A0A096MQN2_PAPAN Loading...

E3 ubiquitin-protein ligase makorin-2

AlphaFold DB , UniProt , Accession A0A096MQN2, Species PAPAN (Papio anubis, Olive baboon), Gene MKRN2, Length 416 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	47.5	Very low	69.6	Low	238 Å²	238	104.7 Å²	104.7	100%	1.172	50%	0.503	S	S	*	.				0	133.9	0	-66.9	-179.5	175.6	0	0	108.3
2	S	54.2	Low	70.2	Confident	95 Å²	95	104.7 Å²	104.7	66%	0.664	50%	0.504	S	S	*	.			trans	-85.3	117.1	-172.9	-178.6	0	0	0	0	111.1	K4	S2-K4 VanDerWaalsContact C-N 3.33Å; S2-K4 PolarHBondContact O-N 3.46Å; S2-K4 WeakPolarHBondContact OG-CG 3.24Å
3	T	65.1	Low	70.1	Confident	61 Å²	61	105.3 Å²	105.3	37%	0.374	51%	0.505	S	S	.	.			trans	-94	22.5	-178.4	45.4	0	0	0	0	114	Q5 V6 L23	T3-Q5 PolarHBondContact O-N 3.32Å; T3-V6 PolarHBondContact O-N 2.92Å; T3-V6 VanDerWaalsContact O-N 3.11Å; T3-L23 CarbonylContact C-O 3.6Å; T3-L23 VanDerWaalsContact C-O 3.25Å; T3-L23 PolarHBondContact OG1-O 3.25Å
4	K	68.6	Low	70.6	Confident	127 Å²	127	103 Å²	103	55%	0.552	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	7	-179.2	-68.2	-174.1	176.5	-168.6	0	115.9	S2 S25	S2-K4 VanDerWaalsContact C-N 3.33Å; S2-K4 PolarHBondContact O-N 3.46Å; S2-K4 WeakPolarHBondContact OG-CG 3.24Å; K4-S25 WeakPolarHBondContact O-CB 3.42Å
5	Q	65.8	Low	71.3	Confident	165 Å²	165	102.2 Å²	102.2	77%	0.771	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	-15.9	173	-67.5	177.2	-8.3	0	0	113	T3 S31 K32	T3-Q5 PolarHBondContact O-N 3.32Å; Q5-S31 WeakPolarHBondContact O-CA 3.21Å; Q5-S31 WeakPolarHBondContact O-CB 3.32Å; Q5-K32 PolarHBondContact O-N 3.23Å
6	V	72.9	Confident	71.9	Confident	50 Å²	50	97.8 Å²	97.8	30%	0.303	51%	0.506	S	S	.	.	B	Isolated β-bridge	trans	-97.9	129.5	179.2	177.4	0	0	0	0	109.4	T3 F24 S25	T3-V6 PolarHBondContact O-N 2.92Å; T3-V6 VanDerWaalsContact O-N 3.11Å; V6-F24 HydrophobicContact CB-CD1 4.31Å; V6-F24 HydrophobicContact CG1-CD1 4.37Å; V6-S25 PolarHBondContact O-N 3.49Å
7	T	79.7	Confident	72.5	Confident	18 Å²	18	106.2 Å²	106.2	11%	0.11	53%	0.529	C	S	.	.	B	Isolated β-bridge	trans	-62.1	133	-179.5	-39.1	0	0	0	0	112.2	R9 L28 S31 K32	T7-R9 PolarHBondContact O-N 3.18Å; T7-L28 HydrophobicContact CG2-CD1 3.56Å; T7-S31 WeakPolarHBondContact CB-OG 3.24Å; T7-S31 PolarHBondContact OG1-OG 3.11Å; T7-K32 PolarHBondContact N-O 2.71Å; T7-K32 PolarHBondContact OG1-O 3.44Å
8	C	78.6	Confident	72.8	Confident	2 Å²	2	107.1 Å²	107.1	1%	0.014	53%	0.532	C	S	.	.			trans	-71.8	106.7	174.2	-177.2	0	0	0	0	110.7	Y10 F11 M12 C22 F24 S25 H26	C8-Y10 PolarHBondContact O-N 2.84Å; C8-F11 HydrophobicContact CB-CB 3.79Å; C8-F11 PolarHBondContact O-N 2.65Å; C8-F11 PolarHBondContact SG-N 3.38Å; C8-M12 PolarHBondContact O-N 3.07Å; C8-C22 VanDerWaalsContact SG-SG 3.65Å; C8-F24 HydrophobicContact CB-CB 3.61Å; C8-S25 WeakPolarHBondContact CB-O 3.33Å; C8-S25 PolarHBondContact N-O 3.35Å; C8-H26 WeakPolarHBondContact CB-CD2 3.43Å; C8-H26 PolarHBondContact SG-NE2 3.44Å; C8-H26 VanDerWaalsContact SG-NE2 3.44Å
9	R	77.1	Confident	72.9	Confident	146 Å²	146	103.5 Å²	103.5	55%	0.551	53%	0.525	S	S	*	.	H	α-helix	trans	-58	-35.1	178.1	-174.9	172.8	-177.4	156.4	0	113.2	T7 F11 M12 H13 Y53	T7-R9 PolarHBondContact O-N 3.18Å; R9-F11 VanDerWaalsContact C-N 3.35Å; R9-M12 HydrophobicContact CG-CE 4.49Å; R9-M12 PolarHBondContact O-N 2.89Å; R9-H13 PolarHBondContact O-CD2 2.96Å; R9-H13 PolarHBondContact O-N 3.36Å; R9-Y53 PolarHBondContact NH1-OH 3.38Å; R9-Y53 VanDerWaalsContact NH1-OH 3.12Å
10	Y	76.6	Confident	72.8	Confident	159 Å²	159	104.2 Å²	104.2	62%	0.624	54%	0.54	S	S	*	.	H	α-helix	trans	-70.8	-31.2	177.8	-62.6	-70.7	0	0	0	112.5	C8 H13 G14 V15 C16	C8-Y10 PolarHBondContact O-N 2.84Å; Y10-H13 CarbonylContact O-C 3.28Å; Y10-G14 PolarHBondContact O-N 3.42Å; Y10-V15 HydrophobicContact CD1-CG2 4.11Å; Y10-V15 WeakPolarHBondContact O-CG2 3.44Å; Y10-V15 PolarHBondContact O-N 3.33Å; Y10-C16 PolarHBondContact O-N 3.46Å; Y10-C16 VanDerWaalsContact O-N 3.13Å
11	F	79.7	Confident	72.8	Confident	91 Å²	91	107.2 Å²	107.2	40%	0.399	55%	0.551	S	S	.	*	H	α-helix	trans	-73.3	-41.6	174.2	178.2	-98.3	0	0	0	111.3	C8 R9 H13 G14 C16 H26	C8-F11 HydrophobicContact CB-CB 3.79Å; C8-F11 PolarHBondContact O-N 2.65Å; C8-F11 PolarHBondContact SG-N 3.38Å; R9-F11 VanDerWaalsContact C-N 3.35Å; F11-H13 PolarHBondContact O-N 3.12Å; F11-H13 VanDerWaalsContact O-N 3.12Å; F11-G14 PolarHBondContact O-N 2.8Å; F11-C16 HydrophobicContact CB-CB 4.01Å; F11-H26 HydrophobicContact CD1-CB 3.78Å; F11-H26 AromaticContact CD1-CG 3.99Å; F11-H26 HydrophobicContact CD2-CB 3.91Å; F11-H26 AromaticContact CD2-CE1 3.79Å; F11-H26 AromaticContact CD2-CG 3.52Å; F11-H26 AromaticContact CD2-ND1 3.33Å; F11-H26 VanDerWaalsContact CD2-ND1 3.33Å; F11-H26 WeakPolarHBondContact CD2-ND1 2.98Å; F11-H26 HydrophobicContact CE1-CB 3.88Å; F11-H26 WeakPolarHBondContact CE1-O 3.33Å; F11-H26 HydrophobicContact CE2-CB 3.99Å; F11-H26 AromaticContact CE2-ND1 3.85Å; F11-H26 HydrophobicContact CG-CB 3.8Å; F11-H26 AromaticContact CG-CD2 3.7Å; F11-H26 AromaticContact CG-CG 3.49Å; F11-H26 VanDerWaalsContact CG-CG 3.49Å; F11-H26 AromaticContact CG-ND1 3.77Å; F11-H26 HydrophobicContact CZ-CB 3.98Å
12	M	76.6	Confident	74.2	Confident	104 Å²	104	96.6 Å²	96.6	51%	0.512	50%	0.5	S	S	.	.	H	α-helix	trans	-58.6	-23.3	174	-168.1	-177	74.2	0	0	113.3	C8 R9 L28	C8-M12 PolarHBondContact O-N 3.07Å; R9-M12 HydrophobicContact CG-CE 4.49Å; R9-M12 PolarHBondContact O-N 2.89Å; M12-L28 HydrophobicContact CG-CD1 4.39Å
13	H	69.9	Low	75.1	Confident	113 Å²	113	98.1 Å²	98.1	52%	0.523	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	14.5	173.2	-63.4	-60.1	0	0	0	113.7	R9 Y10 F11 V15	R9-H13 PolarHBondContact O-CD2 2.96Å; R9-H13 PolarHBondContact O-N 3.36Å; Y10-H13 CarbonylContact O-C 3.28Å; F11-H13 PolarHBondContact O-N 3.12Å; F11-H13 VanDerWaalsContact O-N 3.12Å; H13-V15 VanDerWaalsContact C-N 3.29Å; H13-V15 HydrophobicContact CB-CG2 4.28Å; H13-V15 PolarHBondContact O-N 2.62Å
14	G	76.1	Confident	75.6	Confident	73 Å²	73	99.4 Å²	99.4	75%	0.753	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	10.2	173.9	0	0	0	0	0	116.7	Y10 F11	Y10-G14 PolarHBondContact O-N 3.42Å; F11-G14 PolarHBondContact O-N 2.8Å
15	V	81.9	Confident	76	Confident	91 Å²	91	94.1 Å²	94.1	55%	0.552	48%	0.48	S	S	*	.			trans	-116.4	7.1	-170.4	-66.5	0	0	0	0	114.8	Y10 H13 R17	Y10-V15 HydrophobicContact CD1-CG2 4.11Å; Y10-V15 WeakPolarHBondContact O-CG2 3.44Å; Y10-V15 PolarHBondContact O-N 3.33Å; H13-V15 VanDerWaalsContact C-N 3.29Å; H13-V15 HydrophobicContact CB-CG2 4.28Å; H13-V15 PolarHBondContact O-N 2.62Å; V15-R17 PolarHBondContact O-N 3.28Å
16	C	81	Confident	76.6	Confident	32 Å²	32	88.4 Å²	88.4	22%	0.216	45%	0.453	C	S	.	.			trans	-72.5	123.8	177.5	-169.2	0	0	0	0	111.8	Y10 F11 H26	Y10-C16 PolarHBondContact O-N 3.46Å; Y10-C16 VanDerWaalsContact O-N 3.13Å; F11-C16 HydrophobicContact CB-CB 4.01Å; C16-H26 VanDerWaalsContact SG-CE1 3.56Å; C16-H26 PolarHBondContact SG-NE2 2.79Å
17	R	82.1	Confident	76.8	Confident	241 Å²	241	89.7 Å²	89.7	91%	0.909	46%	0.458	S	S	*	.			trans	-92.4	-13.4	179.9	-60.5	-176.3	-179.6	-168.3	-1.3	114	V15 G19	V15-R17 PolarHBondContact O-N 3.28Å; R17-G19 VanDerWaalsContact C-N 3.31Å; R17-G19 PolarHBondContact O-N 2.89Å
18	E	76.9	Confident	76.1	Confident	122 Å²	122	94.1 Å²	94.1	57%	0.57	48%	0.48	S	S	*	.	S	Bend	trans	-80	-5.6	-173.7	-120	64.1	-159.9	0	0	115	S20 Q21 C22	E18-S20 PolarHBondContact O-N 3.24Å; E18-Q21 PolarHBondContact O-N 3.12Å; E18-C22 HydrophobicContact CB-CB 3.98Å; E18-C22 PolarHBondContact O-N 3.01Å
19	G	74.5	Confident	75.5	Confident	39 Å²	39	98.7 Å²	98.7	40%	0.402	52%	0.519	S	S	.	.	G	3₁₀ helix	trans	51.2	-131.3	177.6	0	0	0	0	0	113.3	R17 Q21 H26	R17-G19 VanDerWaalsContact C-N 3.31Å; R17-G19 PolarHBondContact O-N 2.89Å; G19-Q21 VanDerWaalsContact C-N 3.27Å; G19-Q21 PolarHBondContact O-N 3.26Å; G19-H26 PolarHBondContact O-CE1 3.36Å; G19-H26 PolarHBondContact O-ND1 2.97Å
20	S	71.7	Confident	74.9	Confident	117 Å²	117	98.2 Å²	98.2	82%	0.818	53%	0.527	S	S	*	.	G	3₁₀ helix	trans	-76.1	-7.9	178.4	54.5	0	0	0	0	114.7	E18	E18-S20 PolarHBondContact O-N 3.24Å
21	Q	72.9	Confident	74.2	Confident	167 Å²	167	91.2 Å²	91.2	78%	0.78	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-89.6	-0.3	176.3	-61.7	-169.3	2.7	0	0	113	E18 G19 L23	E18-Q21 PolarHBondContact O-N 3.12Å; G19-Q21 VanDerWaalsContact C-N 3.27Å; G19-Q21 PolarHBondContact O-N 3.26Å; Q21-L23 PolarHBondContact O-N 3.49Å
22	C	76.1	Confident	73.3	Confident	15 Å²	15	95.3 Å²	95.3	10%	0.101	52%	0.519	C	S	.	.			trans	-58.5	137.4	179.2	-159.6	0	0	0	0	112.2	C8 E18 F24 H26	C8-C22 VanDerWaalsContact SG-SG 3.65Å; E18-C22 HydrophobicContact CB-CB 3.98Å; E18-C22 PolarHBondContact O-N 3.01Å; C22-F24 PolarHBondContact O-N 3.07Å; C22-H26 WeakPolarHBondContact CB-NE2 3.49Å
23	L	73.4	Confident	72.5	Confident	127 Å²	127	94.9 Å²	94.9	67%	0.665	52%	0.524	S	S	*	.	S	Bend	trans	-70.8	-8.6	176.3	-63.2	173.4	0	0	0	113.2	T3 Q21	T3-L23 CarbonylContact C-O 3.6Å; T3-L23 VanDerWaalsContact C-O 3.25Å; T3-L23 PolarHBondContact OG1-O 3.25Å; Q21-L23 PolarHBondContact O-N 3.49Å
24	F	75.9	Confident	72.1	Confident	89 Å²	89	92.6 Å²	92.6	39%	0.39	52%	0.521	S	S	.	.	S	Bend	trans	-120.1	152	-178.1	-58.4	-73.6	0	0	0	109.9	V6 C8 C22	V6-F24 HydrophobicContact CB-CD1 4.31Å; V6-F24 HydrophobicContact CG1-CD1 4.37Å; C8-F24 HydrophobicContact CB-CB 3.61Å; C22-F24 PolarHBondContact O-N 3.07Å
25	S	77.6	Confident	71.7	Confident	16 Å²	16	93.3 Å²	93.3	11%	0.112	51%	0.511	C	S	.	.	B	Isolated β-bridge	trans	-68.9	135.5	-175.2	-165.8	0	0	0	0	112.6	K4 V6 C8 D27 S31	K4-S25 WeakPolarHBondContact O-CB 3.42Å; V6-S25 PolarHBondContact O-N 3.49Å; C8-S25 WeakPolarHBondContact CB-O 3.33Å; C8-S25 PolarHBondContact N-O 3.35Å; S25-D27 PolarHBondContact OG-N 3.19Å; S25-D27 VanDerWaalsContact OG-N 3.07Å; S25-D27 PolarHBondContact OG-O 3.48Å; S25-S31 VanDerWaalsContact CB-CB 3.43Å
26	H	78.4	Confident	71.2	Confident	44 Å²	44	92.4 Å²	92.4	20%	0.204	50%	0.502	C	S	.	.			trans	-97.4	-3	166.4	-67.6	-170.1	0	0	0	111.7	C8 F11 C16 G19 C22 L28	C8-H26 WeakPolarHBondContact CB-CD2 3.43Å; C8-H26 PolarHBondContact SG-NE2 3.44Å; C8-H26 VanDerWaalsContact SG-NE2 3.44Å; F11-H26 HydrophobicContact CD1-CB 3.78Å; F11-H26 AromaticContact CD1-CG 3.99Å; F11-H26 HydrophobicContact CD2-CB 3.91Å; F11-H26 AromaticContact CD2-CE1 3.79Å; F11-H26 AromaticContact CD2-CG 3.52Å; F11-H26 AromaticContact CD2-ND1 3.33Å; F11-H26 VanDerWaalsContact CD2-ND1 3.33Å; F11-H26 WeakPolarHBondContact CD2-ND1 2.98Å; F11-H26 HydrophobicContact CE1-CB 3.88Å; F11-H26 WeakPolarHBondContact CE1-O 3.33Å; F11-H26 HydrophobicContact CE2-CB 3.99Å; F11-H26 AromaticContact CE2-ND1 3.85Å; F11-H26 HydrophobicContact CG-CB 3.8Å; F11-H26 AromaticContact CG-CD2 3.7Å; F11-H26 AromaticContact CG-CG 3.49Å; F11-H26 VanDerWaalsContact CG-CG 3.49Å; F11-H26 AromaticContact CG-ND1 3.77Å; F11-H26 HydrophobicContact CZ-CB 3.98Å; C16-H26 VanDerWaalsContact SG-CE1 3.56Å; C16-H26 PolarHBondContact SG-NE2 2.79Å; G19-H26 PolarHBondContact O-CE1 3.36Å; G19-H26 PolarHBondContact O-ND1 2.97Å; C22-H26 WeakPolarHBondContact CB-NE2 3.49Å; H26-L28 PolarHBondContact O-N 3.44Å
27	D	75.8	Confident	71	Confident	78 Å²	78	90.9 Å²	90.9	42%	0.417	49%	0.492	S	S	.	.			trans	-86.5	107.6	172.5	-177.4	-7.1	0	0	0	109.8	S25 A29 N30 S31	S25-D27 PolarHBondContact OG-N 3.19Å; S25-D27 VanDerWaalsContact OG-N 3.07Å; S25-D27 PolarHBondContact OG-O 3.48Å; D27-A29 VanDerWaalsContact C-N 3.34Å; D27-A29 WeakPolarHBondContact OD1-CB 3.37Å; D27-A29 PolarHBondContact OD1-N 3.01Å; D27-N30 PolarHBondContact OD1-N 3.22Å; D27-N30 VanDerWaalsContact OD2-CB 3.24Å; D27-N30 WeakPolarHBondContact OD2-CB 3.47Å; D27-S31 WeakPolarHBondContact O-CB 3.34Å; D27-S31 PolarHBondContact O-N 3.38Å; D27-S31 PolarHBondContact O-OG 2.82Å
28	L	66.1	Low	70.8	Confident	110 Å²	110	86.3 Å²	86.3	58%	0.576	48%	0.479	S	S	*	.	S	Bend	trans	-75.8	-20.5	-179	-145.2	79.8	0	0	0	112.9	T7 M12 H26	T7-L28 HydrophobicContact CG2-CD1 3.56Å; M12-L28 HydrophobicContact CG-CD1 4.39Å; H26-L28 PolarHBondContact O-N 3.44Å
29	A	65.1	Low	70.8	Confident	99 Å²	99	88.3 Å²	88.3	82%	0.818	48%	0.482	S	S	*	.	S	Bend	trans	-79.7	-28.4	178.8	0	0	0	0	0	112	D27	D27-A29 VanDerWaalsContact C-N 3.34Å; D27-A29 WeakPolarHBondContact OD1-CB 3.37Å; D27-A29 PolarHBondContact OD1-N 3.01Å
30	N	64.3	Low	71	Confident	136 Å²	136	90.1 Å²	90.1	73%	0.727	48%	0.477	S	S	*	.	S	Bend	trans	-117.5	8.1	-169.8	-145.4	3.7	0	0	0	114.3	D27	D27-N30 PolarHBondContact OD1-N 3.22Å; D27-N30 VanDerWaalsContact OD2-CB 3.24Å; D27-N30 WeakPolarHBondContact OD2-CB 3.47Å
31	S	62.9	Low	71.2	Confident	12 Å²	12	90.5 Å²	90.5	8%	0.084	47%	0.466	C	S	.	.			trans	-121.4	143.6	177	65.3	0	0	0	0	112.6	Q5 T7 S25 D27	Q5-S31 WeakPolarHBondContact O-CA 3.21Å; Q5-S31 WeakPolarHBondContact O-CB 3.32Å; T7-S31 WeakPolarHBondContact CB-OG 3.24Å; T7-S31 PolarHBondContact OG1-OG 3.11Å; S25-S31 VanDerWaalsContact CB-CB 3.43Å; D27-S31 WeakPolarHBondContact O-CB 3.34Å; D27-S31 PolarHBondContact O-N 3.38Å; D27-S31 PolarHBondContact O-OG 2.82Å
32	K	60.7	Low	71.2	Confident	176 Å²	176	90.7 Å²	90.7	77%	0.765	46%	0.464	S	S	*	.	B	Isolated β-bridge	trans	-94.3	133.8	177.9	-64.9	-179.8	-177.9	178.8	0	109.3	Q5 T7 S34	Q5-K32 PolarHBondContact O-N 3.23Å; T7-K32 PolarHBondContact N-O 2.71Å; T7-K32 PolarHBondContact OG1-O 3.44Å; K32-S34 PolarHBondContact O-N 3.43Å
33	P	59.5	Low	70.9	Confident	95 Å²	95	93 Å²	93	62%	0.617	49%	0.49	S	S	*	.			trans	-63.2	130.1	169.8	26.8	-33	0	0	0	108.7	T35	P33-T35 PolarHBondContact O-N 3.49Å
34	S	61.5	Low	71	Confident	66 Å²	66	95.4 Å²	95.4	46%	0.462	49%	0.492	S	S	.	.			trans	-66.2	105	-179.3	177.2	0	0	0	0	110.4	K32 I36	K32-S34 PolarHBondContact O-N 3.43Å; S34-I36 VanDerWaalsContact C-N 3.27Å; S34-I36 PolarHBondContact O-N 3Å
35	T	67.5	Low	71.3	Confident	88 Å²	88	91.6 Å²	91.6	54%	0.54	48%	0.476	S	S	.	.			trans	-72.7	-19.7	176	50.9	0	0	0	0	112.9	P33 Y53 D54	P33-T35 PolarHBondContact O-N 3.49Å; T35-Y53 CarbonylContact O-C 3.6Å; T35-Y53 WeakPolarHBondContact O-CA 3.31Å; T35-Y53 WeakPolarHBondContact O-CB 3.38Å; T35-D54 PolarHBondContact O-N 3.12Å
36	I	71.8	Confident	71.3	Confident	71 Å²	71	94.5 Å²	94.5	36%	0.364	50%	0.501	S	S	.	.	B	Isolated β-bridge	trans	-81.8	136.5	-169.8	-53.9	173.3	0	0	0	112.3	S34 K38	S34-I36 VanDerWaalsContact C-N 3.27Å; S34-I36 PolarHBondContact O-N 3Å; I36-K38 PolarHBondContact O-N 3.4Å
37	C	77.3	Confident	71.2	Confident	1 Å²	1	100.4 Å²	100.4	1%	0.007	52%	0.523	C	S	.	.			trans	-75.3	106.8	179.4	-175.3	0	0	0	0	113.1	Y39 Y40 Q41 C45 C51 D54 H55	C37-Y39 PolarHBondContact O-N 3.49Å; C37-Y40 PolarHBondContact O-N 3.43Å; C37-Y40 PolarHBondContact SG-N 3.04Å; C37-Q41 PolarHBondContact O-N 2.89Å; C37-C45 VanDerWaalsContact SG-SG 3.67Å; C37-C51 VanDerWaalsContact SG-SG 3.63Å; C37-D54 WeakPolarHBondContact CB-O 3.03Å; C37-D54 PolarHBondContact N-O 3.13Å; C37-H55 WeakPolarHBondContact CB-CD2 3.39Å; C37-H55 PolarHBondContact SG-NE2 3.42Å; C37-H55 VanDerWaalsContact SG-NE2 3.42Å
38	K	77.3	Confident	71.1	Confident	145 Å²	145	98.3 Å²	98.3	63%	0.63	52%	0.52	S	S	*	.	H	α-helix	trans	-58.6	-28.7	177.6	-171.2	175.1	-177.4	177.3	0	114.4	I36 K42	I36-K38 PolarHBondContact O-N 3.4Å; K38-K42 PolarHBondContact O-N 3.48Å
39	Y	77.4	Confident	71.2	Confident	164 Å²	164	100.3 Å²	100.3	64%	0.643	54%	0.537	S	S	*	.	H	α-helix	trans	-76	-44.9	177.6	-63.5	-81.7	0	0	0	111.1	C37 Q41 K42 G43 Y44	C37-Y39 PolarHBondContact O-N 3.49Å; Y39-Q41 VanDerWaalsContact C-N 3.31Å; Y39-Q41 PolarHBondContact O-N 2.79Å; Y39-K42 CarbonylContact O-C 3.55Å; Y39-K42 WeakPolarHBondContact O-CA 3.5Å; Y39-K42 WeakPolarHBondContact O-CB 3.21Å; Y39-K42 PolarHBondContact O-N 2.74Å; Y39-G43 PolarHBondContact O-N 3.23Å; Y39-Y44 CarbonylContact C-O 3.5Å; Y39-Y44 VanDerWaalsContact C-O 3.28Å; Y39-Y44 CarbonylContact O-C 3.08Å; Y39-Y44 PolarHBondContact O-N 2.83Å
40	Y	78.3	Confident	71.4	Confident	76 Å²	76	106.7 Å²	106.7	30%	0.298	54%	0.54	S	S	.	.	H	α-helix	trans	-61.8	-39.2	173.6	-172.5	-102.6	0	0	0	112.2	C37 K42 G43 C45 H55 R57	C37-Y40 PolarHBondContact O-N 3.43Å; C37-Y40 PolarHBondContact SG-N 3.04Å; Y40-K42 PolarHBondContact O-N 3.37Å; Y40-G43 WeakPolarHBondContact O-CA 3.46Å; Y40-G43 PolarHBondContact O-N 2.99Å; Y40-C45 HydrophobicContact CD2-CB 4.36Å; Y40-H55 HydrophobicContact CD1-CB 3.74Å; Y40-H55 AromaticContact CD1-CG 3.89Å; Y40-H55 HydrophobicContact CD2-CB 4.18Å; Y40-H55 AromaticContact CD2-CE1 3.68Å; Y40-H55 AromaticContact CD2-CG 3.69Å; Y40-H55 AromaticContact CD2-ND1 3.34Å; Y40-H55 VanDerWaalsContact CD2-ND1 3.34Å; Y40-H55 WeakPolarHBondContact CD2-ND1 3.47Å; Y40-H55 HydrophobicContact CE1-CB 3.83Å; Y40-H55 WeakPolarHBondContact CE1-O 3.27Å; Y40-H55 HydrophobicContact CE2-CB 4.26Å; Y40-H55 AromaticContact CE2-ND1 3.79Å; Y40-H55 HydrophobicContact CG-CB 3.92Å; Y40-H55 AromaticContact CG-CD2 3.75Å; Y40-H55 AromaticContact CG-CE1 3.97Å; Y40-H55 AromaticContact CG-CG 3.53Å; Y40-H55 AromaticContact CG-ND1 3.69Å; Y40-H55 AromaticContact CG-NE2 4Å; Y40-R57 HydrophobicContact CE1-CG 4.08Å
41	Q	76.5	Confident	71.9	Confident	125 Å²	125	101.4 Å²	101.4	58%	0.584	51%	0.513	S	S	*	.	H	α-helix	trans	-61.5	-24.8	173.9	-164.3	-178.5	21.3	0	0	113.1	C37 Y39 G43	C37-Q41 PolarHBondContact O-N 2.89Å; Y39-Q41 VanDerWaalsContact C-N 3.31Å; Y39-Q41 PolarHBondContact O-N 2.79Å; Q41-G43 VanDerWaalsContact C-N 3.31Å
42	K	72.3	Confident	72.5	Confident	172 Å²	172	112 Å²	112	75%	0.748	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	6.2	172.1	-74.1	-173.7	169.2	-161	0	114	K38 Y39 Y40	K38-K42 PolarHBondContact O-N 3.48Å; Y39-K42 CarbonylContact O-C 3.55Å; Y39-K42 WeakPolarHBondContact O-CA 3.5Å; Y39-K42 WeakPolarHBondContact O-CB 3.21Å; Y39-K42 PolarHBondContact O-N 2.74Å; Y40-K42 PolarHBondContact O-N 3.37Å
43	G	69.8	Low	73.3	Confident	62 Å²	62	108.4 Å²	108.4	64%	0.639	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.1	-17.2	173.5	0	0	0	0	0	115.6	Y39 Y40 Q41	Y39-G43 PolarHBondContact O-N 3.23Å; Y40-G43 WeakPolarHBondContact O-CA 3.46Å; Y40-G43 PolarHBondContact O-N 2.99Å; Q41-G43 VanDerWaalsContact C-N 3.31Å
44	Y	75.4	Confident	74	Confident	178 Å²	178	108 Å²	108	70%	0.698	53%	0.526	S	S	*	.			trans	-148.9	129	179.5	-178	-100.7	0	0	0	112.8	Y39 A46	Y39-Y44 CarbonylContact C-O 3.5Å; Y39-Y44 VanDerWaalsContact C-O 3.28Å; Y39-Y44 CarbonylContact O-C 3.08Å; Y39-Y44 PolarHBondContact O-N 2.83Å; Y44-A46 HydrophobicContact CE1-CB 4.07Å
45	C	82.8	Confident	74.9	Confident	10 Å²	10	107 Å²	107	7%	0.068	52%	0.515	C	S	.	.			trans	-123.5	115.4	173.3	-178.8	0	0	0	0	109.3	C37 Y40 Y47 G48 C51 H55	C37-C45 VanDerWaalsContact SG-SG 3.67Å; Y40-C45 HydrophobicContact CD2-CB 4.36Å; C45-Y47 PolarHBondContact O-N 2.64Å; C45-Y47 VanDerWaalsContact O-N 3.08Å; C45-G48 PolarHBondContact O-N 3.01Å; C45-C51 VanDerWaalsContact SG-SG 3.64Å; C45-H55 PolarHBondContact SG-NE2 2.75Å; C45-H55 VanDerWaalsContact SG-NE2 3.4Å
46	A	77.6	Confident	74.9	Confident	77 Å²	77	105.9 Å²	105.9	64%	0.636	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-19.4	-178.6	0	0	0	0	0	113.8	Y44	Y44-A46 HydrophobicContact CE1-CB 4.07Å
47	Y	74.8	Confident	74.1	Confident	167 Å²	167	112.2 Å²	112.2	66%	0.655	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-4.8	177.7	-56.6	-77	0	0	0	113.7	C45 R50 C51	C45-Y47 PolarHBondContact O-N 2.64Å; C45-Y47 VanDerWaalsContact O-N 3.08Å; Y47-R50 CarbonylContact O-C 3.29Å; Y47-R50 WeakPolarHBondContact O-CA 3.23Å; Y47-R50 WeakPolarHBondContact O-CB 3.49Å; Y47-R50 PolarHBondContact O-N 3.35Å; Y47-C51 PolarHBondContact O-N 3.06Å
48	G	73.8	Confident	72.6	Confident	35 Å²	35	117 Å²	117	36%	0.361	56%	0.558	S	S	.	*	G	3₁₀ helix	trans	52.2	-138.6	176.3	0	0	0	0	0	113.3	C45 R50 C51 H55	C45-G48 PolarHBondContact O-N 3.01Å; G48-R50 PolarHBondContact O-N 3.25Å; G48-C51 PolarHBondContact O-N 2.05Å; G48-H55 PolarHBondContact O-CE1 3.49Å; G48-H55 PolarHBondContact O-ND1 3.14Å
49	T	68.3	Low	70.8	Confident	152 Å²	152	115.8 Å²	115.8	93%	0.933	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-70.1	-6.5	175.8	51.5	0	0	0	0	114.3
50	R	69.8	Low	68.9	Low	233 Å²	233	112.6 Å²	112.6	88%	0.879	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-94.3	8.9	175	-69	-179.6	164.5	-171.1	-5.1	113	Y47 G48	Y47-R50 CarbonylContact O-C 3.29Å; Y47-R50 WeakPolarHBondContact O-CA 3.23Å; Y47-R50 WeakPolarHBondContact O-CB 3.49Å; Y47-R50 PolarHBondContact O-N 3.35Å; G48-R50 PolarHBondContact O-N 3.25Å
51	C	75.4	Confident	66.9	Low	25 Å²	25	113.5 Å²	113.5	17%	0.169	60%	0.599	C	S	.	*			trans	-65.9	136	176.1	-160.5	0	0	0	0	111.2	C37 C45 Y47 G48 Y53 H55	C37-C51 VanDerWaalsContact SG-SG 3.63Å; C45-C51 VanDerWaalsContact SG-SG 3.64Å; Y47-C51 PolarHBondContact O-N 3.06Å; G48-C51 PolarHBondContact O-N 2.05Å; C51-Y53 PolarHBondContact O-N 3.02Å; C51-H55 WeakPolarHBondContact CB-NE2 3.19Å
52	R	74.4	Confident	65.1	Low	234 Å²	234	112.7 Å²	112.7	88%	0.883	61%	0.613	S	S	*	*	S	Bend	trans	-71.1	-11.5	175.4	-175.5	170.1	175.4	88.4	0.3	113.4
53	Y	78.8	Confident	63.1	Low	100 Å²	100	108.6 Å²	108.6	39%	0.392	62%	0.62	S	S	.	*	S	Bend	trans	-111.3	146	178.8	-55.4	-84.7	0	0	0	109.6	R9 T35 C51 H55	R9-Y53 PolarHBondContact NH1-OH 3.38Å; R9-Y53 VanDerWaalsContact NH1-OH 3.12Å; T35-Y53 CarbonylContact O-C 3.6Å; T35-Y53 WeakPolarHBondContact O-CA 3.31Å; T35-Y53 WeakPolarHBondContact O-CB 3.38Å; C51-Y53 PolarHBondContact O-N 3.02Å; Y53-H55 PolarHBondContact O-CD2 3.39Å
54	D	73.6	Confident	61.1	Low	87 Å²	87	109.2 Å²	109.2	47%	0.465	63%	0.626	S	S	.	*	B	Isolated β-bridge	trans	-68.8	138.7	-169.9	-161.6	4	0	0	0	112.4	T35 C37 T56	T35-D54 PolarHBondContact O-N 3.12Å; C37-D54 WeakPolarHBondContact CB-O 3.03Å; C37-D54 PolarHBondContact N-O 3.13Å; D54-T56 PolarHBondContact O-N 2.85Å
55	H	79.9	Confident	59	Low	46 Å²	46	105.6 Å²	105.6	21%	0.213	63%	0.633	C	S	.	*			trans	-104.4	50.9	-172.1	-82.4	-160.7	0	0	0	111.2	C37 Y40 C45 G48 C51 Y53	C37-H55 WeakPolarHBondContact CB-CD2 3.39Å; C37-H55 PolarHBondContact SG-NE2 3.42Å; C37-H55 VanDerWaalsContact SG-NE2 3.42Å; Y40-H55 HydrophobicContact CD1-CB 3.74Å; Y40-H55 AromaticContact CD1-CG 3.89Å; Y40-H55 HydrophobicContact CD2-CB 4.18Å; Y40-H55 AromaticContact CD2-CE1 3.68Å; Y40-H55 AromaticContact CD2-CG 3.69Å; Y40-H55 AromaticContact CD2-ND1 3.34Å; Y40-H55 VanDerWaalsContact CD2-ND1 3.34Å; Y40-H55 WeakPolarHBondContact CD2-ND1 3.47Å; Y40-H55 HydrophobicContact CE1-CB 3.83Å; Y40-H55 WeakPolarHBondContact CE1-O 3.27Å; Y40-H55 HydrophobicContact CE2-CB 4.26Å; Y40-H55 AromaticContact CE2-ND1 3.79Å; Y40-H55 HydrophobicContact CG-CB 3.92Å; Y40-H55 AromaticContact CG-CD2 3.75Å; Y40-H55 AromaticContact CG-CE1 3.97Å; Y40-H55 AromaticContact CG-CG 3.53Å; Y40-H55 AromaticContact CG-ND1 3.69Å; Y40-H55 AromaticContact CG-NE2 4Å; C45-H55 PolarHBondContact SG-NE2 2.75Å; C45-H55 VanDerWaalsContact SG-NE2 3.4Å; G48-H55 PolarHBondContact O-CE1 3.49Å; G48-H55 PolarHBondContact O-ND1 3.14Å; C51-H55 WeakPolarHBondContact CB-NE2 3.19Å; Y53-H55 PolarHBondContact O-CD2 3.39Å
56	T	68.1	Low	56.7	Low	64 Å²	64	112 Å²	112	39%	0.393	67%	0.671	S	S	.	*	P	Polyproline II helix	trans	-83.2	117.7	177.2	47.6	0	0	0	0	111.2	D54	D54-T56 PolarHBondContact O-N 2.85Å
57	R	54.8	Low	54.5	Low	203 Å²	203	111.5 Å²	111.5	77%	0.766	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-74.6	130.2	162.5	-89.2	-174.9	170.2	-172.3	-3	108.7	Y40 S59	Y40-R57 HydrophobicContact CE1-CG 4.08Å; R57-S59 PolarHBondContact O-N 3.27Å
58	P	46.2	Very low	52.4	Low	103 Å²	103	110.4 Å²	110.4	67%	0.669	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-61.4	124.1	169.1	-20.2	32.4	0	0	0	109.8	A60	P58-A60 PolarHBondContact O-N 3.47Å
59	S	39	Very low	50.8	Low	118 Å²	118	117 Å²	117	83%	0.825	71%	0.708	S	S	*	*			trans	-74.6	115.5	173.7	-173.2	0	0	0	0	109.5	R57	R57-S59 PolarHBondContact O-N 3.27Å
60	A	38.1	Very low	49	Very low	98 Å²	98	113.5 Å²	113.5	81%	0.81	70%	0.695	S	S	*	*			trans	-83.2	116.3	164.3	0	0	0	0	0	108	P58 A62	P58-A60 PolarHBondContact O-N 3.47Å; A60-A62 PolarHBondContact O-N 3.29Å
61	A	35	Very low	47.2	Very low	95 Å²	95	110.8 Å²	110.8	79%	0.785	69%	0.692	S	S	*	*			trans	-80.4	117.9	-175.5	0	0	0	0	0	112.6
62	A	38.4	Very low	44.9	Very low	107 Å²	107	114.3 Å²	114.3	88%	0.884	72%	0.717	S	S	*	*			trans	57.4	128.1	143.4	0	0	0	0	0	122.8	A60	A60-A62 PolarHBondContact O-N 3.29Å
63	G	30.6	Very low	43	Very low	86 Å²	86	109.8 Å²	109.8	89%	0.887	72%	0.715	S	S	*	*			trans	122.9	119.2	154	0	0	0	0	0	114.9
64	G	29.6	Very low	41.4	Very low	75 Å²	75	110.3 Å²	110.3	77%	0.773	73%	0.731	S	S	*	*			cis	175.3	152.8	-9.9	0	0	0	0	0	112.7
65	A	31.3	Very low	39.6	Very low	103 Å²	103	111.3 Å²	111.3	85%	0.851	74%	0.744	S	S	*	*			trans	64.2	152.5	170.3	0	0	0	0	0	117.3
66	V	33.5	Very low	37.6	Very low	143 Å²	143	115.2 Å²	115.2	87%	0.867	77%	0.774	S	S	*	*			cis	-147.5	146.3	9.5	170.1	0	0	0	0	110.4
67	G	30.7	Very low	35.8	Very low	67 Å²	67	115.8 Å²	115.8	69%	0.691	79%	0.785	S	S	*	*			trans	71.1	149.9	153.5	0	0	0	0	0	118.8
68	T	30.8	Very low	34.5	Very low	145 Å²	145	114.8 Å²	114.8	89%	0.89	79%	0.787	S	S	*	*			cis	-154.7	169	3.6	-29.3	0	0	0	0	109.9
69	M	39.8	Very low	33.6	Very low	172 Å²	172	118.2 Å²	118.2	85%	0.847	79%	0.793	S	S	*	*			trans	-58.7	161.5	-177.4	-51	-60.2	-178.2	0	0	113.6
70	A	30.6	Very low	33.4	Very low	80 Å²	80	119.2 Å²	119.2	66%	0.661	79%	0.79	S	S	*	*				-176.1	148.7	61.1	0	0	0	0	0	115.9
71	H	32.7	Very low	33.1	Very low	175 Å²	175	120.2 Å²	120.2	81%	0.81	79%	0.788	S	S	*	*			trans	46.8	149.2	138.1	-53.9	-53.1	0	0	0	121.5
72	S	28	Very low	32.9	Very low	99 Å²	99	123.8 Å²	123.8	69%	0.692	79%	0.788	S	S	*	*			cis	-171.1	126.4	9.3	16.4	0	0	0	0	115
73	V	34.5	Very low	33.3	Very low	140 Å²	140	123.9 Å²	123.9	85%	0.848	78%	0.779	S	S	*	*			trans	59.2	177.5	140.5	-126.3	0	0	0	0	120.1
74	P	45.1	Very low	34	Very low	111 Å²	111	124.9 Å²	124.9	72%	0.721	77%	0.77	S	S	*	*				-128.6	-175.7	-103.1	45.3	-29.2	0	0	0	118.1
75	S	34.6	Very low	34.2	Very low	107 Å²	107	126 Å²	126	75%	0.748	77%	0.766	S	S	*	*			trans	-61.1	166.5	162.3	-34.4	0	0	0	0	115.1
76	P	37.9	Very low	34	Very low	129 Å²	129	129 Å²	129	84%	0.838	76%	0.762	S	S	*	*			trans	-106.1	162.2	144.9	36	-27.9	0	0	0	112.4
77	A	31.2	Very low	33.8	Very low	75 Å²	75	129.2 Å²	129.2	62%	0.62	76%	0.764	S	S	*	*			trans	-125.1	-165.9	177.4	0	0	0	0	0	110.7
78	F	26.6	Very low	33.8	Very low	183 Å²	183	132.7 Å²	132.7	80%	0.803	77%	0.772	S	S	*	*			trans	80	145.8	172.7	-44.7	-71.2	0	0	0	115.6
79	H	28	Very low	33.8	Very low	174 Å²	174	130.1 Å²	130.1	81%	0.806	77%	0.765	S	S	*	*			cis	-136.9	164.9	3.7	-88.9	-69.1	0	0	0	111.9
80	N	34.3	Very low	33.2	Very low	140 Å²	140	127.5 Å²	127.5	75%	0.749	76%	0.764	S	S	*	*			trans	-121.5	148.2	165	-169.5	50.9	0	0	0	108.9
81	P	31.3	Very low	33.1	Very low	119 Å²	119	130.6 Å²	130.6	77%	0.773	77%	0.768	S	S	*	*			trans	-137.8	132.3	149.6	33	-16.6	0	0	0	114.9
82	H	32	Very low	32.9	Very low	170 Å²	170	129.3 Å²	129.3	79%	0.787	77%	0.772	S	S	*	*			trans	-103.4	165.1	149.5	-125.6	-48.9	0	0	0	106.7
83	P	47.1	Very low	32.8	Very low	108 Å²	108	133.1 Å²	133.1	70%	0.701	78%	0.776	S	S	*	*				-155.1	-144.9	61	43.3	-19.5	0	0	0	112.3
84	P	44.6	Very low	32.5	Very low	108 Å²	108	132.9 Å²	132.9	70%	0.701	78%	0.775	S	S	*	*			cis	-126.5	172.4	-41	28.3	-8.7	0	0	0	115.4
85	S	33.2	Very low	31.5	Very low	98 Å²	98	134.3 Å²	134.3	69%	0.685	78%	0.777	S	S	*	*			trans	40.1	156.8	138	-67.4	0	0	0	0	123.6
86	E	28	Very low	31	Very low	165 Å²	165	134.3 Å²	134.3	77%	0.771	78%	0.777	S	S	*	*			cis	-167.2	157	-1.6	-118.5	157.1	-120.6	0	0	110.5
87	V	29.8	Very low	30.5	Very low	148 Å²	148	137.1 Å²	137.1	90%	0.897	78%	0.779	S	S	*	*			trans	-172.5	155.3	130.9	-93.8	0	0	0	0	111.4
88	T	30.5	Very low	30.4	Very low	140 Å²	140	141.6 Å²	141.6	86%	0.859	79%	0.787	S	S	*	*			trans	-116.5	174.6	179.2	61.9	0	0	0	0	110.5
89	A	29.6	Very low	30.7	Very low	91 Å²	91	138.2 Å²	138.2	75%	0.752	78%	0.783	S	S	*	*			cis	-142.3	-153.5	15.5	0	0	0	0	0	110.1
90	S	27.3	Very low	30.6	Very low	118 Å²	118	133.6 Å²	133.6	83%	0.825	78%	0.783	S	S	*	*			cis	-158	-159.7	16	-160.2	0	0	0	0	112.9
91	I	28.6	Very low	30.3	Very low	144 Å²	144	137.1 Å²	137.1	74%	0.738	79%	0.791	S	S	*	*			trans	-115.6	140	-168.7	-75.5	154.3	0	0	0	112.5
92	V	28.4	Very low	30.3	Very low	149 Å²	149	143.1 Å²	143.1	90%	0.903	80%	0.798	S	S	*	*				-148.3	154.3	128	-176.7	0	0	0	0	108.5
93	K	27	Very low	30.3	Very low	178 Å²	178	142.4 Å²	142.4	77%	0.774	80%	0.795	S	S	*	*			trans	-143.6	131.4	-164.7	176.3	-171.4	-171.9	180	0	111
94	T	26.5	Very low	29.5	Very low	135 Å²	135	146.9 Å²	146.9	83%	0.828	80%	0.804	S	S	*	*			trans	-171.8	111	149.7	33.8	0	0	0	0	115.2
95	N	24.9	Very low	28.8	Very low	141 Å²	141	152 Å²	152	75%	0.754	81%	0.809	S	S	*	*			trans	41.8	120	134.5	-70.5	13.3	0	0	0	125.5
96	S	24.8	Very low	28.7	Very low	108 Å²	108	153.1 Å²	153.1	76%	0.755	81%	0.812	S	S	*	*				115.1	143.3	111.1	70.8	0	0	0	0	121.8
97	H	27.3	Very low	28.9	Very low	188 Å²	188	153.3 Å²	153.3	87%	0.87	82%	0.817	S	S	*	*			trans	81.7	118.1	167.2	-86.3	-86.4	0	0	0	122.5
98	E	27.8	Very low	28.9	Very low	169 Å²	169	152 Å²	152	79%	0.79	81%	0.809	S	S	*	*			trans	-70.2	175.2	162.5	-83.3	-93.1	95.9	0	0	113.1
99	P	34.3	Very low	28.8	Very low	112 Å²	112	153.4 Å²	153.4	73%	0.727	81%	0.811	S	S	*	*			cis	-127.4	145.1	-24.4	30.4	-12.9	0	0	0	113.2
100	G	25.8	Very low	29	Very low	77 Å²	77	159.2 Å²	159.2	79%	0.794	81%	0.813	S	S	*	*			trans	-125.4	118	-170.1	0	0	0	0	0	116.5	R102	G100-R102 PolarHBondContact O-N 2.99Å
101	K	27.9	Very low	29	Very low	214 Å²	214	161.2 Å²	161.2	93%	0.93	82%	0.815	S	S	*	*			trans	-30.2	121.7	172.6	-64.1	168.2	178.2	173.4	0	115.6
102	R	30.9	Very low	29.3	Very low	245 Å²	245	166 Å²	166	93%	0.925	82%	0.823	S	S	*	*			trans	-88.4	127.8	161.7	-164.3	173	-172.5	171.8	3	110.3	G100	G100-R102 PolarHBondContact O-N 2.99Å
103	E	31.8	Very low	29.5	Very low	155 Å²	155	165.9 Å²	165.9	72%	0.724	82%	0.818	S	S	*	*			trans	-61.8	141.2	-177	-65.1	165.1	102.2	0	0	113
104	K	30.3	Very low	29.7	Very low	201 Å²	201	164.8 Å²	164.8	87%	0.874	82%	0.819	S	S	*	*			trans	-92.5	93.1	167.8	-67	176.7	-178.3	174.6	0	108.7	T106	K104-T106 PolarHBondContact O-N 3.15Å
105	R	31.1	Very low	29.9	Very low	216 Å²	216	163.4 Å²	163.4	82%	0.815	82%	0.815	S	S	*	*			trans	-80.8	109.2	163.8	-78.8	-175.3	172.7	174.1	-2.8	109.2	L107	R105-L107 PolarHBondContact O-N 3.36Å
106	T	30.7	Very low	30.1	Very low	121 Å²	121	160.6 Å²	160.6	74%	0.742	82%	0.82	S	S	*	*			trans	-71.8	114.2	178.7	-58.1	0	0	0	0	109.8	K104 V108	K104-T106 PolarHBondContact O-N 3.15Å; T106-V108 HydrophobicContact CG2-CG2 4.34Å
107	L	30.9	Very low	30.2	Very low	169 Å²	169	163.8 Å²	163.8	89%	0.885	83%	0.825	S	S	*	*			trans	-87.3	108.7	166.1	-74.4	175.8	0	0	0	109.4	R105 L109	R105-L107 PolarHBondContact O-N 3.36Å; L107-L109 PolarHBondContact O-N 2.83Å
108	V	30.5	Very low	30.3	Very low	121 Å²	121	159.6 Å²	159.6	73%	0.733	82%	0.822	S	S	*	*			trans	-73.6	111.6	174.8	179.1	0	0	0	0	109.2	T106	T106-V108 HydrophobicContact CG2-CG2 4.34Å
109	L	29.3	Very low	30.5	Very low	169 Å²	169	161.1 Å²	161.1	89%	0.885	83%	0.83	S	S	*	*			trans	-97.7	108.6	166.5	-103	160.8	0	0	0	108.5	L107	L107-L109 PolarHBondContact O-N 2.83Å
110	R	32	Very low	30.3	Very low	214 Å²	214	159.3 Å²	159.3	81%	0.808	83%	0.831	S	S	*	*			trans	-85.5	119	-176.6	-161	172.9	-169.9	157.5	2.6	109.7	R112	R110-R112 PolarHBondContact O-N 3.41Å
111	D	29.1	Very low	30.4	Very low	159 Å²	159	165.8 Å²	165.8	85%	0.85	84%	0.838	S	S	*	*			trans	-62	130.5	178.4	-81.7	-66.8	0	0	0	112.2
112	R	34.2	Very low	30.4	Very low	245 Å²	245	161.8 Å²	161.8	93%	0.925	83%	0.831	S	S	*	*			trans	-115	92.2	162.3	-172.8	161.1	86.5	170.4	5.4	108.7	R110	R110-R112 PolarHBondContact O-N 3.41Å
113	N	32.5	Very low	30.2	Very low	146 Å²	146	158.7 Å²	158.7	78%	0.781	83%	0.828	S	S	*	*			trans	-96.3	150.9	175.4	-151.1	-15.1	0	0	0	111.7
114	L	31.1	Very low	30.3	Very low	155 Å²	155	155.4 Å²	155.4	81%	0.812	82%	0.82	S	S	*	*			trans	-80	145.8	-175.3	-66.1	140.4	0	0	0	110.9
115	S	30.2	Very low	30.1	Very low	106 Å²	106	151.1 Å²	151.1	74%	0.741	82%	0.815	S	S	*	*			trans	-154.1	98.8	157.4	-76.2	0	0	0	0	108.2
116	G	29.2	Very low	30	Very low	82 Å²	82	148.7 Å²	148.7	85%	0.845	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-69.1	135.5	174.9	0	0	0	0	0	110.6
117	M	27.9	Very low	29.9	Very low	176 Å²	176	149.4 Å²	149.4	87%	0.867	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-93.1	124.9	170.4	-61.8	-68.1	157.3	0	0	108.2
118	A	28.6	Very low	29.9	Very low	99 Å²	99	147 Å²	147	82%	0.818	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-102.5	118.1	170.3	0	0	0	0	0	109.4
119	E	31.8	Very low	29.9	Very low	201 Å²	201	148.3 Å²	148.3	94%	0.939	82%	0.819	S	S	*	*			trans	171.3	133.7	152.7	-98.3	176.9	167.1	0	0	104.8
120	G	30.1	Very low	30.4	Very low	74 Å²	74	146.1 Å²	146.1	76%	0.763	82%	0.815	S	S	*	*			cis	126.2	103.1	21.3	0	0	0	0	0	107.2
121	K	28.5	Very low	30.2	Very low	213 Å²	213	139.1 Å²	139.1	93%	0.926	81%	0.809	S	S	*	*			trans	-144.8	108	178.1	-138.4	173.3	-173.7	-179.1	0	111.9
122	T	27.6	Very low	30	Very low	131 Å²	131	137.4 Å²	137.4	80%	0.804	81%	0.81	S	S	*	*			trans	-80.3	146.4	176.7	-35.7	0	0	0	0	111.3
123	Q	27.9	Very low	29.7	Very low	180 Å²	180	131.1 Å²	131.1	84%	0.841	80%	0.802	S	S	*	*			trans	-159.4	164.4	156.1	-99.8	-68.2	-71.7	0	0	107.3
124	P	33.2	Very low	29.6	Very low	86 Å²	86	130.3 Å²	130.3	56%	0.558	81%	0.807	S	S	*	*				-121.3	177	-116.1	42.5	-32.4	0	0	0	114.5
125	S	25.7	Very low	29.6	Very low	110 Å²	110	130.2 Å²	130.2	77%	0.769	81%	0.808	S	S	*	*			trans	-166.3	169.4	146	-92.3	0	0	0	0	114.4
126	M	29.2	Very low	30.1	Very low	165 Å²	165	129.8 Å²	129.8	81%	0.813	80%	0.803	S	S	*	*			trans	-95.6	170.6	-153.7	-19.3	-60.5	164.5	0	0	114.9
127	V	29.6	Very low	30	Very low	136 Å²	136	133.5 Å²	133.5	82%	0.824	80%	0.798	S	S	*	*			trans	-70.4	139.6	179.9	172.6	0	0	0	0	113.4
128	S	29.4	Very low	30.4	Very low	119 Å²	119	130.2 Å²	130.2	83%	0.832	79%	0.79	S	S	*	*				-173.4	141.1	129.8	-80.5	0	0	0	0	112.8
129	N	32	Very low	30.6	Very low	148 Å²	148	130 Å²	130	79%	0.791	78%	0.782	S	S	*	*			trans	-141	137.5	167.9	-161	41.1	0	0	0	105.9
130	P	38.5	Very low	30.7	Very low	124 Å²	124	126.3 Å²	126.3	81%	0.805	78%	0.776	S	S	*	*				-135.7	170.1	79.4	30	-10.8	0	0	0	112.1
131	G	27.6	Very low	31.4	Very low	66 Å²	66	132 Å²	132	68%	0.68	78%	0.782	S	S	*	*			cis	118.3	87.1	17.7	0	0	0	0	0	110.8
132	S	26.2	Very low	31.9	Very low	124 Å²	124	130.2 Å²	130.2	87%	0.867	78%	0.779	S	S	*	*			trans	-161.6	166.5	161.8	-161.4	0	0	0	0	111
133	C	27.1	Very low	32.7	Very low	113 Å²	113	132.8 Å²	132.8	76%	0.764	78%	0.78	S	S	*	*			trans	-119.7	154.7	-155.7	51.1	0	0	0	0	115.5
134	S	30.5	Very low	33.3	Very low	128 Å²	128	130.3 Å²	130.3	90%	0.895	78%	0.779	S	S	*	*			trans	-179.3	159	138.6	-79	0	0	0	0	112.1
135	D	31.5	Very low	34.3	Very low	154 Å²	154	132.5 Å²	132.5	82%	0.824	78%	0.782	S	S	*	*			trans	-122.5	-171.8	-168.4	-144.6	12.3	0	0	0	109.3
136	P	39.2	Very low	36.3	Very low	97 Å²	97	130.6 Å²	130.6	63%	0.63	77%	0.768	S	S	*	*				-124.1	164.6	-65.3	24.9	-5.2	0	0	0	116.7
137	Q	28.4	Very low	37.4	Very low	160 Å²	160	131.7 Å²	131.7	75%	0.748	76%	0.764	S	S	*	*			trans	71.6	160.1	150.3	-74.8	-68.9	-70.2	0	0	121.3
138	P	35.7	Very low	38.5	Very low	106 Å²	106	130.4 Å²	130.4	69%	0.688	75%	0.753	S	S	*	*			cis	-127.7	162.2	-2	38.7	-22	0	0	0	118
139	S	32.1	Very low	39.7	Very low	95 Å²	95	129.1 Å²	129.1	66%	0.664	73%	0.733	S	S	*	*			trans	26.7	138.4	144.1	-56.5	0	0	0	0	122.2
140	P	33.9	Very low	41.1	Very low	123 Å²	123	125.2 Å²	125.2	80%	0.799	72%	0.721	S	S	*	*				-136.2	159.3	60.5	38.3	-23	0	0	0	117.5
141	E	45.1	Very low	42.3	Very low	193 Å²	193	123.1 Å²	123.1	90%	0.902	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-68.7	122.9	176.8	-58.9	170.7	119.2	0	0	112
142	M	40.4	Very low	43.5	Very low	176 Å²	176	127.3 Å²	127.3	87%	0.867	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-97.9	116.9	162.2	-74.8	-168.5	-78.7	0	0	110
143	K	43.3	Very low	45.1	Very low	186 Å²	186	126.3 Å²	126.3	81%	0.809	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-58.2	146.4	167.1	-82.6	173.5	175	167.6	0	109.6	H145	K143-H145 PolarHBondContact O-N 3.13Å
144	P	41.4	Very low	46.3	Very low	127 Å²	127	123.9 Å²	123.9	83%	0.825	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-59.6	129.5	171.5	26.4	-33.6	0	0	0	109.5
145	H	53.4	Low	47.2	Very low	133 Å²	133	124.3 Å²	124.3	62%	0.616	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-55.8	140.4	-176.8	-85.6	-74.2	0	0	0	112.1	K143 E149	K143-H145 PolarHBondContact O-N 3.13Å; H145-E149 IonicContact CE1-OE2 3.44Å; H145-E149 IonicContact ND1-OE2 2.79Å; H145-E149 PolarHBondContact ND1-OE2 3.45Å
146	S	68.9	Low	47.6	Very low	70 Å²	70	123.7 Å²	123.7	49%	0.49	67%	0.673	S	S	.	*	P	Polyproline II helix	trans	-63.8	145.7	169.4	-178.1	0	0	0	0	110	L148 E149 A150	S146-L148 PolarHBondContact O-N 3.38Å; S146-E149 WeakPolarHBondContact O-CB 3.16Å; S146-E149 PolarHBondContact O-N 3.28Å; S146-A150 PolarHBondContact O-N 3.4Å
147	Y	50.5	Low	47.6	Very low	187 Å²	187	126.8 Å²	126.8	73%	0.733	68%	0.684	S	S	*	*	H	α-helix	trans	-51.5	-32.8	176.7	179.4	-110.7	0	0	0	113	E149 I151	Y147-E149 VanDerWaalsContact C-N 3.27Å; Y147-E149 PolarHBondContact O-N 3.24Å; Y147-I151 HydrophobicContact CD1-CD1 3.92Å; Y147-I151 HydrophobicContact CD2-CD1 4.49Å; Y147-I151 HydrophobicContact CE1-CD1 3.59Å; Y147-I151 HydrophobicContact CE2-CD1 4.2Å; Y147-I151 HydrophobicContact CG-CD1 4.36Å; Y147-I151 WeakPolarHBondContact O-CD1 3.15Å; Y147-I151 VanDerWaalsContact O-CG1 3.31Å; Y147-I151 WeakPolarHBondContact O-CG1 3.43Å; Y147-I151 PolarHBondContact O-N 3.45Å
148	L	54.1	Low	48.6	Very low	110 Å²	110	125.6 Å²	125.6	58%	0.576	69%	0.688	S	S	*	*	H	α-helix	trans	-75.7	-5.9	176.9	-77.5	170	0	0	0	115.2	S146 R152	S146-L148 PolarHBondContact O-N 3.38Å; L148-R152 PolarHBondContact O-NE 3.37Å; L148-R152 PolarHBondContact O-NH2 3.06Å
149	E	53.6	Low	49	Very low	92 Å²	92	129.6 Å²	129.6	43%	0.43	70%	0.698	S	S	.	*	H	α-helix	trans	-101.3	-42.3	-179.7	-155.9	151.1	-135.1	0	0	110.4	H145 S146 Y147 I151 R152 S153	H145-E149 IonicContact CE1-OE2 3.44Å; H145-E149 IonicContact ND1-OE2 2.79Å; H145-E149 PolarHBondContact ND1-OE2 3.45Å; S146-E149 WeakPolarHBondContact O-CB 3.16Å; S146-E149 PolarHBondContact O-N 3.28Å; Y147-E149 VanDerWaalsContact C-N 3.27Å; Y147-E149 PolarHBondContact O-N 3.24Å; E149-I151 PolarHBondContact O-N 3.29Å; E149-R152 PolarHBondContact O-N 3.31Å; E149-S153 PolarHBondContact O-N 3.18Å; E149-S153 VanDerWaalsContact O-N 3.08Å; E149-S153 PolarHBondContact O-OG 3.02Å
150	A	62	Low	49.6	Very low	65 Å²	65	129.6 Å²	129.6	54%	0.537	70%	0.703	S	S	.	*	H	α-helix	trans	-60.7	-22.8	169.4	0	0	0	0	0	113.9	S146	S146-A150 PolarHBondContact O-N 3.4Å
151	I	64.4	Low	49.7	Very low	80 Å²	80	129.9 Å²	129.9	41%	0.41	71%	0.708	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.1	-31.3	173.3	-67.9	167.7	0	0	0	111.7	Y147 E149	Y147-I151 HydrophobicContact CD1-CD1 3.92Å; Y147-I151 HydrophobicContact CD2-CD1 4.49Å; Y147-I151 HydrophobicContact CE1-CD1 3.59Å; Y147-I151 HydrophobicContact CE2-CD1 4.2Å; Y147-I151 HydrophobicContact CG-CD1 4.36Å; Y147-I151 WeakPolarHBondContact O-CD1 3.15Å; Y147-I151 VanDerWaalsContact O-CG1 3.31Å; Y147-I151 WeakPolarHBondContact O-CG1 3.43Å; Y147-I151 PolarHBondContact O-N 3.45Å; E149-I151 PolarHBondContact O-N 3.29Å
152	R	52.1	Low	49.7	Very low	154 Å²	154	126 Å²	126	58%	0.581	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-80.9	-38.6	-177.7	-89.3	-179.7	-76.7	170.2	0.3	112.6	L148 E149 G154 L155	L148-R152 PolarHBondContact O-NE 3.37Å; L148-R152 PolarHBondContact O-NH2 3.06Å; E149-R152 PolarHBondContact O-N 3.31Å; R152-G154 PolarHBondContact O-N 2.56Å; R152-L155 PolarHBondContact O-N 3.5Å; R152-L155 VanDerWaalsContact O-N 3.13Å
153	S	59.7	Low	49.5	Very low	104 Å²	104	122.9 Å²	122.9	73%	0.727	70%	0.698	S	S	*	*	G	3₁₀ helix	trans	-66.5	-0.2	172.9	52.2	0	0	0	0	114.6	E149	E149-S153 PolarHBondContact O-N 3.18Å; E149-S153 VanDerWaalsContact O-N 3.08Å; E149-S153 PolarHBondContact O-OG 3.02Å
154	G	51.5	Low	49.6	Very low	62 Å²	62	124.8 Å²	124.8	64%	0.639	70%	0.702	S	S	*	*	G	3₁₀ helix	trans	-100.1	6.5	171.8	0	0	0	0	0	115.3	R152	R152-G154 PolarHBondContact O-N 2.56Å
155	L	50.2	Low	49.9	Very low	137 Å²	137	123.1 Å²	123.1	72%	0.717	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.7	-7.3	-173.9	-73	175.9	0	0	0	116.2	R152	R152-L155 PolarHBondContact O-N 3.5Å; R152-L155 VanDerWaalsContact O-N 3.13Å
156	D	40.3	Very low	49.6	Very low	141 Å²	141	124.2 Å²	124.2	75%	0.754	70%	0.703	S	S	*	*	S	Bend	trans	-111.1	68.3	179.5	-69.1	-47.1	0	0	0	111.7
157	D	39.2	Very low	49	Very low	161 Å²	161	127.6 Å²	127.6	86%	0.861	71%	0.711	S	S	*	*			trans	-166.8	90	153.3	-108.3	-32.9	0	0	0	110.2
158	V	49.2	Very low	49.8	Very low	136 Å²	136	123.9 Å²	123.9	82%	0.824	70%	0.701	S	S	*	*			trans	-134.3	87.5	171.9	-175.5	0	0	0	0	109.4
159	E	42.9	Very low	50.7	Low	190 Å²	190	125.3 Å²	125.3	89%	0.888	71%	0.705	S	S	*	*	S	Bend	trans	-156.1	126.4	142	-117.4	169.8	-162	0	0	113
160	A	45.2	Very low	52	Low	95 Å²	95	122.7 Å²	122.7	79%	0.785	69%	0.693	S	S	*	*	S	Bend	trans	56.9	75.1	159.4	0	0	0	0	0	120.5
161	S	36.6	Very low	53.1	Low	128 Å²	128	119.7 Å²	119.7	90%	0.895	67%	0.668	S	S	*	*			trans	-154.8	113.7	138.4	-84.2	0	0	0	0	111.7	S163	S161-S163 PolarHBondContact O-N 3.14Å
162	S	45.3	Very low	53.8	Low	112 Å²	112	119.9 Å²	119.9	78%	0.783	67%	0.674	S	S	*	*			trans	-90.4	103.2	-173.9	56.7	0	0	0	0	113.2
163	S	36.3	Very low	55.3	Low	111 Å²	111	119.9 Å²	119.9	78%	0.776	68%	0.676	S	S	*	*			trans	-151.8	89.8	147.6	53.8	0	0	0	0	110.1	S161 S165	S161-S163 PolarHBondContact O-N 3.14Å; S163-S165 PolarHBondContact O-N 3.08Å
164	Y	44.9	Very low	56.4	Low	226 Å²	226	115 Å²	115	89%	0.886	64%	0.641	S	S	*	*			trans	-71.2	111	176.6	-69.8	-96.2	0	0	0	110.8
165	S	47.8	Very low	57.9	Low	92 Å²	92	113.2 Å²	113.2	64%	0.643	62%	0.621	S	S	*	*			trans	-133	49.6	167.4	-64	0	0	0	0	110.9	S163 E167	S163-S165 PolarHBondContact O-N 3.08Å; S165-E167 PolarHBondContact O-N 3.33Å; S165-E167 VanDerWaalsContact O-N 3.17Å
166	N	47.6	Very low	59.4	Low	155 Å²	155	110.6 Å²	110.6	83%	0.829	62%	0.619	S	S	*	*			trans	-81.4	81.8	159.8	-162.9	-11.6	0	0	0	106.7	Q168	N166-Q168 VanDerWaalsContact C-N 3.31Å; N166-Q168 PolarHBondContact O-N 3.1Å
167	E	55.5	Low	61.3	Low	141 Å²	141	105.9 Å²	105.9	66%	0.659	60%	0.604	S	S	*	*			trans	-68.9	78.8	-164	-67.8	174.7	151.7	0	0	113.2	S165 Q169	S165-E167 PolarHBondContact O-N 3.33Å; S165-E167 VanDerWaalsContact O-N 3.17Å; E167-Q169 VanDerWaalsContact C-N 3.28Å; E167-Q169 PolarHBondContact O-N 3.31Å; E167-Q169 PolarHBondContact O-NE2 3.42Å
168	Q	66.3	Low	63.4	Low	109 Å²	109	106.2 Å²	106.2	51%	0.509	60%	0.6	S	S	.	*				48.4	41.6	123	-74.1	170.3	12	0	0	116.6	N166 L170 L188 H202	N166-Q168 VanDerWaalsContact C-N 3.31Å; N166-Q168 PolarHBondContact O-N 3.1Å; Q168-L170 PolarHBondContact O-N 2.76Å; Q168-L188 HydrophobicContact CB-CD1 3.69Å; Q168-L188 HydrophobicContact CB-CG 4.22Å; Q168-L188 HydrophobicContact CG-CD1 4.11Å; Q168-L188 HydrophobicContact CG-CG 4.45Å; Q168-H202 PolarHBondContact O-NE2 3.29Å
169	Q	73.4	Confident	65.2	Low	141 Å²	141	100.4 Å²	100.4	66%	0.659	57%	0.565	S	S	*	*			trans	-58.5	135.7	177.8	-61.8	-62	-67.9	0	0	111.8	E167 L188	E167-Q169 VanDerWaalsContact C-N 3.28Å; E167-Q169 PolarHBondContact O-N 3.31Å; E167-Q169 PolarHBondContact O-NE2 3.42Å; Q169-L188 PolarHBondContact O-N 3.26Å
170	L	81.3	Confident	67.1	Low	37 Å²	37	103 Å²	103	19%	0.194	57%	0.567	C	S	.	*	B	Isolated β-bridge	trans	-61.2	137.2	174.4	-70.5	177.9	0	0	0	110.9	Q168 P172 L188 V200	Q168-L170 PolarHBondContact O-N 2.76Å; L170-P172 WeakPolarHBondContact O-CD 3Å; L170-L188 CarbonylContact C-O 3.52Å; L170-L188 WeakPolarHBondContact CA-O 3.48Å; L170-L188 HydrophobicContact CD2-CB 4.31Å; L170-V200 WeakPolarHBondContact CD1-O 3.41Å
171	C	84.6	Confident	68.7	Low	1 Å²	1	105 Å²	105	1%	0.007	56%	0.558	C	S	.	*			trans	-60.7	114.9	176.1	179.3	0	0	0	0	110.7	Y173 A174 A175 C179 C185 L188 H189	C171-Y173 PolarHBondContact O-N 3.16Å; C171-Y173 VanDerWaalsContact O-N 3.12Å; C171-A174 HydrophobicContact CB-CB 3.86Å; C171-A174 PolarHBondContact O-N 3.18Å; C171-A174 VanDerWaalsContact O-N 3.14Å; C171-A175 WeakPolarHBondContact O-CB 3.48Å; C171-A175 PolarHBondContact O-N 2.86Å; C171-C179 VanDerWaalsContact SG-SG 3.67Å; C171-C185 VanDerWaalsContact SG-SG 3.61Å; C171-L188 WeakPolarHBondContact CB-O 3.25Å; C171-L188 PolarHBondContact N-O 3.3Å; C171-H189 VanDerWaalsContact CB-CD2 3.49Å; C171-H189 WeakPolarHBondContact CB-CD2 3.21Å
172	P	80.4	Confident	70.7	Confident	84 Å²	84	100.3 Å²	100.3	55%	0.545	53%	0.531	S	S	.	.	H	α-helix	trans	-61.5	-26.8	-178	-25.1	35.9	0	0	0	113.4	L170 A176	L170-P172 WeakPolarHBondContact O-CD 3Å; P172-A176 WeakPolarHBondContact O-CB 3.38Å; P172-A176 PolarHBondContact O-N 3.13Å
173	Y	82.8	Confident	72.1	Confident	154 Å²	154	102.6 Å²	102.6	60%	0.604	53%	0.534	S	S	*	.	H	α-helix	trans	-77.9	-38.5	178.1	-57.9	-73.6	0	0	0	112.4	C171 A176 G177 E178	C171-Y173 PolarHBondContact O-N 3.16Å; C171-Y173 VanDerWaalsContact O-N 3.12Å; Y173-A176 PolarHBondContact O-N 3.1Å; Y173-G177 PolarHBondContact O-N 3.47Å; Y173-E178 CarbonylContact O-C 3.46Å; Y173-E178 PolarHBondContact O-N 2.68Å
174	A	82.5	Confident	74.2	Confident	1 Å²	1	101.4 Å²	101.4	1%	0.008	53%	0.531	C	S	.	.	H	α-helix	trans	-69.5	-40.7	173.1	0	0	0	0	0	111.4	C171 A176 G177 C179 H189 R199	C171-A174 HydrophobicContact CB-CB 3.86Å; C171-A174 PolarHBondContact O-N 3.18Å; C171-A174 VanDerWaalsContact O-N 3.14Å; A174-A176 PolarHBondContact O-N 3.35Å; A174-G177 PolarHBondContact O-N 3.01Å; A174-C179 HydrophobicContact CB-CB 3.99Å; A174-H189 HydrophobicContact CB-CB 4.45Å; A174-R199 HydrophobicContact CB-CB 4.3Å
175	A	83.1	Confident	76	Confident	26 Å²	26	92 Å²	92	22%	0.215	50%	0.498	C	S	.	.	H	α-helix	trans	-58.8	-29.7	173.6	0	0	0	0	0	112.9	C171 V200	C171-A175 WeakPolarHBondContact O-CB 3.48Å; C171-A175 PolarHBondContact O-N 2.86Å; A175-V200 HydrophobicContact CB-CG1 3.88Å; A175-V200 WeakPolarHBondContact O-CG1 3.04Å
176	A	81.6	Confident	77.7	Confident	81 Å²	81	94.4 Å²	94.4	67%	0.669	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-2.3	176.4	0	0	0	0	0	114.6	P172 Y173 A174	P172-A176 WeakPolarHBondContact O-CB 3.38Å; P172-A176 PolarHBondContact O-N 3.13Å; Y173-A176 PolarHBondContact O-N 3.1Å; A174-A176 PolarHBondContact O-N 3.35Å
177	G	80.6	Confident	79.4	Confident	42 Å²	42	93.3 Å²	93.3	43%	0.433	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	134.4	-56.4	174.2	0	0	0	0	0	113.6	Y173 A174	Y173-G177 PolarHBondContact O-N 3.47Å; A174-G177 PolarHBondContact O-N 3.01Å
178	E	83.8	Confident	80.6	Confident	169 Å²	169	89.1 Å²	89.1	79%	0.79	48%	0.475	S	S	*	.			trans	-142.1	127.7	-175	-170.9	171.1	-143.6	0	0	112.7	Y173	Y173-E178 CarbonylContact O-C 3.46Å; Y173-E178 PolarHBondContact O-N 2.68Å
179	C	86.7	Confident	81.5	Confident	14 Å²	14	85.9 Å²	85.9	10%	0.095	46%	0.46	C	S	.	.			trans	-102.7	121.1	175.6	-179.5	0	0	0	0	110.8	C171 A174 F181 G182 C185 H189	C171-C179 VanDerWaalsContact SG-SG 3.67Å; A174-C179 HydrophobicContact CB-CB 3.99Å; C179-F181 PolarHBondContact O-N 3.17Å; C179-F181 VanDerWaalsContact O-N 3.1Å; C179-G182 PolarHBondContact O-N 2.92Å; C179-C185 VanDerWaalsContact SG-SG 3.63Å; C179-H189 VanDerWaalsContact CB-CE1 3.41Å; C179-H189 WeakPolarHBondContact CB-CE1 3.39Å; C179-H189 VanDerWaalsContact CB-NE2 3.28Å; C179-H189 WeakPolarHBondContact CB-NE2 3.49Å; C179-H189 PolarHBondContact SG-NE2 2.89Å
180	R	81.7	Confident	82.1	Confident	244 Å²	244	79.3 Å²	79.3	92%	0.921	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-12	-179.4	-69.7	-168.5	159.4	176	-5.5	115.4
181	F	79.4	Confident	82.5	Confident	136 Å²	136	81.6 Å²	81.6	60%	0.596	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-7.7	176.8	-57.2	-73.9	0	0	0	112.6	C179 A184 C185	C179-F181 PolarHBondContact O-N 3.17Å; C179-F181 VanDerWaalsContact O-N 3.1Å; F181-A184 WeakPolarHBondContact O-CA 3.14Å; F181-A184 WeakPolarHBondContact O-CB 3.32Å; F181-A184 PolarHBondContact O-N 3.1Å; F181-C185 HydrophobicContact CB-CB 3.91Å
182	G	78.5	Confident	82.7	Confident	31 Å²	31	85.2 Å²	85.2	32%	0.32	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	50.8	-141.4	-177.9	0	0	0	0	0	111.6	C179 A184 C185 H189	C179-G182 PolarHBondContact O-N 2.92Å; G182-A184 PolarHBondContact O-N 3.43Å; G182-A184 VanDerWaalsContact O-N 3.14Å; G182-C185 WeakPolarHBondContact O-CB 3.4Å; G182-C185 PolarHBondContact O-N 2.88Å; G182-C185 VanDerWaalsContact O-N 3.17Å; G182-H189 PolarHBondContact O-CE1 3.34Å; G182-H189 PolarHBondContact O-ND1 2.89Å
183	D	75.1	Confident	83.3	Confident	159 Å²	159	81.3 Å²	81.3	85%	0.85	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-72.6	-2.8	179.8	-51.5	-44	0	0	0	113.6	C185	D183-C185 VanDerWaalsContact C-N 3.33Å
184	A	80.3	Confident	83.7	Confident	87 Å²	87	82.5 Å²	82.5	72%	0.719	45%	0.448	S	S	*	.	G	3₁₀ helix	trans	-91.1	12.9	170.6	0	0	0	0	0	113.1	F181 G182	F181-A184 WeakPolarHBondContact O-CA 3.14Å; F181-A184 WeakPolarHBondContact O-CB 3.32Å; F181-A184 PolarHBondContact O-N 3.1Å; G182-A184 PolarHBondContact O-N 3.43Å; G182-A184 VanDerWaalsContact O-N 3.14Å
185	C	83.4	Confident	84.1	Confident	27 Å²	27	85.7 Å²	85.7	18%	0.182	46%	0.464	C	S	.	.			trans	-72.6	137.9	175.1	-159.9	0	0	0	0	111.9	C171 C179 F181 G182 D183 Y187 H189	C171-C185 VanDerWaalsContact SG-SG 3.61Å; C179-C185 VanDerWaalsContact SG-SG 3.63Å; F181-C185 HydrophobicContact CB-CB 3.91Å; G182-C185 WeakPolarHBondContact O-CB 3.4Å; G182-C185 PolarHBondContact O-N 2.88Å; G182-C185 VanDerWaalsContact O-N 3.17Å; D183-C185 VanDerWaalsContact C-N 3.33Å; C185-Y187 VanDerWaalsContact C-N 3.26Å; C185-Y187 PolarHBondContact O-N 2.85Å; C185-H189 WeakPolarHBondContact CB-NE2 3.49Å
186	V	83	Confident	84.4	Confident	143 Å²	143	86.6 Å²	86.6	87%	0.867	47%	0.468	S	S	*	.	S	Bend	trans	-72.2	-20.1	176.8	-176.2	0	0	0	0	112.4
187	Y	82.6	Confident	84.8	Confident	133 Å²	133	92.7 Å²	92.7	52%	0.522	47%	0.474	S	S	.	.	S	Bend	trans	-100.4	147.1	179.7	-63.2	-79.1	0	0	0	111.1	C185 H189	C185-Y187 VanDerWaalsContact C-N 3.26Å; C185-Y187 PolarHBondContact O-N 2.85Å; Y187-H189 PolarHBondContact O-N 2.78Å
188	L	82.4	Confident	85.2	Confident	53 Å²	53	93.6 Å²	93.6	28%	0.277	47%	0.469	S	S	.	.	B	Isolated β-bridge	trans	-62.1	126.5	-178.4	-74.4	-167.8	0	0	0	111.5	Q168 Q169 L170 C171 G190 F204	Q168-L188 HydrophobicContact CB-CD1 3.69Å; Q168-L188 HydrophobicContact CB-CG 4.22Å; Q168-L188 HydrophobicContact CG-CD1 4.11Å; Q168-L188 HydrophobicContact CG-CG 4.45Å; Q169-L188 PolarHBondContact O-N 3.26Å; L170-L188 CarbonylContact C-O 3.52Å; L170-L188 WeakPolarHBondContact CA-O 3.48Å; L170-L188 HydrophobicContact CD2-CB 4.31Å; C171-L188 WeakPolarHBondContact CB-O 3.25Å; C171-L188 PolarHBondContact N-O 3.3Å; L188-G190 PolarHBondContact O-N 3.02Å; L188-F204 HydrophobicContact CD1-CD2 4.43Å; L188-F204 HydrophobicContact CD1-CE2 4.47Å
189	H	84.2	Confident	85.4	Confident	40 Å²	40	90.8 Å²	90.8	19%	0.185	45%	0.451	C	S	.	.			trans	-81.3	111.9	165.9	-73.6	-172.5	0	0	0	108.1	C171 A174 C179 G182 C185 Y187	C171-H189 VanDerWaalsContact CB-CD2 3.49Å; C171-H189 WeakPolarHBondContact CB-CD2 3.21Å; A174-H189 HydrophobicContact CB-CB 4.45Å; C179-H189 VanDerWaalsContact CB-CE1 3.41Å; C179-H189 WeakPolarHBondContact CB-CE1 3.39Å; C179-H189 VanDerWaalsContact CB-NE2 3.28Å; C179-H189 WeakPolarHBondContact CB-NE2 3.49Å; C179-H189 PolarHBondContact SG-NE2 2.89Å; G182-H189 PolarHBondContact O-CE1 3.34Å; G182-H189 PolarHBondContact O-ND1 2.89Å; C185-H189 WeakPolarHBondContact CB-NE2 3.49Å; Y187-H189 PolarHBondContact O-N 2.78Å
190	G	86.1	Confident	85.5	Confident	3 Å²	3	91.1 Å²	91.1	3%	0.031	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-64.8	166.6	-179.1	0	0	0	0	0	113.5	L188 R199 L201	L188-G190 PolarHBondContact O-N 3.02Å; G190-R199 WeakPolarHBondContact O-CB 3.14Å; G190-R199 WeakPolarHBondContact O-CG 3.34Å; G190-L201 CarbonylContact C-O 3.58Å; G190-L201 WeakPolarHBondContact CA-O 3.49Å
191	E	88.8	Confident	85.8	Confident	85 Å²	85	80 Å²	80	40%	0.397	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	154.7	167.6	-69.7	171.6	167.7	0	0	110.3	R199 V200 L201 P203 R209	E191-R199 CarbonylContact O-C 3.49Å; E191-R199 WeakPolarHBondContact O-CA 3.44Å; E191-V200 PolarHBondContact O-N 3.46Å; E191-L201 HydrophobicContact CB-CB 3.93Å; E191-L201 PolarHBondContact N-O 3.37Å; E191-L201 WeakPolarHBondContact O-CB 3.33Å; E191-L201 PolarHBondContact O-N 3.25Å; E191-L201 VanDerWaalsContact O-N 3.1Å; E191-P203 HydrophobicContact CG-CB 4.42Å; E191-P203 HydrophobicContact CG-CG 4.28Å; E191-R209 IonicContact OE2-CZ 3.76Å; E191-R209 IonicContact OE2-NE 2.96Å; E191-R209 IonicContact OE2-NH2 3.58Å
192	V	90.8	Very high	86.2	Confident	77 Å²	77	74.7 Å²	74.7	47%	0.467	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	125.4	-177.3	178.8	0	0	0	0	109.8	L198 R199	V192-L198 WeakPolarHBondContact CA-O 3.47Å; V192-R199 HydrophobicContact CG2-CG 3.84Å
193	C	92.1	Very high	86.6	Confident	3 Å²	3	74.9 Å²	74.9	2%	0.02	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-74.5	130.8	169.2	175.9	0	0	0	0	110.4	I195 R197 L198 V200 L201	C193-I195 PolarHBondContact O-N 3.18Å; C193-R197 WeakPolarHBondContact O-CA 3.4Å; C193-R197 PolarHBondContact O-N 3.1Å; C193-L198 PolarHBondContact N-O 3.31Å; C193-V200 HydrophobicContact CB-CG2 4Å; C193-L201 HydrophobicContact CB-CD1 4.1Å; C193-L201 HydrophobicContact CB-CD2 4.05Å; C193-L201 HydrophobicContact CB-CG 3.92Å
194	E	91.1	Very high	87.1	Confident	179 Å²	179	74.6 Å²	74.6	84%	0.836	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-31.9	-177.6	-59.7	-173.6	161.8	0	0	113.6
195	I	90.4	Very high	87.5	Confident	67 Å²	67	73.3 Å²	73.3	34%	0.344	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-60.4	-175.3	-55.9	173.7	0	0	0	110.9	C193 M217 F220	C193-I195 PolarHBondContact O-N 3.18Å; I195-M217 HydrophobicContact CD1-CB 3.87Å; I195-M217 HydrophobicContact CD1-CG 4.46Å; I195-F220 HydrophobicContact CG2-CB 3.67Å; I195-F220 HydrophobicContact CG2-CD2 3.96Å; I195-F220 HydrophobicContact CG2-CG 3.79Å
196	C	90.8	Very high	87.8	Confident	46 Å²	46	75.4 Å²	75.4	31%	0.311	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-11.8	-178.8	65.8	0	0	0	0	114.5	L198 C216	C196-L198 HydrophobicContact CB-CD1 4.48Å; C196-L198 HydrophobicContact CB-CG 4.41Å; C196-L198 PolarHBondContact O-N 3.45Å; C196-L198 VanDerWaalsContact O-N 3.14Å; C196-C216 VanDerWaalsContact CB-SG 3.6Å
197	R	90	Very high	88.2	Confident	208 Å²	208	76 Å²	76	79%	0.785	36%	0.362	S	S	*	.			trans	59.2	16.8	-177.9	-55.8	-178.3	-179.2	171.8	-0.3	115.3	C193	C193-R197 WeakPolarHBondContact O-CA 3.4Å; C193-R197 PolarHBondContact O-N 3.1Å
198	L	88.8	Confident	88.6	Confident	62 Å²	62	72.4 Å²	72.4	33%	0.325	35%	0.351	S	S	.	.	S	Bend	trans	-93.5	154.1	175.8	-59.6	175	0	0	0	111.5	V192 C193 C196 V200	V192-L198 WeakPolarHBondContact CA-O 3.47Å; C193-L198 PolarHBondContact N-O 3.31Å; C196-L198 HydrophobicContact CB-CD1 4.48Å; C196-L198 HydrophobicContact CB-CG 4.41Å; C196-L198 PolarHBondContact O-N 3.45Å; C196-L198 VanDerWaalsContact O-N 3.14Å; L198-V200 HydrophobicContact CB-CG1 3.75Å; L198-V200 HydrophobicContact CB-CG2 4.15Å; L198-V200 PolarHBondContact O-N 3.24Å
199	R	87.9	Confident	89	Confident	110 Å²	110	73 Å²	73	42%	0.415	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	62.9	177.6	-70.9	178.5	178.5	-112	10.9	111.8	A174 G190 E191 V192	A174-R199 HydrophobicContact CB-CB 4.3Å; G190-R199 WeakPolarHBondContact O-CB 3.14Å; G190-R199 WeakPolarHBondContact O-CG 3.34Å; E191-R199 CarbonylContact O-C 3.49Å; E191-R199 WeakPolarHBondContact O-CA 3.44Å; V192-R199 HydrophobicContact CG2-CG 3.84Å
200	V	88.3	Confident	89.5	Confident	20 Å²	20	77.8 Å²	77.8	12%	0.121	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	-6.5	-169.1	-68.6	0	0	0	0	114	L170 A175 E191 C193 L198 Q208 H212	L170-V200 WeakPolarHBondContact CD1-O 3.41Å; A175-V200 HydrophobicContact CB-CG1 3.88Å; A175-V200 WeakPolarHBondContact O-CG1 3.04Å; E191-V200 PolarHBondContact O-N 3.46Å; C193-V200 HydrophobicContact CB-CG2 4Å; L198-V200 HydrophobicContact CB-CG1 3.75Å; L198-V200 HydrophobicContact CB-CG2 4.15Å; L198-V200 PolarHBondContact O-N 3.24Å; V200-Q208 PolarHBondContact O-NE2 2.92Å; V200-H212 WeakPolarHBondContact CG2-CE1 3.46Å; V200-H212 VanDerWaalsContact CG2-NE2 3.33Å; V200-H212 WeakPolarHBondContact CG2-NE2 3.45Å
201	L	88.6	Confident	89.8	Confident	11 Å²	11	80 Å²	80	6%	0.058	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	134.7	177	-58.2	-173.7	0	0	0	110	G190 E191 C193 R209 H212 E213	G190-L201 CarbonylContact C-O 3.58Å; G190-L201 WeakPolarHBondContact CA-O 3.49Å; E191-L201 HydrophobicContact CB-CB 3.93Å; E191-L201 PolarHBondContact N-O 3.37Å; E191-L201 WeakPolarHBondContact O-CB 3.33Å; E191-L201 PolarHBondContact O-N 3.25Å; E191-L201 VanDerWaalsContact O-N 3.1Å; C193-L201 HydrophobicContact CB-CD1 4.1Å; C193-L201 HydrophobicContact CB-CD2 4.05Å; C193-L201 HydrophobicContact CB-CG 3.92Å; L201-R209 HydrophobicContact CB-CG 4.15Å; L201-R209 HydrophobicContact CD1-CG 3.97Å; L201-R209 HydrophobicContact CD2-CG 3.96Å; L201-R209 HydrophobicContact CG-CG 4.23Å; L201-H212 HydrophobicContact CD2-CB 3.82Å; L201-H212 VanDerWaalsContact CD2-CD2 3.43Å; L201-H212 WeakPolarHBondContact CD2-CD2 3.43Å; L201-E213 HydrophobicContact CD2-CG 4.48Å
202	H	87.8	Confident	90.1	Very high	25 Å²	25	78 Å²	78	12%	0.116	38%	0.378	C	S	.	.			trans	-80.6	130.3	176.8	-165.3	-107.1	0	0	0	110.9	Q168 F204 D205 Q208 R209	Q168-H202 PolarHBondContact O-NE2 3.29Å; H202-F204 VanDerWaalsContact C-N 3.31Å; H202-F204 PolarHBondContact ND1-N 2.86Å; H202-F204 PolarHBondContact O-N 3.26Å; H202-D205 HydrophobicContact CB-CB 3.9Å; H202-D205 WeakPolarHBondContact ND1-CB 3.39Å; H202-D205 PolarHBondContact ND1-N 3.23Å; H202-Q208 HydrophobicContact CB-CB 4.44Å; H202-Q208 HydrophobicContact CB-CG 4.39Å; H202-R209 PolarHBondContact O-NE 3.5Å; H202-R209 PolarHBondContact O-NH2 2.85Å
203	P	86.2	Confident	90.2	Very high	35 Å²	35	78.2 Å²	78.2	23%	0.227	37%	0.374	C	S	.	.	S	Bend	trans	-63.9	-34.6	-178.1	-21.5	31.8	0	0	0	113.5	E191 R209	E191-P203 HydrophobicContact CG-CB 4.42Å; E191-P203 HydrophobicContact CG-CG 4.28Å; P203-R209 VanDerWaalsContact C-NH2 3.34Å; P203-R209 PolarHBondContact O-NH2 3.35Å
204	F	85.7	Confident	90.3	Very high	153 Å²	153	84.7 Å²	84.7	67%	0.671	40%	0.402	S	S	*	.	S	Bend	trans	-108.4	-3.9	-172.8	-52.4	-66	0	0	0	114.7	L188 H202	L188-F204 HydrophobicContact CD1-CD2 4.43Å; L188-F204 HydrophobicContact CD1-CE2 4.47Å; H202-F204 VanDerWaalsContact C-N 3.31Å; H202-F204 PolarHBondContact ND1-N 2.86Å; H202-F204 PolarHBondContact O-N 3.26Å
205	D	88.3	Confident	90.5	Very high	60 Å²	60	81.3 Å²	81.3	32%	0.321	39%	0.388	S	S	.	.			trans	-115.1	102.6	179.9	179.1	-8.9	0	0	0	109.8	H202 E207 Q208 R209	H202-D205 HydrophobicContact CB-CB 3.9Å; H202-D205 WeakPolarHBondContact ND1-CB 3.39Å; H202-D205 PolarHBondContact ND1-N 3.23Å; D205-E207 VanDerWaalsContact C-N 3.32Å; D205-E207 WeakPolarHBondContact OD1-CA 3.39Å; D205-E207 WeakPolarHBondContact OD1-CB 3.38Å; D205-E207 PolarHBondContact OD1-N 3.29Å; D205-Q208 HydrophobicContact CB-CB 4.08Å; D205-Q208 VanDerWaalsContact CG-CB 3.46Å; D205-Q208 PolarHBondContact OD1-N 2.75Å; D205-Q208 WeakPolarHBondContact OD2-CB 3.37Å; D205-R209 PolarHBondContact O-N 3.27Å
206	P	89.6	Confident	90.8	Very high	70 Å²	70	78.7 Å²	78.7	46%	0.455	38%	0.376	S	S	.	.	H	α-helix	trans	-77	-16	179.6	32.9	-35.7	0	0	0	113.3	K210	P206-K210 WeakPolarHBondContact O-CD 3.38Å; P206-K210 VanDerWaalsContact O-CG 3.27Å; P206-K210 WeakPolarHBondContact O-CG 3.21Å; P206-K210 PolarHBondContact O-N 3.28Å
207	E	92.1	Very high	91	Very high	156 Å²	156	80.8 Å²	80.8	73%	0.729	38%	0.382	S	S	*	.	H	α-helix	trans	-79.7	-46.6	177	-61.2	-163.7	170.7	0	0	110.5	D205 R209 K210 A211	D205-E207 VanDerWaalsContact C-N 3.32Å; D205-E207 WeakPolarHBondContact OD1-CA 3.39Å; D205-E207 WeakPolarHBondContact OD1-CB 3.38Å; D205-E207 PolarHBondContact OD1-N 3.29Å; E207-R209 VanDerWaalsContact C-N 3.25Å; E207-R209 PolarHBondContact O-N 3.21Å; E207-K210 PolarHBondContact O-N 3.2Å; E207-A211 VanDerWaalsContact O-CB 3.28Å; E207-A211 WeakPolarHBondContact O-CB 3.49Å; E207-A211 PolarHBondContact O-N 3.21Å
208	Q	91.4	Very high	91.2	Very high	58 Å²	58	75.2 Å²	75.2	27%	0.271	37%	0.367	S	S	.	.	H	α-helix	trans	-56.8	-41.7	171.6	-175.1	-82.5	-5.8	0	0	111.3	V200 H202 D205 A211 H212	V200-Q208 PolarHBondContact O-NE2 2.92Å; H202-Q208 HydrophobicContact CB-CB 4.44Å; H202-Q208 HydrophobicContact CB-CG 4.39Å; D205-Q208 HydrophobicContact CB-CB 4.08Å; D205-Q208 VanDerWaalsContact CG-CB 3.46Å; D205-Q208 PolarHBondContact OD1-N 2.75Å; D205-Q208 WeakPolarHBondContact OD2-CB 3.37Å; Q208-A211 PolarHBondContact O-N 2.95Å; Q208-H212 WeakPolarHBondContact O-CB 3.3Å; Q208-H212 PolarHBondContact O-N 3.44Å
209	R	90.7	Very high	91.5	Very high	65 Å²	65	75.4 Å²	75.4	25%	0.245	37%	0.371	C	S	.	.	H	α-helix	trans	-60.8	-54.2	178.9	-166.3	-177.9	-53.8	153.4	9.8	111.8	E191 L201 H202 P203 D205 E207 A211 H212 E213	E191-R209 IonicContact OE2-CZ 3.76Å; E191-R209 IonicContact OE2-NE 2.96Å; E191-R209 IonicContact OE2-NH2 3.58Å; L201-R209 HydrophobicContact CB-CG 4.15Å; L201-R209 HydrophobicContact CD1-CG 3.97Å; L201-R209 HydrophobicContact CD2-CG 3.96Å; L201-R209 HydrophobicContact CG-CG 4.23Å; H202-R209 PolarHBondContact O-NE 3.5Å; H202-R209 PolarHBondContact O-NH2 2.85Å; P203-R209 VanDerWaalsContact C-NH2 3.34Å; P203-R209 PolarHBondContact O-NH2 3.35Å; D205-R209 PolarHBondContact O-N 3.27Å; E207-R209 VanDerWaalsContact C-N 3.25Å; E207-R209 PolarHBondContact O-N 3.21Å; R209-A211 VanDerWaalsContact C-N 3.29Å; R209-A211 PolarHBondContact O-N 3.3Å; R209-H212 PolarHBondContact O-N 3.12Å; R209-E213 WeakPolarHBondContact CG-OE1 3.12Å; R209-E213 WeakPolarHBondContact O-CG 3.48Å; R209-E213 PolarHBondContact O-N 3.36Å
210	K	93.3	Very high	91.8	Very high	141 Å²	141	75.4 Å²	75.4	61%	0.613	38%	0.375	S	S	*	.	H	α-helix	trans	-60.7	-37.3	176.8	-72.7	171.2	-176.8	174.1	0	112.5	P206 E207 K214	P206-K210 WeakPolarHBondContact O-CD 3.38Å; P206-K210 VanDerWaalsContact O-CG 3.27Å; P206-K210 WeakPolarHBondContact O-CG 3.21Å; P206-K210 PolarHBondContact O-N 3.28Å; E207-K210 PolarHBondContact O-N 3.2Å; K210-K214 VanDerWaalsContact O-CB 3.29Å; K210-K214 WeakPolarHBondContact O-CB 3.28Å; K210-K214 PolarHBondContact O-N 3.44Å
211	A	94.2	Very high	92.1	Very high	50 Å²	50	78.9 Å²	78.9	41%	0.413	39%	0.389	S	S	.	.	H	α-helix	trans	-65.1	-44.5	176	0	0	0	0	0	111.4	E207 Q208 R209 I215	E207-A211 VanDerWaalsContact O-CB 3.28Å; E207-A211 WeakPolarHBondContact O-CB 3.49Å; E207-A211 PolarHBondContact O-N 3.21Å; Q208-A211 PolarHBondContact O-N 2.95Å; R209-A211 VanDerWaalsContact C-N 3.29Å; R209-A211 PolarHBondContact O-N 3.3Å; A211-I215 WeakPolarHBondContact O-CD1 3.28Å; A211-I215 VanDerWaalsContact O-CG1 3.24Å; A211-I215 WeakPolarHBondContact O-CG1 3.28Å; A211-I215 PolarHBondContact O-N 3.31Å; A211-I215 VanDerWaalsContact O-N 3.11Å
212	H	93.6	Very high	92.3	Very high	42 Å²	42	83.6 Å²	83.6	19%	0.194	41%	0.411	C	S	.	.	H	α-helix	trans	-63.7	-52.4	174.7	-178.6	83	0	0	0	111.6	V200 L201 Q208 R209 K214 I215 C216	V200-H212 WeakPolarHBondContact CG2-CE1 3.46Å; V200-H212 VanDerWaalsContact CG2-NE2 3.33Å; V200-H212 WeakPolarHBondContact CG2-NE2 3.45Å; L201-H212 HydrophobicContact CD2-CB 3.82Å; L201-H212 VanDerWaalsContact CD2-CD2 3.43Å; L201-H212 WeakPolarHBondContact CD2-CD2 3.43Å; Q208-H212 WeakPolarHBondContact O-CB 3.3Å; Q208-H212 PolarHBondContact O-N 3.44Å; R209-H212 PolarHBondContact O-N 3.12Å; H212-K214 VanDerWaalsContact C-N 3.29Å; H212-K214 PolarHBondContact O-N 3.25Å; H212-I215 PolarHBondContact O-N 3.03Å; H212-I215 VanDerWaalsContact O-N 3.09Å; H212-C216 VanDerWaalsContact O-CB 3.23Å; H212-C216 WeakPolarHBondContact O-CB 3.46Å; H212-C216 PolarHBondContact O-N 3.32Å
213	E	93.4	Very high	92.5	Very high	81 Å²	81	88.3 Å²	88.3	38%	0.379	43%	0.433	S	S	.	.	H	α-helix	trans	-51.6	-48.4	179.3	-74	165.5	178.4	0	0	111.3	L201 R209 I215 C216 M217	L201-E213 HydrophobicContact CD2-CG 4.48Å; R209-E213 WeakPolarHBondContact CG-OE1 3.12Å; R209-E213 WeakPolarHBondContact O-CG 3.48Å; R209-E213 PolarHBondContact O-N 3.36Å; E213-I215 PolarHBondContact O-N 3.42Å; E213-C216 PolarHBondContact O-N 3.21Å; E213-M217 VanDerWaalsContact O-CB 3.27Å; E213-M217 WeakPolarHBondContact O-CB 3.23Å; E213-M217 PolarHBondContact O-N 3.4Å
214	K	95.3	Very high	92.9	Very high	139 Å²	139	90.9 Å²	90.9	60%	0.604	44%	0.443	S	S	*	.	H	α-helix	trans	-60.6	-46.1	176.9	-177.3	176.6	179.8	177.2	0	112.7	K210 H212 L218	K210-K214 VanDerWaalsContact O-CB 3.29Å; K210-K214 WeakPolarHBondContact O-CB 3.28Å; K210-K214 PolarHBondContact O-N 3.44Å; H212-K214 VanDerWaalsContact C-N 3.29Å; H212-K214 PolarHBondContact O-N 3.25Å; K214-L218 HydrophobicContact CG-CD1 4.16Å; K214-L218 WeakPolarHBondContact O-CB 3.39Å; K214-L218 WeakPolarHBondContact O-CD1 3.45Å; K214-L218 VanDerWaalsContact O-CG 3.23Å; K214-L218 WeakPolarHBondContact O-CG 3.31Å; K214-L218 PolarHBondContact O-N 2.95Å; K214-L218 VanDerWaalsContact O-N 3.12Å
215	I	94.9	Very high	93.2	Very high	108 Å²	108	88.3 Å²	88.3	55%	0.554	43%	0.433	S	S	*	.	H	α-helix	trans	-68.3	-39.3	179.8	-68.5	166.2	0	0	0	110.8	A211 H212 E213 T219	A211-I215 WeakPolarHBondContact O-CD1 3.28Å; A211-I215 VanDerWaalsContact O-CG1 3.24Å; A211-I215 WeakPolarHBondContact O-CG1 3.28Å; A211-I215 PolarHBondContact O-N 3.31Å; A211-I215 VanDerWaalsContact O-N 3.11Å; H212-I215 PolarHBondContact O-N 3.03Å; H212-I215 VanDerWaalsContact O-N 3.09Å; E213-I215 PolarHBondContact O-N 3.42Å; I215-T219 WeakPolarHBondContact O-CB 3.41Å; I215-T219 PolarHBondContact O-N 3.44Å; I215-T219 PolarHBondContact O-OG1 2.73Å
216	C	95.1	Very high	93.3	Very high	13 Å²	13	89.7 Å²	89.7	9%	0.088	44%	0.436	C	S	.	.	H	α-helix	trans	-68.2	-44.6	-178.9	-166.8	0	0	0	0	111.2	C196 H212 E213 T219 F220	C196-C216 VanDerWaalsContact CB-SG 3.6Å; H212-C216 VanDerWaalsContact O-CB 3.23Å; H212-C216 WeakPolarHBondContact O-CB 3.46Å; H212-C216 PolarHBondContact O-N 3.32Å; E213-C216 PolarHBondContact O-N 3.21Å; C216-T219 PolarHBondContact O-N 3.41Å; C216-F220 WeakPolarHBondContact O-CB 3.44Å; C216-F220 PolarHBondContact O-N 3.33Å
217	M	95.1	Very high	93.5	Very high	89 Å²	89	89 Å²	89	44%	0.438	44%	0.437	S	S	.	.	H	α-helix	trans	-59	-49.7	173.1	-172.2	174.2	73.4	0	0	111.8	I195 E213 T219 F220 E221	I195-M217 HydrophobicContact CD1-CB 3.87Å; I195-M217 HydrophobicContact CD1-CG 4.46Å; E213-M217 VanDerWaalsContact O-CB 3.27Å; E213-M217 WeakPolarHBondContact O-CB 3.23Å; E213-M217 PolarHBondContact O-N 3.4Å; M217-T219 VanDerWaalsContact C-N 3.27Å; M217-T219 PolarHBondContact O-N 3.49Å; M217-F220 PolarHBondContact O-N 2.91Å; M217-E221 WeakPolarHBondContact O-CB 3.18Å; M217-E221 WeakPolarHBondContact O-CG 3.34Å; M217-E221 PolarHBondContact O-N 2.82Å
218	L	95.6	Very high	93.6	Very high	91 Å²	91	87.6 Å²	87.6	48%	0.476	43%	0.428	S	S	.	.	H	α-helix	trans	-61.2	-34.9	176.8	-72	169.7	0	0	0	113	K214 H222	K214-L218 HydrophobicContact CG-CD1 4.16Å; K214-L218 WeakPolarHBondContact O-CB 3.39Å; K214-L218 WeakPolarHBondContact O-CD1 3.45Å; K214-L218 VanDerWaalsContact O-CG 3.23Å; K214-L218 WeakPolarHBondContact O-CG 3.31Å; K214-L218 PolarHBondContact O-N 2.95Å; K214-L218 VanDerWaalsContact O-N 3.12Å; L218-H222 WeakPolarHBondContact O-CB 3.48Å; L218-H222 PolarHBondContact O-N 2.83Å
219	T	94	Very high	93.6	Very high	67 Å²	67	86 Å²	86	41%	0.411	43%	0.425	S	S	.	.	H	α-helix	trans	-69.8	-45	176.1	-55.8	0	0	0	0	110.7	I215 C216 M217 H222 E223	I215-T219 WeakPolarHBondContact O-CB 3.41Å; I215-T219 PolarHBondContact O-N 3.44Å; I215-T219 PolarHBondContact O-OG1 2.73Å; C216-T219 PolarHBondContact O-N 3.41Å; M217-T219 VanDerWaalsContact C-N 3.27Å; M217-T219 PolarHBondContact O-N 3.49Å; T219-H222 PolarHBondContact O-N 2.96Å; T219-E223 WeakPolarHBondContact O-CG 3.46Å; T219-E223 PolarHBondContact O-N 3.04Å
220	F	95.2	Very high	93.8	Very high	110 Å²	110	86.3 Å²	86.3	48%	0.482	43%	0.428	S	S	.	.	H	α-helix	trans	-63.2	-45.1	178.1	179.2	-98.1	0	0	0	112.3	I195 C216 M217 H222 E223 M224	I195-F220 HydrophobicContact CG2-CB 3.67Å; I195-F220 HydrophobicContact CG2-CD2 3.96Å; I195-F220 HydrophobicContact CG2-CG 3.79Å; C216-F220 WeakPolarHBondContact O-CB 3.44Å; C216-F220 PolarHBondContact O-N 3.33Å; M217-F220 PolarHBondContact O-N 2.91Å; F220-H222 VanDerWaalsContact C-N 3.32Å; F220-H222 PolarHBondContact O-N 2.83Å; F220-E223 PolarHBondContact O-N 2.94Å; F220-M224 VanDerWaalsContact O-CB 3.26Å; F220-M224 WeakPolarHBondContact O-CB 3.47Å; F220-M224 PolarHBondContact O-N 3.24Å
221	E	94.4	Very high	93.8	Very high	92 Å²	92	85.4 Å²	85.4	43%	0.43	43%	0.426	S	S	.	.	H	α-helix	trans	-56.9	-44.9	173.2	-73.8	173	168.7	0	0	111.5	M217 M224 E225	M217-E221 WeakPolarHBondContact O-CB 3.18Å; M217-E221 WeakPolarHBondContact O-CG 3.34Å; M217-E221 PolarHBondContact O-N 2.82Å; E221-M224 PolarHBondContact O-N 2.98Å; E221-E225 PolarHBondContact O-N 3.27Å
222	H	91.7	Very high	93.7	Very high	111 Å²	111	86 Å²	86	51%	0.514	43%	0.432	S	S	.	.	H	α-helix	trans	-67.8	-40.1	178.5	-175.7	60.6	0	0	0	113.1	L218 T219 F220 K226	L218-H222 WeakPolarHBondContact O-CB 3.48Å; L218-H222 PolarHBondContact O-N 2.83Å; T219-H222 PolarHBondContact O-N 2.96Å; F220-H222 VanDerWaalsContact C-N 3.32Å; F220-H222 PolarHBondContact O-N 2.83Å; H222-K226 VanDerWaalsContact O-CB 3.23Å; H222-K226 WeakPolarHBondContact O-CB 3.45Å; H222-K226 PolarHBondContact O-N 2.77Å
223	E	92.5	Very high	93.8	Very high	124 Å²	124	84 Å²	84	58%	0.579	42%	0.422	S	S	*	.	H	α-helix	trans	-66.5	-38.4	174.8	-73.5	-173.1	156.8	0	0	111.9	T219 F220 K226 A227	T219-E223 WeakPolarHBondContact O-CG 3.46Å; T219-E223 PolarHBondContact O-N 3.04Å; F220-E223 PolarHBondContact O-N 2.94Å; E223-K226 PolarHBondContact O-N 3.5Å; E223-A227 WeakPolarHBondContact O-CB 3.21Å; E223-A227 PolarHBondContact O-N 2.77Å
224	M	94.6	Very high	93.8	Very high	89 Å²	89	85.8 Å²	85.8	44%	0.438	43%	0.431	S	S	.	.	H	α-helix	trans	-64.8	-48.6	174.8	-175.6	-176	69.3	0	0	111.9	F220 E221 K226 A227 F228	F220-M224 VanDerWaalsContact O-CB 3.26Å; F220-M224 WeakPolarHBondContact O-CB 3.47Å; F220-M224 PolarHBondContact O-N 3.24Å; E221-M224 PolarHBondContact O-N 2.98Å; M224-K226 VanDerWaalsContact C-N 3.29Å; M224-K226 PolarHBondContact O-N 2.88Å; M224-A227 WeakPolarHBondContact O-CB 3.34Å; M224-A227 PolarHBondContact O-N 3.47Å; M224-A227 VanDerWaalsContact O-N 3.17Å; M224-F228 HydrophobicContact CE-CE2 4.43Å; M224-F228 HydrophobicContact CG-CD2 4.01Å; M224-F228 HydrophobicContact CG-CE2 3.54Å; M224-F228 HydrophobicContact CG-CZ 4.41Å; M224-F228 VanDerWaalsContact O-CD2 3.22Å; M224-F228 WeakPolarHBondContact O-CD2 3.22Å; M224-F228 PolarHBondContact O-N 2.79Å; M224-F228 HydrophobicContact SD-CE2 4.03Å
225	E	92	Very high	93.8	Very high	99 Å²	99	84.3 Å²	84.3	46%	0.463	43%	0.429	S	S	.	.	H	α-helix	trans	-58.1	-44.2	175.2	-176.3	-177.3	-160.1	0	0	111	E221 A227 F228 A229	E221-E225 PolarHBondContact O-N 3.27Å; E225-A227 VanDerWaalsContact C-N 3.33Å; E225-A227 PolarHBondContact O-N 3.01Å; E225-F228 PolarHBondContact O-N 3.23Å; E225-A229 WeakPolarHBondContact O-CB 2.82Å; E225-A229 PolarHBondContact O-N 2.86Å
226	K	90.8	Very high	93.9	Very high	89 Å²	89	81.1 Å²	81.1	39%	0.387	41%	0.411	S	S	.	.	H	α-helix	trans	-63.5	-37.3	177.8	-169.2	-172.3	-174.4	-168.7	0	112.1	H222 E223 M224 A229 F230 Y303	H222-K226 VanDerWaalsContact O-CB 3.23Å; H222-K226 WeakPolarHBondContact O-CB 3.45Å; H222-K226 PolarHBondContact O-N 2.77Å; E223-K226 PolarHBondContact O-N 3.5Å; M224-K226 VanDerWaalsContact C-N 3.29Å; M224-K226 PolarHBondContact O-N 2.88Å; K226-A229 PolarHBondContact O-N 3.43Å; K226-F230 HydrophobicContact CD-CE2 4.29Å; K226-F230 HydrophobicContact CG-CD2 4.07Å; K226-F230 HydrophobicContact CG-CE2 3.91Å; K226-F230 WeakPolarHBondContact O-CD2 3.42Å; K226-F230 PolarHBondContact O-N 3.28Å; K226-Y303 HydrophobicContact CG-CD1 4.41Å; K226-Y303 HydrophobicContact CG-CE1 4.23Å
227	A	93.3	Very high	94	Very high	56 Å²	56	83.7 Å²	83.7	46%	0.463	43%	0.426	S	S	.	.	H	α-helix	trans	-64.2	-44.8	174.7	0	0	0	0	0	111.6	E223 M224 E225 A229 F230 Q231	E223-A227 WeakPolarHBondContact O-CB 3.21Å; E223-A227 PolarHBondContact O-N 2.77Å; M224-A227 WeakPolarHBondContact O-CB 3.34Å; M224-A227 PolarHBondContact O-N 3.47Å; M224-A227 VanDerWaalsContact O-N 3.17Å; E225-A227 VanDerWaalsContact C-N 3.33Å; E225-A227 PolarHBondContact O-N 3.01Å; A227-A229 PolarHBondContact O-N 2.72Å; A227-F230 PolarHBondContact O-N 3.46Å; A227-Q231 PolarHBondContact O-N 3.29Å
228	F	94.4	Very high	94	Very high	126 Å²	126	79.4 Å²	79.4	55%	0.553	41%	0.405	S	S	*	.	H	α-helix	trans	-61.1	-42	172.8	-71.7	-57	0	0	0	112.3	M224 E225 F230 Q231 A232	M224-F228 HydrophobicContact CE-CE2 4.43Å; M224-F228 HydrophobicContact CG-CD2 4.01Å; M224-F228 HydrophobicContact CG-CE2 3.54Å; M224-F228 HydrophobicContact CG-CZ 4.41Å; M224-F228 VanDerWaalsContact O-CD2 3.22Å; M224-F228 WeakPolarHBondContact O-CD2 3.22Å; M224-F228 PolarHBondContact O-N 2.79Å; M224-F228 HydrophobicContact SD-CE2 4.03Å; E225-F228 PolarHBondContact O-N 3.23Å; F228-F230 PolarHBondContact O-N 3Å; F228-Q231 PolarHBondContact O-N 3.38Å; F228-A232 WeakPolarHBondContact O-CB 3.4Å; F228-A232 PolarHBondContact O-N 3.32Å
229	A	92.5	Very high	94	Very high	25 Å²	25	77.5 Å²	77.5	21%	0.207	40%	0.4	C	S	.	.	H	α-helix	trans	-63.6	-38.7	176.3	0	0	0	0	0	112.6	E225 K226 A227 S233 Y303	E225-A229 WeakPolarHBondContact O-CB 2.82Å; E225-A229 PolarHBondContact O-N 2.86Å; K226-A229 PolarHBondContact O-N 3.43Å; A227-A229 PolarHBondContact O-N 2.72Å; A229-S233 WeakPolarHBondContact O-CB 3.47Å; A229-S233 PolarHBondContact O-N 2.99Å; A229-S233 PolarHBondContact O-OG 3.4Å; A229-Y303 HydrophobicContact CB-CD1 4.49Å; A229-Y303 HydrophobicContact CB-CD2 3.86Å; A229-Y303 HydrophobicContact CB-CE2 4.31Å; A229-Y303 HydrophobicContact CB-CG 3.99Å
230	F	92.9	Very high	94	Very high	71 Å²	71	77.8 Å²	77.8	31%	0.311	40%	0.398	S	S	.	.	H	α-helix	trans	-63.5	-48.4	171.7	-87.4	-64	0	0	0	111.7	K226 A227 F228 A232 S233 Q234 V302 Y303	K226-F230 HydrophobicContact CD-CE2 4.29Å; K226-F230 HydrophobicContact CG-CD2 4.07Å; K226-F230 HydrophobicContact CG-CE2 3.91Å; K226-F230 WeakPolarHBondContact O-CD2 3.42Å; K226-F230 PolarHBondContact O-N 3.28Å; A227-F230 PolarHBondContact O-N 3.46Å; F228-F230 PolarHBondContact O-N 3Å; F230-A232 PolarHBondContact O-N 3.41Å; F230-S233 WeakPolarHBondContact CA-OG 3.31Å; F230-S233 WeakPolarHBondContact O-CA 3.16Å; F230-S233 PolarHBondContact O-N 3.24Å; F230-S233 PolarHBondContact O-OG 3Å; F230-Q234 PolarHBondContact O-N 3.42Å; F230-V302 HydrophobicContact CE1-CB 3.99Å; F230-V302 HydrophobicContact CE1-CG2 3.95Å; F230-V302 VanDerWaalsContact CE1-O 3.28Å; F230-V302 WeakPolarHBondContact CE1-O 3.29Å; F230-V302 HydrophobicContact CZ-CB 4.02Å; F230-V302 HydrophobicContact CZ-CG2 3.57Å; F230-Y303 HydrophobicContact CE2-CD1 4.5Å; F230-Y303 HydrophobicContact CZ-CD1 4.47Å
231	Q	94	Very high	94	Very high	122 Å²	122	74.6 Å²	74.6	57%	0.57	39%	0.388	S	S	*	.	H	α-helix	trans	-59.1	-46.3	179.8	-170.5	175.7	12.6	0	0	111.7	A227 F228 S233 Q234	A227-Q231 PolarHBondContact O-N 3.29Å; F228-Q231 PolarHBondContact O-N 3.38Å; Q231-S233 PolarHBondContact O-N 2.96Å; Q231-Q234 PolarHBondContact O-N 3.49Å
232	A	93.3	Very high	94	Very high	63 Å²	63	77.8 Å²	77.8	52%	0.521	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-0.3	174.6	0	0	0	0	0	114.4	F228 F230 K236	F228-A232 WeakPolarHBondContact O-CB 3.4Å; F228-A232 PolarHBondContact O-N 3.32Å; F230-A232 PolarHBondContact O-N 3.41Å; A232-K236 WeakPolarHBondContact O-CE 3.11Å
233	S	94.9	Very high	94.2	Very high	0 Å²	0	76.9 Å²	76.9	0%	0	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.2	-1.6	178	72.6	0	0	0	0	114.9	A229 F230 Q231 D235 K236 L246 W304	A229-S233 WeakPolarHBondContact O-CB 3.47Å; A229-S233 PolarHBondContact O-N 2.99Å; A229-S233 PolarHBondContact O-OG 3.4Å; F230-S233 WeakPolarHBondContact CA-OG 3.31Å; F230-S233 WeakPolarHBondContact O-CA 3.16Å; F230-S233 PolarHBondContact O-N 3.24Å; F230-S233 PolarHBondContact O-OG 3Å; Q231-S233 PolarHBondContact O-N 2.96Å; S233-D235 PolarHBondContact O-N 2.89Å; S233-K236 PolarHBondContact O-N 3.41Å; S233-L246 WeakPolarHBondContact OG-CD1 3.23Å; S233-W304 VanDerWaalsContact CB-CB 3.47Å
234	Q	94.1	Very high	94.4	Very high	118 Å²	118	72.4 Å²	72.4	55%	0.551	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-40	-177	-71.3	-179.4	3.1	0	0	112.8	F230 Q231 V244	F230-Q234 PolarHBondContact O-N 3.42Å; Q231-Q234 PolarHBondContact O-N 3.49Å; Q234-V244 WeakPolarHBondContact O-CG1 3.47Å
235	D	95.3	Very high	94.5	Very high	107 Å²	107	68.2 Å²	68.2	57%	0.572	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	1.5	-175	68.1	-29.7	0	0	0	114.3	S233 V237	S233-D235 PolarHBondContact O-N 2.89Å; D235-V237 PolarHBondContact O-N 3.45Å; D235-V237 VanDerWaalsContact O-N 3.15Å
236	K	95.8	Very high	94.6	Very high	41 Å²	41	65 Å²	65	18%	0.178	35%	0.348	C	S	.	.			trans	-80.6	104.6	-166.5	-60.9	-65.6	169	176.9	0	111.9	A232 S233 I245 F256 T265 W304 E306	A232-K236 WeakPolarHBondContact O-CE 3.11Å; S233-K236 PolarHBondContact O-N 3.41Å; K236-I245 PolarHBondContact O-N 2.97Å; K236-F256 HydrophobicContact CB-CE1 3.72Å; K236-F256 HydrophobicContact CB-CZ 4.16Å; K236-T265 HydrophobicContact CB-CG2 4.1Å; K236-W304 HydrophobicContact CD-CG 4.3Å; K236-W304 HydrophobicContact CG-CB 4.02Å; K236-W304 HydrophobicContact CG-CG 4Å; K236-E306 IonicContact NZ-OE1 3.13Å; K236-E306 PolarHBondContact NZ-OE1 3.22Å
237	V	96.8	Very high	94.8	Very high	67 Å²	67	67.7 Å²	67.7	41%	0.406	36%	0.362	S	S	.	.	B	Isolated β-bridge	trans	-77.4	142	177.6	-179.3	0	0	0	0	111.9	D235 M242 E243 V244 T265	D235-V237 PolarHBondContact O-N 3.45Å; D235-V237 VanDerWaalsContact O-N 3.15Å; V237-M242 WeakPolarHBondContact CG1-O 3.43Å; V237-E243 WeakPolarHBondContact CA-O 3.36Å; V237-V244 HydrophobicContact CG2-CG2 3.86Å; V237-T265 WeakPolarHBondContact O-CB 3.44Å; V237-T265 VanDerWaalsContact O-CG2 3.27Å; V237-T265 WeakPolarHBondContact O-CG2 3.39Å
238	C	96.6	Very high	94.8	Very high	0 Å²	0	65.8 Å²	65.8	0%	0	34%	0.343	C	S	.	.			trans	-81.9	124.9	170.4	176.7	0	0	0	0	112.1	I240 M242 E243 I245 T265 C267	C238-I240 PolarHBondContact O-N 3.02Å; C238-I240 PolarHBondContact SG-N 2.92Å; C238-I240 VanDerWaalsContact SG-N 3.37Å; C238-M242 WeakPolarHBondContact O-CA 3.47Å; C238-M242 PolarHBondContact O-N 2.89Å; C238-E243 PolarHBondContact N-O 3.28Å; C238-I245 HydrophobicContact CB-CD1 3.9Å; C238-I245 HydrophobicContact CB-CG1 3.82Å; C238-T265 WeakPolarHBondContact CA-O 3.43Å; C238-C267 HydrophobicContact CB-CB 4.02Å; C238-C267 PolarHBondContact SG-N 3.39Å
239	S	94.9	Very high	94.6	Very high	51 Å²	51	64.5 Å²	64.5	36%	0.357	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-7.8	178.9	-35.7	0	0	0	0	115.7	T265 E290	S239-T265 PolarHBondContact N-O 2.85Å; S239-T265 PolarHBondContact OG-O 3.4Å; S239-E290 WeakPolarHBondContact CB-OE1 3.22Å; S239-E290 PolarHBondContact OG-OE1 3.48Å; S239-E290 PolarHBondContact OG-OE2 3.29Å
240	I	94.4	Very high	94.5	Very high	73 Å²	73	65.9 Å²	65.9	37%	0.374	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-49	-178.9	-63.3	166.2	0	0	0	111.4	C238 Y266 C270 P289	C238-I240 PolarHBondContact O-N 3.02Å; C238-I240 PolarHBondContact SG-N 2.92Å; C238-I240 VanDerWaalsContact SG-N 3.37Å; I240-Y266 HydrophobicContact CD1-CD1 3.48Å; I240-Y266 VanDerWaalsContact CD1-CD1 3.48Å; I240-Y266 HydrophobicContact CD1-CE1 3.94Å; I240-Y266 HydrophobicContact CD1-CG 4.22Å; I240-Y266 HydrophobicContact CG1-CD1 3.71Å; I240-Y266 HydrophobicContact CG1-CE1 3.91Å; I240-C270 HydrophobicContact CB-CB 3.92Å; I240-C270 HydrophobicContact CD1-CB 3.75Å; I240-C270 HydrophobicContact CG1-CB 4.42Å; I240-C270 HydrophobicContact CG2-CB 4.03Å; I240-P289 HydrophobicContact CD1-CG 4.23Å
241	C	94.9	Very high	94.3	Very high	42 Å²	42	66.2 Å²	66.2	28%	0.284	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-5.6	179.9	68.1	0	0	0	0	114	E243	C241-E243 PolarHBondContact O-N 3.46Å; C241-E243 VanDerWaalsContact O-N 3.12Å
242	M	94.9	Very high	93.9	Very high	160 Å²	160	64 Å²	64	79%	0.788	38%	0.377	S	S	*	.			trans	60.4	14.7	-179.4	-55.4	-177.2	178.9	0	0	115.3	V237 C238	V237-M242 WeakPolarHBondContact CG1-O 3.43Å; C238-M242 WeakPolarHBondContact O-CA 3.47Å; C238-M242 PolarHBondContact O-N 2.89Å
243	E	95.8	Very high	93.7	Very high	91 Å²	91	64.4 Å²	64.4	43%	0.425	37%	0.369	S	S	.	.	S	Bend	trans	-94.4	147.1	175.3	-65.3	166.7	-146.2	0	0	111.8	V237 C238 C241 I245 K248	V237-E243 WeakPolarHBondContact CA-O 3.36Å; C238-E243 PolarHBondContact N-O 3.28Å; C241-E243 PolarHBondContact O-N 3.46Å; C241-E243 VanDerWaalsContact O-N 3.12Å; E243-I245 PolarHBondContact O-N 2.74Å; E243-K248 IonicContact OE1-NZ 3.47Å; E243-K248 VanDerWaalsContact OE2-CE 3.23Å; E243-K248 WeakPolarHBondContact OE2-CE 3.3Å; E243-K248 WeakPolarHBondContact OE2-CG 3.46Å; E243-K248 IonicContact OE2-NZ 3.97Å; E243-K248 PolarHBondContact OE2-NZ 2.7Å
244	V	96.8	Very high	93.7	Very high	31 Å²	31	69.2 Å²	69.2	19%	0.188	39%	0.387	C	S	.	.	B	Isolated β-bridge	trans	-65.9	121.8	167.5	179	0	0	0	0	109.1	Q234 V237 L246 E247	Q234-V244 WeakPolarHBondContact O-CG1 3.47Å; V237-V244 HydrophobicContact CG2-CG2 3.86Å; V244-L246 PolarHBondContact O-N 3.48Å; V244-E247 HydrophobicContact CB-CB 4.09Å; V244-E247 HydrophobicContact CB-CG 4.08Å; V244-E247 WeakPolarHBondContact CB-OE2 3.41Å; V244-E247 HydrophobicContact CG1-CB 4.11Å; V244-E247 HydrophobicContact CG1-CG 3.67Å; V244-E247 PolarHBondContact O-N 3.13Å
245	I	95.6	Very high	93.7	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-37.8	-166	-68.2	166.2	0	0	0	112.2	K236 C238 E243 R254 F256 T265 Y266 C267	K236-I245 PolarHBondContact O-N 2.97Å; C238-I245 HydrophobicContact CB-CD1 3.9Å; C238-I245 HydrophobicContact CB-CG1 3.82Å; E243-I245 PolarHBondContact O-N 2.74Å; I245-R254 WeakPolarHBondContact O-CA 3.43Å; I245-F256 HydrophobicContact CB-CD1 4.25Å; I245-F256 HydrophobicContact CB-CE1 3.74Å; I245-F256 HydrophobicContact CB-CZ 4.04Å; I245-F256 HydrophobicContact CD1-CD1 3.49Å; I245-F256 VanDerWaalsContact CD1-CD1 3.49Å; I245-F256 HydrophobicContact CD1-CE1 3.55Å; I245-F256 HydrophobicContact CG1-CD1 4.47Å; I245-F256 HydrophobicContact CG1-CE1 4.22Å; I245-F256 HydrophobicContact CG2-CD1 4.03Å; I245-F256 HydrophobicContact CG2-CD2 4.42Å; I245-F256 HydrophobicContact CG2-CE1 3.89Å; I245-F256 HydrophobicContact CG2-CE2 4.3Å; I245-F256 HydrophobicContact CG2-CG 4.3Å; I245-F256 HydrophobicContact CG2-CZ 4.03Å; I245-T265 HydrophobicContact CD1-CG2 3.72Å; I245-Y266 VanDerWaalsContact CD1-C 3.45Å; I245-C267 HydrophobicContact CD1-CB 4.32Å; I245-C267 HydrophobicContact CG1-CB 4.01Å
246	L	94.9	Very high	93.7	Very high	33 Å²	33	61.6 Å²	61.6	17%	0.173	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-15.5	-179.3	-70.4	-174.2	0	0	0	114.4	S233 V244 R254 F256	S233-L246 WeakPolarHBondContact OG-CD1 3.23Å; V244-L246 PolarHBondContact O-N 3.48Å; L246-R254 HydrophobicContact CD2-CB 4.14Å; L246-R254 WeakPolarHBondContact O-CD 3.5Å; L246-R254 PolarHBondContact O-NE 3.36Å; L246-F256 HydrophobicContact CD1-CE2 4.32Å; L246-F256 HydrophobicContact CD1-CZ 4.42Å; L246-F256 HydrophobicContact CD2-CE2 3.9Å; L246-F256 HydrophobicContact CD2-CZ 4.38Å; L246-F256 HydrophobicContact CG-CE2 3.94Å; L246-F256 HydrophobicContact CG-CZ 3.96Å
247	E	95.1	Very high	93.6	Very high	145 Å²	145	59.6 Å²	59.6	68%	0.678	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-12.4	179.4	-65.3	-179.6	165.3	0	0	113.2	V244 A249	V244-E247 HydrophobicContact CB-CB 4.09Å; V244-E247 HydrophobicContact CB-CG 4.08Å; V244-E247 WeakPolarHBondContact CB-OE2 3.41Å; V244-E247 HydrophobicContact CG1-CB 4.11Å; V244-E247 HydrophobicContact CG1-CG 3.67Å; V244-E247 PolarHBondContact O-N 3.13Å; E247-A249 PolarHBondContact O-N 2.7Å
248	K	93.1	Very high	93.4	Very high	16 Å²	16	56.6 Å²	56.6	7%	0.07	32%	0.318	C	S	.	.			trans	-45.9	135.9	177.6	-76.4	-179.5	147.7	-68.5	0	112.4	E243 S250 E253 R254	E243-K248 IonicContact OE1-NZ 3.47Å; E243-K248 VanDerWaalsContact OE2-CE 3.23Å; E243-K248 WeakPolarHBondContact OE2-CE 3.3Å; E243-K248 WeakPolarHBondContact OE2-CG 3.46Å; E243-K248 IonicContact OE2-NZ 3.97Å; E243-K248 PolarHBondContact OE2-NZ 2.7Å; K248-S250 VanDerWaalsContact C-N 3.31Å; K248-S250 PolarHBondContact O-N 3.31Å; K248-E253 HydrophobicContact CB-CB 4.39Å; K248-E253 HydrophobicContact CD-CB 3.84Å; K248-E253 IonicContact NZ-OE2 2.64Å; K248-E253 PolarHBondContact NZ-OE2 2.86Å; K248-R254 HydrophobicContact CB-CG 4.25Å; K248-R254 VanDerWaalsContact O-CZ 3.3Å; K248-R254 PolarHBondContact O-NE 3.21Å; K248-R254 PolarHBondContact O-NH2 2.92Å
249	A	90.2	Very high	93.2	Very high	99 Å²	99	56.6 Å²	56.6	82%	0.818	32%	0.318	S	S	*	.	S	Bend	trans	-53	-47.1	-176.3	0	0	0	0	0	112.7	E247 R254	E247-A249 PolarHBondContact O-N 2.7Å; A249-R254 PolarHBondContact O-NH2 3.36Å
250	S	90.5	Very high	92.8	Very high	54 Å²	54	54.7 Å²	54.7	38%	0.378	31%	0.305	S	S	.	.	S	Bend	trans	-81.4	118.3	-179.6	-63.2	0	0	0	0	112.6	K248 S252 E253 R254	K248-S250 VanDerWaalsContact C-N 3.31Å; K248-S250 PolarHBondContact O-N 3.31Å; S250-S252 PolarHBondContact O-N 2.94Å; S250-S252 VanDerWaalsContact O-N 3.1Å; S250-E253 PolarHBondContact O-N 3.33Å; S250-R254 PolarHBondContact O-N 3.11Å
251	A	88.1	Confident	92.5	Very high	77 Å²	77	55.5 Å²	55.5	64%	0.636	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-25.8	174.7	0	0	0	0	0	113.8	E253	A251-E253 VanDerWaalsContact C-N 3.27Å; A251-E253 PolarHBondContact O-N 3.47Å
252	S	86.9	Confident	92.3	Very high	75 Å²	75	54 Å²	54	52%	0.524	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-21	173.4	55.2	0	0	0	0	113.8	S250 R255	S250-S252 PolarHBondContact O-N 2.94Å; S250-S252 VanDerWaalsContact O-N 3.1Å; S252-R255 PolarHBondContact O-NE 2.88Å; S252-R255 PolarHBondContact O-NH2 2.98Å
253	E	88.8	Confident	92.2	Very high	73 Å²	73	50.6 Å²	50.6	34%	0.341	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-12.1	179.4	-59.6	-173.4	-171.6	0	0	113.8	K248 S250 A251 R255	K248-E253 HydrophobicContact CB-CB 4.39Å; K248-E253 HydrophobicContact CD-CB 3.84Å; K248-E253 IonicContact NZ-OE2 2.64Å; K248-E253 PolarHBondContact NZ-OE2 2.86Å; S250-E253 PolarHBondContact O-N 3.33Å; A251-E253 VanDerWaalsContact C-N 3.27Å; A251-E253 PolarHBondContact O-N 3.47Å; E253-R255 PolarHBondContact O-N 2.72Å
254	R	94	Very high	92.2	Very high	101 Å²	101	48.9 Å²	48.9	38%	0.381	28%	0.277	S	S	.	.			trans	-70.7	52.6	173.7	-61.9	178.9	-170.1	-172.3	0.1	112.3	I245 L246 K248 A249 S250	I245-R254 WeakPolarHBondContact O-CA 3.43Å; L246-R254 HydrophobicContact CD2-CB 4.14Å; L246-R254 WeakPolarHBondContact O-CD 3.5Å; L246-R254 PolarHBondContact O-NE 3.36Å; K248-R254 HydrophobicContact CB-CG 4.25Å; K248-R254 VanDerWaalsContact O-CZ 3.3Å; K248-R254 PolarHBondContact O-NE 3.21Å; K248-R254 PolarHBondContact O-NH2 2.92Å; A249-R254 PolarHBondContact O-NH2 3.36Å; S250-R254 PolarHBondContact O-N 3.11Å
255	R	94.4	Very high	92.1	Very high	64 Å²	64	48.4 Å²	48.4	24%	0.242	27%	0.273	C	S	.	.			trans	-138.4	131.5	-176.3	-69.4	-176.8	-71.3	159.3	3.7	110.2	S252 E253 L268 S301 V302 E386	S252-R255 PolarHBondContact O-NE 2.88Å; S252-R255 PolarHBondContact O-NH2 2.98Å; E253-R255 PolarHBondContact O-N 2.72Å; R255-L268 HydrophobicContact CB-CB 4.02Å; R255-L268 HydrophobicContact CB-CD2 3.94Å; R255-L268 VanDerWaalsContact O-CB 3.3Å; R255-L268 WeakPolarHBondContact O-CB 3.27Å; R255-L268 PolarHBondContact O-N 3.2Å; R255-S301 CarbonylContact C-O 3.58Å; R255-S301 VanDerWaalsContact CA-O 3.28Å; R255-S301 WeakPolarHBondContact CA-O 3.38Å; R255-V302 HydrophobicContact CG-CG1 4.49Å; R255-E386 IonicContact CZ-OE2 3.26Å; R255-E386 IonicContact NH1-OE1 2.73Å; R255-E386 IonicContact NH1-OE2 3.58Å; R255-E386 PolarHBondContact NH1-OE2 3.32Å; R255-E386 IonicContact NH2-OE2 3.01Å; R255-E386 PolarHBondContact NH2-OE2 2.87Å
256	F	95.3	Very high	92.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	140.5	175.9	-61.3	-86.8	0	0	0	110.4	K236 I245 L246 I258 T265 P300 S301 W304	K236-F256 HydrophobicContact CB-CE1 3.72Å; K236-F256 HydrophobicContact CB-CZ 4.16Å; I245-F256 HydrophobicContact CB-CD1 4.25Å; I245-F256 HydrophobicContact CB-CE1 3.74Å; I245-F256 HydrophobicContact CB-CZ 4.04Å; I245-F256 HydrophobicContact CD1-CD1 3.49Å; I245-F256 VanDerWaalsContact CD1-CD1 3.49Å; I245-F256 HydrophobicContact CD1-CE1 3.55Å; I245-F256 HydrophobicContact CG1-CD1 4.47Å; I245-F256 HydrophobicContact CG1-CE1 4.22Å; I245-F256 HydrophobicContact CG2-CD1 4.03Å; I245-F256 HydrophobicContact CG2-CD2 4.42Å; I245-F256 HydrophobicContact CG2-CE1 3.89Å; I245-F256 HydrophobicContact CG2-CE2 4.3Å; I245-F256 HydrophobicContact CG2-CG 4.3Å; I245-F256 HydrophobicContact CG2-CZ 4.03Å; L246-F256 HydrophobicContact CD1-CE2 4.32Å; L246-F256 HydrophobicContact CD1-CZ 4.42Å; L246-F256 HydrophobicContact CD2-CE2 3.9Å; L246-F256 HydrophobicContact CD2-CZ 4.38Å; L246-F256 HydrophobicContact CG-CE2 3.94Å; L246-F256 HydrophobicContact CG-CZ 3.96Å; F256-I258 HydrophobicContact CB-CG1 4.13Å; F256-T265 HydrophobicContact CD1-CG2 4.23Å; F256-T265 HydrophobicContact CE1-CG2 4.29Å; F256-P300 WeakPolarHBondContact O-CA 3.47Å; F256-S301 PolarHBondContact N-O 3.35Å; F256-S301 PolarHBondContact O-N 3.31Å; F256-W304 HydrophobicContact CB-CE3 4.24Å; F256-W304 HydrophobicContact CD1-CB 4.13Å; F256-W304 HydrophobicContact CD1-CD2 4.39Å; F256-W304 AromaticContact CD1-CE3 3.75Å; F256-W304 HydrophobicContact CD1-CE3 3.75Å; F256-W304 HydrophobicContact CE1-CB 3.93Å; F256-W304 HydrophobicContact CE1-CE3 4.48Å; F256-W304 HydrophobicContact CE2-CB 4.35Å; F256-W304 HydrophobicContact CG-CB 4.44Å; F256-W304 HydrophobicContact CG-CE3 4.19Å; F256-W304 HydrophobicContact CZ-CB 4.05Å
257	G	93.6	Very high	92.2	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	86.6	168.5	0	0	0	0	0	110.3	Y266	G257-Y266 PolarHBondContact N-O 3.12Å
258	I	92.5	Very high	92.1	Very high	3 Å²	3	40 Å²	40	2%	0.015	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	131.6	-174.6	-58.9	-179.9	0	0	0	110	F256 I299 W304 V305 K311 L314	F256-I258 HydrophobicContact CB-CG1 4.13Å; I258-I299 HydrophobicContact CB-CB 4.49Å; I258-I299 PolarHBondContact N-O 3.05Å; I258-I299 PolarHBondContact O-N 3.45Å; I258-W304 HydrophobicContact CD1-CE3 4.39Å; I258-W304 HydrophobicContact CG1-CE3 4.03Å; I258-W304 HydrophobicContact CG1-CZ3 3.86Å; I258-V305 HydrophobicContact CD1-CB 4.24Å; I258-V305 HydrophobicContact CD1-CG2 4.13Å; I258-K311 HydrophobicContact CG2-CD 4.25Å; I258-K311 HydrophobicContact CG2-CG 4.31Å; I258-L314 HydrophobicContact CD1-CD2 3.72Å
259	L	91.7	Very high	92	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	143.8	172.7	-62.1	-173.8	0	0	0	110.5	N261 Y266 I271 C288 V298	L259-N261 VanDerWaalsContact C-N 3.33Å; L259-N261 PolarHBondContact O-N 2.92Å; L259-Y266 HydrophobicContact CD1-CD2 4.17Å; L259-Y266 HydrophobicContact CD1-CE2 3.76Å; L259-Y266 HydrophobicContact CG-CD2 4.38Å; L259-Y266 HydrophobicContact CG-CE2 4.41Å; L259-I271 HydrophobicContact CD1-CD1 4.37Å; L259-I271 HydrophobicContact CD2-CG1 4.11Å; L259-C288 HydrophobicContact CD1-CB 3.76Å; L259-V298 HydrophobicContact CD2-CG2 3.92Å
260	S	88	Confident	92.2	Very high	12 Å²	12	37.7 Å²	37.7	8%	0.084	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-28.9	-172	65.2	0	0	0	0	114.9	S295 Q308 I315	S260-S295 WeakPolarHBondContact CB-OG 3.43Å; S260-S295 PolarHBondContact N-OG 3.27Å; S260-S295 PolarHBondContact OG-OG 3.39Å; S260-Q308 PolarHBondContact O-NE2 3.12Å; S260-I315 VanDerWaalsContact CB-CD1 3.47Å
261	N	86.9	Confident	92.2	Very high	90 Å²	90	35.1 Å²	35.1	48%	0.481	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-123.3	14	-163.4	-60	-2.7	0	0	0	112.8	L259 V293 I294	L259-N261 VanDerWaalsContact C-N 3.33Å; L259-N261 PolarHBondContact O-N 2.92Å; N261-V293 HydrophobicContact CB-CG1 3.56Å; N261-I294 PolarHBondContact ND2-O 3.41Å
262	C	91.8	Very high	92.3	Very high	11 Å²	11	33.2 Å²	33.2	7%	0.074	17%	0.171	C	C	.	.			trans	-157.5	164.3	177	66.1	0	0	0	0	112.8	K311	C262-K311 PolarHBondContact O-NZ 2.97Å
263	N	92.7	Very high	92.4	Very high	87 Å²	87	36.9 Å²	36.9	47%	0.465	18%	0.18	S	C	.	.			trans	-105.4	18.4	-176.5	-67.3	6.2	0	0	0	113.9	W304 E306 K311	N263-W304 WeakPolarHBondContact O-CZ2 3.23Å; N263-E306 PolarHBondContact ND2-O 3.06Å; N263-K311 PolarHBondContact OD1-NZ 3.21Å
264	H	94.5	Very high	92.4	Very high	56 Å²	56	36.6 Å²	36.6	26%	0.259	18%	0.176	S	C	.	.			trans	-79.4	136.5	176.5	-54.6	99.8	0	0	0	111.7	Y266 C288 E290 C291 W304	H264-Y266 HydrophobicContact CB-CE2 3.79Å; H264-Y266 VanDerWaalsContact CB-OH 3.25Å; H264-Y266 WeakPolarHBondContact CB-OH 3.41Å; H264-C288 PolarHBondContact ND1-SG 3.44Å; H264-E290 IonicContact CD2-OE2 3.27Å; H264-E290 PolarHBondContact CD2-OE2 3.2Å; H264-E290 IonicContact CG-OE1 3.73Å; H264-E290 IonicContact CG-OE2 2.77Å; H264-C291 WeakPolarHBondContact CE1-CB 3.41Å; H264-C291 PolarHBondContact CE1-SG 3.11Å; H264-C291 PolarHBondContact ND1-SG 3.03Å; H264-C291 VanDerWaalsContact ND1-SG 3.41Å; H264-W304 WeakPolarHBondContact O-CH2 3.47Å
265	T	96.1	Very high	92	Very high	20 Å²	20	33 Å²	33	12%	0.123	16%	0.163	C	C	.	.			trans	-98	122.9	-165.7	-55.1	0	0	0	0	111.7	K236 V237 C238 S239 I245 F256 W304	K236-T265 HydrophobicContact CB-CG2 4.1Å; V237-T265 WeakPolarHBondContact O-CB 3.44Å; V237-T265 VanDerWaalsContact O-CG2 3.27Å; V237-T265 WeakPolarHBondContact O-CG2 3.39Å; C238-T265 WeakPolarHBondContact CA-O 3.43Å; S239-T265 PolarHBondContact N-O 2.85Å; S239-T265 PolarHBondContact OG-O 3.4Å; I245-T265 HydrophobicContact CD1-CG2 3.72Å; F256-T265 HydrophobicContact CD1-CG2 4.23Å; F256-T265 HydrophobicContact CE1-CG2 4.29Å; T265-W304 HydrophobicContact CG2-CD2 4.32Å; T265-W304 HydrophobicContact CG2-CE3 4.16Å; T265-W304 HydrophobicContact CG2-CH2 4.48Å; T265-W304 HydrophobicContact CG2-CZ3 4.23Å; T265-W304 WeakPolarHBondContact OG1-CZ2 3.2Å
266	Y	95.7	Very high	91.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.17	C	C	.	.			trans	-131.9	142.6	-179.6	-54.2	-63.2	0	0	0	113.4	I240 I245 G257 L259 H264 I271 C288 P289 E290	I240-Y266 HydrophobicContact CD1-CD1 3.48Å; I240-Y266 VanDerWaalsContact CD1-CD1 3.48Å; I240-Y266 HydrophobicContact CD1-CE1 3.94Å; I240-Y266 HydrophobicContact CD1-CG 4.22Å; I240-Y266 HydrophobicContact CG1-CD1 3.71Å; I240-Y266 HydrophobicContact CG1-CE1 3.91Å; I245-Y266 VanDerWaalsContact CD1-C 3.45Å; G257-Y266 PolarHBondContact N-O 3.12Å; L259-Y266 HydrophobicContact CD1-CD2 4.17Å; L259-Y266 HydrophobicContact CD1-CE2 3.76Å; L259-Y266 HydrophobicContact CG-CD2 4.38Å; L259-Y266 HydrophobicContact CG-CE2 4.41Å; H264-Y266 HydrophobicContact CB-CE2 3.79Å; H264-Y266 VanDerWaalsContact CB-OH 3.25Å; H264-Y266 WeakPolarHBondContact CB-OH 3.41Å; Y266-I271 HydrophobicContact CD2-CB 4.4Å; Y266-I271 HydrophobicContact CD2-CD1 3.9Å; Y266-I271 HydrophobicContact CD2-CG1 4.15Å; Y266-I271 HydrophobicContact CE2-CD1 4.19Å; Y266-I271 HydrophobicContact CG-CB 4.19Å; Y266-I271 HydrophobicContact CG-CD1 4.22Å; Y266-I271 HydrophobicContact CG-CG1 4.41Å; Y266-C288 PolarHBondContact OH-SG 3.47Å; Y266-P289 HydrophobicContact CE1-CB 4.46Å; Y266-P289 HydrophobicContact CE1-CG 4.12Å; Y266-P289 WeakPolarHBondContact OH-CD 3.39Å; Y266-E290 WeakPolarHBondContact CE1-OE1 3.23Å; Y266-E290 PolarHBondContact OH-OE1 2.91Å
267	C	95.6	Very high	90.7	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-68.1	143.9	163.2	102.9	0	0	0	0	109.4	C238 I245 S269 C270 I271	C238-C267 HydrophobicContact CB-CB 4.02Å; C238-C267 PolarHBondContact SG-N 3.39Å; I245-C267 HydrophobicContact CD1-CB 4.32Å; I245-C267 HydrophobicContact CG1-CB 4.01Å; C267-S269 VanDerWaalsContact C-N 3.33Å; C267-S269 PolarHBondContact O-N 3.38Å; C267-S269 PolarHBondContact SG-OG 3.13Å; C267-C270 HydrophobicContact CB-CB 4.12Å; C267-C270 WeakPolarHBondContact CB-SG 3.48Å; C267-C270 WeakPolarHBondContact O-CB 3.36Å; C267-C270 PolarHBondContact O-N 2.93Å; C267-C270 WeakPolarHBondContact SG-CB 3.46Å; C267-C270 PolarHBondContact SG-N 3.24Å; C267-C270 CovalentContact SG-SG 2.05Å; C267-C270 PolarHBondContact SG-SG 3.08Å; C267-I271 PolarHBondContact O-N 3.09Å; C267-I271 VanDerWaalsContact O-N 3.13Å
268	L	93.4	Very high	89.7	Confident	3 Å²	3	44 Å²	44	2%	0.016	22%	0.223	C	C	.	.	H	α-helix	trans	-62.1	-38	-172.9	179.6	63.4	0	0	0	113	R255 R272 V298 P300	R255-L268 HydrophobicContact CB-CB 4.02Å; R255-L268 HydrophobicContact CB-CD2 3.94Å; R255-L268 VanDerWaalsContact O-CB 3.3Å; R255-L268 WeakPolarHBondContact O-CB 3.27Å; R255-L268 PolarHBondContact O-N 3.2Å; L268-R272 WeakPolarHBondContact O-CB 3.38Å; L268-R272 WeakPolarHBondContact O-CD 3.5Å; L268-R272 WeakPolarHBondContact O-CG 3.45Å; L268-R272 PolarHBondContact O-N 2.99Å; L268-V298 HydrophobicContact CD1-CG1 4.19Å; L268-P300 HydrophobicContact CD1-CB 4.06Å; L268-P300 HydrophobicContact CD1-CG 4.03Å; L268-P300 HydrophobicContact CD2-CB 3.89Å; L268-P300 HydrophobicContact CD2-CG 4.36Å
269	S	92	Very high	88.7	Confident	55 Å²	55	52 Å²	52	39%	0.385	26%	0.261	S	S	.	.	H	α-helix	trans	-66.3	-44.8	174.6	40.8	0	0	0	0	111.4	C267 I271 R272 Q273	C267-S269 VanDerWaalsContact C-N 3.33Å; C267-S269 PolarHBondContact O-N 3.38Å; C267-S269 PolarHBondContact SG-OG 3.13Å; S269-I271 PolarHBondContact O-N 3.17Å; S269-R272 WeakPolarHBondContact O-CB 3.38Å; S269-R272 PolarHBondContact O-N 3.03Å; S269-Q273 PolarHBondContact O-N 3.43Å
270	C	93.4	Very high	87.8	Confident	10 Å²	10	56.5 Å²	56.5	7%	0.068	28%	0.281	C	S	.	.	H	α-helix	trans	-54.8	-53.9	179.5	-52.6	0	0	0	0	112.4	I240 C267 R272 Q273 W274	I240-C270 HydrophobicContact CB-CB 3.92Å; I240-C270 HydrophobicContact CD1-CB 3.75Å; I240-C270 HydrophobicContact CG1-CB 4.42Å; I240-C270 HydrophobicContact CG2-CB 4.03Å; C267-C270 HydrophobicContact CB-CB 4.12Å; C267-C270 WeakPolarHBondContact CB-SG 3.48Å; C267-C270 WeakPolarHBondContact O-CB 3.36Å; C267-C270 PolarHBondContact O-N 2.93Å; C267-C270 WeakPolarHBondContact SG-CB 3.46Å; C267-C270 PolarHBondContact SG-N 3.24Å; C267-C270 CovalentContact SG-SG 2.05Å; C267-C270 PolarHBondContact SG-SG 3.08Å; C270-R272 VanDerWaalsContact C-N 3.33Å; C270-R272 PolarHBondContact O-N 3.38Å; C270-Q273 PolarHBondContact O-N 3.44Å; C270-W274 PolarHBondContact O-N 3.02Å; C270-W274 VanDerWaalsContact O-N 3.1Å
271	I	91.6	Very high	87	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-74.4	-23.2	-177.9	-165.9	60.1	0	0	0	112.9	L259 Y266 C267 S269 W274 R275 P289 V298	L259-I271 HydrophobicContact CD1-CD1 4.37Å; L259-I271 HydrophobicContact CD2-CG1 4.11Å; Y266-I271 HydrophobicContact CD2-CB 4.4Å; Y266-I271 HydrophobicContact CD2-CD1 3.9Å; Y266-I271 HydrophobicContact CD2-CG1 4.15Å; Y266-I271 HydrophobicContact CE2-CD1 4.19Å; Y266-I271 HydrophobicContact CG-CB 4.19Å; Y266-I271 HydrophobicContact CG-CD1 4.22Å; Y266-I271 HydrophobicContact CG-CG1 4.41Å; C267-I271 PolarHBondContact O-N 3.09Å; C267-I271 VanDerWaalsContact O-N 3.13Å; S269-I271 PolarHBondContact O-N 3.17Å; I271-W274 HydrophobicContact CD1-CB 4.37Å; I271-W274 HydrophobicContact CD1-CG 4.41Å; I271-R275 WeakPolarHBondContact O-CB 3.33Å; I271-R275 WeakPolarHBondContact O-CG 3.48Å; I271-R275 PolarHBondContact O-N 3.39Å; I271-P289 HydrophobicContact CD1-CG 4.06Å; I271-V298 HydrophobicContact CG1-CG2 4.19Å; I271-V298 HydrophobicContact CG2-CG1 3.74Å; I271-V298 HydrophobicContact CG2-CG2 4.29Å
272	R	88.6	Confident	86.1	Confident	37 Å²	37	62.2 Å²	62.2	14%	0.14	31%	0.306	C	S	.	.	H	α-helix	trans	-67.5	-48	168.3	-79.4	175.4	177.7	174	2.9	110.7	L268 S269 C270 W274 R275 C276 E386	L268-R272 WeakPolarHBondContact O-CB 3.38Å; L268-R272 WeakPolarHBondContact O-CD 3.5Å; L268-R272 WeakPolarHBondContact O-CG 3.45Å; L268-R272 PolarHBondContact O-N 2.99Å; S269-R272 WeakPolarHBondContact O-CB 3.38Å; S269-R272 PolarHBondContact O-N 3.03Å; C270-R272 VanDerWaalsContact C-N 3.33Å; C270-R272 PolarHBondContact O-N 3.38Å; R272-W274 VanDerWaalsContact C-N 3.31Å; R272-W274 PolarHBondContact O-N 2.89Å; R272-R275 CarbonylContact O-C 3.25Å; R272-R275 PolarHBondContact O-N 3.27Å; R272-C276 PolarHBondContact O-N 3.42Å; R272-C276 PolarHBondContact O-SG 2.9Å; R272-C276 VanDerWaalsContact O-SG 3.34Å; R272-E386 IonicContact CZ-OE1 2.74Å; R272-E386 IonicContact CZ-OE2 3.71Å; R272-E386 IonicContact NH1-OE1 3.5Å; R272-E386 IonicContact NH1-OE2 3.74Å; R272-E386 PolarHBondContact NH1-OE2 2.85Å; R272-E386 VanDerWaalsContact NH2-CD 3.3Å; R272-E386 IonicContact NH2-OE1 3.52Å; R272-E386 PolarHBondContact NH2-OE1 2.86Å; R272-E386 IonicContact NH2-OE2 2.77Å; R272-E386 PolarHBondContact NH2-OE2 2.8Å
273	Q	89.4	Confident	85.2	Confident	153 Å²	153	64.9 Å²	64.9	72%	0.715	32%	0.323	S	S	*	.	H	α-helix	trans	-59.2	-41.6	178.6	-168.5	174.1	7.6	0	0	112	S269 C270 R275 C276 A277	S269-Q273 PolarHBondContact O-N 3.43Å; C270-Q273 PolarHBondContact O-N 3.44Å; Q273-R275 PolarHBondContact O-N 3.02Å; Q273-C276 PolarHBondContact O-N 2.9Å; Q273-A277 PolarHBondContact O-N 3.28Å
274	W	88.8	Confident	84.5	Confident	67 Å²	67	64.3 Å²	64.3	25%	0.254	32%	0.319	S	S	.	.	H	α-helix	trans	-56.7	-46.8	170.3	175.8	-103	0	0	0	112.7	C270 I271 R272 C276 A277 I284 S287 P289	C270-W274 PolarHBondContact O-N 3.02Å; C270-W274 VanDerWaalsContact O-N 3.1Å; I271-W274 HydrophobicContact CD1-CB 4.37Å; I271-W274 HydrophobicContact CD1-CG 4.41Å; R272-W274 VanDerWaalsContact C-N 3.31Å; R272-W274 PolarHBondContact O-N 2.89Å; W274-C276 VanDerWaalsContact C-N 3.34Å; W274-C276 PolarHBondContact O-N 3.49Å; W274-A277 VanDerWaalsContact O-CB 3.31Å; W274-A277 WeakPolarHBondContact O-CB 3.42Å; W274-A277 PolarHBondContact O-N 3.38Å; W274-I284 HydrophobicContact CZ2-CG2 4.23Å; W274-S287 PolarHBondContact NE1-O 3.27Å; W274-P289 HydrophobicContact CD2-CG 3.88Å; W274-P289 HydrophobicContact CE3-CG 4.47Å; W274-P289 HydrophobicContact CG-CG 3.95Å; W274-P289 HydrophobicContact CZ2-CB 4.47Å; W274-P289 HydrophobicContact CZ2-CG 4.43Å
275	R	85.9	Confident	83.8	Confident	26 Å²	26	62.7 Å²	62.7	10%	0.098	31%	0.312	C	S	.	.	H	α-helix	trans	-69.9	-26.8	-179.9	-82.4	168	-175.4	-96.3	-10.5	114.2	I271 R272 Q273 I285 K286 S295	I271-R275 WeakPolarHBondContact O-CB 3.33Å; I271-R275 WeakPolarHBondContact O-CG 3.48Å; I271-R275 PolarHBondContact O-N 3.39Å; R272-R275 CarbonylContact O-C 3.25Å; R272-R275 PolarHBondContact O-N 3.27Å; Q273-R275 PolarHBondContact O-N 3.02Å; R275-I285 WeakPolarHBondContact CG-O 3.37Å; R275-K286 PolarHBondContact NH2-O 3.07Å; R275-S295 VanDerWaalsContact CZ-O 3.32Å; R275-S295 PolarHBondContact NH1-O 2.92Å; R275-S295 PolarHBondContact NH2-O 3.46Å
276	C	82.7	Confident	83.2	Confident	58 Å²	58	63.3 Å²	63.3	39%	0.392	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-1.6	177.2	-64.9	0	0	0	0	113.3	R272 Q273 W274 K278	R272-C276 PolarHBondContact O-N 3.42Å; R272-C276 PolarHBondContact O-SG 2.9Å; R272-C276 VanDerWaalsContact O-SG 3.34Å; Q273-C276 PolarHBondContact O-N 2.9Å; W274-C276 VanDerWaalsContact C-N 3.34Å; W274-C276 PolarHBondContact O-N 3.49Å; C276-K278 PolarHBondContact O-N 3.16Å
277	A	80.3	Confident	82.9	Confident	26 Å²	26	63.7 Å²	63.7	22%	0.215	32%	0.316	C	S	.	.			trans	-69.1	102.3	-177.4	0	0	0	0	0	112.2	Q273 W274 Q279 F280 I285	Q273-A277 PolarHBondContact O-N 3.28Å; W274-A277 VanDerWaalsContact O-CB 3.31Å; W274-A277 WeakPolarHBondContact O-CB 3.42Å; W274-A277 PolarHBondContact O-N 3.38Å; A277-Q279 PolarHBondContact O-N 2.85Å; A277-F280 HydrophobicContact CB-CD2 4.28Å; A277-I285 WeakPolarHBondContact O-CG2 3.32Å
278	K	73	Confident	82.7	Confident	209 Å²	209	63.7 Å²	63.7	91%	0.909	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-4.9	180	-60.9	-178.5	-177.8	176.2	0	115.1	C276	C276-K278 PolarHBondContact O-N 3.16Å
279	Q	71.5	Confident	82.6	Confident	171 Å²	171	65.4 Å²	65.4	80%	0.799	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-18.7	-176.6	-66.7	175.9	-11	0	0	113.4	A277	A277-Q279 PolarHBondContact O-N 2.85Å
280	F	72	Confident	82.6	Confident	95 Å²	95	67 Å²	67	42%	0.417	33%	0.329	S	S	.	.	S	Bend	trans	-120	153.9	-175.4	-56.1	-72.2	0	0	0	112	A277 I284 I285	A277-F280 HydrophobicContact CB-CD2 4.28Å; F280-I284 HydrophobicContact CB-CB 4.06Å; F280-I284 HydrophobicContact CB-CD1 4.47Å; F280-I284 HydrophobicContact CB-CG2 3.98Å; F280-I284 HydrophobicContact CD1-CG2 4.43Å; F280-I284 HydrophobicContact CG-CG2 4.21Å; F280-I285 HydrophobicContact CB-CG2 3.78Å
281	E	71.4	Confident	82.6	Confident	144 Å²	144	69 Å²	69	67%	0.673	34%	0.342	S	S	*	.			trans	-68	157.1	177.2	-59.8	-163	160.3	0	0	112.9	P283 I284 I285	E281-P283 HydrophobicContact CB-CG 4.32Å; E281-P283 VanDerWaalsContact O-N 3.16Å; E281-I284 PolarHBondContact O-N 3.03Å; E281-I285 PolarHBondContact O-N 3.26Å
282	N	67.8	Low	82.5	Confident	78 Å²	78	78.6 Å²	78.6	42%	0.417	38%	0.378	S	S	.	.	H	α-helix	trans	-45	-40.1	178.7	-93.7	-93	0	0	0	117.2	K286 R377	N282-K286 WeakPolarHBondContact O-CB 3.48Å; N282-K286 VanDerWaalsContact O-CG 3.28Å; N282-K286 WeakPolarHBondContact O-CG 3.26Å; N282-K286 PolarHBondContact O-N 3.25Å; N282-R377 PolarHBondContact OD1-NH1 3.38Å
283	P	72.8	Confident	82.6	Confident	68 Å²	68	79.7 Å²	79.7	44%	0.442	39%	0.389	S	S	.	.	H	α-helix	trans	-69	-33	175.9	25.6	-34.1	0	0	0	113	E281 S287	E281-P283 HydrophobicContact CB-CG 4.32Å; E281-P283 VanDerWaalsContact O-N 3.16Å; P283-S287 WeakPolarHBondContact O-CB 3.38Å; P283-S287 PolarHBondContact O-N 3.13Å
284	I	78.1	Confident	82.5	Confident	74 Å²	74	76.8 Å²	76.8	38%	0.379	38%	0.377	S	S	.	.	H	α-helix	trans	-74.1	-51.3	-176	-59.2	172.9	0	0	0	110	W274 F280 E281 K286 S287	W274-I284 HydrophobicContact CZ2-CG2 4.23Å; F280-I284 HydrophobicContact CB-CB 4.06Å; F280-I284 HydrophobicContact CB-CD1 4.47Å; F280-I284 HydrophobicContact CB-CG2 3.98Å; F280-I284 HydrophobicContact CD1-CG2 4.43Å; F280-I284 HydrophobicContact CG-CG2 4.21Å; E281-I284 PolarHBondContact O-N 3.03Å; I284-K286 PolarHBondContact O-N 3.34Å; I284-S287 WeakPolarHBondContact O-CB 3.32Å; I284-S287 PolarHBondContact O-N 2.93Å; I284-S287 PolarHBondContact O-OG 2.86Å
285	I	80.4	Confident	82.3	Confident	23 Å²	23	73.7 Å²	73.7	12%	0.118	37%	0.366	C	S	.	.	H	α-helix	trans	-61.9	-26.1	179	64.4	-176.3	0	0	0	113	R275 A277 F280 E281	R275-I285 WeakPolarHBondContact CG-O 3.37Å; A277-I285 WeakPolarHBondContact O-CG2 3.32Å; F280-I285 HydrophobicContact CB-CG2 3.78Å; E281-I285 PolarHBondContact O-N 3.26Å
286	K	82.6	Confident	81.8	Confident	33 Å²	33	77 Å²	77	14%	0.143	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-9.2	174.6	-72.8	-174.7	169.4	-151.8	0	114.1	R275 N282 I284 I294 S295	R275-K286 PolarHBondContact NH2-O 3.07Å; N282-K286 WeakPolarHBondContact O-CB 3.48Å; N282-K286 VanDerWaalsContact O-CG 3.28Å; N282-K286 WeakPolarHBondContact O-CG 3.26Å; N282-K286 PolarHBondContact O-N 3.25Å; I284-K286 PolarHBondContact O-N 3.34Å; K286-I294 HydrophobicContact CB-CG2 4.37Å; K286-S295 PolarHBondContact O-N 2.88Å
287	S	89.2	Confident	81.6	Confident	8 Å²	8	76.8 Å²	76.8	6%	0.056	38%	0.375	C	S	.	.	B	Isolated β-bridge	trans	-85.8	153.8	177	77.4	0	0	0	0	111.2	W274 P283 I284 R292 V293	W274-S287 PolarHBondContact NE1-O 3.27Å; P283-S287 WeakPolarHBondContact O-CB 3.38Å; P283-S287 PolarHBondContact O-N 3.13Å; I284-S287 WeakPolarHBondContact O-CB 3.32Å; I284-S287 PolarHBondContact O-N 2.93Å; I284-S287 PolarHBondContact O-OG 2.86Å; S287-R292 WeakPolarHBondContact CB-O 3.41Å; S287-V293 WeakPolarHBondContact CA-O 3.48Å
288	C	92	Very high	81.9	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	37%	0.365	C	S	.	.			trans	-60.8	128.9	168.2	167	0	0	0	0	109.7	L259 H264 Y266 E290 C291 R292 V293	L259-C288 HydrophobicContact CD1-CB 3.76Å; H264-C288 PolarHBondContact ND1-SG 3.44Å; Y266-C288 PolarHBondContact OH-SG 3.47Å; C288-E290 PolarHBondContact O-N 3.07Å; C288-E290 VanDerWaalsContact O-N 3.14Å; C288-E290 PolarHBondContact SG-N 3.22Å; C288-C291 PolarHBondContact SG-N 3.47Å; C288-R292 WeakPolarHBondContact O-CA 3.39Å; C288-R292 PolarHBondContact O-N 3.38Å; C288-V293 PolarHBondContact N-O 3.27Å
289	P	90.9	Very high	82.7	Confident	38 Å²	38	65.8 Å²	65.8	25%	0.247	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-35.6	177.3	-29.4	32.6	0	0	0	114.8	I240 Y266 I271 W274	I240-P289 HydrophobicContact CD1-CG 4.23Å; Y266-P289 HydrophobicContact CE1-CB 4.46Å; Y266-P289 HydrophobicContact CE1-CG 4.12Å; Y266-P289 WeakPolarHBondContact OH-CD 3.39Å; I271-P289 HydrophobicContact CD1-CG 4.06Å; W274-P289 HydrophobicContact CD2-CG 3.88Å; W274-P289 HydrophobicContact CE3-CG 4.47Å; W274-P289 HydrophobicContact CG-CG 3.95Å; W274-P289 HydrophobicContact CZ2-CB 4.47Å; W274-P289 HydrophobicContact CZ2-CG 4.43Å
290	E	91.5	Very high	83.6	Confident	90 Å²	90	59 Å²	59	42%	0.421	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-68	-178.3	-73.5	154.6	-100.6	0	0	112.5	S239 H264 Y266 C288	S239-E290 WeakPolarHBondContact CB-OE1 3.22Å; S239-E290 PolarHBondContact OG-OE1 3.48Å; S239-E290 PolarHBondContact OG-OE2 3.29Å; H264-E290 IonicContact CD2-OE2 3.27Å; H264-E290 PolarHBondContact CD2-OE2 3.2Å; H264-E290 IonicContact CG-OE1 3.73Å; H264-E290 IonicContact CG-OE2 2.77Å; Y266-E290 WeakPolarHBondContact CE1-OE1 3.23Å; Y266-E290 PolarHBondContact OH-OE1 2.91Å; C288-E290 PolarHBondContact O-N 3.07Å; C288-E290 VanDerWaalsContact O-N 3.14Å; C288-E290 PolarHBondContact SG-N 3.22Å
291	C	93.3	Very high	84.6	Confident	52 Å²	52	54.9 Å²	54.9	35%	0.351	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-3	-172.7	68.7	0	0	0	0	115.5	H264 C288 V293	H264-C291 WeakPolarHBondContact CE1-CB 3.41Å; H264-C291 PolarHBondContact CE1-SG 3.11Å; H264-C291 PolarHBondContact ND1-SG 3.03Å; H264-C291 VanDerWaalsContact ND1-SG 3.41Å; C288-C291 PolarHBondContact SG-N 3.47Å; C291-V293 HydrophobicContact CB-CG2 4.3Å; C291-V293 PolarHBondContact O-N 2.84Å; C291-V293 WeakPolarHBondContact SG-CG2 3.39Å
292	R	90.6	Very high	85.6	Confident	200 Å²	200	51 Å²	51	76%	0.755	26%	0.262	S	S	*	.			trans	56.1	13.2	-177.3	-54.8	-179.7	-177.6	176.6	0.4	115.5	S287 C288 I294	S287-R292 WeakPolarHBondContact CB-O 3.41Å; C288-R292 WeakPolarHBondContact O-CA 3.39Å; C288-R292 PolarHBondContact O-N 3.38Å; R292-I294 PolarHBondContact O-N 2.94Å
293	V	91.4	Very high	86.8	Confident	61 Å²	61	49.9 Å²	49.9	37%	0.37	25%	0.253	S	S	.	.			trans	-64.8	127.8	169.9	178.1	0	0	0	0	108.6	N261 S287 C288 C291 S295	N261-V293 HydrophobicContact CB-CG1 3.56Å; S287-V293 WeakPolarHBondContact CA-O 3.48Å; C288-V293 PolarHBondContact N-O 3.27Å; C291-V293 HydrophobicContact CB-CG2 4.3Å; C291-V293 PolarHBondContact O-N 2.84Å; C291-V293 WeakPolarHBondContact SG-CG2 3.39Å; V293-S295 PolarHBondContact O-N 3.5Å
294	I	85.5	Confident	87.9	Confident	92 Å²	92	47.2 Å²	47.2	47%	0.472	23%	0.234	S	C	.	.	B	Isolated β-bridge	trans	-71.5	130.1	-179.6	-59.6	172.5	0	0	0	108.9	N261 K286 R292	N261-I294 PolarHBondContact ND2-O 3.41Å; K286-I294 HydrophobicContact CB-CG2 4.37Å; R292-I294 PolarHBondContact O-N 2.94Å
295	S	84.3	Confident	88.6	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.007	22%	0.219	C	C	.	.			trans	-130.2	121.3	169.5	-178.2	0	0	0	0	109.4	S260 R275 K286 V293 F297	S260-S295 WeakPolarHBondContact CB-OG 3.43Å; S260-S295 PolarHBondContact N-OG 3.27Å; S260-S295 PolarHBondContact OG-OG 3.39Å; R275-S295 VanDerWaalsContact CZ-O 3.32Å; R275-S295 PolarHBondContact NH1-O 2.92Å; R275-S295 PolarHBondContact NH2-O 3.46Å; K286-S295 PolarHBondContact O-N 2.88Å; V293-S295 PolarHBondContact O-N 3.5Å; S295-F297 PolarHBondContact O-N 3.11Å; S295-F297 PolarHBondContact OG-O 2.99Å; S295-F297 VanDerWaalsContact OG-O 3.11Å
296	E	77.3	Confident	89.1	Confident	97 Å²	97	47.7 Å²	47.7	45%	0.453	24%	0.235	S	C	.	.	S	Bend	trans	-70	-20.8	-174.6	-67.7	-151.8	121.4	0	0	113.7
297	F	77.1	Confident	89.5	Confident	52 Å²	52	50.2 Å²	50.2	23%	0.228	25%	0.25	C	C	.	.			trans	-134.4	151.5	-171.1	-54.2	-83.5	0	0	0	111.1	S295 L344 W379	S295-F297 PolarHBondContact O-N 3.11Å; S295-F297 PolarHBondContact OG-O 2.99Å; S295-F297 VanDerWaalsContact OG-O 3.11Å; F297-L344 HydrophobicContact CD1-CD1 4.06Å; F297-L344 HydrophobicContact CE1-CD1 4.1Å; F297-L344 HydrophobicContact CE1-CD2 4.29Å; F297-L344 HydrophobicContact CE1-CG 4.41Å; F297-W379 AromaticContact CD1-NE1 3.61Å
298	V	87.2	Confident	89.6	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	131.3	162.1	-175.7	0	0	0	0	107	L259 L268 I271 W379	L259-V298 HydrophobicContact CD2-CG2 3.92Å; L268-V298 HydrophobicContact CD1-CG1 4.19Å; I271-V298 HydrophobicContact CG1-CG2 4.19Å; I271-V298 HydrophobicContact CG2-CG1 3.74Å; I271-V298 HydrophobicContact CG2-CG2 4.29Å; V298-W379 WeakPolarHBondContact O-CH2 3.37Å; V298-W379 WeakPolarHBondContact O-CZ2 3.34Å
299	I	88.9	Confident	89.5	Confident	3 Å²	3	59 Å²	59	2%	0.015	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	114.2	174.7	-56.9	87.6	0	0	0	107.9	I258 S301 L314 I315 F318	I258-I299 HydrophobicContact CB-CB 4.49Å; I258-I299 PolarHBondContact N-O 3.05Å; I258-I299 PolarHBondContact O-N 3.45Å; I299-S301 PolarHBondContact O-N 3.47Å; I299-L314 HydrophobicContact CB-CD2 4.38Å; I299-L314 HydrophobicContact CG2-CD2 3.67Å; I299-L314 HydrophobicContact CG2-CG 3.98Å; I299-I315 HydrophobicContact CD1-CD1 3.92Å; I299-I315 HydrophobicContact CD1-CG1 3.68Å; I299-I315 HydrophobicContact CG1-CB 4.49Å; I299-I315 HydrophobicContact CG1-CG1 4.02Å; I299-F318 HydrophobicContact CG2-CB 3.96Å; I299-F318 HydrophobicContact CG2-CD2 4.3Å; I299-F318 HydrophobicContact CG2-CG 4.05Å
300	P	91.8	Very high	89.5	Confident	29 Å²	29	61.6 Å²	61.6	19%	0.188	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	128.4	169.6	-18	31.9	0	0	0	110.2	F256 L268 F318	F256-P300 WeakPolarHBondContact O-CA 3.47Å; L268-P300 HydrophobicContact CD1-CB 4.06Å; L268-P300 HydrophobicContact CD1-CG 4.03Å; L268-P300 HydrophobicContact CD2-CB 3.89Å; L268-P300 HydrophobicContact CD2-CG 4.36Å; P300-F318 HydrophobicContact CG-CE2 4.26Å
301	S	92.2	Very high	89.4	Confident	8 Å²	8	57.4 Å²	57.4	6%	0.056	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	156.8	172.8	-170.8	0	0	0	0	111.3	R255 F256 I299 Y303	R255-S301 CarbonylContact C-O 3.58Å; R255-S301 VanDerWaalsContact CA-O 3.28Å; R255-S301 WeakPolarHBondContact CA-O 3.38Å; F256-S301 PolarHBondContact N-O 3.35Å; F256-S301 PolarHBondContact O-N 3.31Å; I299-S301 PolarHBondContact O-N 3.47Å; S301-Y303 VanDerWaalsContact CB-O 3.22Å; S301-Y303 WeakPolarHBondContact CB-O 3.43Å; S301-Y303 PolarHBondContact OG-N 3.23Å; S301-Y303 PolarHBondContact OG-O 3.3Å
302	V	92.4	Very high	89.2	Confident	64 Å²	64	58.6 Å²	58.6	39%	0.388	28%	0.284	S	S	.	.	S	Bend	trans	-93.8	-17.3	173.1	-66.8	0	0	0	0	112.7	F230 R255	F230-V302 HydrophobicContact CE1-CB 3.99Å; F230-V302 HydrophobicContact CE1-CG2 3.95Å; F230-V302 VanDerWaalsContact CE1-O 3.28Å; F230-V302 WeakPolarHBondContact CE1-O 3.29Å; F230-V302 HydrophobicContact CZ-CB 4.02Å; F230-V302 HydrophobicContact CZ-CG2 3.57Å; R255-V302 HydrophobicContact CG-CG1 4.49Å
303	Y	94.1	Very high	89.2	Confident	54 Å²	54	54.8 Å²	54.8	21%	0.212	28%	0.275	C	S	.	.	S	Bend	trans	-126.6	161	172.2	54.9	-103.4	0	0	0	110.2	K226 A229 F230 S301 V305	K226-Y303 HydrophobicContact CG-CD1 4.41Å; K226-Y303 HydrophobicContact CG-CE1 4.23Å; A229-Y303 HydrophobicContact CB-CD1 4.49Å; A229-Y303 HydrophobicContact CB-CD2 3.86Å; A229-Y303 HydrophobicContact CB-CE2 4.31Å; A229-Y303 HydrophobicContact CB-CG 3.99Å; F230-Y303 HydrophobicContact CE2-CD1 4.5Å; F230-Y303 HydrophobicContact CZ-CD1 4.47Å; S301-Y303 VanDerWaalsContact CB-O 3.22Å; S301-Y303 WeakPolarHBondContact CB-O 3.43Å; S301-Y303 PolarHBondContact OG-N 3.23Å; S301-Y303 PolarHBondContact OG-O 3.3Å; Y303-V305 HydrophobicContact CD2-CG2 3.71Å; Y303-V305 HydrophobicContact CE2-CG2 3.5Å; Y303-V305 VanDerWaalsContact CE2-CG2 3.5Å
304	W	95.3	Very high	89.1	Confident	11 Å²	11	53.3 Å²	53.3	4%	0.042	27%	0.265	C	S	.	.			trans	-85.3	150.4	176.9	-177.3	-116.9	0	0	0	111.6	S233 K236 F256 I258 N263 H264 T265 E306	S233-W304 VanDerWaalsContact CB-CB 3.47Å; K236-W304 HydrophobicContact CD-CG 4.3Å; K236-W304 HydrophobicContact CG-CB 4.02Å; K236-W304 HydrophobicContact CG-CG 4Å; F256-W304 HydrophobicContact CB-CE3 4.24Å; F256-W304 HydrophobicContact CD1-CB 4.13Å; F256-W304 HydrophobicContact CD1-CD2 4.39Å; F256-W304 AromaticContact CD1-CE3 3.75Å; F256-W304 HydrophobicContact CD1-CE3 3.75Å; F256-W304 HydrophobicContact CE1-CB 3.93Å; F256-W304 HydrophobicContact CE1-CE3 4.48Å; F256-W304 HydrophobicContact CE2-CB 4.35Å; F256-W304 HydrophobicContact CG-CB 4.44Å; F256-W304 HydrophobicContact CG-CE3 4.19Å; F256-W304 HydrophobicContact CZ-CB 4.05Å; I258-W304 HydrophobicContact CD1-CE3 4.39Å; I258-W304 HydrophobicContact CG1-CE3 4.03Å; I258-W304 HydrophobicContact CG1-CZ3 3.86Å; N263-W304 WeakPolarHBondContact O-CZ2 3.23Å; H264-W304 WeakPolarHBondContact O-CH2 3.47Å; T265-W304 HydrophobicContact CG2-CD2 4.32Å; T265-W304 HydrophobicContact CG2-CE3 4.16Å; T265-W304 HydrophobicContact CG2-CH2 4.48Å; T265-W304 HydrophobicContact CG2-CZ3 4.23Å; T265-W304 WeakPolarHBondContact OG1-CZ2 3.2Å; W304-E306 PolarHBondContact NE1-OE1 3.15Å; W304-E306 VanDerWaalsContact NE1-OE1 3.13Å
305	V	93.2	Very high	89.1	Confident	12 Å²	12	50 Å²	50	7%	0.073	25%	0.248	C	C	.	.			trans	-137.4	129.8	178.5	-173.2	0	0	0	0	108.8	I258 Y303 K310 K311	I258-V305 HydrophobicContact CD1-CB 4.24Å; I258-V305 HydrophobicContact CD1-CG2 4.13Å; Y303-V305 HydrophobicContact CD2-CG2 3.71Å; Y303-V305 HydrophobicContact CE2-CG2 3.5Å; Y303-V305 VanDerWaalsContact CE2-CG2 3.5Å; V305-K310 HydrophobicContact CG1-CB 3.52Å; V305-K311 HydrophobicContact CB-CG 4.18Å; V305-K311 HydrophobicContact CG1-CG 3.88Å; V305-K311 WeakPolarHBondContact O-CE 3.38Å
306	E	90.1	Very high	89.2	Confident	96 Å²	96	56.5 Å²	56.5	45%	0.449	28%	0.278	S	S	.	.			trans	-105	-41.6	179.8	-65.3	-176.9	177.2	0	0	111.9	K236 N263 W304 Q308	K236-E306 IonicContact NZ-OE1 3.13Å; K236-E306 PolarHBondContact NZ-OE1 3.22Å; N263-E306 PolarHBondContact ND2-O 3.06Å; W304-E306 PolarHBondContact NE1-OE1 3.15Å; W304-E306 VanDerWaalsContact NE1-OE1 3.13Å; E306-Q308 PolarHBondContact O-N 3.3Å
307	D	91.5	Very high	89.7	Confident	85 Å²	85	54.9 Å²	54.9	46%	0.455	28%	0.282	S	S	.	.			trans	-60.5	126.1	179.5	-61.9	-42.1	0	0	0	112.4	N309 K310 K311	D307-N309 VanDerWaalsContact C-N 3.26Å; D307-N309 PolarHBondContact O-N 3.32Å; D307-K310 HydrophobicContact CB-CB 4.12Å; D307-K310 HydrophobicContact CB-CD 4.14Å; D307-K310 HydrophobicContact CB-CG 4.08Å; D307-K310 PolarHBondContact O-N 3.11Å; D307-K310 WeakPolarHBondContact OD2-CD 3.28Å; D307-K310 WeakPolarHBondContact OD2-CE 3.24Å; D307-K310 IonicContact OD2-NZ 3.98Å; D307-K310 PolarHBondContact OD2-NZ 3.32Å; D307-K311 WeakPolarHBondContact O-CG 3.44Å; D307-K311 PolarHBondContact O-N 2.89Å
308	Q	90.3	Very high	90.1	Very high	77 Å²	77	54.3 Å²	54.3	36%	0.36	28%	0.279	S	S	.	.	H	α-helix	trans	-63.2	-31.2	-179.7	-170.7	62.7	47.9	0	0	112.8	S260 E306 K311 N312	S260-Q308 PolarHBondContact O-NE2 3.12Å; E306-Q308 PolarHBondContact O-N 3.3Å; Q308-K311 WeakPolarHBondContact O-CB 3.3Å; Q308-K311 PolarHBondContact O-N 3.42Å; Q308-N312 PolarHBondContact NE2-OD1 2.74Å; Q308-N312 VanDerWaalsContact NE2-OD1 3.07Å; Q308-N312 PolarHBondContact O-N 2.84Å; Q308-N312 PolarHBondContact O-ND2 3.36Å; Q308-N312 PolarHBondContact O-OD1 3.24Å
309	N	91.5	Very high	89.9	Confident	117 Å²	117	59.1 Å²	59.1	63%	0.626	30%	0.3	S	S	*	.	H	α-helix	trans	-67.9	-53	177.3	-68.1	-6.1	0	0	0	111.2	D307 K311 N312 E313	D307-N309 VanDerWaalsContact C-N 3.26Å; D307-N309 PolarHBondContact O-N 3.32Å; N309-K311 PolarHBondContact O-N 3.17Å; N309-N312 WeakPolarHBondContact O-CA 3.29Å; N309-N312 WeakPolarHBondContact O-CB 3.38Å; N309-N312 PolarHBondContact O-N 2.9Å; N309-E313 PolarHBondContact O-N 3.41Å
310	K	89.8	Confident	89.7	Confident	91 Å²	91	64.7 Å²	64.7	40%	0.396	33%	0.326	S	S	.	.	H	α-helix	trans	-59.4	-34.7	174.2	-64.2	-178.9	-176.3	144.6	0	112.1	V305 D307 L314	V305-K310 HydrophobicContact CG1-CB 3.52Å; D307-K310 HydrophobicContact CB-CB 4.12Å; D307-K310 HydrophobicContact CB-CD 4.14Å; D307-K310 HydrophobicContact CB-CG 4.08Å; D307-K310 PolarHBondContact O-N 3.11Å; D307-K310 WeakPolarHBondContact OD2-CD 3.28Å; D307-K310 WeakPolarHBondContact OD2-CE 3.24Å; D307-K310 IonicContact OD2-NZ 3.98Å; D307-K310 PolarHBondContact OD2-NZ 3.32Å; K310-L314 WeakPolarHBondContact O-CB 3.4Å; K310-L314 PolarHBondContact O-N 2.87Å
311	K	90.1	Very high	89.4	Confident	2 Å²	2	64.3 Å²	64.3	1%	0.009	33%	0.328	C	S	.	.	H	α-helix	trans	-58.7	-54.1	169.1	-77.3	-177	-179.1	-176.3	0	110.8	I258 C262 N263 V305 D307 Q308 N309 E313 L314 I315	I258-K311 HydrophobicContact CG2-CD 4.25Å; I258-K311 HydrophobicContact CG2-CG 4.31Å; C262-K311 PolarHBondContact O-NZ 2.97Å; N263-K311 PolarHBondContact OD1-NZ 3.21Å; V305-K311 HydrophobicContact CB-CG 4.18Å; V305-K311 HydrophobicContact CG1-CG 3.88Å; V305-K311 WeakPolarHBondContact O-CE 3.38Å; D307-K311 WeakPolarHBondContact O-CG 3.44Å; D307-K311 PolarHBondContact O-N 2.89Å; Q308-K311 WeakPolarHBondContact O-CB 3.3Å; Q308-K311 PolarHBondContact O-N 3.42Å; N309-K311 PolarHBondContact O-N 3.17Å; K311-E313 VanDerWaalsContact C-N 3.3Å; K311-E313 PolarHBondContact O-N 3.28Å; K311-L314 CarbonylContact O-C 3.43Å; K311-L314 WeakPolarHBondContact O-CA 3.35Å; K311-L314 VanDerWaalsContact O-CB 3.3Å; K311-L314 WeakPolarHBondContact O-CB 3.35Å; K311-L314 PolarHBondContact O-N 2.98Å; K311-I315 VanDerWaalsContact O-CG1 3.27Å; K311-I315 WeakPolarHBondContact O-CG1 3.4Å; K311-I315 PolarHBondContact O-N 3.21Å
312	N	88.9	Confident	89	Confident	78 Å²	78	65 Å²	65	42%	0.417	33%	0.33	S	S	.	.	H	α-helix	trans	-56.8	-43.3	-178.5	-66.4	-21.7	0	0	0	111.9	Q308 N309 I315 E316	Q308-N312 PolarHBondContact NE2-OD1 2.74Å; Q308-N312 VanDerWaalsContact NE2-OD1 3.07Å; Q308-N312 PolarHBondContact O-N 2.84Å; Q308-N312 PolarHBondContact O-ND2 3.36Å; Q308-N312 PolarHBondContact O-OD1 3.24Å; N309-N312 WeakPolarHBondContact O-CA 3.29Å; N309-N312 WeakPolarHBondContact O-CB 3.38Å; N309-N312 PolarHBondContact O-N 2.9Å; N312-I315 WeakPolarHBondContact O-CB 3.48Å; N312-I315 PolarHBondContact O-N 2.9Å; N312-I315 VanDerWaalsContact O-N 3.16Å; N312-E316 PolarHBondContact O-N 2.97Å
313	E	90.8	Very high	88.5	Confident	120 Å²	120	63.6 Å²	63.6	56%	0.561	33%	0.328	S	S	*	.	H	α-helix	trans	-58.4	-45.4	172.8	-69.6	161.9	-157.6	0	0	111.8	N309 K311 I315 E316 A317	N309-E313 PolarHBondContact O-N 3.41Å; K311-E313 VanDerWaalsContact C-N 3.3Å; K311-E313 PolarHBondContact O-N 3.28Å; E313-I315 PolarHBondContact O-N 3.35Å; E313-E316 PolarHBondContact O-N 2.93Å; E313-A317 WeakPolarHBondContact O-CB 3.1Å; E313-A317 PolarHBondContact O-N 3.14Å
314	L	88.4	Confident	88	Confident	30 Å²	30	67.7 Å²	67.7	16%	0.157	35%	0.348	C	S	.	.	H	α-helix	trans	-61.7	-39.5	173.7	-168.7	87.9	0	0	0	112.2	I258 I299 K310 K311 F318	I258-L314 HydrophobicContact CD1-CD2 3.72Å; I299-L314 HydrophobicContact CB-CD2 4.38Å; I299-L314 HydrophobicContact CG2-CD2 3.67Å; I299-L314 HydrophobicContact CG2-CG 3.98Å; K310-L314 WeakPolarHBondContact O-CB 3.4Å; K310-L314 PolarHBondContact O-N 2.87Å; K311-L314 CarbonylContact O-C 3.43Å; K311-L314 WeakPolarHBondContact O-CA 3.35Å; K311-L314 VanDerWaalsContact O-CB 3.3Å; K311-L314 WeakPolarHBondContact O-CB 3.35Å; K311-L314 PolarHBondContact O-N 2.98Å; L314-F318 VanDerWaalsContact O-CB 3.23Å; L314-F318 WeakPolarHBondContact O-CB 3.35Å; L314-F318 PolarHBondContact O-N 2.83Å
315	I	85.6	Confident	87.5	Confident	21 Å²	21	71 Å²	71	11%	0.108	36%	0.362	C	S	.	.	H	α-helix	trans	-63	-43.9	174.4	-52.7	-168.9	0	0	0	110.2	S260 I299 K311 N312 E313 F318 K319	S260-I315 VanDerWaalsContact CB-CD1 3.47Å; I299-I315 HydrophobicContact CD1-CD1 3.92Å; I299-I315 HydrophobicContact CD1-CG1 3.68Å; I299-I315 HydrophobicContact CG1-CB 4.49Å; I299-I315 HydrophobicContact CG1-CG1 4.02Å; K311-I315 VanDerWaalsContact O-CG1 3.27Å; K311-I315 WeakPolarHBondContact O-CG1 3.4Å; K311-I315 PolarHBondContact O-N 3.21Å; N312-I315 WeakPolarHBondContact O-CB 3.48Å; N312-I315 PolarHBondContact O-N 2.9Å; N312-I315 VanDerWaalsContact O-N 3.16Å; E313-I315 PolarHBondContact O-N 3.35Å; I315-F318 PolarHBondContact O-N 2.85Å; I315-K319 HydrophobicContact CG2-CD 4.01Å; I315-K319 HydrophobicContact CG2-CG 4.39Å; I315-K319 WeakPolarHBondContact O-CB 3.37Å; I315-K319 VanDerWaalsContact O-CG 3.29Å; I315-K319 WeakPolarHBondContact O-CG 3.23Å; I315-K319 PolarHBondContact O-N 3.03Å
316	E	87.2	Confident	87.1	Confident	139 Å²	139	74.1 Å²	74.1	65%	0.65	39%	0.39	S	S	*	.	H	α-helix	trans	-68.9	-45.7	-178.4	-172	163.8	-156	0	0	111.8	N312 E313 F318 K319 Q320	N312-E316 PolarHBondContact O-N 2.97Å; E313-E316 PolarHBondContact O-N 2.93Å; E316-F318 VanDerWaalsContact C-N 3.3Å; E316-F318 PolarHBondContact O-N 2.83Å; E316-K319 PolarHBondContact O-N 3.4Å; E316-Q320 WeakPolarHBondContact O-CB 3.47Å; E316-Q320 PolarHBondContact O-N 3.38Å
317	A	87.3	Confident	86.8	Confident	63 Å²	63	69.9 Å²	69.9	52%	0.521	37%	0.37	S	S	.	.	H	α-helix	trans	-57.8	-41.4	172.1	0	0	0	0	0	111.8	E313 G321	E313-A317 WeakPolarHBondContact O-CB 3.1Å; E313-A317 PolarHBondContact O-N 3.14Å; A317-G321 PolarHBondContact O-N 3.42Å
318	F	85.7	Confident	86.4	Confident	39 Å²	39	73 Å²	73	17%	0.171	38%	0.38	C	S	.	.	H	α-helix	trans	-64.9	-46.7	174.8	-179.8	-100.3	0	0	0	112.3	I299 P300 L314 I315 E316 G321 M322 L344 W379	I299-F318 HydrophobicContact CG2-CB 3.96Å; I299-F318 HydrophobicContact CG2-CD2 4.3Å; I299-F318 HydrophobicContact CG2-CG 4.05Å; P300-F318 HydrophobicContact CG-CE2 4.26Å; L314-F318 VanDerWaalsContact O-CB 3.23Å; L314-F318 WeakPolarHBondContact O-CB 3.35Å; L314-F318 PolarHBondContact O-N 2.83Å; I315-F318 PolarHBondContact O-N 2.85Å; E316-F318 VanDerWaalsContact C-N 3.3Å; E316-F318 PolarHBondContact O-N 2.83Å; F318-G321 PolarHBondContact O-N 3.22Å; F318-M322 HydrophobicContact CD1-CG 4.3Å; F318-M322 HydrophobicContact CD2-CE 4.35Å; F318-M322 HydrophobicContact CE1-CG 3.86Å; F318-M322 HydrophobicContact CE2-CE 3.9Å; F318-M322 HydrophobicContact CE2-CG 4.15Å; F318-M322 HydrophobicContact CE2-SD 4.21Å; F318-M322 HydrophobicContact CZ-CE 4.35Å; F318-M322 HydrophobicContact CZ-CG 3.77Å; F318-M322 HydrophobicContact CZ-SD 4.05Å; F318-M322 WeakPolarHBondContact O-CG 3.42Å; F318-M322 PolarHBondContact O-N 3.44Å; F318-L344 HydrophobicContact CE1-CD1 4.26Å; F318-W379 HydrophobicContact CZ-CH2 4.36Å
319	K	83.3	Confident	85.8	Confident	102 Å²	102	73 Å²	73	44%	0.443	38%	0.377	S	S	.	.	H	α-helix	trans	-59	-48.5	175.8	-77.4	168.8	177	171.3	0	111.4	I315 E316 G321 M322 G323 L344	I315-K319 HydrophobicContact CG2-CD 4.01Å; I315-K319 HydrophobicContact CG2-CG 4.39Å; I315-K319 WeakPolarHBondContact O-CB 3.37Å; I315-K319 VanDerWaalsContact O-CG 3.29Å; I315-K319 WeakPolarHBondContact O-CG 3.23Å; I315-K319 PolarHBondContact O-N 3.03Å; E316-K319 PolarHBondContact O-N 3.4Å; K319-G321 VanDerWaalsContact C-N 3.31Å; K319-G321 PolarHBondContact O-N 3.37Å; K319-M322 PolarHBondContact O-N 3.28Å; K319-G323 PolarHBondContact O-N 2.87Å; K319-L344 HydrophobicContact CG-CD2 4.08Å
320	Q	85.4	Confident	85.2	Confident	120 Å²	120	68.4 Å²	68.4	56%	0.561	35%	0.352	S	S	*	.	H	α-helix	trans	-62.4	-39.9	177.1	-161.3	-157.1	82.9	0	0	111.2	E316 G323 K324	E316-Q320 WeakPolarHBondContact O-CB 3.47Å; E316-Q320 PolarHBondContact O-N 3.38Å; Q320-G323 PolarHBondContact O-N 3.1Å; Q320-K324 WeakPolarHBondContact O-CG 3.3Å; Q320-K324 PolarHBondContact O-N 3.05Å
321	G	84.6	Confident	84.8	Confident	22 Å²	22	69.7 Å²	69.7	23%	0.227	36%	0.359	C	S	.	.	H	α-helix	trans	-65.3	-35.8	175.7	0	0	0	0	0	113.8	A317 F318 K319 K325	A317-G321 PolarHBondContact O-N 3.42Å; F318-G321 PolarHBondContact O-N 3.22Å; K319-G321 VanDerWaalsContact C-N 3.31Å; K319-G321 PolarHBondContact O-N 3.37Å; G321-K325 VanDerWaalsContact O-CE 3.23Å; G321-K325 WeakPolarHBondContact O-CE 3.49Å; G321-K325 WeakPolarHBondContact O-CG 3.41Å
322	M	83.1	Confident	84.4	Confident	21 Å²	21	74.6 Å²	74.6	10%	0.103	38%	0.382	C	S	.	.	H	α-helix	trans	-74.3	-40.9	172.5	-66.9	-56.7	101.4	0	0	111.6	F318 K319 K324 K325 L344 Y345	F318-M322 HydrophobicContact CD1-CG 4.3Å; F318-M322 HydrophobicContact CD2-CE 4.35Å; F318-M322 HydrophobicContact CE1-CG 3.86Å; F318-M322 HydrophobicContact CE2-CE 3.9Å; F318-M322 HydrophobicContact CE2-CG 4.15Å; F318-M322 HydrophobicContact CE2-SD 4.21Å; F318-M322 HydrophobicContact CZ-CE 4.35Å; F318-M322 HydrophobicContact CZ-CG 3.77Å; F318-M322 HydrophobicContact CZ-SD 4.05Å; F318-M322 WeakPolarHBondContact O-CG 3.42Å; F318-M322 PolarHBondContact O-N 3.44Å; K319-M322 PolarHBondContact O-N 3.28Å; M322-K324 PolarHBondContact O-N 3.4Å; M322-K324 VanDerWaalsContact O-N 3.13Å; M322-K325 HydrophobicContact CE-CD 4.1Å; M322-K325 PolarHBondContact O-N 2.86Å; M322-L344 CarbonylContact C-O 3.51Å; M322-L344 HydrophobicContact CB-CB 3.91Å; M322-L344 WeakPolarHBondContact CB-O 3.34Å; M322-L344 HydrophobicContact CG-CB 4.37Å; M322-Y345 HydrophobicContact CB-CD1 4.35Å; M322-Y345 HydrophobicContact CB-CE1 4.33Å; M322-Y345 HydrophobicContact CG-CE1 4.4Å; M322-Y345 HydrophobicContact SD-CD1 4.37Å; M322-Y345 HydrophobicContact SD-CE1 3.47Å; M322-Y345 WeakPolarHBondContact SD-CE1 3.47Å
323	G	82	Confident	83.8	Confident	35 Å²	35	72.7 Å²	72.7	36%	0.361	38%	0.381	S	S	.	.	H	α-helix	trans	-66	-12.9	-178.9	0	0	0	0	0	115.1	K319 Q320 L344 R346	K319-G323 PolarHBondContact O-N 2.87Å; Q320-G323 PolarHBondContact O-N 3.1Å; G323-L344 WeakPolarHBondContact CA-O 3.42Å; G323-L344 PolarHBondContact N-O 3.17Å; G323-L344 VanDerWaalsContact N-O 3.07Å; G323-R346 VanDerWaalsContact O-CB 3.29Å; G323-R346 WeakPolarHBondContact O-CB 3.23Å
324	K	85.1	Confident	83.1	Confident	141 Å²	141	74.5 Å²	74.5	61%	0.613	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-26.9	168	-69.7	169	-170.3	171	0	112.8	Q320 M322	Q320-K324 WeakPolarHBondContact O-CG 3.3Å; Q320-K324 PolarHBondContact O-N 3.05Å; M322-K324 PolarHBondContact O-N 3.4Å; M322-K324 VanDerWaalsContact O-N 3.13Å
325	K	84.4	Confident	82.5	Confident	79 Å²	79	74.2 Å²	74.2	34%	0.343	39%	0.391	S	S	.	.	S	Bend	trans	-89.9	128.1	-171.1	-57	177.8	-168.7	-170.2	0	109.9	G321 M322 Y345 R346	G321-K325 VanDerWaalsContact O-CE 3.23Å; G321-K325 WeakPolarHBondContact O-CE 3.49Å; G321-K325 WeakPolarHBondContact O-CG 3.41Å; M322-K325 HydrophobicContact CE-CD 4.1Å; M322-K325 PolarHBondContact O-N 2.86Å; K325-Y345 HydrophobicContact CB-CD1 4.11Å; K325-Y345 HydrophobicContact CB-CE1 4.47Å; K325-R346 WeakPolarHBondContact O-CB 3.28Å; K325-R346 PolarHBondContact O-N 3.17Å
326	A	84.1	Confident	82.2	Confident	79 Å²	79	78.5 Å²	78.5	65%	0.653	42%	0.418	S	S	*	.	B	Isolated β-bridge	trans	-57.3	136.6	-179.8	0	0	0	0	0	112.5	K328	A326-K328 PolarHBondContact O-N 3.16Å
327	C	84.5	Confident	81.6	Confident	6 Å²	6	72.1 Å²	72.1	4%	0.041	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-74.1	121	176.2	179.8	0	0	0	0	111.5	Y329 F330 E331 C337 C343 R346 H347	C327-Y329 PolarHBondContact O-N 2.86Å; C327-Y329 PolarHBondContact SG-N 3.17Å; C327-F330 HydrophobicContact CB-CB 3.89Å; C327-F330 PolarHBondContact O-N 3.02Å; C327-E331 PolarHBondContact O-N 3.24Å; C327-C337 VanDerWaalsContact SG-SG 3.68Å; C327-C343 VanDerWaalsContact SG-SG 3.7Å; C327-R346 WeakPolarHBondContact CB-O 3.46Å; C327-R346 PolarHBondContact N-O 2.93Å; C327-H347 WeakPolarHBondContact CB-CD2 3.39Å; C327-H347 PolarHBondContact SG-NE2 2.96Å; C327-H347 VanDerWaalsContact SG-NE2 3.41Å
328	K	82.3	Confident	80.8	Confident	150 Å²	150	72 Å²	72	65%	0.652	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-34.7	176.9	-173.5	-176	175.3	-170	0	113.3	A326	A326-K328 PolarHBondContact O-N 3.16Å
329	Y	76.9	Confident	79.9	Confident	78 Å²	78	70.7 Å²	70.7	31%	0.306	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-21.2	-175.4	-61.3	-85.8	0	0	0	114	C327 G335 P338 F339 F381	C327-Y329 PolarHBondContact O-N 2.86Å; C327-Y329 PolarHBondContact SG-N 3.17Å; Y329-G335 CarbonylContact O-C 3.51Å; Y329-G335 VanDerWaalsContact O-C 3.29Å; Y329-G335 WeakPolarHBondContact O-CA 3.38Å; Y329-P338 HydrophobicContact CD1-CG 4.35Å; Y329-P338 HydrophobicContact CG-CG 4.47Å; Y329-F339 HydrophobicContact CD2-CD2 4.36Å; Y329-F339 AromaticContact CD2-CE2 3.7Å; Y329-F339 HydrophobicContact CD2-CE2 3.7Å; Y329-F339 AromaticContact CE2-CE2 3.69Å; Y329-F339 HydrophobicContact CE2-CE2 3.69Å; Y329-F339 HydrophobicContact CE2-CZ 4.34Å; Y329-F339 HydrophobicContact CG-CE2 4.39Å; Y329-F381 VanDerWaalsContact OH-CB 3.23Å; Y329-F381 WeakPolarHBondContact OH-CB 3.19Å; Y329-F381 WeakPolarHBondContact OH-CD1 3.48Å; Y329-F381 VanDerWaalsContact OH-CG 3.31Å; Y329-F381 WeakPolarHBondContact OH-CG 3.49Å
330	F	80.9	Confident	79.4	Confident	21 Å²	21	66.6 Å²	66.6	9%	0.092	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-33.4	176	-171.8	-110.3	0	0	0	111.5	C327 Q332 G333 K334 G335 C337 H347 Y349 A355	C327-F330 HydrophobicContact CB-CB 3.89Å; C327-F330 PolarHBondContact O-N 3.02Å; F330-Q332 VanDerWaalsContact C-N 3.26Å; F330-Q332 PolarHBondContact O-N 3.2Å; F330-Q332 VanDerWaalsContact O-N 3.11Å; F330-G333 VanDerWaalsContact CE1-N 3.3Å; F330-G333 WeakPolarHBondContact O-CA 3.48Å; F330-G333 PolarHBondContact O-N 3.25Å; F330-K334 PolarHBondContact O-N 2.86Å; F330-G335 WeakPolarHBondContact CA-O 3.27Å; F330-G335 PolarHBondContact O-N 2.81Å; F330-G335 VanDerWaalsContact O-N 3.12Å; F330-C337 HydrophobicContact CB-CB 4.41Å; F330-H347 HydrophobicContact CD1-CB 3.85Å; F330-H347 HydrophobicContact CD2-CB 4.3Å; F330-H347 HydrophobicContact CE1-CB 4.07Å; F330-H347 HydrophobicContact CE2-CB 4.5Å; F330-H347 HydrophobicContact CG-CB 3.97Å; F330-H347 AromaticContact CG-CD2 3.92Å; F330-H347 AromaticContact CG-CG 3.89Å; F330-H347 HydrophobicContact CZ-CB 4.4Å; F330-Y349 HydrophobicContact CE1-CD1 4.33Å; F330-Y349 HydrophobicContact CE1-CE1 4.36Å; F330-Y349 HydrophobicContact CZ-CD1 4.12Å; F330-Y349 AromaticContact CZ-CE1 3.7Å; F330-Y349 HydrophobicContact CZ-CE1 3.7Å; F330-Y349 HydrophobicContact CZ-CE2 4.33Å; F330-Y349 AromaticContact CZ-CZ 3.81Å; F330-A355 HydrophobicContact CE1-CB 4.06Å; F330-A355 HydrophobicContact CE2-CB 3.97Å; F330-A355 HydrophobicContact CZ-CB 3.46Å; F330-A355 VanDerWaalsContact CZ-CB 3.46Å
331	E	80.8	Confident	78.5	Confident	117 Å²	117	64.2 Å²	64.2	55%	0.547	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	41.3	52.1	176	-158.2	-177.4	-162.7	0	0	113.3	C327 G333 K334	C327-E331 PolarHBondContact O-N 3.24Å; E331-G333 VanDerWaalsContact C-N 3.3Å; E331-G333 PolarHBondContact O-N 2.86Å; E331-K334 HydrophobicContact CB-CB 4.33Å; E331-K334 HydrophobicContact CG-CD 4.38Å; E331-K334 WeakPolarHBondContact O-CB 3.33Å; E331-K334 WeakPolarHBondContact O-CG 3.37Å; E331-K334 PolarHBondContact O-N 3.12Å; E331-K334 VanDerWaalsContact O-N 3.15Å
332	Q	80.8	Confident	77.9	Confident	106 Å²	106	69.6 Å²	69.6	50%	0.495	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	56.5	37.4	-178.4	-58.5	171.5	-18.3	0	0	114.7	F330 K334 A348 P350	F330-Q332 VanDerWaalsContact C-N 3.26Å; F330-Q332 PolarHBondContact O-N 3.2Å; F330-Q332 VanDerWaalsContact O-N 3.11Å; Q332-K334 VanDerWaalsContact C-N 3.34Å; Q332-A348 VanDerWaalsContact CA-O 3.28Å; Q332-A348 WeakPolarHBondContact CA-O 3.24Å; Q332-P350 HydrophobicContact CB-CG 4.01Å; Q332-P350 VanDerWaalsContact O-CD 3.3Å; Q332-P350 WeakPolarHBondContact O-CD 3.22Å
333	G	76.1	Confident	77.5	Confident	38 Å²	38	69.6 Å²	69.6	39%	0.392	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	85.6	1.8	179.4	0	0	0	0	0	114.4	F330 E331 G335	F330-G333 VanDerWaalsContact CE1-N 3.3Å; F330-G333 WeakPolarHBondContact O-CA 3.48Å; F330-G333 PolarHBondContact O-N 3.25Å; E331-G333 VanDerWaalsContact C-N 3.3Å; E331-G333 PolarHBondContact O-N 2.86Å; G333-G335 VanDerWaalsContact C-N 3.35Å
334	K	76.6	Confident	77.2	Confident	158 Å²	158	69.1 Å²	69.1	69%	0.687	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-23.6	171.7	-61.1	175.7	-176	175.7	0	112.7	F330 E331 Q332	F330-K334 PolarHBondContact O-N 2.86Å; E331-K334 HydrophobicContact CB-CB 4.33Å; E331-K334 HydrophobicContact CG-CD 4.38Å; E331-K334 WeakPolarHBondContact O-CB 3.33Å; E331-K334 WeakPolarHBondContact O-CG 3.37Å; E331-K334 PolarHBondContact O-N 3.12Å; E331-K334 VanDerWaalsContact O-N 3.15Å; Q332-K334 VanDerWaalsContact C-N 3.34Å
335	G	75.3	Confident	77	Confident	24 Å²	24	64.4 Å²	64.4	25%	0.247	35%	0.347	C	S	.	.	S	Bend	trans	-126.1	150.5	-178.9	0	0	0	0	0	113.1	Y329 F330 G333	Y329-G335 CarbonylContact O-C 3.51Å; Y329-G335 VanDerWaalsContact O-C 3.29Å; Y329-G335 WeakPolarHBondContact O-CA 3.38Å; F330-G335 WeakPolarHBondContact CA-O 3.27Å; F330-G335 PolarHBondContact O-N 2.81Å; F330-G335 VanDerWaalsContact O-N 3.12Å; G333-G335 VanDerWaalsContact C-N 3.35Å
336	T	79.1	Confident	77.1	Confident	110 Å²	110	65 Å²	65	68%	0.675	35%	0.348	S	S	*	.			trans	-87	119.5	170	-52.2	0	0	0	0	109.4	P338	T336-P338 WeakPolarHBondContact O-CD 3.43Å
337	C	76	Confident	77.2	Confident	6 Å²	6	62.7 Å²	62.7	4%	0.041	32%	0.323	C	S	.	.			trans	-71.1	119.7	175.4	-177.9	0	0	0	0	110.5	C327 F330 F339 G340 H347	C327-C337 VanDerWaalsContact SG-SG 3.68Å; F330-C337 HydrophobicContact CB-CB 4.41Å; C337-F339 PolarHBondContact O-N 3.31Å; C337-F339 VanDerWaalsContact SG-CD2 3.59Å; C337-G340 PolarHBondContact O-N 3Å; C337-H347 WeakPolarHBondContact CB-CE1 3.32Å; C337-H347 WeakPolarHBondContact CB-NE2 3.29Å; C337-H347 VanDerWaalsContact SG-CE1 3.56Å; C337-H347 PolarHBondContact SG-NE2 3.12Å
338	P	70.3	Confident	77.3	Confident	60 Å²	60	63 Å²	63	39%	0.39	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-14.3	-178.3	27.7	-35.2	0	0	0	113.1	Y329 T336	Y329-P338 HydrophobicContact CD1-CG 4.35Å; Y329-P338 HydrophobicContact CG-CG 4.47Å; T336-P338 WeakPolarHBondContact O-CD 3.43Å
339	F	67.5	Low	77.3	Confident	11 Å²	11	60.7 Å²	60.7	5%	0.048	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-12.9	178.7	-44.2	-52.9	0	0	0	112.8	Y329 C337 S341 K342 C343 V376 R377 L378 F381	Y329-F339 HydrophobicContact CD2-CD2 4.36Å; Y329-F339 AromaticContact CD2-CE2 3.7Å; Y329-F339 HydrophobicContact CD2-CE2 3.7Å; Y329-F339 AromaticContact CE2-CE2 3.69Å; Y329-F339 HydrophobicContact CE2-CE2 3.69Å; Y329-F339 HydrophobicContact CE2-CZ 4.34Å; Y329-F339 HydrophobicContact CG-CE2 4.39Å; C337-F339 PolarHBondContact O-N 3.31Å; C337-F339 VanDerWaalsContact SG-CD2 3.59Å; F339-S341 PolarHBondContact O-N 3Å; F339-K342 WeakPolarHBondContact O-CA 3.23Å; F339-K342 WeakPolarHBondContact O-CB 3.46Å; F339-K342 PolarHBondContact O-N 2.73Å; F339-C343 HydrophobicContact CB-CB 4.05Å; F339-V376 WeakPolarHBondContact CD1-O 3.47Å; F339-V376 WeakPolarHBondContact CE1-O 3.38Å; F339-R377 WeakPolarHBondContact CE1-O 3.27Å; F339-L378 HydrophobicContact CB-CB 4.39Å; F339-L378 HydrophobicContact CB-CD1 4.35Å; F339-L378 HydrophobicContact CD1-CB 3.91Å; F339-L378 HydrophobicContact CD1-CD1 4.41Å; F339-L378 HydrophobicContact CD2-CB 4.31Å; F339-L378 HydrophobicContact CD2-CD1 3.28Å; F339-L378 HydrophobicContact CD2-CG 4.37Å; F339-L378 HydrophobicContact CE1-CB 4.34Å; F339-L378 VanDerWaalsContact CE1-N 3.32Å; F339-L378 HydrophobicContact CE2-CD1 3.6Å; F339-L378 HydrophobicContact CG-CB 3.91Å; F339-L378 HydrophobicContact CG-CD1 3.73Å; F339-L378 HydrophobicContact CG-CG 4.4Å; F339-L378 HydrophobicContact CZ-CD1 4.32Å; F339-F381 HydrophobicContact CZ-CD2 4.24Å
340	G	72.3	Confident	77.4	Confident	17 Å²	17	61 Å²	61	18%	0.175	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	47.8	-129.4	177.8	0	0	0	0	0	113.1	C337 K342 C343 H347	C337-G340 PolarHBondContact O-N 3Å; G340-K342 PolarHBondContact O-N 2.95Å; G340-C343 WeakPolarHBondContact O-CB 3.12Å; G340-C343 PolarHBondContact O-N 3.48Å; G340-H347 PolarHBondContact O-CE1 3.14Å
341	S	66.6	Low	77.2	Confident	70 Å²	70	66.5 Å²	66.5	49%	0.49	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-67.2	-6.1	176.5	43.9	0	0	0	0	115.5	F339 E358	F339-S341 PolarHBondContact O-N 3Å; S341-E358 PolarHBondContact OG-O 3.25Å
342	K	70.8	Confident	76.9	Confident	134 Å²	134	62.8 Å²	62.8	58%	0.583	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-100.6	9.2	173.8	-60.4	-169.2	176.9	-166.2	0	113.3	F339 G340	F339-K342 WeakPolarHBondContact O-CA 3.23Å; F339-K342 WeakPolarHBondContact O-CB 3.46Å; F339-K342 PolarHBondContact O-N 2.73Å; G340-K342 PolarHBondContact O-N 2.95Å
343	C	75.8	Confident	76.9	Confident	22 Å²	22	66.8 Å²	66.8	15%	0.149	36%	0.36	C	S	.	.			trans	-70.9	130.1	174.1	-164.6	0	0	0	0	111.1	C327 F339 G340 Y345 H347	C327-C343 VanDerWaalsContact SG-SG 3.7Å; F339-C343 HydrophobicContact CB-CB 4.05Å; G340-C343 WeakPolarHBondContact O-CB 3.12Å; G340-C343 PolarHBondContact O-N 3.48Å; C343-Y345 VanDerWaalsContact C-N 3.28Å; C343-Y345 PolarHBondContact SG-N 3.05Å; C343-H347 VanDerWaalsContact CB-CE1 3.46Å; C343-H347 WeakPolarHBondContact CB-CE1 3.34Å; C343-H347 WeakPolarHBondContact CB-NE2 3.49Å; C343-H347 PolarHBondContact SG-NE2 3.25Å
344	L	74.9	Confident	76.9	Confident	25 Å²	25	70.4 Å²	70.4	13%	0.131	37%	0.37	C	S	.	.			trans	-79.7	-9.6	173.2	-67	168.7	0	0	0	113	F297 F318 K319 M322 G323 L378	F297-L344 HydrophobicContact CD1-CD1 4.06Å; F297-L344 HydrophobicContact CE1-CD1 4.1Å; F297-L344 HydrophobicContact CE1-CD2 4.29Å; F297-L344 HydrophobicContact CE1-CG 4.41Å; F318-L344 HydrophobicContact CE1-CD1 4.26Å; K319-L344 HydrophobicContact CG-CD2 4.08Å; M322-L344 CarbonylContact C-O 3.51Å; M322-L344 HydrophobicContact CB-CB 3.91Å; M322-L344 WeakPolarHBondContact CB-O 3.34Å; M322-L344 HydrophobicContact CG-CB 4.37Å; G323-L344 WeakPolarHBondContact CA-O 3.42Å; G323-L344 PolarHBondContact N-O 3.17Å; G323-L344 VanDerWaalsContact N-O 3.07Å; L344-L378 HydrophobicContact CB-CD2 3.76Å; L344-L378 HydrophobicContact CD1-CD2 3.7Å; L344-L378 HydrophobicContact CG-CD2 3.56Å
345	Y	82.1	Confident	76.7	Confident	41 Å²	41	63.7 Å²	63.7	16%	0.161	34%	0.344	C	S	.	.	S	Bend	trans	-99.5	152.7	-175	-64.6	-70.2	0	0	0	112.3	M322 K325 C343 H347 L378	M322-Y345 HydrophobicContact CB-CD1 4.35Å; M322-Y345 HydrophobicContact CB-CE1 4.33Å; M322-Y345 HydrophobicContact CG-CE1 4.4Å; M322-Y345 HydrophobicContact SD-CD1 4.37Å; M322-Y345 HydrophobicContact SD-CE1 3.47Å; M322-Y345 WeakPolarHBondContact SD-CE1 3.47Å; K325-Y345 HydrophobicContact CB-CD1 4.11Å; K325-Y345 HydrophobicContact CB-CE1 4.47Å; C343-Y345 VanDerWaalsContact C-N 3.28Å; C343-Y345 PolarHBondContact SG-N 3.05Å; Y345-H347 PolarHBondContact O-N 3.26Å; Y345-H347 VanDerWaalsContact O-N 3.17Å; Y345-L378 HydrophobicContact CD2-CD1 4.13Å; Y345-L378 HydrophobicContact CE2-CD1 4.14Å
346	R	84.9	Confident	76.1	Confident	92 Å²	92	70.9 Å²	70.9	35%	0.347	37%	0.371	S	S	.	.	B	Isolated β-bridge	trans	-61.3	115.7	-179.1	-165.1	172.6	151.1	87.1	5.7	111.3	G323 K325 C327 A348 G352 L354	G323-R346 VanDerWaalsContact O-CB 3.29Å; G323-R346 WeakPolarHBondContact O-CB 3.23Å; K325-R346 WeakPolarHBondContact O-CB 3.28Å; K325-R346 PolarHBondContact O-N 3.17Å; C327-R346 WeakPolarHBondContact CB-O 3.46Å; C327-R346 PolarHBondContact N-O 2.93Å; R346-A348 HydrophobicContact CG-CB 4.07Å; R346-G352 PolarHBondContact NH2-O 3.14Å; R346-L354 HydrophobicContact CG-CD2 3.98Å
347	H	87	Confident	75.1	Confident	30 Å²	30	70.5 Å²	70.5	14%	0.139	37%	0.37	C	S	.	.			trans	-92.3	100	162.7	-64.4	174.5	0	0	0	108.2	C327 F330 C337 G340 C343 Y345 L354 A355	C327-H347 WeakPolarHBondContact CB-CD2 3.39Å; C327-H347 PolarHBondContact SG-NE2 2.96Å; C327-H347 VanDerWaalsContact SG-NE2 3.41Å; F330-H347 HydrophobicContact CD1-CB 3.85Å; F330-H347 HydrophobicContact CD2-CB 4.3Å; F330-H347 HydrophobicContact CE1-CB 4.07Å; F330-H347 HydrophobicContact CE2-CB 4.5Å; F330-H347 HydrophobicContact CG-CB 3.97Å; F330-H347 AromaticContact CG-CD2 3.92Å; F330-H347 AromaticContact CG-CG 3.89Å; F330-H347 HydrophobicContact CZ-CB 4.4Å; C337-H347 WeakPolarHBondContact CB-CE1 3.32Å; C337-H347 WeakPolarHBondContact CB-NE2 3.29Å; C337-H347 VanDerWaalsContact SG-CE1 3.56Å; C337-H347 PolarHBondContact SG-NE2 3.12Å; G340-H347 PolarHBondContact O-CE1 3.14Å; C343-H347 VanDerWaalsContact CB-CE1 3.46Å; C343-H347 WeakPolarHBondContact CB-CE1 3.34Å; C343-H347 WeakPolarHBondContact CB-NE2 3.49Å; C343-H347 PolarHBondContact SG-NE2 3.25Å; Y345-H347 PolarHBondContact O-N 3.26Å; Y345-H347 VanDerWaalsContact O-N 3.17Å; H347-L354 WeakPolarHBondContact O-CA 3.21Å; H347-L354 WeakPolarHBondContact O-CD2 3.37Å; H347-A355 HydrophobicContact CB-CB 3.81Å; H347-A355 PolarHBondContact O-N 2.91Å
348	A	85.9	Confident	74.1	Confident	14 Å²	14	76 Å²	76	12%	0.116	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-132.3	136.1	174.9	0	0	0	0	0	109.9	Q332 R346 R353 L354	Q332-A348 VanDerWaalsContact CA-O 3.28Å; Q332-A348 WeakPolarHBondContact CA-O 3.24Å; R346-A348 HydrophobicContact CG-CB 4.07Å; A348-R353 CarbonylContact C-O 3.43Å; A348-R353 VanDerWaalsContact CA-O 3.24Å; A348-R353 WeakPolarHBondContact CA-O 3.41Å; A348-L354 HydrophobicContact CB-CD2 4.32Å
349	Y	82.9	Confident	73.1	Confident	101 Å²	101	82.4 Å²	82.4	40%	0.396	42%	0.417	S	S	.	.			trans	-68.4	172.4	173.7	-68.3	-73.1	0	0	0	111.6	F330 D351 G352 R353 A355	F330-Y349 HydrophobicContact CE1-CD1 4.33Å; F330-Y349 HydrophobicContact CE1-CE1 4.36Å; F330-Y349 HydrophobicContact CZ-CD1 4.12Å; F330-Y349 AromaticContact CZ-CE1 3.7Å; F330-Y349 HydrophobicContact CZ-CE1 3.7Å; F330-Y349 HydrophobicContact CZ-CE2 4.33Å; F330-Y349 AromaticContact CZ-CZ 3.81Å; Y349-D351 PolarHBondContact O-N 3.2Å; Y349-G352 PolarHBondContact O-N 2.9Å; Y349-R353 HydrophobicContact CD2-CB 4.36Å; Y349-R353 WeakPolarHBondContact CD2-O 3.28Å; Y349-R353 PolarHBondContact N-O 2.93Å; Y349-A355 HydrophobicContact CD2-CB 4.47Å; Y349-A355 HydrophobicContact CE2-CB 3.76Å
350	P	78.8	Confident	72.3	Confident	84 Å²	84	86.3 Å²	86.3	55%	0.545	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-33.9	-179.9	-20.3	34.8	0	0	0	111.4	Q332 G352	Q332-P350 HydrophobicContact CB-CG 4.01Å; Q332-P350 VanDerWaalsContact O-CD 3.3Å; Q332-P350 WeakPolarHBondContact O-CD 3.22Å; P350-G352 PolarHBondContact O-N 2.94Å; P350-G352 VanDerWaalsContact O-N 3.09Å
351	D	77.1	Confident	71.3	Confident	136 Å²	136	96.4 Å²	96.4	73%	0.727	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	12.8	177.1	-44.5	-37.2	0	0	0	113.7	Y349 R353	Y349-D351 PolarHBondContact O-N 3.2Å; D351-R353 PolarHBondContact O-N 3.09Å
352	G	73.2	Confident	70.5	Confident	39 Å²	39	100 Å²	100	40%	0.402	48%	0.483	S	S	.	.	S	Bend	trans	71.6	-12.6	179.9	0	0	0	0	0	116	R346 Y349 P350 L354	R346-G352 PolarHBondContact NH2-O 3.14Å; Y349-G352 PolarHBondContact O-N 2.9Å; P350-G352 PolarHBondContact O-N 2.94Å; P350-G352 VanDerWaalsContact O-N 3.09Å; G352-L354 PolarHBondContact O-N 3.47Å
353	R	81.1	Confident	69.3	Low	191 Å²	191	99 Å²	99	72%	0.721	48%	0.481	S	S	*	.	P	Polyproline II helix	trans	-56.2	133.4	173.5	-69.3	-172.2	178.8	-149.5	0.5	110.7	A348 Y349 D351	A348-R353 CarbonylContact C-O 3.43Å; A348-R353 VanDerWaalsContact CA-O 3.24Å; A348-R353 WeakPolarHBondContact CA-O 3.41Å; Y349-R353 HydrophobicContact CD2-CB 4.36Å; Y349-R353 WeakPolarHBondContact CD2-O 3.28Å; Y349-R353 PolarHBondContact N-O 2.93Å; D351-R353 PolarHBondContact O-N 3.09Å
354	L	77.4	Confident	67.6	Low	113 Å²	113	103.6 Å²	103.6	59%	0.592	50%	0.503	S	S	*	.	B	Isolated β-bridge	trans	-71.9	141.9	173.3	-72.4	171.1	0	0	0	110.3	R346 H347 A348 G352	R346-L354 HydrophobicContact CG-CD2 3.98Å; H347-L354 WeakPolarHBondContact O-CA 3.21Å; H347-L354 WeakPolarHBondContact O-CD2 3.37Å; A348-L354 HydrophobicContact CB-CD2 4.32Å; G352-L354 PolarHBondContact O-N 3.47Å
355	A	71.4	Confident	66.4	Low	18 Å²	18	104 Å²	104	15%	0.149	51%	0.508	C	S	.	.	P	Polyproline II helix	trans	-75.5	135	171.1	0	0	0	0	0	110.1	F330 H347 Y349	F330-A355 HydrophobicContact CE1-CB 4.06Å; F330-A355 HydrophobicContact CE2-CB 3.97Å; F330-A355 HydrophobicContact CZ-CB 3.46Å; F330-A355 VanDerWaalsContact CZ-CB 3.46Å; H347-A355 HydrophobicContact CB-CB 3.81Å; H347-A355 PolarHBondContact O-N 2.91Å; Y349-A355 HydrophobicContact CD2-CB 4.47Å; Y349-A355 HydrophobicContact CE2-CB 3.76Å
356	E	62.8	Low	64.9	Low	175 Å²	175	108.3 Å²	108.3	82%	0.818	54%	0.544	S	S	*	.	P	Polyproline II helix	trans	-62.1	144.9	173.7	-67.3	-163.5	157.6	0	0	110.7	E358	E356-E358 PolarHBondContact O-N 2.87Å
357	P	59.3	Low	63.6	Low	101 Å²	101	112 Å²	112	66%	0.656	57%	0.566	S	S	*	*			trans	-64.8	105.7	177.9	25.7	-33.1	0	0	0	110.1	K359	P357-K359 PolarHBondContact O-N 2.82Å; P357-K359 VanDerWaalsContact O-N 3.16Å
358	E	54.5	Low	61.8	Low	123 Å²	123	113.1 Å²	113.1	58%	0.575	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-52.3	124.1	177.7	-73.9	-168	151.6	0	0	110.9	S341 E356	S341-E358 PolarHBondContact OG-O 3.25Å; E356-E358 PolarHBondContact O-N 2.87Å
359	K	48.9	Very low	59.7	Low	193 Å²	193	115.9 Å²	115.9	84%	0.839	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-63.9	135.3	173	-66.8	174.7	-177.5	170.9	0	108.2	P357 R361	P357-K359 PolarHBondContact O-N 2.82Å; P357-K359 VanDerWaalsContact O-N 3.16Å; K359-R361 PolarHBondContact O-N 3.1Å; K359-R361 VanDerWaalsContact O-N 3.11Å
360	P	51.5	Low	57.9	Low	93 Å²	93	114 Å²	114	60%	0.604	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-56.4	120.4	-174.7	18.6	-30.3	0	0	0	111.4	K362	P360-K362 PolarHBondContact O-N 3.36Å
361	R	49.7	Very low	56.2	Low	230 Å²	230	118.5 Å²	118.5	87%	0.868	61%	0.605	S	S	*	*			trans	-65.7	106.2	-174.3	-164.8	173.4	-173.2	134.3	-1.6	110.1	K359 Q363	K359-R361 PolarHBondContact O-N 3.1Å; K359-R361 VanDerWaalsContact O-N 3.11Å; R361-Q363 PolarHBondContact O-N 3.21Å
362	K	49.9	Very low	54.6	Low	146 Å²	146	117.5 Å²	117.5	64%	0.635	60%	0.595	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77.4	113.6	173.2	-66.8	-179.4	-177.4	-178.3	0	108.7	P360 V370 F372	P360-K362 PolarHBondContact O-N 3.36Å; K362-V370 HydrophobicContact CB-CG1 3.94Å; K362-V370 HydrophobicContact CD-CG1 4.28Å; K362-V370 HydrophobicContact CG-CG1 4.01Å; K362-F372 HydrophobicContact CD-CE1 4.3Å; K362-F372 HydrophobicContact CD-CZ 4.38Å; K362-F372 HydrophobicContact CG-CD1 4.26Å; K362-F372 HydrophobicContact CG-CE1 3.67Å; K362-F372 HydrophobicContact CG-CZ 4.13Å
363	Q	46.8	Very low	53	Low	113 Å²	113	123.4 Å²	123.4	53%	0.528	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-93.7	111.6	167.1	-174.1	170.2	-12.6	0	0	108.8	R361 R371	R361-Q363 PolarHBondContact O-N 3.21Å; Q363-R371 PolarHBondContact N-O 2.81Å; Q363-R371 VanDerWaalsContact N-O 3.11Å; Q363-R371 PolarHBondContact O-N 3.26Å
364	L	39.6	Very low	51.1	Low	117 Å²	117	121.3 Å²	121.3	61%	0.613	61%	0.612	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-78.1	122.6	171.3	-162.5	69.5	0	0	0	108.1	V370	L364-V370 HydrophobicContact CD1-CG2 3.6Å
365	S	48.8	Very low	49.2	Very low	33 Å²	33	118.1 Å²	118.1	23%	0.231	60%	0.6	C	S	.	*			trans	-70.9	161	169.5	77.1	0	0	0	0	110.3	Q367 G368 T369	S365-Q367 PolarHBondContact O-N 2.77Å; S365-Q367 PolarHBondContact OG-N 3.09Å; S365-G368 PolarHBondContact O-N 3.5Å; S365-T369 PolarHBondContact N-O 3.05Å; S365-T369 WeakPolarHBondContact OG-CB 3.31Å; S365-T369 PolarHBondContact OG-N 3.11Å; S365-T369 VanDerWaalsContact OG-N 3.09Å; S365-T369 PolarHBondContact OG-O 2.86Å; S365-T369 PolarHBondContact OG-OG1 3.43Å
366	S	50.7	Low	48.1	Very low	133 Å²	133	121 Å²	121	93%	0.93	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-7.6	170.2	47.8	0	0	0	0	114.1
367	Q	57.7	Low	47.6	Very low	170 Å²	170	116.5 Å²	116.5	79%	0.794	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	17.9	174.2	-61.6	-179.1	2	0	0	112.5	S365 T369	S365-Q367 PolarHBondContact O-N 2.77Å; S365-Q367 PolarHBondContact OG-N 3.09Å; Q367-T369 PolarHBondContact O-N 3.3Å; Q367-T369 VanDerWaalsContact O-N 3.13Å
368	G	50.3	Low	47.1	Very low	52 Å²	52	112.3 Å²	112.3	54%	0.536	56%	0.563	S	S	.	*	S	Bend	trans	72.3	1.5	178.2	0	0	0	0	0	115.2	S365 V370	S365-G368 PolarHBondContact O-N 3.5Å; G368-V370 PolarHBondContact O-N 2.81Å
369	T	40.1	Very low	46.8	Very low	72 Å²	72	108.6 Å²	108.6	44%	0.442	54%	0.544	S	S	.	.			trans	-76.7	115.8	176.7	-40.1	0	0	0	0	110	S365 Q367 R371	S365-T369 PolarHBondContact N-O 3.05Å; S365-T369 WeakPolarHBondContact OG-CB 3.31Å; S365-T369 PolarHBondContact OG-N 3.11Å; S365-T369 VanDerWaalsContact OG-N 3.09Å; S365-T369 PolarHBondContact OG-O 2.86Å; S365-T369 PolarHBondContact OG-OG1 3.43Å; Q367-T369 PolarHBondContact O-N 3.3Å; Q367-T369 VanDerWaalsContact O-N 3.13Å; T369-R371 PolarHBondContact O-N 3.42Å; T369-R371 VanDerWaalsContact O-N 3.12Å
370	V	45.5	Very low	46.7	Very low	63 Å²	63	103.5 Å²	103.5	38%	0.382	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	103.3	170.1	179.8	0	0	0	0	109	K362 L364 G368 F372	K362-V370 HydrophobicContact CB-CG1 3.94Å; K362-V370 HydrophobicContact CD-CG1 4.28Å; K362-V370 HydrophobicContact CG-CG1 4.01Å; L364-V370 HydrophobicContact CD1-CG2 3.6Å; G368-V370 PolarHBondContact O-N 2.81Å; V370-F372 HydrophobicContact CG1-CD2 4.05Å; V370-F372 HydrophobicContact CG1-CE2 3.71Å; V370-F372 HydrophobicContact CG1-CZ 4.01Å
371	R	43.7	Very low	46.4	Very low	177 Å²	177	104.4 Å²	104.4	67%	0.668	52%	0.52	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	108.9	166.6	-69.5	-173.1	178.6	174.4	0.6	108.4	Q363 T369	Q363-R371 PolarHBondContact N-O 2.81Å; Q363-R371 VanDerWaalsContact N-O 3.11Å; Q363-R371 PolarHBondContact O-N 3.26Å; T369-R371 PolarHBondContact O-N 3.42Å; T369-R371 VanDerWaalsContact O-N 3.12Å
372	F	43.9	Very low	46.6	Very low	115 Å²	115	94.5 Å²	94.5	50%	0.504	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	123.5	157.6	-63.1	-89.1	0	0	0	106.8	K362 V370 N374	K362-F372 HydrophobicContact CD-CE1 4.3Å; K362-F372 HydrophobicContact CD-CZ 4.38Å; K362-F372 HydrophobicContact CG-CD1 4.26Å; K362-F372 HydrophobicContact CG-CE1 3.67Å; K362-F372 HydrophobicContact CG-CZ 4.13Å; V370-F372 HydrophobicContact CG1-CD2 4.05Å; V370-F372 HydrophobicContact CG1-CE2 3.71Å; V370-F372 HydrophobicContact CG1-CZ 4.01Å; F372-N374 PolarHBondContact O-N 3.35Å
373	F	40.2	Very low	46.4	Very low	164 Å²	164	93.6 Å²	93.6	72%	0.719	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-61.3	124.8	167.5	-103.9	-91	0	0	0	108.1	S375	F373-S375 PolarHBondContact O-N 3.44Å
374	N	40	Very low	45.9	Very low	146 Å²	146	92.3 Å²	92.3	78%	0.781	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-54.9	119.1	171	-88.2	-20	0	0	0	107.6	F372 V376	F372-N374 PolarHBondContact O-N 3.35Å; N374-V376 PolarHBondContact O-N 3.07Å
375	S	38.1	Very low	46.3	Very low	47 Å²	47	92.8 Å²	92.8	33%	0.329	47%	0.473	S	S	.	.			trans	-53.3	109.5	174.8	59.7	0	0	0	0	108.3	F373 R377	F373-S375 PolarHBondContact O-N 3.44Å; S375-R377 VanDerWaalsContact O-CG 3.31Å; S375-R377 WeakPolarHBondContact O-CG 3.45Å; S375-R377 PolarHBondContact O-N 3.49Å; S375-R377 PolarHBondContact OG-NE 3.25Å
376	V	47.8	Very low	46	Very low	78 Å²	78	94.3 Å²	94.3	47%	0.473	48%	0.476	S	S	.	.			trans	-56.2	126.7	161.5	177.6	0	0	0	0	105	F339 N374 F381	F339-V376 WeakPolarHBondContact CD1-O 3.47Å; F339-V376 WeakPolarHBondContact CE1-O 3.38Å; N374-V376 PolarHBondContact O-N 3.07Å; V376-F381 HydrophobicContact CG1-CE2 4.42Å
377	R	53.3	Low	45.4	Very low	80 Å²	80	91.7 Å²	91.7	30%	0.302	46%	0.458	S	S	.	.			trans	-100.1	140	-156.6	-91.2	142.2	178.3	-155.8	1	110.9	N282 F339 S375 W379 D380	N282-R377 PolarHBondContact OD1-NH1 3.38Å; F339-R377 WeakPolarHBondContact CE1-O 3.27Å; S375-R377 VanDerWaalsContact O-CG 3.31Å; S375-R377 WeakPolarHBondContact O-CG 3.45Å; S375-R377 PolarHBondContact O-N 3.49Å; S375-R377 PolarHBondContact OG-NE 3.25Å; R377-W379 PolarHBondContact O-N 3.17Å; R377-D380 PolarHBondContact N-OD2 3.36Å; R377-D380 PolarHBondContact O-N 2.88Å
378	L	48.8	Very low	44.4	Very low	14 Å²	14	92.8 Å²	92.8	7%	0.073	46%	0.455	C	S	.	.	G	3₁₀ helix	trans	-50.1	-25.2	-171.1	-179.1	63.4	0	0	0	114.9	F339 L344 Y345 I382	F339-L378 HydrophobicContact CB-CB 4.39Å; F339-L378 HydrophobicContact CB-CD1 4.35Å; F339-L378 HydrophobicContact CD1-CB 3.91Å; F339-L378 HydrophobicContact CD1-CD1 4.41Å; F339-L378 HydrophobicContact CD2-CB 4.31Å; F339-L378 HydrophobicContact CD2-CD1 3.28Å; F339-L378 HydrophobicContact CD2-CG 4.37Å; F339-L378 HydrophobicContact CE1-CB 4.34Å; F339-L378 VanDerWaalsContact CE1-N 3.32Å; F339-L378 HydrophobicContact CE2-CD1 3.6Å; F339-L378 HydrophobicContact CG-CB 3.91Å; F339-L378 HydrophobicContact CG-CD1 3.73Å; F339-L378 HydrophobicContact CG-CG 4.4Å; F339-L378 HydrophobicContact CZ-CD1 4.32Å; L344-L378 HydrophobicContact CB-CD2 3.76Å; L344-L378 HydrophobicContact CD1-CD2 3.7Å; L344-L378 HydrophobicContact CG-CD2 3.56Å; Y345-L378 HydrophobicContact CD2-CD1 4.13Å; Y345-L378 HydrophobicContact CE2-CD1 4.14Å; L378-I382 HydrophobicContact CG-CD1 4.08Å; L378-I382 WeakPolarHBondContact O-CG1 3.45Å
379	W	47.5	Very low	43.6	Very low	44 Å²	44	98 Å²	98	17%	0.167	47%	0.465	C	S	.	.	G	3₁₀ helix	trans	-84.4	-16.7	-176.8	-73	99.1	0	0	0	115.4	F297 V298 F318 R377 F381 I382	F297-W379 AromaticContact CD1-NE1 3.61Å; V298-W379 WeakPolarHBondContact O-CH2 3.37Å; V298-W379 WeakPolarHBondContact O-CZ2 3.34Å; F318-W379 HydrophobicContact CZ-CH2 4.36Å; R377-W379 PolarHBondContact O-N 3.17Å; W379-F381 PolarHBondContact O-N 3.36Å; W379-I382 HydrophobicContact CD2-CD1 3.63Å; W379-I382 HydrophobicContact CE3-CB 3.99Å; W379-I382 HydrophobicContact CE3-CD1 3.5Å; W379-I382 HydrophobicContact CE3-CG1 4.28Å; W379-I382 HydrophobicContact CE3-CG2 4.09Å; W379-I382 HydrophobicContact CG-CD1 4.32Å; W379-I382 HydrophobicContact CH2-CD1 3.9Å; W379-I382 HydrophobicContact CZ2-CD1 4.02Å; W379-I382 HydrophobicContact CZ3-CB 4.13Å; W379-I382 HydrophobicContact CZ3-CD1 3.65Å; W379-I382 HydrophobicContact CZ3-CG1 4.46Å; W379-I382 HydrophobicContact CZ3-CG2 3.71Å
380	D	45.8	Very low	43.2	Very low	87 Å²	87	100 Å²	100	47%	0.465	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-64.5	-8.5	175.5	-60.2	-32.3	0	0	0	112.5	R377	R377-D380 PolarHBondContact N-OD2 3.36Å; R377-D380 PolarHBondContact O-N 2.88Å
381	F	46.3	Very low	42.4	Very low	111 Å²	111	102.1 Å²	102.1	49%	0.487	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-136.4	7.6	-171	-72.8	-81.3	0	0	0	116.2	Y329 F339 V376 W379 E383	Y329-F381 VanDerWaalsContact OH-CB 3.23Å; Y329-F381 WeakPolarHBondContact OH-CB 3.19Å; Y329-F381 WeakPolarHBondContact OH-CD1 3.48Å; Y329-F381 VanDerWaalsContact OH-CG 3.31Å; Y329-F381 WeakPolarHBondContact OH-CG 3.49Å; F339-F381 HydrophobicContact CZ-CD2 4.24Å; V376-F381 HydrophobicContact CG1-CE2 4.42Å; W379-F381 PolarHBondContact O-N 3.36Å; F381-E383 PolarHBondContact O-N 3.36Å
382	I	52.8	Low	42	Very low	22 Å²	22	100 Å²	100	11%	0.113	49%	0.494	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-5.5	-178.5	-79.7	168.1	0	0	0	113.4	L378 W379 N384	L378-I382 HydrophobicContact CG-CD1 4.08Å; L378-I382 WeakPolarHBondContact O-CG1 3.45Å; W379-I382 HydrophobicContact CD2-CD1 3.63Å; W379-I382 HydrophobicContact CE3-CB 3.99Å; W379-I382 HydrophobicContact CE3-CD1 3.5Å; W379-I382 HydrophobicContact CE3-CG1 4.28Å; W379-I382 HydrophobicContact CE3-CG2 4.09Å; W379-I382 HydrophobicContact CG-CD1 4.32Å; W379-I382 HydrophobicContact CH2-CD1 3.9Å; W379-I382 HydrophobicContact CZ2-CD1 4.02Å; W379-I382 HydrophobicContact CZ3-CB 4.13Å; W379-I382 HydrophobicContact CZ3-CD1 3.65Å; W379-I382 HydrophobicContact CZ3-CG1 4.46Å; W379-I382 HydrophobicContact CZ3-CG2 3.71Å; I382-N384 VanDerWaalsContact C-N 3.29Å; I382-N384 PolarHBondContact O-N 3.31Å
383	E	46.6	Very low	41.2	Very low	128 Å²	128	101.1 Å²	101.1	60%	0.598	51%	0.505	S	S	*	.	H	α-helix	trans	-64.2	-25.9	176.7	-66.9	-173	147.9	0	0	114.7	F381 R385 S387	F381-E383 PolarHBondContact O-N 3.36Å; E383-R385 VanDerWaalsContact C-N 3.34Å; E383-R385 PolarHBondContact O-N 3.36Å; E383-S387 PolarHBondContact O-OG 3.01Å
384	N	37.4	Very low	41	Very low	85 Å²	85	100.1 Å²	100.1	46%	0.455	50%	0.503	S	S	.	.	H	α-helix	trans	-89.1	11.3	-163.8	-148.7	95.3	0	0	0	115.3	I382	I382-N384 VanDerWaalsContact C-N 3.29Å; I382-N384 PolarHBondContact O-N 3.31Å
385	R	47	Very low	41	Very low	127 Å²	127	100.9 Å²	100.9	48%	0.479	51%	0.507	S	S	.	.	H	α-helix	trans	-113.5	-46.1	177.3	-177.2	179	176.8	133.2	9.3	113.6	E383 S387 R388	E383-R385 VanDerWaalsContact C-N 3.34Å; E383-R385 PolarHBondContact O-N 3.36Å; R385-S387 VanDerWaalsContact C-N 3.26Å; R385-S387 PolarHBondContact O-N 2.87Å; R385-R388 PolarHBondContact O-N 3.2Å
386	E	42.4	Very low	40.8	Very low	66 Å²	66	104.9 Å²	104.9	31%	0.308	53%	0.529	S	S	.	.	H	α-helix	trans	-67.7	-31.6	-179.6	-69.6	178.3	-167.7	0	0	111.7	R255 R272 R388	R255-E386 IonicContact CZ-OE2 3.26Å; R255-E386 IonicContact NH1-OE1 2.73Å; R255-E386 IonicContact NH1-OE2 3.58Å; R255-E386 PolarHBondContact NH1-OE2 3.32Å; R255-E386 IonicContact NH2-OE2 3.01Å; R255-E386 PolarHBondContact NH2-OE2 2.87Å; R272-E386 IonicContact CZ-OE1 2.74Å; R272-E386 IonicContact CZ-OE2 3.71Å; R272-E386 IonicContact NH1-OE1 3.5Å; R272-E386 IonicContact NH1-OE2 3.74Å; R272-E386 PolarHBondContact NH1-OE2 2.85Å; R272-E386 VanDerWaalsContact NH2-CD 3.3Å; R272-E386 IonicContact NH2-OE1 3.52Å; R272-E386 PolarHBondContact NH2-OE1 2.86Å; R272-E386 IonicContact NH2-OE2 2.77Å; R272-E386 PolarHBondContact NH2-OE2 2.8Å; E386-R388 PolarHBondContact O-N 3.48Å
387	S	37.6	Very low	40.3	Very low	78 Å²	78	106.9 Å²	106.9	55%	0.545	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-9.1	174.9	46.9	0	0	0	0	115.5	E383 R385	E383-S387 PolarHBondContact O-OG 3.01Å; R385-S387 VanDerWaalsContact C-N 3.26Å; R385-S387 PolarHBondContact O-N 2.87Å
388	R	37.4	Very low	39.6	Very low	192 Å²	192	111 Å²	111	73%	0.725	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.6	10.4	-175.8	-67.5	-171.1	-179.7	-118.4	-2.4	114.8	R385 E386	R385-R388 PolarHBondContact O-N 3.2Å; E386-R388 PolarHBondContact O-N 3.48Å
389	H	32.4	Very low	39.2	Very low	162 Å²	162	114.6 Å²	114.6	75%	0.75	58%	0.584	S	S	*	*	S	Bend	trans	-96.5	3.1	172.2	-130.8	-60	0	0	0	114.1
390	V	32.7	Very low	38.8	Very low	113 Å²	113	120.3 Å²	120.3	69%	0.685	61%	0.613	S	S	*	*	S	Bend	trans	-108.6	115.2	166.2	-174.4	0	0	0	0	106.3	N392	V390-N392 PolarHBondContact O-N 3.26Å
391	P	28.8	Very low	38.4	Very low	108 Å²	108	121.6 Å²	121.6	70%	0.701	62%	0.619	S	S	*	*			trans	-61.7	127.3	160.1	-8.1	23.4	0	0	0	106.7	N393	P391-N393 VanDerWaalsContact C-N 3.35Å; P391-N393 PolarHBondContact O-N 2.9Å
392	N	34	Very low	38	Very low	132 Å²	132	118.3 Å²	118.3	71%	0.706	62%	0.616	S	S	*	*			trans	-61.8	101.1	171.9	-170.1	65.5	0	0	0	107.8	V390 E394	V390-N392 PolarHBondContact O-N 3.26Å; N392-E394 PolarHBondContact ND2-OE1 3.37Å
393	N	28.4	Very low	37.4	Very low	139 Å²	139	121.8 Å²	121.8	74%	0.743	64%	0.635	S	S	*	*			trans	-127.9	102.9	174.9	-145.5	29.1	0	0	0	105.4	P391	P391-N393 VanDerWaalsContact C-N 3.35Å; P391-N393 PolarHBondContact O-N 2.9Å
394	E	36.6	Very low	36.8	Very low	143 Å²	143	121.5 Å²	121.5	67%	0.668	64%	0.637	S	S	*	*			trans	-69.6	138.5	-176.4	-68.3	149.1	-171.5	0	0	108.9	N392	N392-E394 PolarHBondContact ND2-OE1 3.37Å
395	D	40	Very low	36.8	Very low	163 Å²	163	125.1 Å²	125.1	87%	0.872	65%	0.649	S	S	*	*			trans	45.5	84.3	167.4	-56	-40.8	0	0	0	118.1
396	V	33.9	Very low	36.9	Very low	130 Å²	130	125.8 Å²	125.8	79%	0.788	66%	0.659	S	S	*	*			trans	-131.5	126.3	150	-167.5	0	0	0	0	109.6
397	D	35.7	Very low	37	Very low	120 Å²	120	130.3 Å²	130.3	64%	0.642	68%	0.68	S	S	*	*			trans	-59.2	130.2	-165.3	-159.9	-24.2	0	0	0	114.2	T399	D397-T399 VanDerWaalsContact C-N 3.29Å; D397-T399 WeakPolarHBondContact OD1-CB 3.42Å; D397-T399 PolarHBondContact OD1-N 2.85Å; D397-T399 PolarHBondContact OD1-OG1 3.42Å
398	M	39.4	Very low	37	Very low	167 Å²	167	133.9 Å²	133.9	82%	0.823	69%	0.692	S	S	*	*	S	Bend	trans	-86.4	2.4	179.1	-121.5	-77.8	-165.8	0	0	112.8
399	T	40.4	Very low	37	Very low	90 Å²	90	128.5 Å²	128.5	55%	0.552	68%	0.684	S	S	*	*	S	Bend	trans	-81.6	-35.7	-177	-45.7	0	0	0	0	112.3	D397 L401 G402	D397-T399 VanDerWaalsContact C-N 3.29Å; D397-T399 WeakPolarHBondContact OD1-CB 3.42Å; D397-T399 PolarHBondContact OD1-N 2.85Å; D397-T399 PolarHBondContact OD1-OG1 3.42Å; T399-L401 PolarHBondContact O-N 3.28Å; T399-L401 VanDerWaalsContact O-N 3.14Å; T399-G402 PolarHBondContact O-N 2.81Å
400	E	39.6	Very low	37	Very low	163 Å²	163	124.6 Å²	124.6	76%	0.762	69%	0.688	S	S	*	*	H	α-helix	trans	-70.6	-13.2	-171	-132.7	-178.6	-164	0	0	114.7
401	L	36.7	Very low	37	Very low	114 Å²	114	125.2 Å²	125.2	60%	0.597	69%	0.692	S	S	*	*	H	α-helix	trans	-92.6	-14.8	-179.4	-145.9	74.6	0	0	0	113.7	T399	T399-L401 PolarHBondContact O-N 3.28Å; T399-L401 VanDerWaalsContact O-N 3.14Å
402	G	39.2	Very low	37.4	Very low	42 Å²	42	129.3 Å²	129.3	43%	0.433	70%	0.701	S	S	.	*	H	α-helix	trans	-76.2	-43.9	173.4	0	0	0	0	0	112.2	T399 L404 F405 M406	T399-G402 PolarHBondContact O-N 2.81Å; G402-L404 VanDerWaalsContact C-N 3.28Å; G402-L404 PolarHBondContact O-N 2.84Å; G402-F405 PolarHBondContact O-N 3.42Å; G402-F405 VanDerWaalsContact O-N 3.1Å; G402-M406 PolarHBondContact O-N 2.92Å
403	D	38.4	Very low	37.3	Very low	95 Å²	95	128.5 Å²	128.5	51%	0.508	71%	0.706	S	S	.	*	H	α-helix	trans	-64.6	-31	-176.5	-68.5	-19.9	0	0	0	112.9	F405 M406 H407	D403-F405 PolarHBondContact O-N 3Å; D403-M406 PolarHBondContact O-N 2.83Å; D403-H407 PolarHBondContact O-N 3Å; D403-H407 PolarHBondContact O-ND1 3.2Å
404	L	35.4	Very low	37.8	Very low	123 Å²	123	126.6 Å²	126.6	64%	0.644	70%	0.704	S	S	*	*	H	α-helix	trans	-68.9	-21	177.8	-165.8	64.2	0	0	0	113.1	G402	G402-L404 VanDerWaalsContact C-N 3.28Å; G402-L404 PolarHBondContact O-N 2.84Å
405	F	36	Very low	37.6	Very low	160 Å²	160	128.3 Å²	128.3	70%	0.702	71%	0.712	S	S	*	*	H	α-helix	trans	-85	-36.4	176.4	-166.9	-105.5	0	0	0	112	G402 D403 H407 L408	G402-F405 PolarHBondContact O-N 3.42Å; G402-F405 VanDerWaalsContact O-N 3.1Å; D403-F405 PolarHBondContact O-N 3Å; F405-H407 PolarHBondContact O-N 3.08Å; F405-L408 PolarHBondContact O-N 2.96Å
406	M	49.6	Very low	38	Very low	141 Å²	141	129.8 Å²	129.8	70%	0.695	73%	0.731	S	S	*	*	H	α-helix	trans	-64.9	-34.5	177.4	-75.7	-77	-77.7	0	0	113.1	G402 D403 L408 S409	G402-M406 PolarHBondContact O-N 2.92Å; D403-M406 PolarHBondContact O-N 2.83Å; M406-L408 PolarHBondContact O-N 3.17Å; M406-S409 PolarHBondContact O-N 3.13Å
407	H	44.1	Very low	38.2	Very low	162 Å²	162	129.8 Å²	129.8	75%	0.75	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-1.6	-178.7	-72	85.7	0	0	0	115	D403 F405	D403-H407 PolarHBondContact O-N 3Å; D403-H407 PolarHBondContact O-ND1 3.2Å; F405-H407 PolarHBondContact O-N 3.08Å
408	L	37.6	Very low	38.3	Very low	152 Å²	152	130.3 Å²	130.3	80%	0.796	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-1.8	173.3	-75.2	163.8	0	0	0	113	F405 M406	F405-L408 PolarHBondContact O-N 2.96Å; M406-L408 PolarHBondContact O-N 3.17Å
409	S	37.7	Very low	38.3	Very low	79 Å²	79	128.3 Å²	128.3	55%	0.552	73%	0.727	S	S	*	*			trans	-103.7	67.2	176	-59.1	0	0	0	0	110.7	M406 V411	M406-S409 PolarHBondContact O-N 3.13Å; S409-V411 PolarHBondContact O-N 3.31Å
410	G	33.6	Very low	38.2	Very low	81 Å²	81	130.5 Å²	130.5	84%	0.835	74%	0.737	S	S	*	*			trans	-65	100.3	177.4	0	0	0	0	0	112.2
411	V	32.5	Very low	38.1	Very low	125 Å²	125	128.5 Å²	128.5	76%	0.758	74%	0.736	S	S	*	*			trans	-116.1	104.2	163	-179.8	0	0	0	0	106.6	S409 S413	S409-V411 PolarHBondContact O-N 3.31Å; V411-S413 PolarHBondContact O-N 3.49Å
412	E	36.7	Very low	38.2	Very low	194 Å²	194	129.5 Å²	129.5	91%	0.907	75%	0.745	S	S	*	*			trans	-66.6	118.4	167.2	-72.6	-175	126	0	0	108.5
413	S	33	Very low	38.1	Very low	115 Å²	115	135.7 Å²	135.7	80%	0.804	77%	0.767	S	S	*	*			trans	-116.4	94.3	164.6	55	0	0	0	0	107.9	V411	V411-S413 PolarHBondContact O-N 3.49Å
414	S	36.9	Very low	38.1	Very low	99 Å²	99	138.8 Å²	138.8	69%	0.692	79%	0.787	S	S	*	*			trans	-82.4	138.3	176.9	50.9	0	0	0	0	112.2
415	E	32.8	Very low	38.3	Very low	179 Å²	179	140.2 Å²	140.2	84%	0.836	80%	0.799	S	S	*	*			trans	72.9	156.3	154.8	-74.3	-177.1	153.5	0	0	117.1
416	P	49.1	Very low	38.5	Very low	195 Å²	195	138.4 Å²	138.4	100%	1.266	81%	0.808	S	S	*	*			cis	-97.1	0	17.1	39.8	-35.9	0	0	0	117

Retrieved 416 of 416 residues in 223.5 ms (Link to these results)

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