Y393-I801 HydrophobicContact CD1-CD1 3.47Å; Y393-I801 VanDerWaalsContact CD1-CD1 3.47Å; Y393-I801 HydrophobicContact CD1-CG1 3.7Å; Y393-I801 HydrophobicContact CD2-CD1 3.53Å; Y393-I801 HydrophobicContact CD2-CG1 4.1Å; Y393-I801 HydrophobicContact CD2-CG2 4.17Å; Y393-I801 HydrophobicContact CE1-CD1 3.9Å; Y393-I801 HydrophobicContact CE1-CG1 3.59Å; Y393-I801 HydrophobicContact CE1-CG2 4.46Å; Y393-I801 HydrophobicContact CE2-CB 4.44Å; Y393-I801 HydrophobicContact CE2-CD1 3.94Å; Y393-I801 HydrophobicContact CE2-CG1 3.99Å; Y393-I801 HydrophobicContact CE2-CG2 3.55Å; Y393-I801 HydrophobicContact CG-CD1 3.25Å; Y393-I801 HydrophobicContact CG-CG1 3.94Å; C797-I801 HydrophobicContact CB-CD1 4.19Å; C797-I801 WeakPolarHBondContact O-CB 3.46Å; C797-I801 WeakPolarHBondContact O-CD1 3.29Å; C797-I801 WeakPolarHBondContact O-CG1 3.31Å; C797-I801 PolarHBondContact O-N 3.02Å; Y799-I801 VanDerWaalsContact C-N 3.32Å; Y799-I801 PolarHBondContact O-N 3.31Å; I801-N803 PolarHBondContact O-N 3.23Å; I801-S804 PolarHBondContact O-N 2.95Å; I801-C805 VanDerWaalsContact O-CB 3.28Å; I801-C805 WeakPolarHBondContact O-CB 3.36Å; I801-C805 PolarHBondContact O-N 2.81Å; I801-C805 PolarHBondContact O-SG 3.42Å
802	Q	59.4	Low	47.6	Very low	3 Å²	3	52.1 Å²	52.1	1%	0.014	30%	0.297	C	S	.	.	H	α-helix	trans	-58.7	-37	177.9	166.1	155.1	23.7	0	0	111.5	I197 F798 Y799 G806	I197-Q802 HydrophobicContact CD1-CG 4.21Å; F798-Q802 WeakPolarHBondContact O-CB 3.46Å; F798-Q802 PolarHBondContact O-N 2.98Å; Y799-Q802 PolarHBondContact O-N 2.91Å; Q802-G806 PolarHBondContact O-N 3.02Å
803	N	56.7	Low	47.5	Very low	16 Å²	16	53.8 Å²	53.8	9%	0.086	31%	0.306	C	S	.	.	H	α-helix	trans	-76.2	-39.3	-178.9	-62	-14.3	0	0	0	110.9	R125 Y799 E800 I801	R125-N803 VanDerWaalsContact CB-OD1 3.24Å; R125-N803 WeakPolarHBondContact CB-OD1 3.42Å; R125-N803 WeakPolarHBondContact CG-OD1 3.19Å; R125-N803 PolarHBondContact NH1-O 3.09Å; R125-N803 PolarHBondContact NH2-O 2.82Å; Y799-N803 WeakPolarHBondContact O-CB 3.34Å; Y799-N803 PolarHBondContact O-N 3.48Å; Y799-N803 PolarHBondContact O-ND2 2.8Å; Y799-N803 PolarHBondContact O-OD1 2.78Å; E800-N803 PolarHBondContact O-N 3.48Å; I801-N803 PolarHBondContact O-N 3.23Å
804	S	53.5	Low	47.1	Very low	62 Å²	62	54.9 Å²	54.9	43%	0.434	31%	0.313	S	S	.	.	H	α-helix	trans	-66.4	-46.6	172.4	-58.5	0	0	0	0	113.1	E800 I801 G806 L807	E800-S804 PolarHBondContact O-N 2.86Å; E800-S804 PolarHBondContact O-OG 2.85Å; E800-S804 VanDerWaalsContact O-OG 3.12Å; I801-S804 PolarHBondContact O-N 2.95Å; S804-G806 PolarHBondContact O-N 3.34Å; S804-G806 VanDerWaalsContact O-N 3.15Å; S804-L807 VanDerWaalsContact O-CB 3.24Å; S804-L807 WeakPolarHBondContact O-CB 3.46Å; S804-L807 VanDerWaalsContact O-CG 3.25Å; S804-L807 WeakPolarHBondContact O-CG 3.5Å; S804-L807 PolarHBondContact O-N 3.06Å
805	C	49.6	Very low	46.7	Very low	19 Å²	19	55.4 Å²	55.4	13%	0.128	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-3	-176.2	-61.2	0	0	0	0	114.3	K248 F281 I801	K248-C805 PolarHBondContact NZ-O 2.85Å; F281-C805 HydrophobicContact CE1-CB 4.04Å; F281-C805 WeakPolarHBondContact CE1-SG 3.26Å; F281-C805 HydrophobicContact CZ-CB 4.1Å; I801-C805 VanDerWaalsContact O-CB 3.28Å; I801-C805 WeakPolarHBondContact O-CB 3.36Å; I801-C805 PolarHBondContact O-N 2.81Å; I801-C805 PolarHBondContact O-SG 3.42Å
806	G	42.6	Very low	46.1	Very low	9 Å²	9	57.2 Å²	57.2	9%	0.093	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	10.5	164.9	0	0	0	0	0	114.1	R125 Q802 S804 D808	R125-G806 PolarHBondContact NH2-O 2.97Å; Q802-G806 PolarHBondContact O-N 3.02Å; S804-G806 PolarHBondContact O-N 3.34Å; S804-G806 VanDerWaalsContact O-N 3.15Å; G806-D808 PolarHBondContact O-N 3.48Å
807	L	32.6	Very low	45.5	Very low	124 Å²	124	59.6 Å²	59.6	65%	0.649	33%	0.333	S	S	*	.			trans	-78	89.2	167.2	-69.9	169	0	0	0	109.7	S804 N809	S804-L807 VanDerWaalsContact O-CB 3.24Å; S804-L807 WeakPolarHBondContact O-CB 3.46Å; S804-L807 VanDerWaalsContact O-CG 3.25Å; S804-L807 WeakPolarHBondContact O-CG 3.5Å; S804-L807 PolarHBondContact O-N 3.06Å; L807-N809 PolarHBondContact O-N 3.39Å
808	D	34.1	Very low	44.7	Very low	73 Å²	73	63.1 Å²	63.1	39%	0.39	35%	0.352	S	S	.	.			trans	-73.5	54.8	168.1	-62.6	-42.1	0	0	0	111.4	N163 Y165 G806	N163-D808 PolarHBondContact ND2-OD2 3.03Å; Y165-D808 PolarHBondContact OH-OD1 3.17Å; Y165-D808 PolarHBondContact OH-OD2 3.34Å; G806-D808 PolarHBondContact O-N 3.48Å
809	N	28.3	Very low	43.7	Very low	134 Å²	134	67.6 Å²	67.6	72%	0.717	38%	0.377	S	S	*	.			trans	-103.6	94.9	159.9	-96.2	2.5	0	0	0	107.3	L807 N811	L807-N809 PolarHBondContact O-N 3.39Å; N809-N811 PolarHBondContact O-N 2.82Å
810	V	27.1	Very low	42.4	Very low	142 Å²	142	72.5 Å²	72.5	86%	0.861	41%	0.405	S	S	*	.			trans	-77.5	77	166.6	-178.2	0	0	0	0	107.5
811	N	22.5	Very low	40.9	Very low	138 Å²	138	74.4 Å²	74.4	74%	0.738	42%	0.419	S	S	*	.			trans	-161.6	107.6	167.9	-87	-19.4	0	0	0	106.4	N809	N809-N811 PolarHBondContact O-N 2.82Å
812	D	24.1	Very low	39.1	Very low	166 Å²	166	80.5 Å²	80.5	89%	0.888	45%	0.454	S	S	*	.			trans	61	0	167.5	-47.2	-23.7	0	0	0	120.9	R742	R742-D812 PolarHBondContact NH1-O 2.77Å; R742-D812 PolarHBondContact NH2-O 3.41Å; R742-D812 PolarHBondContact NH2-OXT 3.42Å

Retrieved 812 of 812 residues in 190.3 ms (Link to these results)

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