A0A087X0S7_HUMAN Loading...

Leucine rich repeat containing 41

AlphaFold DB , UniProt , Accession A0A087X0S7, Species HUMAN (Homo sapiens, Human), Gene LRRC41, Length 521 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	33.6	Very low	30.9	Very low	251 Å²	251	151.4 Å²	151.4	100%	1.236	88%	0.878	S	S	*	*				0	126.2	0	-71.2	178.9	173.3	0	0	106.6
2	E	28.9	Very low	31	Very low	203 Å²	203	155 Å²	155	95%	0.949	88%	0.876	S	S	*	*			trans	-109.8	168.1	-167.7	-68.9	170.3	107.5	0	0	112.1
3	A	32.3	Very low	30.9	Very low	85 Å²	85	152.5 Å²	152.5	70%	0.702	88%	0.875	S	S	*	*			trans	-127.7	150.5	172	0	0	0	0	0	110.6
4	T	34.8	Very low	31.6	Very low	136 Å²	136	149.7 Å²	149.7	83%	0.834	87%	0.869	S	S	*	*			trans	54.9	115.9	159.9	53	0	0	0	0	119.4
5	S	29.8	Very low	32	Very low	126 Å²	126	146.3 Å²	146.3	88%	0.881	87%	0.865	S	S	*	*				-152.1	150.1	104	-82.3	0	0	0	0	111.8
6	R	35.6	Very low	32	Very low	252 Å²	252	144.1 Å²	144.1	95%	0.951	86%	0.859	S	S	*	*			trans	-114.4	136.4	173	-93.5	176.5	159.2	171.6	-6.5	107.7
7	E	28.6	Very low	32	Very low	204 Å²	204	138.5 Å²	138.5	95%	0.953	84%	0.838	S	S	*	*			trans	-131.8	157.1	158.8	-156.3	165.4	135.2	0	0	110
8	A	30.1	Very low	32.7	Very low	95 Å²	95	138.4 Å²	138.4	79%	0.785	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-102.4	142.6	-158.2	0	0	0	0	0	114.2
9	A	28	Very low	33.1	Very low	90 Å²	90	139.6 Å²	139.6	74%	0.744	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-78.8	146.5	166.4	0	0	0	0	0	111
10	P	30.6	Very low	34.2	Very low	123 Å²	123	135.5 Å²	135.5	80%	0.799	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-67.5	139.9	-178.6	27.4	-34.7	0	0	0	112.3	K12	P10-K12 PolarHBondContact O-N 3.22Å
11	A	27.9	Very low	35.6	Very low	100 Å²	100	134.5 Å²	134.5	83%	0.826	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-68.6	128	-174	0	0	0	0	0	112.9	S13	A11-S13 PolarHBondContact O-N 2.98Å
12	K	31.9	Very low	37.4	Very low	195 Å²	195	125.1 Å²	125.1	85%	0.848	78%	0.778	S	S	*	*			trans	-76.8	112.1	164.5	-68.1	177.1	179.1	175.8	0	108.9	P10 S14	P10-K12 PolarHBondContact O-N 3.22Å; K12-S14 VanDerWaalsContact C-N 3.25Å; K12-S14 PolarHBondContact O-N 3.18Å
13	S	30	Very low	40.1	Very low	123 Å²	123	118.2 Å²	118.2	86%	0.86	76%	0.756	S	S	*	*			trans	-78.7	65.3	177.5	44.3	0	0	0	0	112.7	A11 A15	A11-S13 PolarHBondContact O-N 2.98Å; S13-A15 PolarHBondContact O-N 3Å
14	S	40.3	Very low	42.4	Very low	113 Å²	113	120.7 Å²	120.7	79%	0.79	76%	0.756	S	S	*	*			trans	-83.2	93.9	176.3	54.9	0	0	0	0	111.9	K12	K12-S14 VanDerWaalsContact C-N 3.25Å; K12-S14 PolarHBondContact O-N 3.18Å
15	A	36.9	Very low	44.4	Very low	99 Å²	99	119.1 Å²	119.1	82%	0.818	74%	0.738	S	S	*	*			trans	-153.4	58.6	178.4	0	0	0	0	0	114.9	S13	S13-A15 PolarHBondContact O-N 3Å
16	S	32.8	Very low	46.7	Very low	110 Å²	110	116.8 Å²	116.8	77%	0.769	71%	0.714	S	S	*	*			trans	-145	98.8	158.1	51.4	0	0	0	0	111
17	G	32.2	Very low	48.9	Very low	49 Å²	49	109.2 Å²	109.2	51%	0.505	69%	0.691	S	S	.	*			trans	-72.3	162.8	168.5	0	0	0	0	0	111.4	N19 A20	G17-N19 PolarHBondContact O-N 3.21Å; G17-A20 PolarHBondContact O-N 3.49Å; G17-A20 VanDerWaalsContact O-N 3.08Å
18	P	45	Very low	51.2	Low	138 Å²	138	102.7 Å²	102.7	90%	0.896	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-7.8	-174	25.4	-35.1	0	0	0	115.4
19	N	40.5	Very low	53.4	Low	160 Å²	160	98.3 Å²	98.3	86%	0.856	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.9	10.5	177.7	-73.8	-15.3	0	0	0	114.1	G17	G17-N19 PolarHBondContact O-N 3.21Å
20	A	54.1	Low	55.7	Low	57 Å²	57	100.2 Å²	100.2	47%	0.471	62%	0.62	S	S	.	*	S	Bend	trans	-67.8	131.8	170.2	0	0	0	0	0	109.8	G17	G17-A20 PolarHBondContact O-N 3.49Å; G17-A20 VanDerWaalsContact O-N 3.08Å
21	P	63.1	Low	58.1	Low	116 Å²	116	96.7 Å²	96.7	75%	0.753	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-61.9	134.4	176.9	25.7	-33.4	0	0	0	109.7	A23	P21-A23 PolarHBondContact O-N 3.4Å
22	P	72.6	Confident	60.6	Low	53 Å²	53	93.9 Å²	93.9	34%	0.344	57%	0.573	S	S	.	*	P	Polyproline II helix	trans	-60.8	134.6	-176.5	25.2	-34.7	0	0	0	110.3	E26 L27	P22-E26 HydrophobicContact CB-CB 4.36Å; P22-L27 HydrophobicContact CB-CD2 4.41Å; P22-L27 HydrophobicContact CB-CG 4.34Å; P22-L27 HydrophobicContact CG-CD1 4.4Å; P22-L27 HydrophobicContact CG-CD2 3.74Å; P22-L27 HydrophobicContact CG-CG 4.01Å
23	A	84.2	Confident	62.7	Low	59 Å²	59	85.5 Å²	85.5	49%	0.488	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-55.6	147.8	180	0	0	0	0	0	111	P21 F25 E26 L27	P21-A23 PolarHBondContact O-N 3.4Å; A23-F25 PolarHBondContact O-N 2.86Å; A23-E26 WeakPolarHBondContact O-CA 3.47Å; A23-E26 WeakPolarHBondContact O-CB 3.29Å; A23-E26 PolarHBondContact O-N 2.76Å; A23-L27 PolarHBondContact O-N 3.11Å
24	L	80.6	Confident	65	Low	136 Å²	136	83.2 Å²	83.2	71%	0.712	53%	0.528	S	S	*	.	H	α-helix	trans	-53.2	-34.1	179.2	-177.2	147	0	0	0	112.1	L27 C28	L24-L27 PolarHBondContact O-N 3.25Å; L24-C28 WeakPolarHBondContact O-CB 3.44Å; L24-C28 PolarHBondContact O-N 3.1Å; L24-C28 PolarHBondContact O-SG 2.84Å
25	F	77.2	Confident	67	Low	104 Å²	104	83.5 Å²	83.5	46%	0.456	52%	0.516	S	S	.	.	H	α-helix	trans	-58.7	-46.5	172	-178.7	-94.7	0	0	0	113.3	A23 C28 G29 S53 L57	A23-F25 PolarHBondContact O-N 2.86Å; F25-C28 PolarHBondContact O-N 3.1Å; F25-G29 PolarHBondContact O-N 2.96Å; F25-S53 VanDerWaalsContact CZ-OG 3.31Å; F25-S53 WeakPolarHBondContact CZ-OG 3.38Å; F25-L57 HydrophobicContact CE1-CD1 4.18Å
26	E	78.7	Confident	69.3	Low	77 Å²	77	78.9 Å²	78.9	36%	0.36	48%	0.478	S	S	.	.	H	α-helix	trans	-65.8	-39.4	175.6	-75.6	-166	-152.8	0	0	111.9	P22 A23 G29 R30	P22-E26 HydrophobicContact CB-CB 4.36Å; A23-E26 WeakPolarHBondContact O-CA 3.47Å; A23-E26 WeakPolarHBondContact O-CB 3.29Å; A23-E26 PolarHBondContact O-N 2.76Å; E26-G29 PolarHBondContact O-N 2.7Å; E26-R30 VanDerWaalsContact O-CB 3.3Å; E26-R30 WeakPolarHBondContact O-CB 3.42Å; E26-R30 WeakPolarHBondContact O-CG 3.43Å; E26-R30 PolarHBondContact O-N 2.82Å; E26-R30 IonicContact OE2-CZ 2.79Å; E26-R30 IonicContact OE2-NE 2.72Å; E26-R30 IonicContact OE2-NH2 3.29Å; E26-R30 PolarHBondContact OE2-NH2 3.46Å
27	L	81.1	Confident	71.6	Confident	93 Å²	93	75.7 Å²	75.7	49%	0.487	46%	0.463	S	S	.	.	H	α-helix	trans	-61.7	-46.9	177	-71.6	172.4	0	0	0	111.2	P22 A23 L24 R30 A31	P22-L27 HydrophobicContact CB-CD2 4.41Å; P22-L27 HydrophobicContact CB-CG 4.34Å; P22-L27 HydrophobicContact CG-CD1 4.4Å; P22-L27 HydrophobicContact CG-CD2 3.74Å; P22-L27 HydrophobicContact CG-CG 4.01Å; A23-L27 PolarHBondContact O-N 3.11Å; L24-L27 PolarHBondContact O-N 3.25Å; L27-R30 PolarHBondContact O-N 3.23Å; L27-A31 WeakPolarHBondContact O-CB 3.38Å; L27-A31 PolarHBondContact O-N 3.43Å
28	C	78.3	Confident	74	Confident	66 Å²	66	79.4 Å²	79.4	45%	0.446	48%	0.475	S	S	.	.	H	α-helix	trans	-61.1	-45.5	173.5	-68.8	0	0	0	0	112	L24 F25 A31 V32	L24-C28 WeakPolarHBondContact O-CB 3.44Å; L24-C28 PolarHBondContact O-N 3.1Å; L24-C28 PolarHBondContact O-SG 2.84Å; F25-C28 PolarHBondContact O-N 3.1Å; C28-A31 PolarHBondContact O-N 3.44Å; C28-V32 WeakPolarHBondContact O-CG2 3.41Å; C28-V32 PolarHBondContact O-N 3.05Å
29	G	75.9	Confident	75.8	Confident	3 Å²	3	76.1 Å²	76.1	3%	0.031	45%	0.45	C	S	.	.	H	α-helix	trans	-67.9	-34.5	180	0	0	0	0	0	113.9	F25 E26 V32 S33	F25-G29 PolarHBondContact O-N 2.96Å; E26-G29 PolarHBondContact O-N 2.7Å; G29-V32 PolarHBondContact O-N 3.06Å; G29-S33 WeakPolarHBondContact O-CB 3.3Å; G29-S33 PolarHBondContact O-N 3.32Å
30	R	76.6	Confident	77.8	Confident	131 Å²	131	69.4 Å²	69.4	49%	0.494	41%	0.413	S	S	.	.	H	α-helix	trans	-66	-39.3	170.6	-70.6	168.8	-165.9	-152.1	8.3	111.3	E26 L27 S33 A34	E26-R30 VanDerWaalsContact O-CB 3.3Å; E26-R30 WeakPolarHBondContact O-CB 3.42Å; E26-R30 WeakPolarHBondContact O-CG 3.43Å; E26-R30 PolarHBondContact O-N 2.82Å; E26-R30 IonicContact OE2-CZ 2.79Å; E26-R30 IonicContact OE2-NE 2.72Å; E26-R30 IonicContact OE2-NH2 3.29Å; E26-R30 PolarHBondContact OE2-NH2 3.46Å; L27-R30 PolarHBondContact O-N 3.23Å; R30-S33 WeakPolarHBondContact O-CB 3.49Å; R30-S33 PolarHBondContact O-N 3.01Å; R30-A34 WeakPolarHBondContact O-CB 3.46Å; R30-A34 PolarHBondContact O-N 3.01Å
31	A	80.6	Confident	79	Confident	49 Å²	49	71.7 Å²	71.7	41%	0.405	43%	0.426	S	S	.	.	H	α-helix	trans	-67.1	-41.4	174.7	0	0	0	0	0	112.3	L27 C28 A34 H35	L27-A31 WeakPolarHBondContact O-CB 3.38Å; L27-A31 PolarHBondContact O-N 3.43Å; C28-A31 PolarHBondContact O-N 3.44Å; A31-A34 PolarHBondContact O-N 2.88Å; A31-H35 PolarHBondContact O-CD2 2.68Å; A31-H35 PolarHBondContact O-N 3.02Å
32	V	79.6	Confident	79.9	Confident	40 Å²	40	68.1 Å²	68.1	24%	0.242	41%	0.41	C	S	.	.	H	α-helix	trans	-58.9	-48.7	170.9	168.6	0	0	0	0	110.3	C28 G29 A34 H35 M36 L39 V43 I54	C28-V32 WeakPolarHBondContact O-CG2 3.41Å; C28-V32 PolarHBondContact O-N 3.05Å; G29-V32 PolarHBondContact O-N 3.06Å; V32-A34 PolarHBondContact O-N 3.45Å; V32-H35 CarbonylContact O-C 3.56Å; V32-H35 PolarHBondContact O-N 3.4Å; V32-M36 HydrophobicContact CG1-SD 4.09Å; V32-M36 WeakPolarHBondContact O-CG 3.39Å; V32-M36 PolarHBondContact O-N 3.27Å; V32-L39 HydrophobicContact CB-CD1 4.5Å; V32-L39 HydrophobicContact CG1-CD1 4.19Å; V32-L39 HydrophobicContact CG2-CD1 4.48Å; V32-V43 HydrophobicContact CG1-CG2 4.38Å; V32-I54 HydrophobicContact CG1-CG2 4.37Å
33	S	76.8	Confident	80.4	Confident	19 Å²	19	66.1 Å²	66.1	13%	0.133	40%	0.397	C	S	.	.	H	α-helix	trans	-55.2	-47.3	177.6	-167.6	0	0	0	0	112.3	G29 R30 H35 M36 L57	G29-S33 WeakPolarHBondContact O-CB 3.3Å; G29-S33 PolarHBondContact O-N 3.32Å; R30-S33 WeakPolarHBondContact O-CB 3.49Å; R30-S33 PolarHBondContact O-N 3.01Å; S33-H35 PolarHBondContact O-N 2.96Å; S33-M36 WeakPolarHBondContact O-CB 3.45Å; S33-M36 WeakPolarHBondContact O-CG 3.5Å; S33-M36 PolarHBondContact O-N 3.12Å; S33-L57 WeakPolarHBondContact CB-O 3.37Å; S33-L57 PolarHBondContact OG-O 2.89Å
34	A	78.8	Confident	80.4	Confident	76 Å²	76	66.9 Å²	66.9	63%	0.628	39%	0.387	S	S	*	.	H	α-helix	trans	-66.5	-13.2	176.9	0	0	0	0	0	114.7	R30 A31 V32	R30-A34 WeakPolarHBondContact O-CB 3.46Å; R30-A34 PolarHBondContact O-N 3.01Å; A31-A34 PolarHBondContact O-N 2.88Å; V32-A34 PolarHBondContact O-N 3.45Å
35	H	82.4	Confident	80.7	Confident	119 Å²	119	64 Å²	64	55%	0.551	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.1	11.6	179	-62.7	-24.2	0	0	0	113.1	A31 V32 S33 G37 V38 L39	A31-H35 PolarHBondContact O-CD2 2.68Å; A31-H35 PolarHBondContact O-N 3.02Å; V32-H35 CarbonylContact O-C 3.56Å; V32-H35 PolarHBondContact O-N 3.4Å; S33-H35 PolarHBondContact O-N 2.96Å; H35-G37 PolarHBondContact O-N 2.9Å; H35-G37 VanDerWaalsContact O-N 3.1Å; H35-V38 PolarHBondContact O-N 3.48Å; H35-L39 HydrophobicContact CB-CD1 4.01Å; H35-L39 HydrophobicContact CB-CG 4.43Å; H35-L39 WeakPolarHBondContact O-CG 3.48Å; H35-L39 PolarHBondContact O-N 3.24Å; H35-L39 VanDerWaalsContact O-N 3.1Å
36	M	84.5	Confident	81.1	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.005	37%	0.374	C	S	.	.	H	α-helix	trans	-56.2	-29.3	180	-82.9	-62.2	-60.7	0	0	113.7	V32 S33 V38 L39 E40 V43 L58 Y62	V32-M36 HydrophobicContact CG1-SD 4.09Å; V32-M36 WeakPolarHBondContact O-CG 3.39Å; V32-M36 PolarHBondContact O-N 3.27Å; S33-M36 WeakPolarHBondContact O-CB 3.45Å; S33-M36 WeakPolarHBondContact O-CG 3.5Å; S33-M36 PolarHBondContact O-N 3.12Å; M36-V38 PolarHBondContact O-N 2.87Å; M36-L39 PolarHBondContact O-N 3.01Å; M36-E40 WeakPolarHBondContact O-CA 3.34Å; M36-E40 VanDerWaalsContact O-CB 3.29Å; M36-E40 WeakPolarHBondContact O-CB 3.21Å; M36-E40 PolarHBondContact O-N 3.4Å; M36-V43 HydrophobicContact CE-CB 4.15Å; M36-V43 HydrophobicContact CE-CG1 3.92Å; M36-V43 HydrophobicContact SD-CB 4.15Å; M36-V43 HydrophobicContact SD-CG1 3.94Å; M36-V43 HydrophobicContact SD-CG2 3.93Å; M36-L58 HydrophobicContact CE-CD2 4.14Å; M36-L58 HydrophobicContact CG-CD2 3.73Å; M36-L58 HydrophobicContact SD-CD2 3.88Å; M36-Y62 HydrophobicContact CB-CD1 3.71Å; M36-Y62 HydrophobicContact CB-CD2 3.55Å; M36-Y62 HydrophobicContact CB-CE1 3.63Å; M36-Y62 HydrophobicContact CB-CE2 3.53Å; M36-Y62 HydrophobicContact CB-CG 3.72Å; M36-Y62 HydrophobicContact CE-CD1 3.99Å; M36-Y62 HydrophobicContact CE-CG 4.18Å; M36-Y62 HydrophobicContact CG-CD1 4.39Å; M36-Y62 HydrophobicContact CG-CD2 4Å; M36-Y62 HydrophobicContact CG-CE2 4.43Å; M36-Y62 HydrophobicContact CG-CG 4.07Å
37	G	80.7	Confident	81.5	Confident	44 Å²	44	61.6 Å²	61.6	45%	0.454	38%	0.381	S	S	.	.	H	α-helix	trans	-62.3	-22.2	175.6	0	0	0	0	0	115.1	H35	H35-G37 PolarHBondContact O-N 2.9Å; H35-G37 VanDerWaalsContact O-N 3.1Å
38	V	83.6	Confident	81.8	Confident	127 Å²	127	58 Å²	58	77%	0.77	37%	0.367	S	S	*	.	H	α-helix	trans	-98.5	-36	172.1	-177.4	0	0	0	0	110.9	H35 M36	H35-V38 PolarHBondContact O-N 3.48Å; M36-V38 PolarHBondContact O-N 2.87Å
39	L	82.6	Confident	82.3	Confident	68 Å²	68	59.5 Å²	59.5	36%	0.356	38%	0.376	S	S	.	.	H	α-helix	trans	-84.6	-7.2	-173.7	-59.5	174.5	0	0	0	114.2	V32 H35 M36 S41 G42 V43	V32-L39 HydrophobicContact CB-CD1 4.5Å; V32-L39 HydrophobicContact CG1-CD1 4.19Å; V32-L39 HydrophobicContact CG2-CD1 4.48Å; H35-L39 HydrophobicContact CB-CD1 4.01Å; H35-L39 HydrophobicContact CB-CG 4.43Å; H35-L39 WeakPolarHBondContact O-CG 3.48Å; H35-L39 PolarHBondContact O-N 3.24Å; H35-L39 VanDerWaalsContact O-N 3.1Å; M36-L39 PolarHBondContact O-N 3.01Å; L39-S41 PolarHBondContact O-N 3.48Å; L39-G42 PolarHBondContact O-N 2.91Å; L39-V43 HydrophobicContact CB-CG2 3.79Å; L39-V43 WeakPolarHBondContact O-CG2 3.17Å; L39-V43 PolarHBondContact O-N 3.31Å
40	E	82.4	Confident	82.8	Confident	20 Å²	20	63.4 Å²	63.4	9%	0.093	40%	0.395	C	S	.	.	H	α-helix	trans	-48	-51.9	-169.4	-151.3	172.4	150	0	0	113.1	M36 G42 W44 R65 R131	M36-E40 WeakPolarHBondContact O-CA 3.34Å; M36-E40 VanDerWaalsContact O-CB 3.29Å; M36-E40 WeakPolarHBondContact O-CB 3.21Å; M36-E40 PolarHBondContact O-N 3.4Å; E40-G42 PolarHBondContact O-N 3.48Å; E40-W44 HydrophobicContact CG-CZ2 3.76Å; E40-W44 VanDerWaalsContact O-CG 3.24Å; E40-W44 PolarHBondContact O-N 2.8Å; E40-W44 PolarHBondContact O-NE1 3.33Å; E40-W44 WeakPolarHBondContact OE1-CZ2 3.41Å; E40-R65 IonicContact OE1-CZ 3.86Å; E40-R65 IonicContact OE1-NE 3.24Å; E40-R65 PolarHBondContact OE1-NE 2.89Å; E40-R65 IonicContact OE1-NH2 2.7Å; E40-R65 PolarHBondContact OE1-NH2 2.81Å; E40-R131 IonicContact OE2-CZ 3.41Å; E40-R131 IonicContact OE2-NH1 3.11Å; E40-R131 PolarHBondContact OE2-NH1 3.05Å; E40-R131 VanDerWaalsContact OE2-NH1 3.11Å; E40-R131 IonicContact OE2-NH2 2.76Å; E40-R131 PolarHBondContact OE2-NH2 2.88Å
41	S	78.6	Confident	83.3	Confident	105 Å²	105	57.1 Å²	57.1	73%	0.734	37%	0.371	S	S	*	.	H	α-helix	trans	-66.3	-33.8	-178.1	54.7	0	0	0	0	113.9	L39	L39-S41 PolarHBondContact O-N 3.48Å
42	G	81.5	Confident	83.7	Confident	41 Å²	41	60.6 Å²	60.6	42%	0.423	38%	0.379	S	S	.	.	H	α-helix	trans	-83.3	-39.8	179.7	0	0	0	0	0	113.3	L39 E40 W44 A45	L39-G42 PolarHBondContact O-N 2.91Å; E40-G42 PolarHBondContact O-N 3.48Å; G42-W44 VanDerWaalsContact C-N 3.26Å; G42-W44 PolarHBondContact O-N 2.83Å; G42-A45 WeakPolarHBondContact O-CB 3.13Å; G42-A45 PolarHBondContact O-N 2.79Å
43	V	83.4	Confident	84	Confident	10 Å²	10	60.7 Å²	60.7	6%	0.061	38%	0.381	C	S	.	.	H	α-helix	trans	-63.1	-34	-178.5	167	0	0	0	0	111.5	V32 M36 L39 A45 L46 L51 I66	V32-V43 HydrophobicContact CG1-CG2 4.38Å; M36-V43 HydrophobicContact CE-CB 4.15Å; M36-V43 HydrophobicContact CE-CG1 3.92Å; M36-V43 HydrophobicContact SD-CB 4.15Å; M36-V43 HydrophobicContact SD-CG1 3.94Å; M36-V43 HydrophobicContact SD-CG2 3.93Å; L39-V43 HydrophobicContact CB-CG2 3.79Å; L39-V43 WeakPolarHBondContact O-CG2 3.17Å; L39-V43 PolarHBondContact O-N 3.31Å; V43-A45 PolarHBondContact O-N 3.1Å; V43-L46 HydrophobicContact CB-CD1 4.32Å; V43-L46 HydrophobicContact CG1-CD1 4.2Å; V43-L46 HydrophobicContact CG2-CD1 4.28Å; V43-L46 WeakPolarHBondContact O-CB 3.46Å; V43-L46 WeakPolarHBondContact O-CG 2.98Å; V43-L46 PolarHBondContact O-N 3.2Å; V43-L51 HydrophobicContact CG1-CD1 4.44Å; V43-I66 HydrophobicContact CG1-CD1 4.23Å
44	W	85	Confident	84.5	Confident	76 Å²	76	60.4 Å²	60.4	29%	0.288	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-24.3	176.9	-66	10.2	0	0	0	113	E40 G42 R65 I66 T69 K73	E40-W44 HydrophobicContact CG-CZ2 3.76Å; E40-W44 VanDerWaalsContact O-CG 3.24Å; E40-W44 PolarHBondContact O-N 2.8Å; E40-W44 PolarHBondContact O-NE1 3.33Å; E40-W44 WeakPolarHBondContact OE1-CZ2 3.41Å; G42-W44 VanDerWaalsContact C-N 3.26Å; G42-W44 PolarHBondContact O-N 2.83Å; W44-R65 HydrophobicContact CZ2-CB 4.36Å; W44-I66 VanDerWaalsContact CD1-CD1 3.41Å; W44-I66 HydrophobicContact CG-CD1 4.44Å; W44-I66 HydrophobicContact CG-CG1 4.4Å; W44-T69 HydrophobicContact CB-CG2 4.1Å; W44-T69 WeakPolarHBondContact O-CG2 3.38Å; W44-K73 WeakPolarHBondContact O-CE 3.38Å; W44-K73 PolarHBondContact O-NZ 3.05Å
45	A	85.8	Confident	85.1	Confident	76 Å²	76	57 Å²	57	63%	0.628	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-24.2	176.2	0	0	0	0	0	113.1	G42 V43 K73	G42-A45 WeakPolarHBondContact O-CB 3.13Å; G42-A45 PolarHBondContact O-N 2.79Å; V43-A45 PolarHBondContact O-N 3.1Å; A45-K73 PolarHBondContact O-NZ 3.32Å
46	L	86.3	Confident	85.4	Confident	51 Å²	51	53.4 Å²	53.4	27%	0.267	34%	0.337	S	S	.	.	S	Bend	trans	-54.4	150.1	-167.7	-68	173.8	0	0	0	114.9	V43 I50 I54 K73	V43-L46 HydrophobicContact CB-CD1 4.32Å; V43-L46 HydrophobicContact CG1-CD1 4.2Å; V43-L46 HydrophobicContact CG2-CD1 4.28Å; V43-L46 WeakPolarHBondContact O-CB 3.46Å; V43-L46 WeakPolarHBondContact O-CG 2.98Å; V43-L46 PolarHBondContact O-N 3.2Å; L46-I50 HydrophobicContact CD1-CG2 4.11Å; L46-I54 HydrophobicContact CD1-CD1 3.77Å; L46-K73 PolarHBondContact O-NZ 3.22Å
47	P	88.2	Confident	85.6	Confident	79 Å²	79	55.1 Å²	55.1	51%	0.513	35%	0.346	S	S	.	.			trans	-54.5	142.7	172	-26.1	34.6	0	0	0	112.9	I50 L51	P47-I50 HydrophobicContact CG-CD1 4.29Å; P47-I50 PolarHBondContact O-N 3.18Å; P47-L51 PolarHBondContact O-N 2.72Å
48	G	87.4	Confident	86	Confident	17 Å²	17	53.3 Å²	53.3	18%	0.175	33%	0.325	C	S	.	.	H	α-helix	trans	-46.4	-48.1	-177.9	0	0	0	0	0	115.1	I50 L51 Q52 L75	G48-I50 VanDerWaalsContact C-N 3.31Å; G48-I50 PolarHBondContact O-N 2.78Å; G48-L51 PolarHBondContact O-N 3.16Å; G48-Q52 WeakPolarHBondContact O-CB 3.39Å; G48-Q52 PolarHBondContact O-N 3.12Å; G48-L75 WeakPolarHBondContact O-CD1 3.16Å
49	P	88.3	Confident	86.3	Confident	98 Å²	98	47.9 Å²	47.9	64%	0.636	29%	0.292	S	S	*	.	H	α-helix	trans	-63.6	-30.4	179.4	-25.6	35.8	0	0	0	114.9	S53	P49-S53 PolarHBondContact O-OG 3.03Å
50	I	85.1	Confident	86.6	Confident	84 Å²	84	44.7 Å²	44.7	43%	0.431	28%	0.275	S	S	.	.	H	α-helix	trans	-78.3	-40.4	176	-57.5	-179	0	0	0	109.5	L46 P47 G48 S53 I54	L46-I50 HydrophobicContact CD1-CG2 4.11Å; P47-I50 HydrophobicContact CG-CD1 4.29Å; P47-I50 PolarHBondContact O-N 3.18Å; G48-I50 VanDerWaalsContact C-N 3.31Å; G48-I50 PolarHBondContact O-N 2.78Å; I50-S53 PolarHBondContact O-N 3.46Å; I50-S53 PolarHBondContact O-OG 2.67Å; I50-S53 VanDerWaalsContact O-OG 3.08Å; I50-I54 HydrophobicContact CG2-CD1 4.01Å; I50-I54 WeakPolarHBondContact O-CG1 3.31Å; I50-I54 PolarHBondContact O-N 2.89Å
51	L	87.8	Confident	87	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62.8	-44.3	175.7	-176.2	60.2	0	0	0	111.2	V43 P47 G48 S53 I54 L55 I66 K73 L75	V43-L51 HydrophobicContact CG1-CD1 4.44Å; P47-L51 PolarHBondContact O-N 2.72Å; G48-L51 PolarHBondContact O-N 3.16Å; L51-S53 PolarHBondContact O-N 3.3Å; L51-I54 PolarHBondContact O-N 3.26Å; L51-L55 HydrophobicContact CD1-CD2 4.32Å; L51-L55 HydrophobicContact CD1-CG 4.38Å; L51-L55 HydrophobicContact CG-CD1 4.41Å; L51-L55 HydrophobicContact CG-CG 4.28Å; L51-L55 WeakPolarHBondContact O-CG 3.37Å; L51-L55 PolarHBondContact O-N 3.48Å; L51-I66 HydrophobicContact CD1-CD1 3.62Å; L51-I66 HydrophobicContact CD1-CG1 4.41Å; L51-K73 HydrophobicContact CD2-CD 3.57Å; L51-L75 HydrophobicContact CB-CD1 3.99Å; L51-L75 HydrophobicContact CD2-CD1 3.95Å; L51-L75 HydrophobicContact CG-CD1 3.95Å
52	Q	89.1	Confident	87.6	Confident	121 Å²	121	40 Å²	40	57%	0.565	24%	0.241	S	C	*	.	H	α-helix	trans	-55	-35	179.7	-173.1	178.3	7.5	0	0	113.4	G48 P56 L75	G48-Q52 WeakPolarHBondContact O-CB 3.39Å; G48-Q52 PolarHBondContact O-N 3.12Å; Q52-P56 WeakPolarHBondContact O-CD 3.46Å; Q52-L75 HydrophobicContact CB-CD1 4.14Å; Q52-L75 HydrophobicContact CB-CD2 4.02Å; Q52-L75 HydrophobicContact CG-CD2 4.31Å
53	S	85.8	Confident	88.1	Confident	42 Å²	42	38.1 Å²	38.1	29%	0.294	22%	0.221	S	C	.	.	H	α-helix	trans	-88	-17.5	-179.8	62.4	0	0	0	0	113.6	F25 P49 I50 L51	F25-S53 VanDerWaalsContact CZ-OG 3.31Å; F25-S53 WeakPolarHBondContact CZ-OG 3.38Å; P49-S53 PolarHBondContact O-OG 3.03Å; I50-S53 PolarHBondContact O-N 3.46Å; I50-S53 PolarHBondContact O-OG 2.67Å; I50-S53 VanDerWaalsContact O-OG 3.08Å; L51-S53 PolarHBondContact O-N 3.3Å
54	I	88.2	Confident	88.4	Confident	14 Å²	14	38 Å²	38	7%	0.072	22%	0.22	C	C	.	.	H	α-helix	trans	-81.3	-39.7	171	-67	167.6	0	0	0	111.7	V32 L46 I50 L51 P56 L57 L58	V32-I54 HydrophobicContact CG1-CG2 4.37Å; L46-I54 HydrophobicContact CD1-CD1 3.77Å; I50-I54 HydrophobicContact CG2-CD1 4.01Å; I50-I54 WeakPolarHBondContact O-CG1 3.31Å; I50-I54 PolarHBondContact O-N 2.89Å; L51-I54 PolarHBondContact O-N 3.26Å; I54-P56 VanDerWaalsContact C-CD 3.42Å; I54-P56 VanDerWaalsContact O-N 3.15Å; I54-L57 WeakPolarHBondContact O-CB 2.98Å; I54-L57 PolarHBondContact O-N 2.93Å; I54-L58 HydrophobicContact CG2-CD2 3.97Å; I54-L58 HydrophobicContact CG2-CG 4.32Å
55	L	90	Very high	88.7	Confident	3 Å²	3	38.9 Å²	38.9	2%	0.016	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-48	-43.2	-173.7	-71.4	168	0	0	0	115.1	L51 L57 L58 L63 I66 A70 L75 T77 I80	L51-L55 HydrophobicContact CD1-CD2 4.32Å; L51-L55 HydrophobicContact CD1-CG 4.38Å; L51-L55 HydrophobicContact CG-CD1 4.41Å; L51-L55 HydrophobicContact CG-CG 4.28Å; L51-L55 WeakPolarHBondContact O-CG 3.37Å; L51-L55 PolarHBondContact O-N 3.48Å; L55-L57 PolarHBondContact O-N 2.92Å; L55-L58 HydrophobicContact CD2-CD1 4.01Å; L55-L58 PolarHBondContact O-N 3.16Å; L55-L63 HydrophobicContact CB-CD1 4.39Å; L55-L63 HydrophobicContact CD2-CD1 4.11Å; L55-I66 HydrophobicContact CD2-CG2 3.37Å; L55-A70 HydrophobicContact CD1-CB 4.12Å; L55-L75 HydrophobicContact CD1-CD1 4.09Å; L55-T77 HydrophobicContact CD1-CG2 4.36Å; L55-I80 HydrophobicContact CB-CD1 3.49Å; L55-I80 VanDerWaalsContact CB-CD1 3.49Å
56	P	90.1	Very high	88.9	Confident	45 Å²	45	35.3 Å²	35.3	29%	0.292	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-71.6	-9.2	-178.6	-17.5	32.6	0	0	0	115.2	Q52 I54 I80 R126	Q52-P56 WeakPolarHBondContact O-CD 3.46Å; I54-P56 VanDerWaalsContact C-CD 3.42Å; I54-P56 VanDerWaalsContact O-N 3.15Å; P56-I80 HydrophobicContact CG-CD1 3.97Å; P56-I80 HydrophobicContact CG-CG1 4.34Å; P56-R126 PolarHBondContact O-NH2 3.45Å; P56-R126 VanDerWaalsContact O-NH2 3.15Å
57	L	87.8	Confident	89.1	Confident	37 Å²	37	33.1 Å²	33.1	19%	0.194	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-103.3	-8.7	-176.7	-54.9	177.6	0	0	0	112.4	F25 S33 I54 L55	F25-L57 HydrophobicContact CE1-CD1 4.18Å; S33-L57 WeakPolarHBondContact CB-O 3.37Å; S33-L57 PolarHBondContact OG-O 2.89Å; I54-L57 WeakPolarHBondContact O-CB 2.98Å; I54-L57 PolarHBondContact O-N 2.93Å; L55-L57 PolarHBondContact O-N 2.92Å
58	L	88.8	Confident	89.2	Confident	5 Å²	5	35 Å²	35	3%	0.026	18%	0.184	C	C	.	.	S	Bend	trans	-68.9	151.8	175.1	-63.4	-179.4	0	0	0	111.7	M36 I54 L55 L63 I66	M36-L58 HydrophobicContact CE-CD2 4.14Å; M36-L58 HydrophobicContact CG-CD2 3.73Å; M36-L58 HydrophobicContact SD-CD2 3.88Å; I54-L58 HydrophobicContact CG2-CD2 3.97Å; I54-L58 HydrophobicContact CG2-CG 4.32Å; L55-L58 HydrophobicContact CD2-CD1 4.01Å; L55-L58 PolarHBondContact O-N 3.16Å; L58-L63 HydrophobicContact CB-CB 4.27Å; L58-I66 HydrophobicContact CD1-CD1 4.39Å; L58-I66 HydrophobicContact CD1-CG2 3.88Å
59	N	89.3	Confident	89.4	Confident	13 Å²	13	35.4 Å²	35.4	7%	0.07	18%	0.183	C	C	.	.			trans	-72.2	167.9	162.3	76.9	17.2	0	0	0	110.5	Y61 Y62 L63 R126 D129	N59-Y61 VanDerWaalsContact C-N 3.27Å; N59-Y61 PolarHBondContact O-N 3.38Å; N59-Y61 WeakPolarHBondContact OD1-CB 3.48Å; N59-Y61 PolarHBondContact OD1-N 2.94Å; N59-Y61 VanDerWaalsContact OD1-N 3.16Å; N59-Y62 VanDerWaalsContact CG-CD2 3.45Å; N59-Y62 WeakPolarHBondContact ND2-CE2 3.39Å; N59-Y62 PolarHBondContact O-N 3.49Å; N59-Y62 WeakPolarHBondContact OD1-CD2 3.38Å; N59-Y62 PolarHBondContact OD1-N 3.43Å; N59-L63 WeakPolarHBondContact O-CB 3.45Å; N59-L63 PolarHBondContact O-N 3.31Å; N59-R126 WeakPolarHBondContact CB-O 3.45Å; N59-D129 WeakPolarHBondContact ND2-CB 3.41Å; N59-D129 PolarHBondContact ND2-OD2 3.05Å
60	I	90.3	Very high	89.5	Confident	1 Å²	1	30.8 Å²	30.8	1%	0.005	15%	0.153	C	C	.	.	H	α-helix	trans	-62.6	-33.8	-174.9	-63.9	-164.1	0	0	0	112.2	L63 E64 W81 L84 L88 F106 M107 R126 L127 F132	I60-L63 PolarHBondContact O-N 2.83Å; I60-E64 WeakPolarHBondContact O-CB 3.28Å; I60-E64 PolarHBondContact O-N 3.05Å; I60-W81 HydrophobicContact CG2-CH2 4.09Å; I60-W81 HydrophobicContact CG2-CZ3 4.06Å; I60-L84 HydrophobicContact CD1-CD1 4.45Å; I60-L84 HydrophobicContact CG1-CD1 4.3Å; I60-L88 HydrophobicContact CD1-CD1 4.07Å; I60-F106 HydrophobicContact CD1-CE1 3.51Å; I60-F106 HydrophobicContact CD1-CZ 3.45Å; I60-F106 VanDerWaalsContact CD1-CZ 3.45Å; I60-M107 HydrophobicContact CG2-SD 4.2Å; I60-R126 PolarHBondContact N-O 3.36Å; I60-L127 HydrophobicContact CD1-CD2 3.41Å; I60-L127 VanDerWaalsContact CD1-CD2 3.41Å; I60-L127 HydrophobicContact CG1-CD2 4.1Å; I60-F132 HydrophobicContact CB-CZ 4.34Å; I60-F132 HydrophobicContact CG2-CE1 4.48Å; I60-F132 HydrophobicContact CG2-CZ 3.84Å
61	Y	90.3	Very high	89.8	Confident	16 Å²	16	31.5 Å²	31.5	6%	0.063	16%	0.157	C	C	.	.	H	α-helix	trans	-63.2	-49.1	177.4	175.1	-104	0	0	0	112.9	N59 R65 R131 F132 H137	N59-Y61 VanDerWaalsContact C-N 3.27Å; N59-Y61 PolarHBondContact O-N 3.38Å; N59-Y61 WeakPolarHBondContact OD1-CB 3.48Å; N59-Y61 PolarHBondContact OD1-N 2.94Å; N59-Y61 VanDerWaalsContact OD1-N 3.16Å; Y61-R65 VanDerWaalsContact CZ-CD 3.41Å; Y61-R65 VanDerWaalsContact O-CG 3.31Å; Y61-R65 WeakPolarHBondContact O-CG 3.32Å; Y61-R65 PolarHBondContact O-N 3.48Å; Y61-R131 HydrophobicContact CE1-CB 4.09Å; Y61-R131 HydrophobicContact CE2-CB 4.26Å; Y61-F132 HydrophobicContact CD2-CB 4.04Å; Y61-F132 AromaticContact CD2-CD2 3.82Å; Y61-F132 HydrophobicContact CD2-CD2 3.82Å; Y61-F132 HydrophobicContact CD2-CG 4.35Å; Y61-F132 HydrophobicContact CG-CB 4.19Å; Y61-F132 HydrophobicContact CG-CD2 4.32Å; Y61-H137 AromaticContact CD2-NE2 3.87Å; Y61-H137 AromaticContact CE2-NE2 3.53Å
62	Y	90.6	Very high	89.9	Confident	11 Å²	11	38.9 Å²	38.9	4%	0.043	19%	0.189	C	C	.	.	H	α-helix	trans	-69.3	-38.1	176.8	-63.1	-63.5	0	0	0	112.1	M36 N59 E64 R65 I66 D129 R131	M36-Y62 HydrophobicContact CB-CD1 3.71Å; M36-Y62 HydrophobicContact CB-CD2 3.55Å; M36-Y62 HydrophobicContact CB-CE1 3.63Å; M36-Y62 HydrophobicContact CB-CE2 3.53Å; M36-Y62 HydrophobicContact CB-CG 3.72Å; M36-Y62 HydrophobicContact CE-CD1 3.99Å; M36-Y62 HydrophobicContact CE-CG 4.18Å; M36-Y62 HydrophobicContact CG-CD1 4.39Å; M36-Y62 HydrophobicContact CG-CD2 4Å; M36-Y62 HydrophobicContact CG-CE2 4.43Å; M36-Y62 HydrophobicContact CG-CG 4.07Å; N59-Y62 VanDerWaalsContact CG-CD2 3.45Å; N59-Y62 WeakPolarHBondContact ND2-CE2 3.39Å; N59-Y62 PolarHBondContact O-N 3.49Å; N59-Y62 WeakPolarHBondContact OD1-CD2 3.38Å; N59-Y62 PolarHBondContact OD1-N 3.43Å; Y62-E64 VanDerWaalsContact C-N 3.34Å; Y62-R65 PolarHBondContact O-N 3.46Å; Y62-I66 VanDerWaalsContact O-CB 3.28Å; Y62-I66 WeakPolarHBondContact O-CB 3.13Å; Y62-I66 WeakPolarHBondContact O-CG2 3.46Å; Y62-I66 PolarHBondContact O-N 3.5Å; Y62-D129 WeakPolarHBondContact CE2-OD2 3.4Å; Y62-D129 VanDerWaalsContact CZ-OD2 3.31Å; Y62-D129 PolarHBondContact OH-OD2 3.44Å; Y62-R131 PolarHBondContact OH-NH2 3.38Å
63	L	91.8	Very high	90	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-64.1	-39.3	177	-173.8	65.3	0	0	0	111.9	L55 L58 N59 I60 E67 T77 I80 W81 L84	L55-L63 HydrophobicContact CB-CD1 4.39Å; L55-L63 HydrophobicContact CD2-CD1 4.11Å; L58-L63 HydrophobicContact CB-CB 4.27Å; N59-L63 WeakPolarHBondContact O-CB 3.45Å; N59-L63 PolarHBondContact O-N 3.31Å; I60-L63 PolarHBondContact O-N 2.83Å; L63-E67 PolarHBondContact O-N 3.08Å; L63-T77 HydrophobicContact CD1-CG2 4.31Å; L63-I80 HydrophobicContact CD1-CD1 4.42Å; L63-I80 HydrophobicContact CD1-CG2 4.43Å; L63-I80 HydrophobicContact CD2-CG2 3.78Å; L63-W81 HydrophobicContact CB-CH2 4.35Å; L63-W81 HydrophobicContact CB-CZ2 4.21Å; L63-W81 HydrophobicContact CD2-CD2 4.1Å; L63-W81 HydrophobicContact CD2-CE3 4.28Å; L63-W81 HydrophobicContact CD2-CH2 3.98Å; L63-W81 HydrophobicContact CD2-CZ2 3.79Å; L63-W81 HydrophobicContact CD2-CZ3 4.22Å; L63-W81 HydrophobicContact CG-CH2 4.08Å; L63-W81 HydrophobicContact CG-CZ2 3.6Å; L63-L84 HydrophobicContact CD2-CD1 3.6Å
64	E	91.3	Very high	90.2	Very high	8 Å²	8	38.1 Å²	38.1	4%	0.037	20%	0.199	C	C	.	.	H	α-helix	trans	-61.8	-49.6	175.9	-170.8	-87.9	-107.7	0	0	111.2	I60 Y62 E67 W81 R103 M107 H137 R140	I60-E64 WeakPolarHBondContact O-CB 3.28Å; I60-E64 PolarHBondContact O-N 3.05Å; Y62-E64 VanDerWaalsContact C-N 3.34Å; E64-E67 WeakPolarHBondContact O-CB 3.28Å; E64-W81 HydrophobicContact CB-CH2 4.26Å; E64-R103 PolarHBondContact O-NH2 3.15Å; E64-R103 IonicContact OE2-NH2 2.64Å; E64-R103 PolarHBondContact OE2-NH2 3.37Å; E64-M107 HydrophobicContact CG-CE 3.92Å; E64-H137 IonicContact OE1-CD2 3.52Å; E64-R140 VanDerWaalsContact CD-NH1 3.3Å; E64-R140 IonicContact OE1-CZ 2.84Å; E64-R140 VanDerWaalsContact OE1-CZ 3.32Å; E64-R140 IonicContact OE1-NH1 2.72Å; E64-R140 PolarHBondContact OE1-NH1 2.82Å; E64-R140 IonicContact OE1-NH2 2.72Å; E64-R140 PolarHBondContact OE1-NH2 2.85Å; E64-R140 IonicContact OE2-CZ 3.57Å; E64-R140 IonicContact OE2-NH1 3.32Å; E64-R140 PolarHBondContact OE2-NH1 3.05Å; E64-R140 IonicContact OE2-NH2 3.67Å; E64-R140 PolarHBondContact OE2-NH2 3.38Å
65	R	90.5	Very high	90.5	Very high	95 Å²	95	38.5 Å²	38.5	36%	0.358	20%	0.201	S	C	.	.	H	α-helix	trans	-69.8	-37.8	-176.2	-69.7	170.6	61.3	72.6	-2	113.6	E40 W44 Y61 Y62 E67	E40-R65 IonicContact OE1-CZ 3.86Å; E40-R65 IonicContact OE1-NE 3.24Å; E40-R65 PolarHBondContact OE1-NE 2.89Å; E40-R65 IonicContact OE1-NH2 2.7Å; E40-R65 PolarHBondContact OE1-NH2 2.81Å; W44-R65 HydrophobicContact CZ2-CB 4.36Å; Y61-R65 VanDerWaalsContact CZ-CD 3.41Å; Y61-R65 VanDerWaalsContact O-CG 3.31Å; Y61-R65 WeakPolarHBondContact O-CG 3.32Å; Y61-R65 PolarHBondContact O-N 3.48Å; Y62-R65 PolarHBondContact O-N 3.46Å; R65-E67 VanDerWaalsContact C-N 3.29Å; R65-E67 PolarHBondContact O-N 3.12Å
66	I	89.9	Confident	90.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-79.9	-10.6	-175.1	-153.8	162.5	0	0	0	113.3	V43 W44 L51 L55 L58 Y62 E68 T69 A70	V43-I66 HydrophobicContact CG1-CD1 4.23Å; W44-I66 VanDerWaalsContact CD1-CD1 3.41Å; W44-I66 HydrophobicContact CG-CD1 4.44Å; W44-I66 HydrophobicContact CG-CG1 4.4Å; L51-I66 HydrophobicContact CD1-CD1 3.62Å; L51-I66 HydrophobicContact CD1-CG1 4.41Å; L55-I66 HydrophobicContact CD2-CG2 3.37Å; L58-I66 HydrophobicContact CD1-CD1 4.39Å; L58-I66 HydrophobicContact CD1-CG2 3.88Å; Y62-I66 VanDerWaalsContact O-CB 3.28Å; Y62-I66 WeakPolarHBondContact O-CB 3.13Å; Y62-I66 WeakPolarHBondContact O-CG2 3.46Å; Y62-I66 PolarHBondContact O-N 3.5Å; I66-E68 VanDerWaalsContact C-N 3.33Å; I66-E68 PolarHBondContact O-N 3.48Å; I66-T69 WeakPolarHBondContact O-CA 3.14Å; I66-T69 WeakPolarHBondContact O-CB 3.32Å; I66-T69 PolarHBondContact O-N 2.95Å; I66-A70 PolarHBondContact O-N 3.35Å
67	E	90.5	Very high	90.7	Very high	6 Å²	6	40.2 Å²	40.2	3%	0.028	22%	0.215	C	C	.	.	H	α-helix	trans	-46.2	-51.4	-179.1	-177.7	90.1	170.5	0	0	112.5	L63 E64 R65 T69 A70 L71 T77 W81 R103	L63-E67 PolarHBondContact O-N 3.08Å; E64-E67 WeakPolarHBondContact O-CB 3.28Å; R65-E67 VanDerWaalsContact C-N 3.29Å; R65-E67 PolarHBondContact O-N 3.12Å; E67-T69 VanDerWaalsContact C-N 3.3Å; E67-T69 PolarHBondContact O-N 3.16Å; E67-A70 WeakPolarHBondContact O-CB 3.46Å; E67-A70 PolarHBondContact O-N 3.29Å; E67-L71 HydrophobicContact CG-CD1 3.99Å; E67-L71 WeakPolarHBondContact O-CG 3.5Å; E67-L71 PolarHBondContact O-N 2.85Å; E67-T77 PolarHBondContact OE1-OG1 3.04Å; E67-T77 VanDerWaalsContact OE1-OG1 3.06Å; E67-T77 VanDerWaalsContact OE2-CB 3.24Å; E67-T77 WeakPolarHBondContact OE2-CB 3.4Å; E67-T77 VanDerWaalsContact OE2-CG2 3.27Å; E67-T77 WeakPolarHBondContact OE2-CG2 3.37Å; E67-T77 PolarHBondContact OE2-OG1 3.12Å; E67-W81 PolarHBondContact OE2-NE1 2.98Å; E67-R103 VanDerWaalsContact OE1-CD 3.23Å; E67-R103 WeakPolarHBondContact OE1-CD 3.13Å; E67-R103 WeakPolarHBondContact OE2-CD 3.32Å; E67-R103 IonicContact OE2-NE 3.23Å
68	E	90.5	Very high	91	Very high	118 Å²	118	40.7 Å²	40.7	55%	0.551	22%	0.216	S	C	*	.	H	α-helix	trans	-62.1	-38.2	-179.4	-75.5	-168.8	-148.8	0	0	112.7	I66 K72	I66-E68 VanDerWaalsContact C-N 3.33Å; I66-E68 PolarHBondContact O-N 3.48Å; E68-K72 VanDerWaalsContact O-CB 3.32Å; E68-K72 WeakPolarHBondContact O-CB 3.35Å; E68-K72 VanDerWaalsContact O-CD 3.28Å; E68-K72 WeakPolarHBondContact O-CD 3.1Å; E68-K72 WeakPolarHBondContact O-CG 3.45Å; E68-K72 PolarHBondContact O-N 3.01Å; E68-K72 IonicContact OE2-NZ 3.05Å; E68-K72 PolarHBondContact OE2-NZ 2.96Å
69	T	90.7	Very high	91.1	Very high	26 Å²	26	44 Å²	44	16%	0.16	24%	0.244	C	C	.	.	H	α-helix	trans	-71.8	-35.7	178.8	-61.8	0	0	0	0	111.1	W44 I66 E67 K73	W44-T69 HydrophobicContact CB-CG2 4.1Å; W44-T69 WeakPolarHBondContact O-CG2 3.38Å; I66-T69 WeakPolarHBondContact O-CA 3.14Å; I66-T69 WeakPolarHBondContact O-CB 3.32Å; I66-T69 PolarHBondContact O-N 2.95Å; E67-T69 VanDerWaalsContact C-N 3.3Å; E67-T69 PolarHBondContact O-N 3.16Å; T69-K73 HydrophobicContact CG2-CD 4.18Å; T69-K73 WeakPolarHBondContact O-CB 3.45Å; T69-K73 WeakPolarHBondContact O-CD 3.47Å; T69-K73 WeakPolarHBondContact O-CG 3.4Å; T69-K73 PolarHBondContact O-N 3.05Å
70	A	90.8	Very high	91.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.5	-49	171.9	0	0	0	0	0	110.9	L55 I66 E67 K72 K73 G74 L75 T77	L55-A70 HydrophobicContact CD1-CB 4.12Å; I66-A70 PolarHBondContact O-N 3.35Å; E67-A70 WeakPolarHBondContact O-CB 3.46Å; E67-A70 PolarHBondContact O-N 3.29Å; A70-K72 PolarHBondContact O-N 3.2Å; A70-K73 CarbonylContact O-C 3.37Å; A70-K73 WeakPolarHBondContact O-CA 3.31Å; A70-K73 PolarHBondContact O-N 3.3Å; A70-G74 PolarHBondContact O-N 2.89Å; A70-L75 CarbonylContact C-O 3.39Å; A70-L75 HydrophobicContact CB-CB 4.12Å; A70-L75 WeakPolarHBondContact O-CB 3.43Å; A70-L75 PolarHBondContact O-N 3.4Å; A70-T77 HydrophobicContact CB-CG2 4.17Å
71	L	91.3	Very high	91.4	Very high	100 Å²	100	44.6 Å²	44.6	52%	0.524	25%	0.247	S	C	.	.	H	α-helix	trans	-60.9	-44.3	176.8	-69.2	170.5	0	0	0	112.1	E67 K73 G74	E67-L71 HydrophobicContact CG-CD1 3.99Å; E67-L71 WeakPolarHBondContact O-CG 3.5Å; E67-L71 PolarHBondContact O-N 2.85Å; L71-K73 PolarHBondContact O-N 3.26Å; L71-G74 PolarHBondContact O-N 3.2Å
72	K	90.9	Very high	91.5	Very high	154 Å²	154	49.7 Å²	49.7	67%	0.67	27%	0.266	S	S	*	.	H	α-helix	trans	-61.8	-20.3	174.3	-71.7	161.2	-165	165.7	0	113.1	E68 A70	E68-K72 VanDerWaalsContact O-CB 3.32Å; E68-K72 WeakPolarHBondContact O-CB 3.35Å; E68-K72 VanDerWaalsContact O-CD 3.28Å; E68-K72 WeakPolarHBondContact O-CD 3.1Å; E68-K72 WeakPolarHBondContact O-CG 3.45Å; E68-K72 PolarHBondContact O-N 3.01Å; E68-K72 IonicContact OE2-NZ 3.05Å; E68-K72 PolarHBondContact OE2-NZ 2.96Å; A70-K72 PolarHBondContact O-N 3.2Å
73	K	90.7	Very high	91.4	Very high	76 Å²	76	56.1 Å²	56.1	33%	0.33	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	9.5	173.5	-68.5	167	-172.3	-86.4	0	113.4	W44 A45 L46 L51 T69 A70 L71 L75	W44-K73 WeakPolarHBondContact O-CE 3.38Å; W44-K73 PolarHBondContact O-NZ 3.05Å; A45-K73 PolarHBondContact O-NZ 3.32Å; L46-K73 PolarHBondContact O-NZ 3.22Å; L51-K73 HydrophobicContact CD2-CD 3.57Å; T69-K73 HydrophobicContact CG2-CD 4.18Å; T69-K73 WeakPolarHBondContact O-CB 3.45Å; T69-K73 WeakPolarHBondContact O-CD 3.47Å; T69-K73 WeakPolarHBondContact O-CG 3.4Å; T69-K73 PolarHBondContact O-N 3.05Å; A70-K73 CarbonylContact O-C 3.37Å; A70-K73 WeakPolarHBondContact O-CA 3.31Å; A70-K73 PolarHBondContact O-N 3.3Å; L71-K73 PolarHBondContact O-N 3.26Å; K73-L75 VanDerWaalsContact C-N 3.33Å; K73-L75 HydrophobicContact CB-CG 4.49Å; K73-L75 PolarHBondContact O-N 3.48Å
74	G	90.9	Very high	91.4	Very high	72 Å²	72	56.2 Å²	56.2	74%	0.742	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	14.5	178.8	0	0	0	0	0	115.2	A70 L71	A70-G74 PolarHBondContact O-N 2.89Å; L71-G74 PolarHBondContact O-N 3.2Å
75	L	92.6	Very high	91.3	Very high	21 Å²	21	56.5 Å²	56.5	11%	0.11	29%	0.292	C	S	.	.			trans	-94.4	138.2	179.7	-56.5	178.9	0	0	0	111.1	G48 L51 Q52 L55 A70 K73	G48-L75 WeakPolarHBondContact O-CD1 3.16Å; L51-L75 HydrophobicContact CB-CD1 3.99Å; L51-L75 HydrophobicContact CD2-CD1 3.95Å; L51-L75 HydrophobicContact CG-CD1 3.95Å; Q52-L75 HydrophobicContact CB-CD1 4.14Å; Q52-L75 HydrophobicContact CB-CD2 4.02Å; Q52-L75 HydrophobicContact CG-CD2 4.31Å; L55-L75 HydrophobicContact CD1-CD1 4.09Å; A70-L75 CarbonylContact C-O 3.39Å; A70-L75 HydrophobicContact CB-CB 4.12Å; A70-L75 WeakPolarHBondContact O-CB 3.43Å; A70-L75 PolarHBondContact O-N 3.4Å; K73-L75 VanDerWaalsContact C-N 3.33Å; K73-L75 HydrophobicContact CB-CG 4.49Å; K73-L75 PolarHBondContact O-N 3.48Å
76	S	92.1	Very high	91.2	Very high	84 Å²	84	56.6 Å²	56.6	59%	0.587	30%	0.299	S	S	*	.			trans	-103.6	125.5	172.4	-178.6	0	0	0	0	111.2	Q78	S76-Q78 WeakPolarHBondContact OG-CG 3.44Å; S76-Q78 PolarHBondContact OG-N 3.29Å
77	T	93.6	Very high	91	Very high	1 Å²	1	60 Å²	60	1%	0.006	32%	0.315	C	S	.	.			trans	-86.5	-8	174.3	55.3	0	0	0	0	112.9	L55 L63 E67 A70 A79 I80 W81	L55-T77 HydrophobicContact CD1-CG2 4.36Å; L63-T77 HydrophobicContact CD1-CG2 4.31Å; E67-T77 PolarHBondContact OE1-OG1 3.04Å; E67-T77 VanDerWaalsContact OE1-OG1 3.06Å; E67-T77 VanDerWaalsContact OE2-CB 3.24Å; E67-T77 WeakPolarHBondContact OE2-CB 3.4Å; E67-T77 VanDerWaalsContact OE2-CG2 3.27Å; E67-T77 WeakPolarHBondContact OE2-CG2 3.37Å; E67-T77 PolarHBondContact OE2-OG1 3.12Å; A70-T77 HydrophobicContact CB-CG2 4.17Å; T77-A79 VanDerWaalsContact C-N 3.26Å; T77-A79 PolarHBondContact O-N 3.37Å; T77-A79 VanDerWaalsContact O-N 3.15Å; T77-I80 WeakPolarHBondContact O-CA 3.31Å; T77-I80 VanDerWaalsContact O-CB 3.28Å; T77-I80 WeakPolarHBondContact O-CB 3.19Å; T77-I80 PolarHBondContact O-N 2.74Å; T77-W81 PolarHBondContact O-N 3.19Å; T77-W81 PolarHBondContact OG1-NE1 3.49Å
78	Q	93.4	Very high	90.8	Very high	47 Å²	47	61.3 Å²	61.3	22%	0.22	32%	0.322	C	S	.	.	H	α-helix	trans	-58.1	-35.6	-168.1	-64.6	-69.5	-45.4	0	0	113.2	S76 I80 W81 R82	S76-Q78 WeakPolarHBondContact OG-CG 3.44Å; S76-Q78 PolarHBondContact OG-N 3.29Å; Q78-I80 VanDerWaalsContact C-N 3.33Å; Q78-W81 PolarHBondContact O-N 3.42Å; Q78-R82 PolarHBondContact O-N 2.98Å
79	A	91.7	Very high	90.5	Very high	75 Å²	75	56 Å²	56	62%	0.62	30%	0.298	S	S	*	.	H	α-helix	trans	-68.7	-29.6	174.6	0	0	0	0	0	113.1	T77 R83	T77-A79 VanDerWaalsContact C-N 3.26Å; T77-A79 PolarHBondContact O-N 3.37Å; T77-A79 VanDerWaalsContact O-N 3.15Å; A79-R83 WeakPolarHBondContact O-CB 3.28Å; A79-R83 PolarHBondContact O-N 3.08Å
80	I	92.7	Very high	90	Very high	25 Å²	25	63.5 Å²	63.5	13%	0.128	33%	0.328	C	S	.	.	H	α-helix	trans	-73.8	-45.7	176	-49.5	175	0	0	0	109.3	L55 P56 L63 T77 Q78 R82 R83 L84	L55-I80 HydrophobicContact CB-CD1 3.49Å; L55-I80 VanDerWaalsContact CB-CD1 3.49Å; P56-I80 HydrophobicContact CG-CD1 3.97Å; P56-I80 HydrophobicContact CG-CG1 4.34Å; L63-I80 HydrophobicContact CD1-CD1 4.42Å; L63-I80 HydrophobicContact CD1-CG2 4.43Å; L63-I80 HydrophobicContact CD2-CG2 3.78Å; T77-I80 WeakPolarHBondContact O-CA 3.31Å; T77-I80 VanDerWaalsContact O-CB 3.28Å; T77-I80 WeakPolarHBondContact O-CB 3.19Å; T77-I80 PolarHBondContact O-N 2.74Å; Q78-I80 VanDerWaalsContact C-N 3.33Å; I80-R82 VanDerWaalsContact C-N 3.35Å; I80-R82 PolarHBondContact O-N 2.79Å; I80-R83 PolarHBondContact O-N 3.47Å; I80-R83 VanDerWaalsContact O-N 3.15Å; I80-L84 HydrophobicContact CG2-CD1 4.44Å; I80-L84 WeakPolarHBondContact O-CG 3.33Å; I80-L84 PolarHBondContact O-N 2.83Å
81	W	93.1	Very high	89.2	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-62	-38.6	174.8	-68.8	113.4	0	0	0	112.7	I60 L63 E64 E67 T77 Q78 L84 W85 W102 R103 F106 M107	I60-W81 HydrophobicContact CG2-CH2 4.09Å; I60-W81 HydrophobicContact CG2-CZ3 4.06Å; L63-W81 HydrophobicContact CB-CH2 4.35Å; L63-W81 HydrophobicContact CB-CZ2 4.21Å; L63-W81 HydrophobicContact CD2-CD2 4.1Å; L63-W81 HydrophobicContact CD2-CE3 4.28Å; L63-W81 HydrophobicContact CD2-CH2 3.98Å; L63-W81 HydrophobicContact CD2-CZ2 3.79Å; L63-W81 HydrophobicContact CD2-CZ3 4.22Å; L63-W81 HydrophobicContact CG-CH2 4.08Å; L63-W81 HydrophobicContact CG-CZ2 3.6Å; E64-W81 HydrophobicContact CB-CH2 4.26Å; E67-W81 PolarHBondContact OE2-NE1 2.98Å; T77-W81 PolarHBondContact O-N 3.19Å; T77-W81 PolarHBondContact OG1-NE1 3.49Å; Q78-W81 PolarHBondContact O-N 3.42Å; W81-L84 HydrophobicContact CE3-CD1 4.19Å; W81-L84 HydrophobicContact CZ3-CD1 4.38Å; W81-W85 PolarHBondContact O-N 3.01Å; W81-W102 HydrophobicContact CB-CB 3.82Å; W81-R103 HydrophobicContact CD2-CB 4.07Å; W81-R103 HydrophobicContact CD2-CG 4.23Å; W81-R103 HydrophobicContact CG-CB 3.95Å; W81-R103 HydrophobicContact CZ2-CG 3.94Å; W81-F106 HydrophobicContact CE3-CB 4.22Å; W81-F106 AromaticContact CE3-CD1 3.79Å; W81-F106 HydrophobicContact CE3-CD1 3.79Å; W81-F106 HydrophobicContact CE3-CE1 4.48Å; W81-F106 AromaticContact CE3-CG 3.98Å; W81-F106 HydrophobicContact CE3-CG 3.98Å; W81-F106 AromaticContact CZ3-CD1 3.73Å; W81-F106 HydrophobicContact CZ3-CD1 3.73Å; W81-F106 HydrophobicContact CZ3-CE1 4.14Å; W81-F106 HydrophobicContact CZ3-CG 4.39Å; W81-M107 HydrophobicContact CH2-SD 4.35Å; W81-M107 HydrophobicContact CZ3-SD 4.21Å
82	R	91.2	Very high	88.1	Confident	123 Å²	123	73.5 Å²	73.5	46%	0.464	37%	0.366	S	S	.	.	H	α-helix	trans	-62.2	-46.4	169.6	179.7	178.8	-67.3	164.3	-0.6	112.1	Q78 I80 L84 W85 D86 W102	Q78-R82 PolarHBondContact O-N 2.98Å; I80-R82 VanDerWaalsContact C-N 3.35Å; I80-R82 PolarHBondContact O-N 2.79Å; R82-L84 VanDerWaalsContact C-N 3.32Å; R82-L84 PolarHBondContact O-N 3.22Å; R82-W85 WeakPolarHBondContact O-CA 3.35Å; R82-W85 VanDerWaalsContact O-CB 3.27Å; R82-W85 WeakPolarHBondContact O-CB 3.38Å; R82-W85 PolarHBondContact O-N 3.33Å; R82-W85 VanDerWaalsContact O-N 3.1Å; R82-D86 PolarHBondContact O-N 3.15Å; R82-W102 HydrophobicContact CB-CD2 3.8Å; R82-W102 HydrophobicContact CB-CE3 3.7Å; R82-W102 HydrophobicContact CB-CG 4.2Å; R82-W102 HydrophobicContact CB-CZ3 4.14Å; R82-W102 HydrophobicContact CG-CD2 4.19Å; R82-W102 HydrophobicContact CG-CE3 3.91Å; R82-W102 HydrophobicContact CG-CH2 4.01Å; R82-W102 HydrophobicContact CG-CZ2 4.36Å; R82-W102 HydrophobicContact CG-CZ3 3.8Å; R82-W102 VanDerWaalsContact NE-CE2 3.33Å; R82-W102 VanDerWaalsContact NE-CZ2 3.25Å; R82-W102 VanDerWaalsContact NH2-NE1 3.13Å
83	R	90.1	Very high	87	Confident	146 Å²	146	67.8 Å²	67.8	55%	0.551	35%	0.345	S	S	*	.	H	α-helix	trans	-61.4	-40.9	178.5	-178.5	174.4	172.7	163.6	4.5	112.2	A79 I80 W85 D86 E87	A79-R83 WeakPolarHBondContact O-CB 3.28Å; A79-R83 PolarHBondContact O-N 3.08Å; I80-R83 PolarHBondContact O-N 3.47Å; I80-R83 VanDerWaalsContact O-N 3.15Å; R83-W85 VanDerWaalsContact C-N 3.33Å; R83-D86 PolarHBondContact O-N 3.18Å; R83-E87 HydrophobicContact CG-CG 4.36Å; R83-E87 IonicContact CZ-OE1 2.87Å; R83-E87 VanDerWaalsContact CZ-OE1 3.24Å; R83-E87 IonicContact NE-OE1 3.21Å; R83-E87 PolarHBondContact NE-OE1 3.32Å; R83-E87 IonicContact NE-OE2 3.87Å; R83-E87 IonicContact NH2-OE1 2.77Å; R83-E87 PolarHBondContact NH2-OE1 3.48Å; R83-E87 WeakPolarHBondContact O-CB 3.33Å; R83-E87 VanDerWaalsContact O-CG 3.31Å; R83-E87 WeakPolarHBondContact O-CG 3.47Å; R83-E87 PolarHBondContact O-N 3.43Å
84	L	89.9	Confident	85.9	Confident	4 Å²	4	68 Å²	68	2%	0.021	36%	0.356	C	S	.	.	H	α-helix	trans	-65.1	-35.6	173.8	-71.2	172.7	0	0	0	112.2	I60 L63 I80 W81 R82 L88 F106	I60-L84 HydrophobicContact CD1-CD1 4.45Å; I60-L84 HydrophobicContact CG1-CD1 4.3Å; L63-L84 HydrophobicContact CD2-CD1 3.6Å; I80-L84 HydrophobicContact CG2-CD1 4.44Å; I80-L84 WeakPolarHBondContact O-CG 3.33Å; I80-L84 PolarHBondContact O-N 2.83Å; W81-L84 HydrophobicContact CE3-CD1 4.19Å; W81-L84 HydrophobicContact CZ3-CD1 4.38Å; R82-L84 VanDerWaalsContact C-N 3.32Å; R82-L84 PolarHBondContact O-N 3.22Å; L84-L88 HydrophobicContact CB-CD1 4.49Å; L84-L88 HydrophobicContact CD2-CD1 4.37Å; L84-L88 VanDerWaalsContact O-CB 3.25Å; L84-L88 WeakPolarHBondContact O-CB 3.49Å; L84-L88 WeakPolarHBondContact O-CG 3.49Å; L84-L88 PolarHBondContact O-N 3.3Å; L84-F106 HydrophobicContact CB-CD2 4.21Å; L84-F106 HydrophobicContact CB-CE2 3.82Å; L84-F106 HydrophobicContact CB-CZ 4.4Å
85	W	90.4	Very high	84.2	Confident	14 Å²	14	70.5 Å²	70.5	5%	0.053	36%	0.362	C	S	.	.	H	α-helix	trans	-58.7	-52.5	171	177.3	-74.5	0	0	0	111.1	W81 R82 R83 E87 L88 M89 T91 P93 W102 K105 F106 A109	W81-W85 PolarHBondContact O-N 3.01Å; R82-W85 WeakPolarHBondContact O-CA 3.35Å; R82-W85 VanDerWaalsContact O-CB 3.27Å; R82-W85 WeakPolarHBondContact O-CB 3.38Å; R82-W85 PolarHBondContact O-N 3.33Å; R82-W85 VanDerWaalsContact O-N 3.1Å; R83-W85 VanDerWaalsContact C-N 3.33Å; W85-E87 VanDerWaalsContact C-N 3.34Å; W85-E87 PolarHBondContact O-N 2.99Å; W85-L88 PolarHBondContact O-N 3.38Å; W85-M89 HydrophobicContact CD2-CB 4.11Å; W85-M89 HydrophobicContact CD2-CG 3.87Å; W85-M89 HydrophobicContact CE3-CG 3.94Å; W85-M89 HydrophobicContact CG-CB 4.34Å; W85-M89 HydrophobicContact CG-CG 4.23Å; W85-M89 HydrophobicContact CZ2-CB 4.34Å; W85-M89 HydrophobicContact CZ3-CG 4.33Å; W85-M89 WeakPolarHBondContact O-CB 3.42Å; W85-M89 PolarHBondContact O-N 2.69Å; W85-T91 PolarHBondContact NE1-O 2.88Å; W85-P93 HydrophobicContact CZ2-CG 4.16Å; W85-W102 HydrophobicContact CB-CE3 4.25Å; W85-W102 HydrophobicContact CB-CZ3 4.12Å; W85-W102 HydrophobicContact CD2-CZ3 4.31Å; W85-W102 HydrophobicContact CG-CE3 4.42Å; W85-W102 AromaticContact CG-CZ3 3.91Å; W85-W102 HydrophobicContact CG-CZ3 3.91Å; W85-K105 HydrophobicContact CE3-CG 4.41Å; W85-K105 HydrophobicContact CH2-CG 4.37Å; W85-K105 HydrophobicContact CZ3-CG 3.85Å; W85-F106 HydrophobicContact CB-CD2 4.13Å; W85-F106 HydrophobicContact CE3-CB 4.47Å; W85-A109 HydrophobicContact CE3-CB 4.33Å; W85-A109 HydrophobicContact CH2-CB 3.66Å; W85-A109 HydrophobicContact CZ3-CB 3.34Å
86	D	87.8	Confident	82.2	Confident	97 Å²	97	77.6 Å²	77.6	52%	0.519	40%	0.399	S	S	.	.	H	α-helix	trans	-64.5	-36.8	-177.8	-62.6	-35.5	0	0	0	112.2	R82 R83	R82-D86 PolarHBondContact O-N 3.15Å; R83-D86 PolarHBondContact O-N 3.18Å
87	E	86.6	Confident	81.1	Confident	71 Å²	71	77.6 Å²	77.6	33%	0.332	39%	0.39	S	S	.	.	H	α-helix	trans	-74.1	-37.2	178.6	-72.7	174.5	167.6	0	0	113.2	R83 W85 R126	R83-E87 HydrophobicContact CG-CG 4.36Å; R83-E87 IonicContact CZ-OE1 2.87Å; R83-E87 VanDerWaalsContact CZ-OE1 3.24Å; R83-E87 IonicContact NE-OE1 3.21Å; R83-E87 PolarHBondContact NE-OE1 3.32Å; R83-E87 IonicContact NE-OE2 3.87Å; R83-E87 IonicContact NH2-OE1 2.77Å; R83-E87 PolarHBondContact NH2-OE1 3.48Å; R83-E87 WeakPolarHBondContact O-CB 3.33Å; R83-E87 VanDerWaalsContact O-CG 3.31Å; R83-E87 WeakPolarHBondContact O-CG 3.47Å; R83-E87 PolarHBondContact O-N 3.43Å; W85-E87 VanDerWaalsContact C-N 3.34Å; W85-E87 PolarHBondContact O-N 2.99Å; E87-R126 IonicContact OE2-CZ 2.79Å; E87-R126 IonicContact OE2-NH1 3.39Å; E87-R126 PolarHBondContact OE2-NH1 2.99Å; E87-R126 IonicContact OE2-NH2 2.69Å
88	L	85.7	Confident	80.2	Confident	33 Å²	33	82.6 Å²	82.6	17%	0.173	43%	0.425	C	S	.	.	H	α-helix	trans	-105.1	-46.5	-171.2	-64	169	0	0	0	114.7	I60 L84 W85 K90 F106 L127	I60-L88 HydrophobicContact CD1-CD1 4.07Å; L84-L88 HydrophobicContact CB-CD1 4.49Å; L84-L88 HydrophobicContact CD2-CD1 4.37Å; L84-L88 VanDerWaalsContact O-CB 3.25Å; L84-L88 WeakPolarHBondContact O-CB 3.49Å; L84-L88 WeakPolarHBondContact O-CG 3.49Å; L84-L88 PolarHBondContact O-N 3.3Å; W85-L88 PolarHBondContact O-N 3.38Å; L88-K90 VanDerWaalsContact C-N 3.34Å; L88-K90 PolarHBondContact O-N 3.19Å; L88-F106 HydrophobicContact CD1-CE2 4.01Å; L88-F106 HydrophobicContact CD1-CZ 3.79Å; L88-L127 HydrophobicContact CD1-CD2 3.96Å; L88-L127 HydrophobicContact CD2-CD1 4.43Å
89	M	84.5	Confident	79.7	Confident	8 Å²	8	81.8 Å²	81.8	4%	0.039	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-21.9	-171.6	-58.4	-61.4	158.6	0	0	112.6	W85 T91 F106 A109 F110 I119	W85-M89 HydrophobicContact CD2-CB 4.11Å; W85-M89 HydrophobicContact CD2-CG 3.87Å; W85-M89 HydrophobicContact CE3-CG 3.94Å; W85-M89 HydrophobicContact CG-CB 4.34Å; W85-M89 HydrophobicContact CG-CG 4.23Å; W85-M89 HydrophobicContact CZ2-CB 4.34Å; W85-M89 HydrophobicContact CZ3-CG 4.33Å; W85-M89 WeakPolarHBondContact O-CB 3.42Å; W85-M89 PolarHBondContact O-N 2.69Å; M89-T91 WeakPolarHBondContact O-CG2 3.46Å; M89-T91 PolarHBondContact O-N 3.23Å; M89-T91 PolarHBondContact O-OG1 3.45Å; M89-F106 HydrophobicContact CE-CD2 3.87Å; M89-F106 HydrophobicContact CE-CE1 4.16Å; M89-F106 HydrophobicContact CE-CE2 3.38Å; M89-F106 HydrophobicContact CE-CG 4.45Å; M89-F106 HydrophobicContact CE-CZ 3.52Å; M89-F106 HydrophobicContact CG-CE2 4.46Å; M89-A109 HydrophobicContact SD-CB 4.1Å; M89-F110 HydrophobicContact CE-CB 3.66Å; M89-F110 HydrophobicContact CE-CD2 4.09Å; M89-F110 HydrophobicContact CE-CG 4.36Å; M89-I119 HydrophobicContact CE-CD1 4.22Å; M89-I119 HydrophobicContact SD-CD1 4.05Å
90	K	79.6	Confident	79.4	Confident	183 Å²	183	84.8 Å²	84.8	80%	0.796	43%	0.434	S	S	*	.			trans	51	17.3	176.5	-61.3	175.1	-175.6	172.1	0	115	L88	L88-K90 VanDerWaalsContact C-N 3.34Å; L88-K90 PolarHBondContact O-N 3.19Å
91	T	74.5	Confident	79.3	Confident	70 Å²	70	85.7 Å²	85.7	43%	0.429	44%	0.442	S	S	.	.	S	Bend	trans	-125.3	142	-175.7	42.5	0	0	0	0	108	W85 M89	W85-T91 PolarHBondContact NE1-O 2.88Å; M89-T91 WeakPolarHBondContact O-CG2 3.46Å; M89-T91 PolarHBondContact O-N 3.23Å; M89-T91 PolarHBondContact O-OG1 3.45Å
92	R	68.9	Low	79.2	Confident	239 Å²	239	86.9 Å²	86.9	90%	0.902	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-80.4	140.1	172.2	-66.5	-176.9	-178.3	172.9	2.5	108.8
93	P	68.1	Low	79.3	Confident	34 Å²	34	82.9 Å²	82.9	22%	0.221	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-56.5	151.5	163.5	-19.3	31.8	0	0	0	110.1	W85 S95 V99 W102	W85-P93 HydrophobicContact CZ2-CG 4.16Å; P93-S95 PolarHBondContact O-N 2.8Å; P93-V99 HydrophobicContact CB-CG2 4.24Å; P93-W102 HydrophobicContact CG-CH2 3.8Å; P93-W102 HydrophobicContact CG-CZ3 4.16Å
94	S	66.1	Low	79.4	Confident	80 Å²	80	77.7 Å²	77.7	56%	0.559	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-54.5	129.5	173.3	-59.6	0	0	0	0	110	L96 E97	S94-L96 PolarHBondContact O-N 3.35Å; S94-E97 WeakPolarHBondContact O-CB 3.43Å; S94-E97 PolarHBondContact O-N 3.26Å
95	S	55.2	Low	79.5	Confident	126 Å²	126	79.4 Å²	79.4	88%	0.881	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-17.2	-176.6	48.6	0	0	0	0	114.4	P93	P93-S95 PolarHBondContact O-N 2.8Å
96	L	51.8	Low	79.6	Confident	169 Å²	169	78.8 Å²	78.8	89%	0.885	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-9.9	174.6	-62.9	168.9	0	0	0	113.4	S94	S94-L96 PolarHBondContact O-N 3.35Å
97	E	69.3	Low	79.8	Confident	84 Å²	84	74.1 Å²	74.1	39%	0.393	40%	0.4	S	S	.	.			trans	-100.8	106.8	-172.7	-165.9	-176.5	168.8	0	0	111.9	S94 V99 K105	S94-E97 WeakPolarHBondContact O-CB 3.43Å; S94-E97 PolarHBondContact O-N 3.26Å; E97-V99 PolarHBondContact O-N 2.89Å; E97-K105 VanDerWaalsContact OE1-CE 3.28Å; E97-K105 WeakPolarHBondContact OE1-CE 3.49Å; E97-K105 IonicContact OE1-NZ 2.68Å; E97-K105 PolarHBondContact OE1-NZ 2.74Å; E97-K105 WeakPolarHBondContact OE2-CE 3.44Å; E97-K105 IonicContact OE2-NZ 3.19Å; E97-K105 PolarHBondContact OE2-NZ 3.01Å
98	S	74.8	Confident	80.1	Confident	107 Å²	107	72.6 Å²	72.6	75%	0.748	39%	0.393	S	S	*	.			trans	-74.7	85.2	175.3	45.6	0	0	0	0	111.4	T100	S98-T100 PolarHBondContact O-N 3.22Å
99	V	82.8	Confident	80.3	Confident	29 Å²	29	71.7 Å²	71.7	18%	0.176	39%	0.39	C	S	.	.			trans	-62	96.4	-177.4	-174.6	0	0	0	0	112.1	P93 E97 W102 K105	P93-V99 HydrophobicContact CB-CG2 4.24Å; E97-V99 PolarHBondContact O-N 2.89Å; V99-W102 HydrophobicContact CB-CD2 4.47Å; V99-W102 HydrophobicContact CB-CZ2 3.89Å; V99-W102 HydrophobicContact CG1-CD2 3.78Å; V99-W102 HydrophobicContact CG1-CE3 4.42Å; V99-W102 HydrophobicContact CG1-CG 3.93Å; V99-W102 HydrophobicContact CG1-CZ2 4.1Å; V99-W102 HydrophobicContact CG2-CZ2 4.16Å; V99-W102 PolarHBondContact O-NE1 2.99Å; V99-K105 HydrophobicContact CG1-CB 3.82Å; V99-K105 HydrophobicContact CG1-CG 4.06Å; V99-K105 HydrophobicContact CG2-CG 4.39Å
100	T	85	Confident	80.7	Confident	138 Å²	138	71.3 Å²	71.3	85%	0.847	39%	0.388	S	S	*	.	S	Bend	trans	-72.3	-32.1	179.3	54.4	0	0	0	0	113.4	S98	S98-T100 PolarHBondContact O-N 3.22Å
101	C	90.5	Very high	81.3	Confident	44 Å²	44	62.6 Å²	62.6	30%	0.297	35%	0.35	S	S	.	.			trans	-140.9	107.2	179.2	-175.8	0	0	0	0	111.6	R103 A104 K105	C101-R103 VanDerWaalsContact C-N 3.35Å; C101-R103 PolarHBondContact O-N 2.88Å; C101-A104 HydrophobicContact CB-CB 4.18Å; C101-A104 PolarHBondContact O-N 3.2Å; C101-K105 PolarHBondContact O-N 3.19Å
102	W	91.6	Very high	82.1	Confident	25 Å²	25	59.9 Å²	59.9	10%	0.095	33%	0.334	C	S	.	.	H	α-helix	trans	-68.6	-30.7	179.9	-73.3	78.6	0	0	0	112.8	W81 R82 W85 P93 V99 F106	W81-W102 HydrophobicContact CB-CB 3.82Å; R82-W102 HydrophobicContact CB-CD2 3.8Å; R82-W102 HydrophobicContact CB-CE3 3.7Å; R82-W102 HydrophobicContact CB-CG 4.2Å; R82-W102 HydrophobicContact CB-CZ3 4.14Å; R82-W102 HydrophobicContact CG-CD2 4.19Å; R82-W102 HydrophobicContact CG-CE3 3.91Å; R82-W102 HydrophobicContact CG-CH2 4.01Å; R82-W102 HydrophobicContact CG-CZ2 4.36Å; R82-W102 HydrophobicContact CG-CZ3 3.8Å; R82-W102 VanDerWaalsContact NE-CE2 3.33Å; R82-W102 VanDerWaalsContact NE-CZ2 3.25Å; R82-W102 VanDerWaalsContact NH2-NE1 3.13Å; W85-W102 HydrophobicContact CB-CE3 4.25Å; W85-W102 HydrophobicContact CB-CZ3 4.12Å; W85-W102 HydrophobicContact CD2-CZ3 4.31Å; W85-W102 HydrophobicContact CG-CE3 4.42Å; W85-W102 AromaticContact CG-CZ3 3.91Å; W85-W102 HydrophobicContact CG-CZ3 3.91Å; P93-W102 HydrophobicContact CG-CH2 3.8Å; P93-W102 HydrophobicContact CG-CZ3 4.16Å; V99-W102 HydrophobicContact CB-CD2 4.47Å; V99-W102 HydrophobicContact CB-CZ2 3.89Å; V99-W102 HydrophobicContact CG1-CD2 3.78Å; V99-W102 HydrophobicContact CG1-CE3 4.42Å; V99-W102 HydrophobicContact CG1-CG 3.93Å; V99-W102 HydrophobicContact CG1-CZ2 4.1Å; V99-W102 HydrophobicContact CG2-CZ2 4.16Å; V99-W102 PolarHBondContact O-NE1 2.99Å; W102-F106 WeakPolarHBondContact O-CB 3.38Å; W102-F106 PolarHBondContact O-N 3.32Å
103	R	92.6	Very high	83.1	Confident	40 Å²	40	50.3 Å²	50.3	15%	0.151	30%	0.299	C	S	.	.	H	α-helix	trans	-59.1	-51	171.4	179.5	168.6	177	-120.9	13.4	111.4	E64 E67 W81 C101 M107 R140	E64-R103 PolarHBondContact O-NH2 3.15Å; E64-R103 IonicContact OE2-NH2 2.64Å; E64-R103 PolarHBondContact OE2-NH2 3.37Å; E67-R103 VanDerWaalsContact OE1-CD 3.23Å; E67-R103 WeakPolarHBondContact OE1-CD 3.13Å; E67-R103 WeakPolarHBondContact OE2-CD 3.32Å; E67-R103 IonicContact OE2-NE 3.23Å; W81-R103 HydrophobicContact CD2-CB 4.07Å; W81-R103 HydrophobicContact CD2-CG 4.23Å; W81-R103 HydrophobicContact CG-CB 3.95Å; W81-R103 HydrophobicContact CZ2-CG 3.94Å; C101-R103 VanDerWaalsContact C-N 3.35Å; C101-R103 PolarHBondContact O-N 2.88Å; R103-M107 WeakPolarHBondContact O-CB 3.42Å; R103-M107 WeakPolarHBondContact O-CG 3.4Å; R103-M107 PolarHBondContact O-N 3.1Å; R103-R140 VanDerWaalsContact NH2-NH2 3.15Å
104	A	91.6	Very high	84.1	Confident	36 Å²	36	49.7 Å²	49.7	30%	0.298	30%	0.295	S	S	.	.	H	α-helix	trans	-64.7	-49.4	-179.8	0	0	0	0	0	111.1	C101 F106 M107 E108	C101-A104 HydrophobicContact CB-CB 4.18Å; C101-A104 PolarHBondContact O-N 3.2Å; A104-F106 PolarHBondContact O-N 3.08Å; A104-M107 PolarHBondContact O-N 3.42Å; A104-E108 PolarHBondContact O-N 2.9Å
105	K	91.4	Very high	85.3	Confident	41 Å²	41	46.4 Å²	46.4	18%	0.178	27%	0.271	C	S	.	.	H	α-helix	trans	-60.9	-43.3	-179.5	-170.9	61.2	174	-170.4	0	112.5	W85 E97 V99 C101 A109	W85-K105 HydrophobicContact CE3-CG 4.41Å; W85-K105 HydrophobicContact CH2-CG 4.37Å; W85-K105 HydrophobicContact CZ3-CG 3.85Å; E97-K105 VanDerWaalsContact OE1-CE 3.28Å; E97-K105 WeakPolarHBondContact OE1-CE 3.49Å; E97-K105 IonicContact OE1-NZ 2.68Å; E97-K105 PolarHBondContact OE1-NZ 2.74Å; E97-K105 WeakPolarHBondContact OE2-CE 3.44Å; E97-K105 IonicContact OE2-NZ 3.19Å; E97-K105 PolarHBondContact OE2-NZ 3.01Å; V99-K105 HydrophobicContact CG1-CB 3.82Å; V99-K105 HydrophobicContact CG1-CG 4.06Å; V99-K105 HydrophobicContact CG2-CG 4.39Å; C101-K105 PolarHBondContact O-N 3.19Å; K105-A109 PolarHBondContact O-N 3.03Å; K105-A109 VanDerWaalsContact O-N 3.12Å
106	F	92.4	Very high	86.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-60.2	-49.2	174.3	178.9	-82.1	0	0	0	111.5	I60 W81 L84 W85 L88 M89 W102 A104 E108 A109 F110	I60-F106 HydrophobicContact CD1-CE1 3.51Å; I60-F106 HydrophobicContact CD1-CZ 3.45Å; I60-F106 VanDerWaalsContact CD1-CZ 3.45Å; W81-F106 HydrophobicContact CE3-CB 4.22Å; W81-F106 AromaticContact CE3-CD1 3.79Å; W81-F106 HydrophobicContact CE3-CD1 3.79Å; W81-F106 HydrophobicContact CE3-CE1 4.48Å; W81-F106 AromaticContact CE3-CG 3.98Å; W81-F106 HydrophobicContact CE3-CG 3.98Å; W81-F106 AromaticContact CZ3-CD1 3.73Å; W81-F106 HydrophobicContact CZ3-CD1 3.73Å; W81-F106 HydrophobicContact CZ3-CE1 4.14Å; W81-F106 HydrophobicContact CZ3-CG 4.39Å; L84-F106 HydrophobicContact CB-CD2 4.21Å; L84-F106 HydrophobicContact CB-CE2 3.82Å; L84-F106 HydrophobicContact CB-CZ 4.4Å; W85-F106 HydrophobicContact CB-CD2 4.13Å; W85-F106 HydrophobicContact CE3-CB 4.47Å; L88-F106 HydrophobicContact CD1-CE2 4.01Å; L88-F106 HydrophobicContact CD1-CZ 3.79Å; M89-F106 HydrophobicContact CE-CD2 3.87Å; M89-F106 HydrophobicContact CE-CE1 4.16Å; M89-F106 HydrophobicContact CE-CE2 3.38Å; M89-F106 HydrophobicContact CE-CG 4.45Å; M89-F106 HydrophobicContact CE-CZ 3.52Å; M89-F106 HydrophobicContact CG-CE2 4.46Å; W102-F106 WeakPolarHBondContact O-CB 3.38Å; W102-F106 PolarHBondContact O-N 3.32Å; A104-F106 PolarHBondContact O-N 3.08Å; F106-E108 PolarHBondContact O-N 3.19Å; F106-A109 PolarHBondContact O-N 2.86Å; F106-F110 HydrophobicContact CD1-CB 4.27Å; F106-F110 HydrophobicContact CE1-CB 3.84Å; F106-F110 HydrophobicContact CE1-CD2 4.39Å; F106-F110 HydrophobicContact CE1-CG 4.03Å; F106-F110 HydrophobicContact CZ-CB 4.35Å; F106-F110 HydrophobicContact CZ-CD2 4.4Å; F106-F110 HydrophobicContact CZ-CG 4.46Å; F106-F110 WeakPolarHBondContact O-CB 3.38Å; F106-F110 PolarHBondContact O-N 3.17Å
107	M	93.3	Very high	88.4	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-66.1	-37.9	-176.6	-66.3	-66.6	-82.5	0	0	112	I60 E64 W81 R103 A104 F110 F111 H137 S138 H141	I60-M107 HydrophobicContact CG2-SD 4.2Å; E64-M107 HydrophobicContact CG-CE 3.92Å; W81-M107 HydrophobicContact CH2-SD 4.35Å; W81-M107 HydrophobicContact CZ3-SD 4.21Å; R103-M107 WeakPolarHBondContact O-CB 3.42Å; R103-M107 WeakPolarHBondContact O-CG 3.4Å; R103-M107 PolarHBondContact O-N 3.1Å; A104-M107 PolarHBondContact O-N 3.42Å; M107-F110 PolarHBondContact O-N 3.48Å; M107-F111 WeakPolarHBondContact O-CB 3.33Å; M107-F111 PolarHBondContact O-N 2.89Å; M107-H137 HydrophobicContact CE-CB 4.44Å; M107-S138 WeakPolarHBondContact O-CB 3.28Å; M107-H141 HydrophobicContact CB-CB 3.76Å
108	E	92.5	Very high	89.2	Confident	38 Å²	38	39.8 Å²	39.8	18%	0.178	24%	0.24	C	C	.	.	H	α-helix	trans	-66.5	-39.8	176	-177	171	-120.5	0	0	112.8	A104 F106 S112 V142 R143 Q144	A104-E108 PolarHBondContact O-N 2.9Å; F106-E108 PolarHBondContact O-N 3.19Å; E108-S112 WeakPolarHBondContact O-CB 3.46Å; E108-S112 PolarHBondContact O-N 3.03Å; E108-S112 VanDerWaalsContact O-N 3.17Å; E108-S112 PolarHBondContact O-OG 2.94Å; E108-V142 HydrophobicContact CG-CG1 4.44Å; E108-V142 HydrophobicContact CG-CG2 4.45Å; E108-R143 PolarHBondContact OE1-N 3.19Å; E108-Q144 PolarHBondContact OE1-N 3.18Å
109	A	91	Very high	89.8	Confident	14 Å²	14	36 Å²	36	12%	0.116	21%	0.211	C	C	.	.	H	α-helix	trans	-68.8	-42.8	172.4	0	0	0	0	0	111.9	W85 M89 K105 F106 F111 S112 H113	W85-A109 HydrophobicContact CE3-CB 4.33Å; W85-A109 HydrophobicContact CH2-CB 3.66Å; W85-A109 HydrophobicContact CZ3-CB 3.34Å; M89-A109 HydrophobicContact SD-CB 4.1Å; K105-A109 PolarHBondContact O-N 3.03Å; K105-A109 VanDerWaalsContact O-N 3.12Å; F106-A109 PolarHBondContact O-N 2.86Å; A109-F111 PolarHBondContact O-N 3.48Å; A109-S112 CarbonylContact O-C 3.59Å; A109-S112 WeakPolarHBondContact O-CA 3.41Å; A109-S112 WeakPolarHBondContact O-CB 3.35Å; A109-S112 PolarHBondContact O-N 3.11Å; A109-S112 VanDerWaalsContact O-N 3.1Å; A109-H113 WeakPolarHBondContact O-CB 3.37Å; A109-H113 PolarHBondContact O-CD2 2.68Å; A109-H113 VanDerWaalsContact O-CD2 3.23Å; A109-H113 PolarHBondContact O-N 3.29Å
110	F	92	Very high	89.7	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-59.4	-46.4	177.6	-178.6	-116.9	0	0	0	111.7	M89 F106 M107 S112 H113 V114 I119 V121 L127 F132 P134	M89-F110 HydrophobicContact CE-CB 3.66Å; M89-F110 HydrophobicContact CE-CD2 4.09Å; M89-F110 HydrophobicContact CE-CG 4.36Å; F106-F110 HydrophobicContact CD1-CB 4.27Å; F106-F110 HydrophobicContact CE1-CB 3.84Å; F106-F110 HydrophobicContact CE1-CD2 4.39Å; F106-F110 HydrophobicContact CE1-CG 4.03Å; F106-F110 HydrophobicContact CZ-CB 4.35Å; F106-F110 HydrophobicContact CZ-CD2 4.4Å; F106-F110 HydrophobicContact CZ-CG 4.46Å; F106-F110 WeakPolarHBondContact O-CB 3.38Å; F106-F110 PolarHBondContact O-N 3.17Å; M107-F110 PolarHBondContact O-N 3.48Å; F110-S112 VanDerWaalsContact C-N 3.31Å; F110-S112 PolarHBondContact O-N 3.08Å; F110-H113 PolarHBondContact O-N 2.69Å; F110-V114 HydrophobicContact CD2-CG2 4.14Å; F110-V114 HydrophobicContact CE1-CG2 4.36Å; F110-V114 HydrophobicContact CE2-CG2 3.8Å; F110-V114 HydrophobicContact CZ-CG2 3.92Å; F110-V114 WeakPolarHBondContact O-CG2 3.43Å; F110-V114 PolarHBondContact O-N 3.4Å; F110-I119 HydrophobicContact CD2-CD1 4.36Å; F110-I119 HydrophobicContact CE2-CG2 4.4Å; F110-V121 HydrophobicContact CE2-CG2 4.47Å; F110-V121 HydrophobicContact CZ-CG2 4.22Å; F110-L127 HydrophobicContact CE2-CD1 4.28Å; F110-L127 HydrophobicContact CE2-CD2 3.77Å; F110-L127 HydrophobicContact CZ-CD2 4.05Å; F110-F132 AromaticContact CE1-CE1 3.77Å; F110-F132 HydrophobicContact CE1-CE1 3.77Å; F110-F132 AromaticContact CE1-CZ 3.68Å; F110-F132 HydrophobicContact CE1-CZ 3.68Å; F110-F132 AromaticContact CZ-CE1 3.96Å; F110-F132 HydrophobicContact CZ-CE1 3.96Å; F110-F132 HydrophobicContact CZ-CZ 4.32Å; F110-P134 HydrophobicContact CE1-CB 3.71Å; F110-P134 HydrophobicContact CZ-CB 3.93Å
111	F	93.1	Very high	89.6	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-51.6	-52.3	170.3	-175.7	-86.7	0	0	0	111.3	M107 A109 H113 V114 L115 L135 S138 V142 L145 L157 V165 L169	M107-F111 WeakPolarHBondContact O-CB 3.33Å; M107-F111 PolarHBondContact O-N 2.89Å; A109-F111 PolarHBondContact O-N 3.48Å; F111-H113 VanDerWaalsContact C-N 3.28Å; F111-H113 PolarHBondContact O-N 3.19Å; F111-V114 PolarHBondContact O-N 3.17Å; F111-L115 HydrophobicContact CD1-CD2 4.47Å; F111-L115 HydrophobicContact CE1-CD2 3.67Å; F111-L115 HydrophobicContact CZ-CD2 4.25Å; F111-L115 WeakPolarHBondContact O-CB 3.46Å; F111-L115 PolarHBondContact O-N 2.95Å; F111-L135 HydrophobicContact CD2-CB 4.34Å; F111-L135 HydrophobicContact CD2-CD2 3.87Å; F111-L135 WeakPolarHBondContact CD2-O 3.41Å; F111-L135 HydrophobicContact CE2-CB 3.96Å; F111-L135 HydrophobicContact CE2-CD2 3.81Å; F111-L135 HydrophobicContact CE2-CG 4.47Å; F111-L135 WeakPolarHBondContact CE2-O 3.18Å; F111-L135 HydrophobicContact CG-CD2 4.33Å; F111-L135 HydrophobicContact CZ-CD2 4.21Å; F111-S138 WeakPolarHBondContact CB-OG 3.4Å; F111-S138 WeakPolarHBondContact CD2-OG 3.23Å; F111-V142 HydrophobicContact CB-CG2 3.67Å; F111-V142 HydrophobicContact CD1-CG2 3.68Å; F111-V142 HydrophobicContact CD2-CG2 3.93Å; F111-V142 HydrophobicContact CE1-CG2 4.34Å; F111-V142 HydrophobicContact CG-CG2 3.46Å; F111-V142 VanDerWaalsContact CG-CG2 3.46Å; F111-L145 HydrophobicContact CD1-CD1 4.44Å; F111-L145 HydrophobicContact CE1-CD1 3.86Å; F111-L157 HydrophobicContact CZ-CD2 3.87Å; F111-V165 HydrophobicContact CE2-CG1 3.6Å; F111-V165 HydrophobicContact CZ-CG1 4Å; F111-L169 HydrophobicContact CZ-CD1 3.88Å; F111-L169 HydrophobicContact CZ-CD2 4.32Å
112	S	90.3	Very high	89.1	Confident	13 Å²	13	35.9 Å²	35.9	9%	0.091	21%	0.21	C	C	.	.	H	α-helix	trans	-65.1	-28.1	-177.9	-61.1	0	0	0	0	113.7	E108 A109 F110 R116	E108-S112 WeakPolarHBondContact O-CB 3.46Å; E108-S112 PolarHBondContact O-N 3.03Å; E108-S112 VanDerWaalsContact O-N 3.17Å; E108-S112 PolarHBondContact O-OG 2.94Å; A109-S112 CarbonylContact O-C 3.59Å; A109-S112 WeakPolarHBondContact O-CA 3.41Å; A109-S112 WeakPolarHBondContact O-CB 3.35Å; A109-S112 PolarHBondContact O-N 3.11Å; A109-S112 VanDerWaalsContact O-N 3.1Å; F110-S112 VanDerWaalsContact C-N 3.31Å; F110-S112 PolarHBondContact O-N 3.08Å; S112-R116 WeakPolarHBondContact O-CD 3.46Å; S112-R116 WeakPolarHBondContact O-CG 3.43Å; S112-R116 PolarHBondContact O-NE 2.93Å
113	H	89.1	Confident	88.3	Confident	38 Å²	38	39.3 Å²	39.3	18%	0.176	24%	0.238	C	C	.	.	H	α-helix	trans	-84.6	-36.2	178.6	-87.1	-75.7	0	0	0	112.6	A109 F110 F111 R116 T118 I119	A109-H113 WeakPolarHBondContact O-CB 3.37Å; A109-H113 PolarHBondContact O-CD2 2.68Å; A109-H113 VanDerWaalsContact O-CD2 3.23Å; A109-H113 PolarHBondContact O-N 3.29Å; F110-H113 PolarHBondContact O-N 2.69Å; F111-H113 VanDerWaalsContact C-N 3.28Å; F111-H113 PolarHBondContact O-N 3.19Å; H113-R116 PolarHBondContact O-N 2.84Å; H113-T118 VanDerWaalsContact CA-OG1 3.32Å; H113-T118 WeakPolarHBondContact CA-OG1 3.44Å; H113-T118 WeakPolarHBondContact CB-OG1 3.41Å; H113-T118 PolarHBondContact ND1-OG1 3.26Å; H113-T118 PolarHBondContact O-N 3.17Å; H113-T118 PolarHBondContact O-OG1 2.83Å; H113-I119 HydrophobicContact CB-CD1 3.58Å; H113-I119 HydrophobicContact CB-CG1 3.91Å
114	V	90.6	Very high	87.7	Confident	22 Å²	22	39.5 Å²	39.5	13%	0.133	24%	0.242	C	C	.	.	H	α-helix	trans	-67.1	-47.1	173.1	174.4	0	0	0	0	110.6	F110 F111 R116 G117 V121 P134 L135	F110-V114 HydrophobicContact CD2-CG2 4.14Å; F110-V114 HydrophobicContact CE1-CG2 4.36Å; F110-V114 HydrophobicContact CE2-CG2 3.8Å; F110-V114 HydrophobicContact CZ-CG2 3.92Å; F110-V114 WeakPolarHBondContact O-CG2 3.43Å; F110-V114 PolarHBondContact O-N 3.4Å; F111-V114 PolarHBondContact O-N 3.17Å; V114-R116 PolarHBondContact O-N 2.69Å; V114-G117 PolarHBondContact O-N 3.19Å; V114-V121 HydrophobicContact CG2-CG2 3.83Å; V114-P134 HydrophobicContact CG1-CB 4.23Å; V114-P134 HydrophobicContact CG2-CB 4.19Å; V114-L135 HydrophobicContact CB-CD2 4.03Å; V114-L135 HydrophobicContact CG1-CD2 3.82Å; V114-L135 HydrophobicContact CG1-CG 4.07Å
115	L	90.6	Very high	87	Confident	10 Å²	10	48.9 Å²	48.9	5%	0.052	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-10.6	178.5	-174	61.1	0	0	0	114.2	F111 L135 L145 E156 L157	F111-L115 HydrophobicContact CD1-CD2 4.47Å; F111-L115 HydrophobicContact CE1-CD2 3.67Å; F111-L115 HydrophobicContact CZ-CD2 4.25Å; F111-L115 WeakPolarHBondContact O-CB 3.46Å; F111-L115 PolarHBondContact O-N 2.95Å; L115-L135 HydrophobicContact CB-CD2 4.09Å; L115-L145 HydrophobicContact CD2-CD1 3.82Å; L115-E156 HydrophobicContact CD1-CB 4.01Å; L115-E156 HydrophobicContact CD1-CG 3.97Å; L115-L157 HydrophobicContact CD1-CD2 4.13Å; L115-L157 HydrophobicContact CD1-CG 3.93Å; L115-L157 HydrophobicContact CD2-CD1 3.77Å; L115-L157 HydrophobicContact CD2-CD2 4.36Å; L115-L157 HydrophobicContact CD2-CG 4.07Å
116	R	86.3	Confident	86.5	Confident	95 Å²	95	50.2 Å²	50.2	36%	0.358	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	2.2	173.5	-64.8	172.2	-163	147.6	6.3	113	S112 H113 V114 T118	S112-R116 WeakPolarHBondContact O-CD 3.46Å; S112-R116 WeakPolarHBondContact O-CG 3.43Å; S112-R116 PolarHBondContact O-NE 2.93Å; H113-R116 PolarHBondContact O-N 2.84Å; V114-R116 PolarHBondContact O-N 2.69Å; R116-T118 HydrophobicContact CB-CG2 3.84Å; R116-T118 PolarHBondContact O-N 3.15Å
117	G	86.4	Confident	86	Confident	62 Å²	62	50.4 Å²	50.4	64%	0.639	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	15.1	-172.2	0	0	0	0	0	114.7	V114	V114-G117 PolarHBondContact O-N 3.19Å
118	T	85.4	Confident	85.3	Confident	84 Å²	84	53.8 Å²	53.8	52%	0.515	30%	0.297	S	S	.	.			trans	-86.7	-10.1	-172.7	58.2	0	0	0	0	114.5	H113 R116	H113-T118 VanDerWaalsContact CA-OG1 3.32Å; H113-T118 WeakPolarHBondContact CA-OG1 3.44Å; H113-T118 WeakPolarHBondContact CB-OG1 3.41Å; H113-T118 PolarHBondContact ND1-OG1 3.26Å; H113-T118 PolarHBondContact O-N 3.17Å; H113-T118 PolarHBondContact O-OG1 2.83Å; R116-T118 HydrophobicContact CB-CG2 3.84Å; R116-T118 PolarHBondContact O-N 3.15Å
119	I	86.4	Confident	84.9	Confident	26 Å²	26	53.4 Å²	53.4	13%	0.133	30%	0.296	C	S	.	.	S	Bend	trans	-125.7	114.9	169.6	-68.9	176.4	0	0	0	107.3	M89 F110 H113 V121 L127	M89-I119 HydrophobicContact CE-CD1 4.22Å; M89-I119 HydrophobicContact SD-CD1 4.05Å; F110-I119 HydrophobicContact CD2-CD1 4.36Å; F110-I119 HydrophobicContact CE2-CG2 4.4Å; H113-I119 HydrophobicContact CB-CD1 3.58Å; H113-I119 HydrophobicContact CB-CG1 3.91Å; I119-V121 PolarHBondContact O-N 2.62Å; I119-L127 HydrophobicContact CG2-CD1 3.51Å
120	D	81.6	Confident	84.5	Confident	88 Å²	88	62.5 Å²	62.5	47%	0.471	34%	0.336	S	S	.	.			trans	-77.8	106.5	167.1	174.1	30.2	0	0	0	109.9	S122 S123	D120-S122 PolarHBondContact O-N 3.02Å; D120-S122 WeakPolarHBondContact OD1-CB 3.43Å; D120-S122 PolarHBondContact OD1-N 3.36Å; D120-S122 PolarHBondContact OD1-OG 2.86Å; D120-S123 PolarHBondContact O-N 3.23Å; D120-S123 PolarHBondContact O-OG 3.4Å; D120-S123 WeakPolarHBondContact OD2-CB 3.34Å; D120-S123 PolarHBondContact OD2-N 3.1Å; D120-S123 VanDerWaalsContact OD2-N 3.11Å
121	V	82.5	Confident	84.2	Confident	27 Å²	27	67.5 Å²	67.5	16%	0.164	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-23.3	176.8	172.8	0	0	0	0	112.1	F110 V114 I119 L127 C128 P134	F110-V121 HydrophobicContact CE2-CG2 4.47Å; F110-V121 HydrophobicContact CZ-CG2 4.22Å; V114-V121 HydrophobicContact CG2-CG2 3.83Å; I119-V121 PolarHBondContact O-N 2.62Å; V121-L127 HydrophobicContact CB-CB 4.4Å; V121-L127 HydrophobicContact CG1-CB 4Å; V121-C128 PolarHBondContact O-N 3.47Å; V121-P134 HydrophobicContact CB-CG 4.37Å; V121-P134 HydrophobicContact CG1-CG 3.79Å; V121-P134 HydrophobicContact CG2-CB 4.37Å; V121-P134 HydrophobicContact CG2-CG 3.89Å
122	S	80.1	Confident	83.9	Confident	95 Å²	95	68.3 Å²	68.3	66%	0.664	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-29.4	177.8	-29.6	0	0	0	0	112.6	D120	D120-S122 PolarHBondContact O-N 3.02Å; D120-S122 WeakPolarHBondContact OD1-CB 3.43Å; D120-S122 PolarHBondContact OD1-N 3.36Å; D120-S122 PolarHBondContact OD1-OG 2.86Å
123	S	75.7	Confident	83.9	Confident	96 Å²	96	69.9 Å²	69.9	67%	0.671	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-25.4	-173.6	69.7	0	0	0	0	114.8	D120	D120-S123 PolarHBondContact O-N 3.23Å; D120-S123 PolarHBondContact O-OG 3.4Å; D120-S123 WeakPolarHBondContact OD2-CB 3.34Å; D120-S123 PolarHBondContact OD2-N 3.1Å; D120-S123 VanDerWaalsContact OD2-N 3.11Å
124	D	79.6	Confident	84	Confident	45 Å²	45	69.1 Å²	69.1	24%	0.241	37%	0.368	C	S	.	.			trans	-118.3	125.8	-177.7	-176.1	1	0	0	0	112.1	R126 L127 C128	D124-R126 PolarHBondContact O-N 2.87Å; D124-R126 VanDerWaalsContact O-N 3.16Å; D124-R126 PolarHBondContact OD1-N 3.45Å; D124-L127 HydrophobicContact CB-CB 4.35Å; D124-L127 HydrophobicContact CB-CD1 4.12Å; D124-L127 HydrophobicContact CB-CG 3.97Å; D124-L127 PolarHBondContact O-N 2.91Å; D124-C128 PolarHBondContact O-N 3.17Å
125	R	77.2	Confident	84.1	Confident	232 Å²	232	68.4 Å²	68.4	88%	0.875	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-18.7	173.4	-74.9	-174.2	170.8	-164.6	-2.2	114.3
126	R	81.3	Confident	84.2	Confident	70 Å²	70	70.5 Å²	70.5	26%	0.264	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-18.9	171.4	-74.2	169.7	147.3	-175.2	-10.7	113.2	P56 N59 I60 E87 D124	P56-R126 PolarHBondContact O-NH2 3.45Å; P56-R126 VanDerWaalsContact O-NH2 3.15Å; N59-R126 WeakPolarHBondContact CB-O 3.45Å; I60-R126 PolarHBondContact N-O 3.36Å; E87-R126 IonicContact OE2-CZ 2.79Å; E87-R126 IonicContact OE2-NH1 3.39Å; E87-R126 PolarHBondContact OE2-NH1 2.99Å; E87-R126 IonicContact OE2-NH2 2.69Å; D124-R126 PolarHBondContact O-N 2.87Å; D124-R126 VanDerWaalsContact O-N 3.16Å; D124-R126 PolarHBondContact OD1-N 3.45Å
127	L	81.7	Confident	84.4	Confident	3 Å²	3	67.7 Å²	67.7	2%	0.016	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-34.5	177.8	-57.5	-175.5	0	0	0	111.9	I60 L88 F110 I119 V121 D124 D129 F132	I60-L127 HydrophobicContact CD1-CD2 3.41Å; I60-L127 VanDerWaalsContact CD1-CD2 3.41Å; I60-L127 HydrophobicContact CG1-CD2 4.1Å; L88-L127 HydrophobicContact CD1-CD2 3.96Å; L88-L127 HydrophobicContact CD2-CD1 4.43Å; F110-L127 HydrophobicContact CE2-CD1 4.28Å; F110-L127 HydrophobicContact CE2-CD2 3.77Å; F110-L127 HydrophobicContact CZ-CD2 4.05Å; I119-L127 HydrophobicContact CG2-CD1 3.51Å; V121-L127 HydrophobicContact CB-CB 4.4Å; V121-L127 HydrophobicContact CG1-CB 4Å; D124-L127 HydrophobicContact CB-CB 4.35Å; D124-L127 HydrophobicContact CB-CD1 4.12Å; D124-L127 HydrophobicContact CB-CG 3.97Å; D124-L127 PolarHBondContact O-N 2.91Å; L127-D129 PolarHBondContact O-N 3.48Å; L127-F132 WeakPolarHBondContact O-CD1 3.27Å
128	C	78.5	Confident	84.7	Confident	71 Å²	71	64.8 Å²	64.8	48%	0.48	34%	0.335	S	S	.	.			trans	-80.6	111.3	-178.6	179.2	0	0	0	0	113.4	V121 D124	V121-C128 PolarHBondContact O-N 3.47Å; D124-C128 PolarHBondContact O-N 3.17Å
129	D	83.8	Confident	85.1	Confident	30 Å²	30	60.8 Å²	60.8	16%	0.16	31%	0.311	C	S	.	.			trans	-140.8	136.3	162.8	-169.6	-57.7	0	0	0	108.7	N59 Y62 L127 R131 F132	N59-D129 WeakPolarHBondContact ND2-CB 3.41Å; N59-D129 PolarHBondContact ND2-OD2 3.05Å; Y62-D129 WeakPolarHBondContact CE2-OD2 3.4Å; Y62-D129 VanDerWaalsContact CZ-OD2 3.31Å; Y62-D129 PolarHBondContact OH-OD2 3.44Å; L127-D129 PolarHBondContact O-N 3.48Å; D129-R131 PolarHBondContact O-N 2.96Å; D129-R131 VanDerWaalsContact O-N 3.12Å; D129-R131 PolarHBondContact OD1-N 3.15Å; D129-F132 HydrophobicContact CB-CB 3.94Å; D129-F132 PolarHBondContact O-N 3.5Å
130	Q	83.4	Confident	85.4	Confident	205 Å²	205	64.4 Å²	64.4	96%	0.958	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-21.6	-178.4	-67.4	-178.8	-8.5	0	0	113.6
131	R	84.9	Confident	85.9	Confident	106 Å²	106	61.7 Å²	61.7	40%	0.4	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-5.3	177.8	-58.2	-170.1	-68.5	162.6	-2	113.1	E40 Y61 Y62 D129	E40-R131 IonicContact OE2-CZ 3.41Å; E40-R131 IonicContact OE2-NH1 3.11Å; E40-R131 PolarHBondContact OE2-NH1 3.05Å; E40-R131 VanDerWaalsContact OE2-NH1 3.11Å; E40-R131 IonicContact OE2-NH2 2.76Å; E40-R131 PolarHBondContact OE2-NH2 2.88Å; Y61-R131 HydrophobicContact CE1-CB 4.09Å; Y61-R131 HydrophobicContact CE2-CB 4.26Å; Y62-R131 PolarHBondContact OH-NH2 3.38Å; D129-R131 PolarHBondContact O-N 2.96Å; D129-R131 VanDerWaalsContact O-N 3.12Å; D129-R131 PolarHBondContact OD1-N 3.15Å
132	F	87.1	Confident	86.4	Confident	16 Å²	16	60.4 Å²	60.4	7%	0.07	30%	0.299	C	S	.	.			trans	-99.7	105.1	-176.8	-173.1	-128	0	0	0	111.2	I60 Y61 F110 L127 D129 P134 H137	I60-F132 HydrophobicContact CB-CZ 4.34Å; I60-F132 HydrophobicContact CG2-CE1 4.48Å; I60-F132 HydrophobicContact CG2-CZ 3.84Å; Y61-F132 HydrophobicContact CD2-CB 4.04Å; Y61-F132 AromaticContact CD2-CD2 3.82Å; Y61-F132 HydrophobicContact CD2-CD2 3.82Å; Y61-F132 HydrophobicContact CD2-CG 4.35Å; Y61-F132 HydrophobicContact CG-CB 4.19Å; Y61-F132 HydrophobicContact CG-CD2 4.32Å; F110-F132 AromaticContact CE1-CE1 3.77Å; F110-F132 HydrophobicContact CE1-CE1 3.77Å; F110-F132 AromaticContact CE1-CZ 3.68Å; F110-F132 HydrophobicContact CE1-CZ 3.68Å; F110-F132 AromaticContact CZ-CE1 3.96Å; F110-F132 HydrophobicContact CZ-CE1 3.96Å; F110-F132 HydrophobicContact CZ-CZ 4.32Å; L127-F132 WeakPolarHBondContact O-CD1 3.27Å; D129-F132 HydrophobicContact CB-CB 3.94Å; D129-F132 PolarHBondContact O-N 3.5Å; F132-P134 HydrophobicContact CD1-CG 4.16Å; F132-P134 HydrophobicContact CE1-CB 4.22Å; F132-P134 HydrophobicContact CE1-CG 4.19Å; F132-P134 WeakPolarHBondContact O-CD 3.24Å; F132-H137 HydrophobicContact CD2-CB 3.96Å; F132-H137 AromaticContact CD2-CG 3.71Å; F132-H137 AromaticContact CD2-ND1 3.63Å; F132-H137 HydrophobicContact CE2-CB 3.57Å; F132-H137 AromaticContact CE2-CG 3.85Å
133	S	90.1	Very high	87	Confident	46 Å²	46	62.1 Å²	62.1	32%	0.322	29%	0.291	S	S	.	.			trans	-84	111.5	157.6	168.9	0	0	0	0	108	L135 L136 H137	S133-L135 PolarHBondContact O-N 3.07Å; S133-L136 PolarHBondContact O-N 3.23Å; S133-L136 WeakPolarHBondContact OG-CB 3.37Å; S133-H137 PolarHBondContact N-ND1 3.25Å; S133-H137 PolarHBondContact O-N 3.11Å; S133-H137 VanDerWaalsContact O-N 3.12Å; S133-H137 PolarHBondContact O-ND1 2.72Å
134	P	90.4	Very high	87.9	Confident	22 Å²	22	60.7 Å²	60.7	14%	0.143	27%	0.274	C	S	.	.	H	α-helix	trans	-58.7	-50.4	-172.9	-27.1	36.4	0	0	0	112.5	F110 V114 V121 F132 L136 H137 S138	F110-P134 HydrophobicContact CE1-CB 3.71Å; F110-P134 HydrophobicContact CZ-CB 3.93Å; V114-P134 HydrophobicContact CG1-CB 4.23Å; V114-P134 HydrophobicContact CG2-CB 4.19Å; V121-P134 HydrophobicContact CB-CG 4.37Å; V121-P134 HydrophobicContact CG1-CG 3.79Å; V121-P134 HydrophobicContact CG2-CB 4.37Å; V121-P134 HydrophobicContact CG2-CG 3.89Å; F132-P134 HydrophobicContact CD1-CG 4.16Å; F132-P134 HydrophobicContact CE1-CB 4.22Å; F132-P134 HydrophobicContact CE1-CG 4.19Å; F132-P134 WeakPolarHBondContact O-CD 3.24Å; P134-L136 PolarHBondContact O-N 2.58Å; P134-H137 PolarHBondContact O-N 3.07Å; P134-S138 WeakPolarHBondContact O-CB 3.19Å; P134-S138 PolarHBondContact O-N 2.91Å; P134-S138 VanDerWaalsContact O-N 3.1Å; P134-S138 PolarHBondContact O-OG 2.91Å
135	L	92.8	Very high	88.5	Confident	7 Å²	7	58.6 Å²	58.6	4%	0.037	26%	0.263	C	S	.	.	H	α-helix	trans	-62.4	-42.8	-179.3	-63.4	178.8	0	0	0	111.9	F111 V114 L115 S133 S138 S139 E156 V165	F111-L135 HydrophobicContact CD2-CB 4.34Å; F111-L135 HydrophobicContact CD2-CD2 3.87Å; F111-L135 WeakPolarHBondContact CD2-O 3.41Å; F111-L135 HydrophobicContact CE2-CB 3.96Å; F111-L135 HydrophobicContact CE2-CD2 3.81Å; F111-L135 HydrophobicContact CE2-CG 4.47Å; F111-L135 WeakPolarHBondContact CE2-O 3.18Å; F111-L135 HydrophobicContact CG-CD2 4.33Å; F111-L135 HydrophobicContact CZ-CD2 4.21Å; V114-L135 HydrophobicContact CB-CD2 4.03Å; V114-L135 HydrophobicContact CG1-CD2 3.82Å; V114-L135 HydrophobicContact CG1-CG 4.07Å; L115-L135 HydrophobicContact CB-CD2 4.09Å; S133-L135 PolarHBondContact O-N 3.07Å; L135-S138 PolarHBondContact O-N 2.83Å; L135-S139 VanDerWaalsContact O-CB 3.27Å; L135-S139 WeakPolarHBondContact O-CB 3.27Å; L135-S139 PolarHBondContact O-N 2.85Å; L135-S139 PolarHBondContact O-OG 2.95Å; L135-E156 WeakPolarHBondContact CD1-OE1 3.45Å; L135-V165 HydrophobicContact CB-CG1 4.03Å; L135-V165 HydrophobicContact CB-CG2 4.09Å
136	L	92.7	Very high	89.2	Confident	55 Å²	55	49.2 Å²	49.2	29%	0.288	23%	0.231	S	C	.	.	H	α-helix	trans	-68.5	-37.2	-178.4	-176.8	60.9	0	0	0	113.4	S133 P134 S139 R164 V165	S133-L136 PolarHBondContact O-N 3.23Å; S133-L136 WeakPolarHBondContact OG-CB 3.37Å; P134-L136 PolarHBondContact O-N 2.58Å; L136-S139 PolarHBondContact O-OG 3.06Å; L136-S139 VanDerWaalsContact O-OG 3.12Å; L136-R164 HydrophobicContact CD1-CB 3.77Å; L136-V165 HydrophobicContact CB-CG2 4.14Å; L136-V165 HydrophobicContact CD1-CG2 4.33Å
137	H	91.3	Very high	89.7	Confident	36 Å²	36	46 Å²	46	17%	0.167	22%	0.219	C	C	.	.	H	α-helix	trans	-78	-27.4	179	-70	83.4	0	0	0	112.4	Y61 E64 M107 F132 S133 P134	Y61-H137 AromaticContact CD2-NE2 3.87Å; Y61-H137 AromaticContact CE2-NE2 3.53Å; E64-H137 IonicContact OE1-CD2 3.52Å; M107-H137 HydrophobicContact CE-CB 4.44Å; F132-H137 HydrophobicContact CD2-CB 3.96Å; F132-H137 AromaticContact CD2-CG 3.71Å; F132-H137 AromaticContact CD2-ND1 3.63Å; F132-H137 HydrophobicContact CE2-CB 3.57Å; F132-H137 AromaticContact CE2-CG 3.85Å; S133-H137 PolarHBondContact N-ND1 3.25Å; S133-H137 PolarHBondContact O-N 3.11Å; S133-H137 VanDerWaalsContact O-N 3.12Å; S133-H137 PolarHBondContact O-ND1 2.72Å; P134-H137 PolarHBondContact O-N 3.07Å
138	S	92.7	Very high	89.8	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-91.7	-26.5	179.9	54.5	0	0	0	0	114.7	M107 F111 P134 L135 R140 H141	M107-S138 WeakPolarHBondContact O-CB 3.28Å; F111-S138 WeakPolarHBondContact CB-OG 3.4Å; F111-S138 WeakPolarHBondContact CD2-OG 3.23Å; P134-S138 WeakPolarHBondContact O-CB 3.19Å; P134-S138 PolarHBondContact O-N 2.91Å; P134-S138 VanDerWaalsContact O-N 3.1Å; P134-S138 PolarHBondContact O-OG 2.91Å; L135-S138 PolarHBondContact O-N 2.83Å; S138-R140 VanDerWaalsContact C-N 3.28Å; S138-R140 PolarHBondContact O-N 2.82Å; S138-H141 WeakPolarHBondContact O-CB 3.13Å; S138-H141 PolarHBondContact O-N 2.95Å
139	S	93.9	Very high	89.7	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-52.2	-41	-179.1	58.5	0	0	0	0	114.1	L135 L136 H141 V142 T168 S172	L135-S139 VanDerWaalsContact O-CB 3.27Å; L135-S139 WeakPolarHBondContact O-CB 3.27Å; L135-S139 PolarHBondContact O-N 2.85Å; L135-S139 PolarHBondContact O-OG 2.95Å; L136-S139 PolarHBondContact O-OG 3.06Å; L136-S139 VanDerWaalsContact O-OG 3.12Å; S139-H141 PolarHBondContact O-N 2.95Å; S139-H141 VanDerWaalsContact O-N 3.07Å; S139-V142 WeakPolarHBondContact O-CB 3.07Å; S139-V142 PolarHBondContact O-N 2.87Å; S139-T168 WeakPolarHBondContact OG-CG2 3.46Å; S139-S172 PolarHBondContact O-OG 3.22Å
140	R	91.9	Very high	89.3	Confident	102 Å²	102	51 Å²	51	39%	0.385	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-17.9	177.9	74.9	-175.9	-157.3	-148.9	0.7	114.4	E64 R103 S138 T168	E64-R140 VanDerWaalsContact CD-NH1 3.3Å; E64-R140 IonicContact OE1-CZ 2.84Å; E64-R140 VanDerWaalsContact OE1-CZ 3.32Å; E64-R140 IonicContact OE1-NH1 2.72Å; E64-R140 PolarHBondContact OE1-NH1 2.82Å; E64-R140 IonicContact OE1-NH2 2.72Å; E64-R140 PolarHBondContact OE1-NH2 2.85Å; E64-R140 IonicContact OE2-CZ 3.57Å; E64-R140 IonicContact OE2-NH1 3.32Å; E64-R140 PolarHBondContact OE2-NH1 3.05Å; E64-R140 IonicContact OE2-NH2 3.67Å; E64-R140 PolarHBondContact OE2-NH2 3.38Å; R103-R140 VanDerWaalsContact NH2-NH2 3.15Å; S138-R140 VanDerWaalsContact C-N 3.28Å; S138-R140 PolarHBondContact O-N 2.82Å; R140-T168 HydrophobicContact CB-CG2 3.97Å
141	H	92	Very high	89.2	Confident	32 Å²	32	41.2 Å²	41.2	15%	0.148	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-14.2	175.4	-63.6	-77.7	0	0	0	112.6	M107 S138 S139 R143	M107-H141 HydrophobicContact CB-CB 3.76Å; S138-H141 WeakPolarHBondContact O-CB 3.13Å; S138-H141 PolarHBondContact O-N 2.95Å; S139-H141 PolarHBondContact O-N 2.95Å; S139-H141 VanDerWaalsContact O-N 3.07Å; H141-R143 PolarHBondContact O-N 2.86Å
142	V	93.9	Very high	89.1	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.199	C	C	.	.			trans	-76.2	121.1	179.8	-176.4	0	0	0	0	109.9	E108 F111 S139 Q144 L169 S172 L173	E108-V142 HydrophobicContact CG-CG1 4.44Å; E108-V142 HydrophobicContact CG-CG2 4.45Å; F111-V142 HydrophobicContact CB-CG2 3.67Å; F111-V142 HydrophobicContact CD1-CG2 3.68Å; F111-V142 HydrophobicContact CD2-CG2 3.93Å; F111-V142 HydrophobicContact CE1-CG2 4.34Å; F111-V142 HydrophobicContact CG-CG2 3.46Å; F111-V142 VanDerWaalsContact CG-CG2 3.46Å; S139-V142 WeakPolarHBondContact O-CB 3.07Å; S139-V142 PolarHBondContact O-N 2.87Å; V142-Q144 WeakPolarHBondContact CG1-O 3.2Å; V142-L169 HydrophobicContact CB-CD2 3.86Å; V142-L169 HydrophobicContact CG1-CD2 4.03Å; V142-L169 HydrophobicContact CG2-CD2 4.38Å; V142-S172 WeakPolarHBondContact O-CB 3.37Å; V142-S172 PolarHBondContact O-OG 3.4Å; V142-L173 HydrophobicContact CG1-CD1 3.83Å
143	R	92.9	Very high	89	Confident	131 Å²	131	40.5 Å²	40.5	49%	0.494	20%	0.199	S	C	.	.	S	Bend	trans	-108.9	-25.6	168.9	-60.1	-53.9	-169.2	167.7	2.4	111.6	E108 H141 S172 L173 H174 T175	E108-R143 PolarHBondContact OE1-N 3.19Å; H141-R143 PolarHBondContact O-N 2.86Å; R143-S172 WeakPolarHBondContact CD-O 3.43Å; R143-S172 PolarHBondContact NH1-O 2.98Å; R143-L173 WeakPolarHBondContact O-CD1 3.36Å; R143-H174 PolarHBondContact NH1-CE1 3.39Å; R143-H174 PolarHBondContact O-N 3.45Å; R143-T175 PolarHBondContact O-N 3.41Å; R143-T175 VanDerWaalsContact O-N 3.13Å
144	Q	92.9	Very high	88.9	Confident	66 Å²	66	38.3 Å²	38.3	31%	0.308	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	121.9	177.6	-176.4	160.2	119.2	0	0	111.8	E108 V142 T175 K177	E108-Q144 PolarHBondContact OE1-N 3.18Å; V142-Q144 WeakPolarHBondContact CG1-O 3.2Å; Q144-T175 WeakPolarHBondContact CA-O 3.08Å; Q144-T175 HydrophobicContact CG-CG2 4.09Å; Q144-T175 PolarHBondContact NE2-OG1 2.85Å; Q144-K177 HydrophobicContact CG-CD 3.97Å; Q144-K177 HydrophobicContact CG-CG 4.19Å
145	L	93.5	Very high	88.8	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	134.3	178.3	177.1	58.4	0	0	0	108.9	F111 L115 I147 L157 L173 T175 L176 K177 L199	F111-L145 HydrophobicContact CD1-CD1 4.44Å; F111-L145 HydrophobicContact CE1-CD1 3.86Å; L115-L145 HydrophobicContact CD2-CD1 3.82Å; L145-I147 HydrophobicContact CD2-CD1 4.43Å; L145-I147 HydrophobicContact CD2-CG1 4.31Å; L145-I147 HydrophobicContact CG-CG1 4.21Å; L145-L157 HydrophobicContact CD2-CD1 3.82Å; L145-L173 HydrophobicContact CB-CD1 3.52Å; L145-L173 HydrophobicContact CB-CD2 3.92Å; L145-L173 HydrophobicContact CB-CG 4.37Å; L145-L173 HydrophobicContact CD2-CD2 4.18Å; L145-T175 PolarHBondContact N-O 3.42Å; L145-T175 VanDerWaalsContact N-O 3.07Å; L145-L176 HydrophobicContact CB-CD1 4.04Å; L145-L176 HydrophobicContact CD2-CD1 3.89Å; L145-L176 HydrophobicContact CG-CD1 4Å; L145-K177 PolarHBondContact O-N 3.19Å; L145-L199 HydrophobicContact CD2-CD1 4.46Å
146	T	91.6	Very high	88.7	Confident	34 Å²	34	42 Å²	42	21%	0.209	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	112.9	170.9	-49.7	0	0	0	0	110.2	K177 R179	T146-K177 CarbonylContact C-O 3.56Å; T146-K177 WeakPolarHBondContact CA-O 3.29Å; T146-K177 HydrophobicContact CG2-CB 4.1Å; T146-R179 HydrophobicContact CG2-CB 4.13Å
147	I	90.8	Very high	88.7	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.01	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	131.6	173.1	-58.1	178.1	0	0	0	108.3	L145 L151 A154 L176 K177 F178 R179 L195	L145-I147 HydrophobicContact CD2-CD1 4.43Å; L145-I147 HydrophobicContact CD2-CG1 4.31Å; L145-I147 HydrophobicContact CG-CG1 4.21Å; I147-L151 HydrophobicContact CG2-CD2 4.08Å; I147-A154 HydrophobicContact CD1-CB 4.43Å; I147-L176 HydrophobicContact CD1-CD1 3.86Å; I147-L176 HydrophobicContact CG1-CD1 4.2Å; I147-K177 PolarHBondContact N-O 2.84Å; I147-F178 HydrophobicContact CB-CD1 3.87Å; I147-F178 HydrophobicContact CB-CE1 4.03Å; I147-F178 HydrophobicContact CD1-CD1 4.47Å; I147-F178 HydrophobicContact CD1-CE1 3.76Å; I147-F178 HydrophobicContact CD1-CZ 4.22Å; I147-F178 HydrophobicContact CG1-CE1 4.39Å; I147-F178 HydrophobicContact CG2-CD1 4.19Å; I147-F178 HydrophobicContact CG2-CE1 4.27Å; I147-F178 WeakPolarHBondContact O-CA 3.48Å; I147-R179 PolarHBondContact O-N 3.21Å; I147-L195 HydrophobicContact CD1-CD2 3.36Å
148	C	84.5	Confident	88.7	Confident	37 Å²	37	39 Å²	39	25%	0.25	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	168.6	-177.6	-55.6	0	0	0	0	111.1	R179	C148-R179 VanDerWaalsContact CA-O 3.32Å; C148-R179 WeakPolarHBondContact CA-O 3.47Å
149	N	77.1	Confident	88.6	Confident	63 Å²	63	40.9 Å²	40.9	34%	0.337	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	62.9	-156.2	169.2	-164.1	10.3	0	0	0	112.4	L151 H180 L181	N149-L151 PolarHBondContact O-N 3.07Å; N149-H180 PolarHBondContact N-O 3.05Å; N149-L181 WeakPolarHBondContact O-CD2 3.45Å
150	M	74.9	Confident	88.4	Confident	109 Å²	109	47.6 Å²	47.6	54%	0.537	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	42.7	174.5	-53.5	-178.6	-55.8	0	0	113.6	Q152 L182	M150-Q152 PolarHBondContact O-N 3.18Å; M150-L182 HydrophobicContact CG-CB 4.06Å
151	L	81.1	Confident	88.2	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	22	176.6	-53.7	164.9	0	0	0	115.3	I147 N149 G153 A154 T155 F178 L181 A188 L192 L220	I147-L151 HydrophobicContact CG2-CD2 4.08Å; N149-L151 PolarHBondContact O-N 3.07Å; L151-G153 PolarHBondContact O-N 3.25Å; L151-A154 HydrophobicContact CB-CB 4.27Å; L151-A154 WeakPolarHBondContact O-CA 3.48Å; L151-A154 VanDerWaalsContact O-CB 3.28Å; L151-A154 WeakPolarHBondContact O-CB 3.28Å; L151-A154 PolarHBondContact O-N 2.93Å; L151-T155 PolarHBondContact O-N 2.8Å; L151-F178 HydrophobicContact CD2-CE1 4.45Å; L151-L181 HydrophobicContact CD2-CD1 4.14Å; L151-L181 HydrophobicContact CD2-CD2 3.72Å; L151-A188 HydrophobicContact CB-CB 4.21Å; L151-A188 HydrophobicContact CD1-CB 4.21Å; L151-L192 HydrophobicContact CD1-CB 4.18Å; L151-L192 HydrophobicContact CD1-CD2 4.03Å; L151-L192 HydrophobicContact CD2-CD1 4.41Å; L151-L192 HydrophobicContact CD2-CD2 3.98Å; L151-L220 HydrophobicContact CD1-CD1 3.84Å; L151-L220 HydrophobicContact CD1-CD2 4.16Å
152	Q	83.3	Confident	88.3	Confident	100 Å²	100	47.8 Å²	47.8	47%	0.467	25%	0.252	S	S	.	.	H	α-helix	trans	-53.5	-39.4	-179	-177.7	-180	-5.1	0	0	112.9	M150 A154 T155 E156	M150-Q152 PolarHBondContact O-N 3.18Å; Q152-A154 PolarHBondContact O-N 3.3Å; Q152-T155 PolarHBondContact O-N 3.17Å; Q152-T155 PolarHBondContact O-OG1 3.02Å; Q152-E156 WeakPolarHBondContact O-CB 3.39Å; Q152-E156 PolarHBondContact O-N 3.01Å
153	G	84.1	Confident	88.1	Confident	8 Å²	8	53.2 Å²	53.2	8%	0.082	27%	0.273	C	S	.	.	H	α-helix	trans	-65.9	-22.7	174.9	0	0	0	0	0	114	L151 L157	L151-G153 PolarHBondContact O-N 3.25Å; G153-L157 WeakPolarHBondContact O-CB 3.46Å; G153-L157 WeakPolarHBondContact O-CD1 3.25Å; G153-L157 WeakPolarHBondContact O-CG 3.46Å; G153-L157 PolarHBondContact O-N 3.47Å
154	A	87.9	Confident	88.2	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-79.7	-40.4	173.4	0	0	0	0	0	111.9	I147 L151 Q152 V158 L195	I147-A154 HydrophobicContact CD1-CB 4.43Å; L151-A154 HydrophobicContact CB-CB 4.27Å; L151-A154 WeakPolarHBondContact O-CA 3.48Å; L151-A154 VanDerWaalsContact O-CB 3.28Å; L151-A154 WeakPolarHBondContact O-CB 3.28Å; L151-A154 PolarHBondContact O-N 2.93Å; Q152-A154 PolarHBondContact O-N 3.3Å; A154-V158 WeakPolarHBondContact O-CB 3.31Å; A154-V158 WeakPolarHBondContact O-CG2 3.38Å; A154-V158 PolarHBondContact O-N 2.98Å; A154-L195 HydrophobicContact CB-CD2 3.86Å
155	T	89.1	Confident	88.3	Confident	49 Å²	49	52.5 Å²	52.5	30%	0.301	27%	0.267	S	S	.	.	H	α-helix	trans	-66.1	-40.8	175.2	60.1	0	0	0	0	111.1	L151 Q152 A159 A188	L151-T155 PolarHBondContact O-N 2.8Å; Q152-T155 PolarHBondContact O-N 3.17Å; Q152-T155 PolarHBondContact O-OG1 3.02Å; T155-A159 PolarHBondContact O-N 3.3Å; T155-A188 HydrophobicContact CG2-CB 4.13Å
156	E	91.3	Very high	88.3	Confident	57 Å²	57	53.3 Å²	53.3	27%	0.266	27%	0.272	S	S	.	.	H	α-helix	trans	-65.8	-41.1	177.3	-177	172.9	171.8	0	0	113.2	L115 L135 Q152 N162	L115-E156 HydrophobicContact CD1-CB 4.01Å; L115-E156 HydrophobicContact CD1-CG 3.97Å; L135-E156 WeakPolarHBondContact CD1-OE1 3.45Å; Q152-E156 WeakPolarHBondContact O-CB 3.39Å; Q152-E156 PolarHBondContact O-N 3.01Å; E156-N162 WeakPolarHBondContact CG-ND2 3.32Å; E156-N162 WeakPolarHBondContact O-CB 3.34Å; E156-N162 PolarHBondContact O-ND2 2.96Å
157	L	92.4	Very high	88.4	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-74.4	-26.3	179.3	-71.4	175.3	0	0	0	114	F111 L115 L145 G153 V165 L169 L195	F111-L157 HydrophobicContact CZ-CD2 3.87Å; L115-L157 HydrophobicContact CD1-CD2 4.13Å; L115-L157 HydrophobicContact CD1-CG 3.93Å; L115-L157 HydrophobicContact CD2-CD1 3.77Å; L115-L157 HydrophobicContact CD2-CD2 4.36Å; L115-L157 HydrophobicContact CD2-CG 4.07Å; L145-L157 HydrophobicContact CD2-CD1 3.82Å; G153-L157 WeakPolarHBondContact O-CB 3.46Å; G153-L157 WeakPolarHBondContact O-CD1 3.25Å; G153-L157 WeakPolarHBondContact O-CG 3.46Å; G153-L157 PolarHBondContact O-N 3.47Å; L157-V165 HydrophobicContact CD2-CG1 3.97Å; L157-L169 HydrophobicContact CD1-CD1 3.91Å; L157-L169 HydrophobicContact CD2-CD1 4.06Å; L157-L195 HydrophobicContact CB-CD1 3.75Å; L157-L195 HydrophobicContact CD1-CD1 4.23Å
158	V	90.9	Very high	88.6	Confident	29 Å²	29	58.2 Å²	58.2	18%	0.176	30%	0.295	C	S	.	.	H	α-helix	trans	-84.1	-17.4	177.3	170.7	0	0	0	0	112.2	A154 E160 L166 Q194 L195	A154-V158 WeakPolarHBondContact O-CB 3.31Å; A154-V158 WeakPolarHBondContact O-CG2 3.38Å; A154-V158 PolarHBondContact O-N 2.98Å; V158-E160 PolarHBondContact O-N 3.4Å; V158-L166 HydrophobicContact CG2-CD2 4.26Å; V158-Q194 HydrophobicContact CG1-CB 4.1Å; V158-Q194 VanDerWaalsContact CG1-OE1 3.31Å; V158-Q194 HydrophobicContact CG2-CB 4.3Å; V158-L195 HydrophobicContact CG2-CB 3.87Å; V158-L195 HydrophobicContact CG2-CD1 3.89Å
159	A	90.8	Very high	89.1	Confident	39 Å²	39	56.4 Å²	56.4	32%	0.322	28%	0.283	S	S	.	.	S	Bend	trans	-61.3	135.3	175.3	0	0	0	0	0	112.1	T155 P161 N162 R163	T155-A159 PolarHBondContact O-N 3.3Å; A159-P161 HydrophobicContact CB-CG 4.3Å; A159-P161 WeakPolarHBondContact O-CD 3.46Å; A159-P161 VanDerWaalsContact O-N 3.12Å; A159-N162 WeakPolarHBondContact O-CA 3.46Å; A159-N162 PolarHBondContact O-N 3.33Å; A159-R163 PolarHBondContact O-N 2.94Å
160	E	88.5	Confident	89.9	Confident	140 Å²	140	54.2 Å²	54.2	65%	0.654	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-43.3	-43.3	-179.3	-72.6	-67.6	163.6	0	0	116.5	V158 N162 R163	V158-E160 PolarHBondContact O-N 3.4Å; E160-N162 PolarHBondContact O-N 2.93Å; E160-R163 WeakPolarHBondContact O-CB 3.27Å; E160-R163 PolarHBondContact O-N 2.77Å; E160-R163 VanDerWaalsContact O-N 3.1Å
161	P	89.3	Confident	90.7	Very high	118 Å²	118	53 Å²	53	77%	0.766	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-59.5	-29.2	176.3	23	-35.4	0	0	0	113.9	A159	A159-P161 HydrophobicContact CB-CG 4.3Å; A159-P161 WeakPolarHBondContact O-CD 3.46Å; A159-P161 VanDerWaalsContact O-N 3.12Å
162	N	92.4	Very high	91.3	Very high	21 Å²	21	53.3 Å²	53.3	11%	0.112	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-94.5	4.9	179.6	-75.2	-33.9	0	0	0	113.5	E156 A159 E160 R164 V165 L166	E156-N162 WeakPolarHBondContact CG-ND2 3.32Å; E156-N162 WeakPolarHBondContact O-CB 3.34Å; E156-N162 PolarHBondContact O-ND2 2.96Å; A159-N162 WeakPolarHBondContact O-CA 3.46Å; A159-N162 PolarHBondContact O-N 3.33Å; E160-N162 PolarHBondContact O-N 2.93Å; N162-R164 VanDerWaalsContact C-N 3.29Å; N162-R164 PolarHBondContact O-N 3.21Å; N162-R164 VanDerWaalsContact O-N 3.15Å; N162-V165 HydrophobicContact CB-CB 4.34Å; N162-V165 HydrophobicContact CB-CG2 4.08Å; N162-V165 VanDerWaalsContact O-CA 3.31Å; N162-V165 WeakPolarHBondContact O-CA 3.45Å; N162-V165 WeakPolarHBondContact O-CB 3.34Å; N162-V165 WeakPolarHBondContact O-CG2 3.49Å; N162-V165 PolarHBondContact O-N 2.82Å; N162-L166 PolarHBondContact O-N 3.43Å; N162-L166 VanDerWaalsContact O-N 3.08Å
163	R	91.5	Very high	91.9	Very high	113 Å²	113	48.5 Å²	48.5	43%	0.426	26%	0.255	S	S	.	.	H	α-helix	trans	-48	-46.2	179	-179.9	-174	172.4	107.2	19.8	113.9	A159 E160 V165 L166 E167	A159-R163 PolarHBondContact O-N 2.94Å; E160-R163 WeakPolarHBondContact O-CB 3.27Å; E160-R163 PolarHBondContact O-N 2.77Å; E160-R163 VanDerWaalsContact O-N 3.1Å; R163-V165 VanDerWaalsContact C-N 3.27Å; R163-V165 PolarHBondContact O-N 3.33Å; R163-L166 PolarHBondContact O-N 2.84Å; R163-E167 IonicContact CZ-OE1 3.19Å; R163-E167 IonicContact NE-OE1 3.37Å; R163-E167 PolarHBondContact NE-OE1 2.72Å; R163-E167 IonicContact NH2-OE1 2.82Å; R163-E167 PolarHBondContact NH2-OE1 3.37Å; R163-E167 WeakPolarHBondContact O-CG 3.42Å; R163-E167 PolarHBondContact O-N 3.4Å
164	R	93.4	Very high	92.4	Very high	180 Å²	180	52 Å²	52	68%	0.679	27%	0.269	S	S	*	.	H	α-helix	trans	-66.3	-27.9	177.5	-68.6	-175.8	179.1	-178.1	0.4	113.2	L136 N162 T168	L136-R164 HydrophobicContact CD1-CB 3.77Å; N162-R164 VanDerWaalsContact C-N 3.29Å; N162-R164 PolarHBondContact O-N 3.21Å; N162-R164 VanDerWaalsContact O-N 3.15Å; R164-T168 WeakPolarHBondContact O-CB 3.45Å; R164-T168 PolarHBondContact O-N 2.95Å; R164-T168 PolarHBondContact O-OG1 3.48Å
165	V	95.3	Very high	92.7	Very high	2 Å²	2	52.6 Å²	52.6	1%	0.012	27%	0.273	C	S	.	.	H	α-helix	trans	-66.7	-48.1	173.5	-168.5	0	0	0	0	108.8	F111 L135 L136 L157 N162 R163 T168 L169	F111-V165 HydrophobicContact CE2-CG1 3.6Å; F111-V165 HydrophobicContact CZ-CG1 4Å; L135-V165 HydrophobicContact CB-CG1 4.03Å; L135-V165 HydrophobicContact CB-CG2 4.09Å; L136-V165 HydrophobicContact CB-CG2 4.14Å; L136-V165 HydrophobicContact CD1-CG2 4.33Å; L157-V165 HydrophobicContact CD2-CG1 3.97Å; N162-V165 HydrophobicContact CB-CB 4.34Å; N162-V165 HydrophobicContact CB-CG2 4.08Å; N162-V165 VanDerWaalsContact O-CA 3.31Å; N162-V165 WeakPolarHBondContact O-CA 3.45Å; N162-V165 WeakPolarHBondContact O-CB 3.34Å; N162-V165 WeakPolarHBondContact O-CG2 3.49Å; N162-V165 PolarHBondContact O-N 2.82Å; R163-V165 VanDerWaalsContact C-N 3.27Å; R163-V165 PolarHBondContact O-N 3.33Å; V165-T168 WeakPolarHBondContact O-CB 3.2Å; V165-T168 PolarHBondContact O-N 3.01Å; V165-L169 HydrophobicContact CG1-CD1 4.37Å; V165-L169 WeakPolarHBondContact O-CG 3.41Å; V165-L169 PolarHBondContact O-N 2.81Å
166	L	93.8	Very high	93	Very high	19 Å²	19	50.3 Å²	50.3	10%	0.099	26%	0.259	C	S	.	.	H	α-helix	trans	-64.9	-42.7	177.5	-177.4	54.4	0	0	0	112.7	V158 N162 R163 T168 L169 A170 L195 Q198 L199	V158-L166 HydrophobicContact CG2-CD2 4.26Å; N162-L166 PolarHBondContact O-N 3.43Å; N162-L166 VanDerWaalsContact O-N 3.08Å; R163-L166 PolarHBondContact O-N 2.84Å; L166-T168 VanDerWaalsContact C-N 3.27Å; L166-T168 PolarHBondContact O-N 3.17Å; L166-L169 PolarHBondContact O-N 3.24Å; L166-A170 PolarHBondContact O-N 2.9Å; L166-L195 HydrophobicContact CD1-CD1 3.63Å; L166-L195 HydrophobicContact CD2-CD1 4.3Å; L166-Q198 HydrophobicContact CD1-CB 4.29Å; L166-Q198 HydrophobicContact CD2-CB 4.26Å; L166-Q198 HydrophobicContact CD2-CG 4.13Å; L166-Q198 HydrophobicContact CG-CB 4.27Å; L166-L199 HydrophobicContact CD1-CD2 3.72Å; L166-L199 HydrophobicContact CD1-CG 3.98Å
167	E	93.4	Very high	93.2	Very high	100 Å²	100	49.3 Å²	49.3	47%	0.467	25%	0.254	S	S	.	.	H	α-helix	trans	-58.9	-38.3	172.8	-71.7	165.8	171	0	0	111.4	R163	R163-E167 IonicContact CZ-OE1 3.19Å; R163-E167 IonicContact NE-OE1 3.37Å; R163-E167 PolarHBondContact NE-OE1 2.72Å; R163-E167 IonicContact NH2-OE1 2.82Å; R163-E167 PolarHBondContact NH2-OE1 3.37Å; R163-E167 WeakPolarHBondContact O-CG 3.42Å; R163-E167 PolarHBondContact O-N 3.4Å
168	T	94.6	Very high	93.1	Very high	38 Å²	38	49.4 Å²	49.4	23%	0.233	25%	0.254	C	S	.	.	H	α-helix	trans	-68.5	-48.5	173.8	-54.4	0	0	0	0	111.6	S139 R140 R164 V165 L166 A170 S171 S172	S139-T168 WeakPolarHBondContact OG-CG2 3.46Å; R140-T168 HydrophobicContact CB-CG2 3.97Å; R164-T168 WeakPolarHBondContact O-CB 3.45Å; R164-T168 PolarHBondContact O-N 2.95Å; R164-T168 PolarHBondContact O-OG1 3.48Å; V165-T168 WeakPolarHBondContact O-CB 3.2Å; V165-T168 PolarHBondContact O-N 3.01Å; L166-T168 VanDerWaalsContact C-N 3.27Å; L166-T168 PolarHBondContact O-N 3.17Å; T168-A170 VanDerWaalsContact C-N 3.31Å; T168-A170 PolarHBondContact O-N 3.48Å; T168-S171 PolarHBondContact O-N 2.79Å; T168-S171 PolarHBondContact O-OG 3.1Å; T168-S172 PolarHBondContact O-N 3.35Å; T168-S172 VanDerWaalsContact O-N 3.07Å
169	L	95.3	Very high	93	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.9	-38.5	179.6	-73.5	174	0	0	0	112.4	F111 V142 L157 V165 L166 S171 S172 L173 L199	F111-L169 HydrophobicContact CZ-CD1 3.88Å; F111-L169 HydrophobicContact CZ-CD2 4.32Å; V142-L169 HydrophobicContact CB-CD2 3.86Å; V142-L169 HydrophobicContact CG1-CD2 4.03Å; V142-L169 HydrophobicContact CG2-CD2 4.38Å; L157-L169 HydrophobicContact CD1-CD1 3.91Å; L157-L169 HydrophobicContact CD2-CD1 4.06Å; V165-L169 HydrophobicContact CG1-CD1 4.37Å; V165-L169 WeakPolarHBondContact O-CG 3.41Å; V165-L169 PolarHBondContact O-N 2.81Å; L166-L169 PolarHBondContact O-N 3.24Å; L169-S171 PolarHBondContact O-N 3.41Å; L169-S171 VanDerWaalsContact O-N 3.15Å; L169-S172 PolarHBondContact O-N 3.46Å; L169-S172 VanDerWaalsContact O-N 3.11Å; L169-L173 WeakPolarHBondContact O-CB 3.49Å; L169-L173 PolarHBondContact O-N 3.15Å; L169-L199 HydrophobicContact CB-CD2 3.9Å
170	A	93.7	Very high	92.6	Very high	16 Å²	16	56.2 Å²	56.2	13%	0.132	27%	0.272	C	S	.	.	H	α-helix	trans	-55.8	-32.7	175.8	0	0	0	0	0	112	L166 T168 L199 G203 A204	L166-A170 PolarHBondContact O-N 2.9Å; T168-A170 VanDerWaalsContact C-N 3.31Å; T168-A170 PolarHBondContact O-N 3.48Å; A170-L199 HydrophobicContact CB-CD2 4.5Å; A170-G203 CarbonylContact O-C 3.5Å; A170-G203 WeakPolarHBondContact O-CA 3.44Å; A170-A204 PolarHBondContact O-N 2.86Å
171	S	93	Very high	92.3	Very high	84 Å²	84	49.8 Å²	49.8	59%	0.587	24%	0.242	S	C	*	.	H	α-helix	trans	-86.3	-29.8	175.2	76.1	0	0	0	0	114.7	T168 L169	T168-S171 PolarHBondContact O-N 2.79Å; T168-S171 PolarHBondContact O-OG 3.1Å; L169-S171 PolarHBondContact O-N 3.41Å; L169-S171 VanDerWaalsContact O-N 3.15Å
172	S	92.9	Very high	91.7	Very high	6 Å²	6	48.9 Å²	48.9	4%	0.042	23%	0.23	C	C	.	.	H	α-helix	trans	-96.3	-30.8	-172.4	74.9	0	0	0	0	113.9	S139 V142 R143 T168 L169 H174	S139-S172 PolarHBondContact O-OG 3.22Å; V142-S172 WeakPolarHBondContact O-CB 3.37Å; V142-S172 PolarHBondContact O-OG 3.4Å; R143-S172 WeakPolarHBondContact CD-O 3.43Å; R143-S172 PolarHBondContact NH1-O 2.98Å; T168-S172 PolarHBondContact O-N 3.35Å; T168-S172 VanDerWaalsContact O-N 3.07Å; L169-S172 PolarHBondContact O-N 3.46Å; L169-S172 VanDerWaalsContact O-N 3.11Å; S172-H174 PolarHBondContact O-CE1 2.87Å; S172-H174 PolarHBondContact O-ND1 3.1Å
173	L	95.3	Very high	90.5	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	26%	0.258	C	S	.	.			trans	-83	128	-167.2	-168.5	73.6	0	0	0	112.2	V142 R143 L145 L169 L176 L199 A204 V205	V142-L173 HydrophobicContact CG1-CD1 3.83Å; R143-L173 WeakPolarHBondContact O-CD1 3.36Å; L145-L173 HydrophobicContact CB-CD1 3.52Å; L145-L173 HydrophobicContact CB-CD2 3.92Å; L145-L173 HydrophobicContact CB-CG 4.37Å; L145-L173 HydrophobicContact CD2-CD2 4.18Å; L169-L173 WeakPolarHBondContact O-CB 3.49Å; L169-L173 PolarHBondContact O-N 3.15Å; L173-L176 HydrophobicContact CD2-CD1 4.42Å; L173-L199 HydrophobicContact CD2-CD1 3.75Å; L173-L199 HydrophobicContact CD2-CD2 4.01Å; L173-L199 HydrophobicContact CD2-CG 4.37Å; L173-A204 CarbonylContact O-C 3.42Å; L173-A204 WeakPolarHBondContact O-CB 3.27Å; L173-V205 HydrophobicContact CB-CG2 4.06Å; L173-V205 HydrophobicContact CD2-CG2 3.64Å; L173-V205 HydrophobicContact CG-CG2 3.79Å; L173-V205 WeakPolarHBondContact O-CG2 3.2Å; L173-V205 PolarHBondContact O-N 3.01Å
174	H	94.7	Very high	89.6	Confident	81 Å²	81	50.2 Å²	50.2	38%	0.375	24%	0.239	S	C	.	.			trans	-114.2	-36.6	-179.6	-68.6	54	0	0	0	111.7	R143 S172 V205 S206 Q207	R143-H174 PolarHBondContact NH1-CE1 3.39Å; R143-H174 PolarHBondContact O-N 3.45Å; S172-H174 PolarHBondContact O-CE1 2.87Å; S172-H174 PolarHBondContact O-ND1 3.1Å; H174-V205 WeakPolarHBondContact O-CA 3.27Å; H174-S206 PolarHBondContact O-N 3.34Å; H174-Q207 PolarHBondContact O-N 2.94Å; H174-Q207 VanDerWaalsContact O-N 3.14Å
175	T	95.6	Very high	89.2	Confident	13 Å²	13	46 Å²	46	8%	0.08	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	129.1	177.4	-42.7	0	0	0	0	111.6	R143 Q144 L145 K177 Q207	R143-T175 PolarHBondContact O-N 3.41Å; R143-T175 VanDerWaalsContact O-N 3.13Å; Q144-T175 WeakPolarHBondContact CA-O 3.08Å; Q144-T175 HydrophobicContact CG-CG2 4.09Å; Q144-T175 PolarHBondContact NE2-OG1 2.85Å; L145-T175 PolarHBondContact N-O 3.42Å; L145-T175 VanDerWaalsContact N-O 3.07Å; T175-K177 HydrophobicContact CG2-CD 4.4Å; T175-K177 HydrophobicContact CG2-CG 3.86Å; T175-Q207 WeakPolarHBondContact CA-O 3.32Å; T175-Q207 HydrophobicContact CG2-CB 4.1Å; T175-Q207 HydrophobicContact CG2-CG 3.82Å; T175-Q207 PolarHBondContact OG1-OE1 2.78Å
176	L	95.6	Very high	88.7	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	115.7	170.6	-178	61.1	0	0	0	110.5	L145 I147 L173 F178 L196 L199 V205 Q207 V208 S209	L145-L176 HydrophobicContact CB-CD1 4.04Å; L145-L176 HydrophobicContact CD2-CD1 3.89Å; L145-L176 HydrophobicContact CG-CD1 4Å; I147-L176 HydrophobicContact CD1-CD1 3.86Å; I147-L176 HydrophobicContact CG1-CD1 4.2Å; L173-L176 HydrophobicContact CD2-CD1 4.42Å; L176-F178 HydrophobicContact CD1-CZ 4.48Å; L176-F178 HydrophobicContact CD2-CE2 3.77Å; L176-F178 HydrophobicContact CD2-CZ 3.71Å; L176-F178 HydrophobicContact CG-CD2 4.49Å; L176-F178 HydrophobicContact CG-CE2 3.69Å; L176-F178 HydrophobicContact CG-CZ 3.93Å; L176-L196 HydrophobicContact CD2-CD2 3.69Å; L176-L199 HydrophobicContact CD2-CD1 4.37Å; L176-V205 HydrophobicContact CB-CG1 3.91Å; L176-Q207 PolarHBondContact N-O 2.9Å; L176-V208 HydrophobicContact CB-CG2 4.36Å; L176-V208 VanDerWaalsContact O-CA 3.29Å; L176-V208 WeakPolarHBondContact O-CA 3.35Å; L176-S209 PolarHBondContact O-N 3.15Å
177	K	93.9	Very high	88.4	Confident	37 Å²	37	52.3 Å²	52.3	16%	0.161	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	140.8	-178.9	-58.2	-167.6	158.9	-179.2	0	110.8	Q144 L145 T146 I147 T175 S209 Y211	Q144-K177 HydrophobicContact CG-CD 3.97Å; Q144-K177 HydrophobicContact CG-CG 4.19Å; L145-K177 PolarHBondContact O-N 3.19Å; T146-K177 CarbonylContact C-O 3.56Å; T146-K177 WeakPolarHBondContact CA-O 3.29Å; T146-K177 HydrophobicContact CG2-CB 4.1Å; I147-K177 PolarHBondContact N-O 2.84Å; T175-K177 HydrophobicContact CG2-CD 4.4Å; T175-K177 HydrophobicContact CG2-CG 3.86Å; K177-S209 CarbonylContact C-O 3.6Å; K177-S209 VanDerWaalsContact CA-O 3.32Å; K177-S209 WeakPolarHBondContact CA-O 3.41Å; K177-Y211 HydrophobicContact CB-CE2 4.13Å; K177-Y211 HydrophobicContact CD-CD2 4.49Å; K177-Y211 HydrophobicContact CD-CE2 3.56Å; K177-Y211 WeakPolarHBondContact CE-OH 3.4Å; K177-Y211 HydrophobicContact CG-CE2 3.9Å; K177-Y211 PolarHBondContact NZ-OH 3.31Å; K177-Y211 VanDerWaalsContact NZ-OH 3.16Å
178	F	92.3	Very high	88	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.009	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	137.5	168.9	-60.8	-92.7	0	0	0	109.4	I147 L151 L176 L181 L192 L196 V208 S209 L210 Y211 I224	I147-F178 HydrophobicContact CB-CD1 3.87Å; I147-F178 HydrophobicContact CB-CE1 4.03Å; I147-F178 HydrophobicContact CD1-CD1 4.47Å; I147-F178 HydrophobicContact CD1-CE1 3.76Å; I147-F178 HydrophobicContact CD1-CZ 4.22Å; I147-F178 HydrophobicContact CG1-CE1 4.39Å; I147-F178 HydrophobicContact CG2-CD1 4.19Å; I147-F178 HydrophobicContact CG2-CE1 4.27Å; I147-F178 WeakPolarHBondContact O-CA 3.48Å; L151-F178 HydrophobicContact CD2-CE1 4.45Å; L176-F178 HydrophobicContact CD1-CZ 4.48Å; L176-F178 HydrophobicContact CD2-CE2 3.77Å; L176-F178 HydrophobicContact CD2-CZ 3.71Å; L176-F178 HydrophobicContact CG-CD2 4.49Å; L176-F178 HydrophobicContact CG-CE2 3.69Å; L176-F178 HydrophobicContact CG-CZ 3.93Å; F178-L181 HydrophobicContact CB-CD1 3.93Å; F178-L181 HydrophobicContact CB-CD2 4.44Å; F178-L181 HydrophobicContact CB-CG 4.16Å; F178-L181 HydrophobicContact CD1-CD1 3.86Å; F178-L181 HydrophobicContact CD1-CD2 4.2Å; F178-L181 HydrophobicContact CD1-CG 4.47Å; F178-L181 HydrophobicContact CG-CD1 4.21Å; F178-L192 HydrophobicContact CE1-CD1 3.6Å; F178-L192 HydrophobicContact CZ-CD1 3.79Å; F178-L196 HydrophobicContact CE2-CD2 4.43Å; F178-L196 HydrophobicContact CZ-CD2 4.03Å; F178-V208 HydrophobicContact CD2-CG1 4.23Å; F178-V208 HydrophobicContact CE2-CG1 4.1Å; F178-S209 PolarHBondContact N-O 3.22Å; F178-L210 HydrophobicContact CB-CD2 3.64Å; F178-L210 HydrophobicContact CD2-CD2 3.4Å; F178-L210 VanDerWaalsContact CD2-CD2 3.4Å; F178-L210 HydrophobicContact CE2-CD2 4.36Å; F178-L210 HydrophobicContact CG-CD2 3.84Å; F178-Y211 PolarHBondContact O-N 2.99Å; F178-I224 HydrophobicContact CD1-CD1 4.46Å; F178-I224 HydrophobicContact CE1-CD1 4.5Å; F178-I224 HydrophobicContact CE2-CG2 4.32Å; F178-I224 HydrophobicContact CG-CD1 4.48Å
179	R	88.7	Confident	87.6	Confident	124 Å²	124	47.1 Å²	47.1	47%	0.468	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	134.9	-177.4	179.7	178.4	170.9	175.3	0.1	111.8	T146 I147 C148 L181 Y211	T146-R179 HydrophobicContact CG2-CB 4.13Å; I147-R179 PolarHBondContact O-N 3.21Å; C148-R179 VanDerWaalsContact CA-O 3.32Å; C148-R179 WeakPolarHBondContact CA-O 3.47Å; R179-L181 VanDerWaalsContact C-N 3.26Å; R179-L181 PolarHBondContact O-N 3.42Å; R179-Y211 WeakPolarHBondContact CA-O 3.35Å
180	H	82.1	Confident	87.3	Confident	87 Å²	87	51.6 Å²	51.6	40%	0.403	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	48.1	49.7	178.6	-53.1	-36.9	0	0	0	111.8	N149 S212	N149-H180 PolarHBondContact N-O 3.05Å; H180-S212 VanDerWaalsContact CE1-CB 3.47Å; H180-S212 WeakPolarHBondContact CE1-CB 3.07Å; H180-S212 PolarHBondContact N-O 2.78Å; H180-S212 PolarHBondContact ND1-O 3.05Å
181	L	81.7	Confident	87.1	Confident	4 Å²	4	51.9 Å²	51.9	2%	0.021	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	135.2	173.2	-63.9	-173.8	0	0	0	108.9	N149 L151 F178 R179 W213 L220 I224	N149-L181 WeakPolarHBondContact O-CD2 3.45Å; L151-L181 HydrophobicContact CD2-CD1 4.14Å; L151-L181 HydrophobicContact CD2-CD2 3.72Å; F178-L181 HydrophobicContact CB-CD1 3.93Å; F178-L181 HydrophobicContact CB-CD2 4.44Å; F178-L181 HydrophobicContact CB-CG 4.16Å; F178-L181 HydrophobicContact CD1-CD1 3.86Å; F178-L181 HydrophobicContact CD1-CD2 4.2Å; F178-L181 HydrophobicContact CD1-CG 4.47Å; F178-L181 HydrophobicContact CG-CD1 4.21Å; R179-L181 VanDerWaalsContact C-N 3.26Å; R179-L181 PolarHBondContact O-N 3.42Å; L181-W213 HydrophobicContact CB-CD2 4Å; L181-W213 HydrophobicContact CB-CG 4.38Å; L181-W213 HydrophobicContact CB-CZ2 3.95Å; L181-W213 HydrophobicContact CD1-CD2 4.44Å; L181-W213 HydrophobicContact CD1-CE3 4.17Å; L181-W213 HydrophobicContact CD1-CH2 3.89Å; L181-W213 HydrophobicContact CD1-CZ2 4.15Å; L181-W213 HydrophobicContact CD1-CZ3 3.87Å; L181-W213 PolarHBondContact O-NE1 2.86Å; L181-L220 HydrophobicContact CD1-CD2 4.15Å; L181-I224 HydrophobicContact CD1-CD1 4.07Å
182	L	76	Confident	87.1	Confident	99 Å²	99	47.9 Å²	47.9	52%	0.518	24%	0.241	S	C	.	.			trans	-108.4	175.1	174.6	-61.6	-176.6	0	0	0	109.3	M150 S184	M150-L182 HydrophobicContact CG-CB 4.06Å; L182-S184 PolarHBondContact O-N 3.48Å
183	F	66.8	Low	87	Confident	160 Å²	160	51.2 Å²	51.2	70%	0.702	25%	0.253	S	S	*	.			trans	-49.2	135.3	178.6	-169.6	-90	0	0	0	111.3
184	S	74.6	Confident	86.7	Confident	3 Å²	3	55.3 Å²	55.3	2%	0.021	27%	0.272	C	S	.	.			trans	-113.2	138.9	-171.4	60.4	0	0	0	0	111.9	L182 Q189 E217	L182-S184 PolarHBondContact O-N 3.48Å; S184-Q189 VanDerWaalsContact OG-CG 3.26Å; S184-Q189 WeakPolarHBondContact OG-CG 3.42Å; S184-Q189 PolarHBondContact OG-NE2 3.28Å; S184-E217 PolarHBondContact N-OE2 2.96Å; S184-E217 VanDerWaalsContact N-OE2 3.12Å; S184-E217 PolarHBondContact OG-OE2 3.5Å
185	D	83.3	Confident	86.6	Confident	92 Å²	92	51.5 Å²	51.5	49%	0.492	25%	0.254	S	S	.	.			trans	-81.5	165.3	172.5	95.1	-66.7	0	0	0	111.1	A187 A188 Q189	D185-A187 PolarHBondContact O-N 3.43Å; D185-A187 WeakPolarHBondContact OD2-CB 3.26Å; D185-A187 PolarHBondContact OD2-N 2.82Å; D185-A188 PolarHBondContact O-N 3.27Å; D185-A188 WeakPolarHBondContact OD1-CB 3.38Å; D185-A188 PolarHBondContact OD1-N 3.03Å; D185-Q189 WeakPolarHBondContact O-CG 3.38Å; D185-Q189 PolarHBondContact O-N 3.44Å
186	V	85	Confident	86.5	Confident	101 Å²	101	50.9 Å²	50.9	61%	0.612	25%	0.25	S	S	*	.	H	α-helix	trans	-61.8	-32.5	-177.3	-178.3	0	0	0	0	111.7	Q190	V186-Q190 VanDerWaalsContact O-CG 3.29Å; V186-Q190 WeakPolarHBondContact O-CG 3.26Å; V186-Q190 PolarHBondContact O-N 3.15Å
187	A	87	Confident	86.3	Confident	52 Å²	52	51.1 Å²	51.1	43%	0.43	25%	0.251	S	S	.	.	H	α-helix	trans	-69.6	-46.2	175.4	0	0	0	0	0	111.6	D185 Q189 Q190 S191	D185-A187 PolarHBondContact O-N 3.43Å; D185-A187 WeakPolarHBondContact OD2-CB 3.26Å; D185-A187 PolarHBondContact OD2-N 2.82Å; A187-Q189 VanDerWaalsContact C-N 3.31Å; A187-Q189 PolarHBondContact O-N 3.45Å; A187-Q190 CarbonylContact O-C 3.42Å; A187-Q190 WeakPolarHBondContact O-CB 3.4Å; A187-Q190 PolarHBondContact O-N 2.96Å; A187-Q190 VanDerWaalsContact O-N 3.07Å; A187-S191 PolarHBondContact O-N 3.42Å; A187-S191 PolarHBondContact O-OG 2.86Å
188	A	85.9	Confident	86.2	Confident	2 Å²	2	51.9 Å²	51.9	2%	0.017	26%	0.256	C	S	.	.	H	α-helix	trans	-59.5	-38.8	174.7	0	0	0	0	0	112.9	L151 T155 D185 S191 L192	L151-A188 HydrophobicContact CB-CB 4.21Å; L151-A188 HydrophobicContact CD1-CB 4.21Å; T155-A188 HydrophobicContact CG2-CB 4.13Å; D185-A188 PolarHBondContact O-N 3.27Å; D185-A188 WeakPolarHBondContact OD1-CB 3.38Å; D185-A188 PolarHBondContact OD1-N 3.03Å; A188-S191 PolarHBondContact O-N 2.93Å; A188-L192 WeakPolarHBondContact O-CB 3.4Å; A188-L192 PolarHBondContact O-N 3.41Å
189	Q	87.3	Confident	86.3	Confident	26 Å²	26	51.8 Å²	51.8	12%	0.121	26%	0.255	C	S	.	.	H	α-helix	trans	-65.5	-37	172.6	-67.8	-169.4	15.9	0	0	112.6	S184 D185 A187 R193 E217 L220	S184-Q189 VanDerWaalsContact OG-CG 3.26Å; S184-Q189 WeakPolarHBondContact OG-CG 3.42Å; S184-Q189 PolarHBondContact OG-NE2 3.28Å; D185-Q189 WeakPolarHBondContact O-CG 3.38Å; D185-Q189 PolarHBondContact O-N 3.44Å; A187-Q189 VanDerWaalsContact C-N 3.31Å; A187-Q189 PolarHBondContact O-N 3.45Å; Q189-R193 WeakPolarHBondContact O-CB 3.04Å; Q189-R193 VanDerWaalsContact O-CG 3.27Å; Q189-R193 WeakPolarHBondContact O-CG 3.43Å; Q189-R193 PolarHBondContact O-N 2.83Å; Q189-E217 PolarHBondContact NE2-OE1 3.21Å; Q189-L220 HydrophobicContact CG-CD1 4.46Å
190	Q	88.1	Confident	86.5	Confident	95 Å²	95	45.9 Å²	45.9	44%	0.444	23%	0.233	S	C	.	.	H	α-helix	trans	-68.9	-41	174.2	-73.5	177.4	22.4	0	0	112.2	V186 A187 R193 Q194	V186-Q190 VanDerWaalsContact O-CG 3.29Å; V186-Q190 WeakPolarHBondContact O-CG 3.26Å; V186-Q190 PolarHBondContact O-N 3.15Å; A187-Q190 CarbonylContact O-C 3.42Å; A187-Q190 WeakPolarHBondContact O-CB 3.4Å; A187-Q190 PolarHBondContact O-N 2.96Å; A187-Q190 VanDerWaalsContact O-N 3.07Å; Q190-R193 WeakPolarHBondContact O-CB 3.05Å; Q190-R193 PolarHBondContact O-N 3.47Å; Q190-Q194 WeakPolarHBondContact O-CG 3.22Å; Q190-Q194 PolarHBondContact O-N 2.83Å
191	S	90.1	Very high	86.8	Confident	21 Å²	21	42.4 Å²	42.4	15%	0.147	22%	0.217	C	C	.	.	H	α-helix	trans	-62.6	-43.2	172.2	-65.5	0	0	0	0	111.4	A187 A188 R193 Q194 L195	A187-S191 PolarHBondContact O-N 3.42Å; A187-S191 PolarHBondContact O-OG 2.86Å; A188-S191 PolarHBondContact O-N 2.93Å; S191-R193 PolarHBondContact O-N 3.35Å; S191-Q194 PolarHBondContact O-N 2.89Å; S191-L195 WeakPolarHBondContact O-CB 3.49Å; S191-L195 PolarHBondContact O-N 3.42Å
192	L	91.6	Very high	87.2	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.5	-43	175.5	-179.2	63.3	0	0	0	112.2	L151 F178 A188 Q194 L195 L196 L220 L223 I224	L151-L192 HydrophobicContact CD1-CB 4.18Å; L151-L192 HydrophobicContact CD1-CD2 4.03Å; L151-L192 HydrophobicContact CD2-CD1 4.41Å; L151-L192 HydrophobicContact CD2-CD2 3.98Å; F178-L192 HydrophobicContact CE1-CD1 3.6Å; F178-L192 HydrophobicContact CZ-CD1 3.79Å; A188-L192 WeakPolarHBondContact O-CB 3.4Å; A188-L192 PolarHBondContact O-N 3.41Å; L192-Q194 VanDerWaalsContact C-N 3.32Å; L192-Q194 PolarHBondContact O-N 3.41Å; L192-L195 PolarHBondContact O-N 2.77Å; L192-L196 HydrophobicContact CD1-CD1 4.01Å; L192-L196 HydrophobicContact CD1-CD2 4.42Å; L192-L196 HydrophobicContact CD1-CG 3.85Å; L192-L196 HydrophobicContact CD2-CD1 4.34Å; L192-L196 HydrophobicContact CG-CD1 3.82Å; L192-L196 HydrophobicContact CG-CG 4.14Å; L192-L196 WeakPolarHBondContact O-CB 3.5Å; L192-L196 WeakPolarHBondContact O-CG 3.46Å; L192-L196 PolarHBondContact O-N 3.31Å; L192-L220 HydrophobicContact CD2-CD1 3.46Å; L192-L220 VanDerWaalsContact CD2-CD1 3.46Å; L192-L223 HydrophobicContact CD2-CD2 4.29Å; L192-I224 HydrophobicContact CD2-CD1 4.19Å; L192-I224 HydrophobicContact CD2-CG1 3.95Å
193	R	90.5	Very high	87.9	Confident	77 Å²	77	41.1 Å²	41.1	29%	0.291	21%	0.211	S	C	.	.	H	α-helix	trans	-53.3	-49.4	172.6	-79	167.4	-161.5	-133.6	5.7	111.1	Q189 Q190 S191 H197 L223 M227 W232	Q189-R193 WeakPolarHBondContact O-CB 3.04Å; Q189-R193 VanDerWaalsContact O-CG 3.27Å; Q189-R193 WeakPolarHBondContact O-CG 3.43Å; Q189-R193 PolarHBondContact O-N 2.83Å; Q190-R193 WeakPolarHBondContact O-CB 3.05Å; Q190-R193 PolarHBondContact O-N 3.47Å; S191-R193 PolarHBondContact O-N 3.35Å; R193-H197 WeakPolarHBondContact O-CB 3.39Å; R193-H197 PolarHBondContact O-N 2.96Å; R193-L223 HydrophobicContact CG-CD1 3.51Å; R193-L223 HydrophobicContact CG-CD2 3.83Å; R193-L223 HydrophobicContact CG-CG 4.31Å; R193-M227 HydrophobicContact CG-SD 4.47Å; R193-M227 WeakPolarHBondContact O-CE 3.23Å; R193-W232 HydrophobicContact CB-CH2 4.06Å; R193-W232 HydrophobicContact CB-CZ3 3.86Å; R193-W232 HydrophobicContact CG-CZ3 4.41Å; R193-W232 WeakPolarHBondContact O-CZ3 3.45Å
194	Q	90.1	Very high	89.1	Confident	86 Å²	86	34.9 Å²	34.9	40%	0.402	19%	0.189	S	C	.	.	H	α-helix	trans	-67.4	-37.6	179	-67.9	177.7	32.3	0	0	112.8	V158 Q190 S191 L192 H197 Q198	V158-Q194 HydrophobicContact CG1-CB 4.1Å; V158-Q194 VanDerWaalsContact CG1-OE1 3.31Å; V158-Q194 HydrophobicContact CG2-CB 4.3Å; Q190-Q194 WeakPolarHBondContact O-CG 3.22Å; Q190-Q194 PolarHBondContact O-N 2.83Å; S191-Q194 PolarHBondContact O-N 2.89Å; L192-Q194 VanDerWaalsContact C-N 3.32Å; L192-Q194 PolarHBondContact O-N 3.41Å; Q194-H197 WeakPolarHBondContact O-CB 3.4Å; Q194-H197 PolarHBondContact O-N 2.95Å; Q194-Q198 WeakPolarHBondContact O-CG 3.21Å; Q194-Q198 PolarHBondContact O-N 3.39Å
195	L	93.4	Very high	90.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-66.8	-50.2	178.5	-168.1	82.6	0	0	0	111.5	I147 A154 L157 V158 L166 S191 L192 H197 Q198 L199	I147-L195 HydrophobicContact CD1-CD2 3.36Å; A154-L195 HydrophobicContact CB-CD2 3.86Å; L157-L195 HydrophobicContact CB-CD1 3.75Å; L157-L195 HydrophobicContact CD1-CD1 4.23Å; V158-L195 HydrophobicContact CG2-CB 3.87Å; V158-L195 HydrophobicContact CG2-CD1 3.89Å; L166-L195 HydrophobicContact CD1-CD1 3.63Å; L166-L195 HydrophobicContact CD2-CD1 4.3Å; S191-L195 WeakPolarHBondContact O-CB 3.49Å; S191-L195 PolarHBondContact O-N 3.42Å; L192-L195 PolarHBondContact O-N 2.77Å; L195-H197 PolarHBondContact O-N 2.77Å; L195-Q198 PolarHBondContact O-N 3.07Å; L195-L199 HydrophobicContact CD1-CD1 4.1Å; L195-L199 HydrophobicContact CD2-CD1 4.05Å; L195-L199 HydrophobicContact CG-CD1 3.7Å; L195-L199 HydrophobicContact CG-CG 4.34Å; L195-L199 WeakPolarHBondContact O-CB 3.48Å; L195-L199 WeakPolarHBondContact O-CG 3.46Å; L195-L199 PolarHBondContact O-N 3.5Å
196	L	93.2	Very high	90.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-58.1	-41.4	173.2	-69.7	172.8	0	0	0	110.3	L176 F178 L192 Q198 L199 I200 H201 I224 M227	L176-L196 HydrophobicContact CD2-CD2 3.69Å; F178-L196 HydrophobicContact CE2-CD2 4.43Å; F178-L196 HydrophobicContact CZ-CD2 4.03Å; L192-L196 HydrophobicContact CD1-CD1 4.01Å; L192-L196 HydrophobicContact CD1-CD2 4.42Å; L192-L196 HydrophobicContact CD1-CG 3.85Å; L192-L196 HydrophobicContact CD2-CD1 4.34Å; L192-L196 HydrophobicContact CG-CD1 3.82Å; L192-L196 HydrophobicContact CG-CG 4.14Å; L192-L196 WeakPolarHBondContact O-CB 3.5Å; L192-L196 WeakPolarHBondContact O-CG 3.46Å; L192-L196 PolarHBondContact O-N 3.31Å; L196-Q198 PolarHBondContact O-N 2.73Å; L196-L199 PolarHBondContact O-N 3.24Å; L196-I200 HydrophobicContact CD2-CD1 3.74Å; L196-I200 WeakPolarHBondContact O-CB 3.26Å; L196-I200 PolarHBondContact O-N 3.23Å; L196-H201 PolarHBondContact O-CD2 2.9Å; L196-I224 HydrophobicContact CD1-CG1 4.29Å; L196-M227 HydrophobicContact CB-CB 4.36Å; L196-M227 HydrophobicContact CB-CE 3.54Å; L196-M227 HydrophobicContact CB-SD 3.67Å; L196-M227 HydrophobicContact CD1-CB 4.13Å; L196-M227 HydrophobicContact CD1-CG 4.41Å; L196-M227 HydrophobicContact CD1-SD 3.86Å; L196-M227 HydrophobicContact CG-SD 4.42Å
197	H	90.8	Very high	91.2	Very high	5 Å²	5	29.5 Å²	29.5	2%	0.023	16%	0.158	C	C	.	.	I	π-helix	trans	-55.9	-50.7	177.3	-170.8	51.5	0	0	0	112.2	R193 Q194 L195 H201 H202 M227 W232 C241 C244	R193-H197 WeakPolarHBondContact O-CB 3.39Å; R193-H197 PolarHBondContact O-N 2.96Å; Q194-H197 WeakPolarHBondContact O-CB 3.4Å; Q194-H197 PolarHBondContact O-N 2.95Å; L195-H197 PolarHBondContact O-N 2.77Å; H197-H201 WeakPolarHBondContact O-CB 3.23Å; H197-H201 PolarHBondContact O-N 2.84Å; H197-H202 AromaticContact CE1-NE2 3.65Å; H197-H202 AromaticContact NE2-CD2 3.87Å; H197-H202 AromaticContact NE2-NE2 3.44Å; H197-H202 PolarHBondContact NE2-NE2 3.43Å; H197-H202 PolarHBondContact O-N 2.9Å; H197-M227 HydrophobicContact CB-CE 4.02Å; H197-W232 HydrophobicContact CB-CE3 4.45Å; H197-W232 HydrophobicContact CB-CH2 3.92Å; H197-W232 HydrophobicContact CB-CZ2 4.21Å; H197-W232 HydrophobicContact CB-CZ3 4.06Å; H197-W232 AromaticContact CE1-CD1 3.91Å; H197-W232 AromaticContact CE1-CE2 3.92Å; H197-W232 AromaticContact CE1-NE1 3.7Å; H197-W232 AromaticContact CG-CE2 3.96Å; H197-W232 AromaticContact CG-CZ2 3.88Å; H197-W232 AromaticContact ND1-CD2 3.79Å; H197-W232 AromaticContact ND1-CE2 3.73Å; H197-W232 AromaticContact ND1-NE1 3.94Å; H197-C241 WeakPolarHBondContact NE2-CB 3.47Å; H197-C241 PolarHBondContact NE2-SG 3.45Å; H197-C244 PolarHBondContact CE1-SG 3.49Å; H197-C244 PolarHBondContact NE2-SG 2.99Å
198	Q	91.1	Very high	91.7	Very high	53 Å²	53	27 Å²	27	25%	0.248	14%	0.138	C	C	.	.	I	π-helix	trans	-71	-42.1	178.8	-63.3	-55	-35.8	0	0	113.1	L166 Q194 L195 L196 H202 G203	L166-Q198 HydrophobicContact CD1-CB 4.29Å; L166-Q198 HydrophobicContact CD2-CB 4.26Å; L166-Q198 HydrophobicContact CD2-CG 4.13Å; L166-Q198 HydrophobicContact CG-CB 4.27Å; Q194-Q198 WeakPolarHBondContact O-CG 3.21Å; Q194-Q198 PolarHBondContact O-N 3.39Å; L195-Q198 PolarHBondContact O-N 3.07Å; L196-Q198 PolarHBondContact O-N 2.73Å; Q198-H202 CarbonylContact O-C 3.59Å; Q198-G203 PolarHBondContact O-N 2.79Å
199	L	94.4	Very high	92.1	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.137	C	C	.	.	I	π-helix	trans	-79.2	-35.8	-172.1	-66.8	178.8	0	0	0	114.1	L145 L166 L169 A170 L173 L176 L195 L196 G203 V205	L145-L199 HydrophobicContact CD2-CD1 4.46Å; L166-L199 HydrophobicContact CD1-CD2 3.72Å; L166-L199 HydrophobicContact CD1-CG 3.98Å; L169-L199 HydrophobicContact CB-CD2 3.9Å; A170-L199 HydrophobicContact CB-CD2 4.5Å; L173-L199 HydrophobicContact CD2-CD1 3.75Å; L173-L199 HydrophobicContact CD2-CD2 4.01Å; L173-L199 HydrophobicContact CD2-CG 4.37Å; L176-L199 HydrophobicContact CD2-CD1 4.37Å; L195-L199 HydrophobicContact CD1-CD1 4.1Å; L195-L199 HydrophobicContact CD2-CD1 4.05Å; L195-L199 HydrophobicContact CG-CD1 3.7Å; L195-L199 HydrophobicContact CG-CG 4.34Å; L195-L199 WeakPolarHBondContact O-CB 3.48Å; L195-L199 WeakPolarHBondContact O-CG 3.46Å; L195-L199 PolarHBondContact O-N 3.5Å; L196-L199 PolarHBondContact O-N 3.24Å; L199-G203 CarbonylContact O-C 3.5Å; L199-G203 VanDerWaalsContact O-C 3.28Å; L199-G203 VanDerWaalsContact O-CA 3.26Å; L199-G203 WeakPolarHBondContact O-CA 3.19Å; L199-V205 HydrophobicContact CB-CG2 3.95Å; L199-V205 WeakPolarHBondContact O-CB 3.47Å; L199-V205 WeakPolarHBondContact O-CG2 3.33Å; L199-V205 PolarHBondContact O-N 2.86Å
200	I	93.2	Very high	92.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.131	C	C	.	.	I	π-helix	trans	-93.3	-48.3	-178.3	-63.6	176.6	0	0	0	111.3	L196 V205 V208 R438 I440	L196-I200 HydrophobicContact CD2-CD1 3.74Å; L196-I200 WeakPolarHBondContact O-CB 3.26Å; L196-I200 PolarHBondContact O-N 3.23Å; I200-V205 HydrophobicContact CG1-CB 4.18Å; I200-V205 HydrophobicContact CG1-CG1 4.1Å; I200-V208 HydrophobicContact CD1-CG2 4.01Å; I200-R438 WeakPolarHBondContact O-CD 3.45Å; I200-R438 PolarHBondContact O-NH1 3.49Å; I200-I440 HydrophobicContact CB-CG2 4.48Å; I200-I440 HydrophobicContact CD1-CG2 4Å; I200-I440 HydrophobicContact CG1-CG2 4.05Å; I200-I440 HydrophobicContact CG2-CG2 3.68Å
201	H	89.1	Confident	92.4	Very high	14 Å²	14	23.6 Å²	23.6	7%	0.065	12%	0.119	C	C	.	.	I	π-helix	trans	-89.6	-30.4	-167.8	-50.6	-92.8	0	0	0	112.9	L196 H197 M227 F437 R438	L196-H201 PolarHBondContact O-CD2 2.9Å; H197-H201 WeakPolarHBondContact O-CB 3.23Å; H197-H201 PolarHBondContact O-N 2.84Å; H201-M227 PolarHBondContact CE1-O 3.31Å; H201-M227 VanDerWaalsContact NE2-CE 3.27Å; H201-M227 WeakPolarHBondContact NE2-CE 3.32Å; H201-M227 PolarHBondContact NE2-O 3.43Å; H201-F437 HydrophobicContact CB-CB 4.01Å; H201-F437 HydrophobicContact CB-CG 4.47Å; H201-F437 VanDerWaalsContact ND1-CB 3.26Å; H201-F437 WeakPolarHBondContact ND1-CB 3.34Å; H201-R438 PolarHBondContact ND1-O 2.87Å
202	H	89.4	Confident	92.1	Very high	66 Å²	66	24.6 Å²	24.6	31%	0.306	13%	0.126	S	C	.	.	S	Bend	trans	-108	-8.3	173.4	-63.7	-56.5	0	0	0	113.9	H197 Q198 C241 L243 C244	H197-H202 AromaticContact CE1-NE2 3.65Å; H197-H202 AromaticContact NE2-CD2 3.87Å; H197-H202 AromaticContact NE2-NE2 3.44Å; H197-H202 PolarHBondContact NE2-NE2 3.43Å; H197-H202 PolarHBondContact O-N 2.9Å; Q198-H202 CarbonylContact O-C 3.59Å; H202-C241 PolarHBondContact NE2-SG 2.88Å; H202-L243 HydrophobicContact CB-CD1 3.99Å; H202-L243 VanDerWaalsContact CE1-CB 3.43Å; H202-L243 WeakPolarHBondContact CE1-CB 3.38Å; H202-C244 PolarHBondContact NE2-SG 3Å; H202-C244 VanDerWaalsContact NE2-SG 3.45Å
203	G	90.7	Very high	91.8	Very high	11 Å²	11	24.9 Å²	24.9	11%	0.113	13%	0.127	C	C	.	.	S	Bend	trans	-114.1	-174	-176.4	0	0	0	0	0	114.1	A170 Q198 L199 R438	A170-G203 CarbonylContact O-C 3.5Å; A170-G203 WeakPolarHBondContact O-CA 3.44Å; Q198-G203 PolarHBondContact O-N 2.79Å; L199-G203 CarbonylContact O-C 3.5Å; L199-G203 VanDerWaalsContact O-C 3.28Å; L199-G203 VanDerWaalsContact O-CA 3.26Å; L199-G203 WeakPolarHBondContact O-CA 3.19Å; G203-R438 PolarHBondContact O-NH1 2.84Å
204	A	93.3	Very high	91.2	Very high	28 Å²	28	25.8 Å²	25.8	23%	0.231	14%	0.143	C	C	.	.			trans	-86.7	-10.6	-173.5	0	0	0	0	0	114.7	A170 L173 S206 R438	A170-A204 PolarHBondContact O-N 2.86Å; L173-A204 CarbonylContact O-C 3.42Å; L173-A204 WeakPolarHBondContact O-CB 3.27Å; A204-S206 PolarHBondContact O-N 3.12Å; A204-S206 VanDerWaalsContact O-N 3.08Å; A204-R438 PolarHBondContact O-NH2 3.47Å
205	V	96.4	Very high	90.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.159	C	C	.	.			trans	-56	117.2	-170.8	175.1	0	0	0	0	111.4	L173 H174 L176 L199 I200 V208 R438 I440	L173-V205 HydrophobicContact CB-CG2 4.06Å; L173-V205 HydrophobicContact CD2-CG2 3.64Å; L173-V205 HydrophobicContact CG-CG2 3.79Å; L173-V205 WeakPolarHBondContact O-CG2 3.2Å; L173-V205 PolarHBondContact O-N 3.01Å; H174-V205 WeakPolarHBondContact O-CA 3.27Å; L176-V205 HydrophobicContact CB-CG1 3.91Å; L199-V205 HydrophobicContact CB-CG2 3.95Å; L199-V205 WeakPolarHBondContact O-CB 3.47Å; L199-V205 WeakPolarHBondContact O-CG2 3.33Å; L199-V205 PolarHBondContact O-N 2.86Å; I200-V205 HydrophobicContact CG1-CB 4.18Å; I200-V205 HydrophobicContact CG1-CG1 4.1Å; V205-V208 HydrophobicContact CG1-CG2 4.29Å; V205-R438 PolarHBondContact O-NH1 2.96Å; V205-R438 PolarHBondContact O-NH2 2.89Å; V205-I440 HydrophobicContact CG1-CG2 4.47Å
206	S	94.6	Very high	90.2	Very high	38 Å²	38	28.6 Å²	28.6	27%	0.266	17%	0.166	S	C	.	.			trans	-114.2	-10.1	179.6	58	0	0	0	0	113	H174 A204 I440 S441 T442	H174-S206 PolarHBondContact O-N 3.34Å; A204-S206 PolarHBondContact O-N 3.12Å; A204-S206 VanDerWaalsContact O-N 3.08Å; S206-I440 WeakPolarHBondContact O-CB 3.17Å; S206-S441 PolarHBondContact O-N 3Å; S206-T442 PolarHBondContact O-N 3.08Å
207	Q	95.9	Very high	89.9	Confident	46 Å²	46	30.4 Å²	30.4	22%	0.215	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	126.3	-179.6	-176.8	-175.4	25.5	0	0	110.3	H174 T175 L176 T442 E444	H174-Q207 PolarHBondContact O-N 2.94Å; H174-Q207 VanDerWaalsContact O-N 3.14Å; T175-Q207 WeakPolarHBondContact CA-O 3.32Å; T175-Q207 HydrophobicContact CG2-CB 4.1Å; T175-Q207 HydrophobicContact CG2-CG 3.82Å; T175-Q207 PolarHBondContact OG1-OE1 2.78Å; L176-Q207 PolarHBondContact N-O 2.9Å; Q207-T442 WeakPolarHBondContact CA-O 3.42Å; Q207-T442 HydrophobicContact CG-CG2 3.9Å; Q207-E444 PolarHBondContact NE2-OE1 3.48Å
208	V	96.6	Very high	89.7	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	133.2	168.5	174.8	0	0	0	0	109.3	L176 F178 I200 V205 L210 I224 I440 T442 L443 E444	L176-V208 HydrophobicContact CB-CG2 4.36Å; L176-V208 VanDerWaalsContact O-CA 3.29Å; L176-V208 WeakPolarHBondContact O-CA 3.35Å; F178-V208 HydrophobicContact CD2-CG1 4.23Å; F178-V208 HydrophobicContact CE2-CG1 4.1Å; I200-V208 HydrophobicContact CD1-CG2 4.01Å; V205-V208 HydrophobicContact CG1-CG2 4.29Å; V208-L210 HydrophobicContact CG1-CD2 4.14Å; V208-I224 HydrophobicContact CG1-CG2 4.16Å; V208-I440 HydrophobicContact CB-CD1 3.46Å; V208-I440 VanDerWaalsContact CB-CD1 3.46Å; V208-I440 HydrophobicContact CG2-CD1 3.55Å; V208-I440 HydrophobicContact CG2-CG2 4.11Å; V208-T442 PolarHBondContact N-O 3.5Å; V208-L443 WeakPolarHBondContact O-CA 3.49Å; V208-E444 PolarHBondContact O-N 2.98Å
209	S	93.9	Very high	89.5	Confident	0 Å²	0	32 Å²	32	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	125.5	-176.4	-47.9	0	0	0	0	111.7	L176 K177 F178 Y211 E444	L176-S209 PolarHBondContact O-N 3.15Å; K177-S209 CarbonylContact C-O 3.6Å; K177-S209 VanDerWaalsContact CA-O 3.32Å; K177-S209 WeakPolarHBondContact CA-O 3.41Å; F178-S209 PolarHBondContact N-O 3.22Å; S209-Y211 VanDerWaalsContact CB-CZ 3.41Å; S209-Y211 VanDerWaalsContact CB-OH 3.28Å; S209-Y211 WeakPolarHBondContact CB-OH 3.48Å; S209-Y211 PolarHBondContact OG-OH 3.03Å; S209-E444 CarbonylContact C-O 3.28Å; S209-E444 WeakPolarHBondContact CA-O 3.4Å; S209-E444 VanDerWaalsContact CB-OE2 3.25Å; S209-E444 WeakPolarHBondContact CB-OE2 3.42Å; S209-E444 PolarHBondContact OG-OE2 3.49Å
210	L	92.9	Very high	89.2	Confident	1 Å²	1	32 Å²	32	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	118	178.9	-48	-173.2	0	0	0	109	F178 V208 W213 F221 I224 E444 L445 F446 V448	F178-L210 HydrophobicContact CB-CD2 3.64Å; F178-L210 HydrophobicContact CD2-CD2 3.4Å; F178-L210 VanDerWaalsContact CD2-CD2 3.4Å; F178-L210 HydrophobicContact CE2-CD2 4.36Å; F178-L210 HydrophobicContact CG-CD2 3.84Å; V208-L210 HydrophobicContact CG1-CD2 4.14Å; L210-W213 HydrophobicContact CD1-CZ3 4.34Å; L210-F221 HydrophobicContact CD1-CD2 3.82Å; L210-F221 HydrophobicContact CD1-CE2 3.5Å; L210-F221 HydrophobicContact CD1-CZ 4.43Å; L210-I224 HydrophobicContact CD1-CG2 4.33Å; L210-I224 HydrophobicContact CD2-CG2 4.11Å; L210-E444 PolarHBondContact N-O 3.28Å; L210-L445 HydrophobicContact CB-CD2 3.83Å; L210-L445 HydrophobicContact CD1-CD2 3.57Å; L210-L445 HydrophobicContact CG-CD2 3.73Å; L210-F446 PolarHBondContact O-N 3.15Å; L210-V448 HydrophobicContact CB-CG2 4.1Å
211	Y	89.1	Confident	89	Confident	50 Å²	50	32 Å²	32	20%	0.196	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	136.9	-177.8	-50.7	-94.7	0	0	0	112.3	K177 F178 R179 S209 W213 E444 F446	K177-Y211 HydrophobicContact CB-CE2 4.13Å; K177-Y211 HydrophobicContact CD-CD2 4.49Å; K177-Y211 HydrophobicContact CD-CE2 3.56Å; K177-Y211 WeakPolarHBondContact CE-OH 3.4Å; K177-Y211 HydrophobicContact CG-CE2 3.9Å; K177-Y211 PolarHBondContact NZ-OH 3.31Å; K177-Y211 VanDerWaalsContact NZ-OH 3.16Å; F178-Y211 PolarHBondContact O-N 2.99Å; R179-Y211 WeakPolarHBondContact CA-O 3.35Å; S209-Y211 VanDerWaalsContact CB-CZ 3.41Å; S209-Y211 VanDerWaalsContact CB-OH 3.28Å; S209-Y211 WeakPolarHBondContact CB-OH 3.48Å; S209-Y211 PolarHBondContact OG-OH 3.03Å; Y211-W213 PolarHBondContact O-N 3.37Å; Y211-E444 PolarHBondContact OH-OE2 2.78Å; Y211-F446 CarbonylContact C-O 3.49Å; Y211-F446 WeakPolarHBondContact CA-O 3.46Å; Y211-F446 HydrophobicContact CD1-CB 3.68Å; Y211-F446 AromaticContact CD1-CD2 3.47Å; Y211-F446 HydrophobicContact CD1-CD2 3.47Å; Y211-F446 VanDerWaalsContact CD1-CD2 3.47Å; Y211-F446 HydrophobicContact CD1-CE2 4.28Å; Y211-F446 AromaticContact CD1-CG 3.82Å; Y211-F446 HydrophobicContact CD1-CG 3.82Å; Y211-F446 HydrophobicContact CE1-CB 4.33Å; Y211-F446 AromaticContact CE1-CD2 3.2Å; Y211-F446 HydrophobicContact CE1-CD2 3.2Å; Y211-F446 AromaticContact CE1-CE2 3.56Å; Y211-F446 HydrophobicContact CE1-CE2 3.56Å; Y211-F446 AromaticContact CE1-CG 3.96Å; Y211-F446 HydrophobicContact CE1-CG 3.96Å; Y211-F446 HydrophobicContact CG-CB 4.48Å
212	S	83.8	Confident	89.1	Confident	42 Å²	42	32 Å²	32	29%	0.294	20%	0.196	S	C	.	.	S	Bend	trans	52.9	59.6	166.8	-51.4	0	0	0	0	112.7	H180 P214 F446 T447	H180-S212 VanDerWaalsContact CE1-CB 3.47Å; H180-S212 WeakPolarHBondContact CE1-CB 3.07Å; H180-S212 PolarHBondContact N-O 2.78Å; H180-S212 PolarHBondContact ND1-O 3.05Å; S212-P214 WeakPolarHBondContact O-CD 3.42Å; S212-F446 PolarHBondContact N-O 3.07Å; S212-T447 WeakPolarHBondContact CA-OG1 3.38Å; S212-T447 PolarHBondContact N-OG1 2.91Å; S212-T447 VanDerWaalsContact N-OG1 3.08Å; S212-T447 PolarHBondContact OG-OG1 2.9Å
213	W	85.7	Confident	89.1	Confident	5 Å²	5	29.6 Å²	29.6	2%	0.019	19%	0.185	C	C	.	.			trans	-122.8	80.6	-179.6	-171.9	11.2	0	0	0	108.5	L181 L210 Y211 V215 P216 L220 F221 I224 T447 V448 P449	L181-W213 HydrophobicContact CB-CD2 4Å; L181-W213 HydrophobicContact CB-CG 4.38Å; L181-W213 HydrophobicContact CB-CZ2 3.95Å; L181-W213 HydrophobicContact CD1-CD2 4.44Å; L181-W213 HydrophobicContact CD1-CE3 4.17Å; L181-W213 HydrophobicContact CD1-CH2 3.89Å; L181-W213 HydrophobicContact CD1-CZ2 4.15Å; L181-W213 HydrophobicContact CD1-CZ3 3.87Å; L181-W213 PolarHBondContact O-NE1 2.86Å; L210-W213 HydrophobicContact CD1-CZ3 4.34Å; Y211-W213 PolarHBondContact O-N 3.37Å; W213-V215 VanDerWaalsContact C-N 3.31Å; W213-V215 PolarHBondContact NE1-O 3.15Å; W213-V215 PolarHBondContact O-N 3.44Å; W213-P216 HydrophobicContact CD2-CB 3.96Å; W213-P216 HydrophobicContact CE3-CB 4.33Å; W213-P216 HydrophobicContact CG-CB 4.41Å; W213-P216 HydrophobicContact CH2-CB 4.37Å; W213-P216 HydrophobicContact CZ2-CB 4.02Å; W213-L220 HydrophobicContact CH2-CB 4.14Å; W213-L220 HydrophobicContact CH2-CD2 3.96Å; W213-L220 HydrophobicContact CH2-CG 3.84Å; W213-L220 HydrophobicContact CZ2-CB 4.37Å; W213-L220 HydrophobicContact CZ2-CD2 3.83Å; W213-L220 HydrophobicContact CZ2-CG 4.17Å; W213-F221 HydrophobicContact CE3-CD2 4.09Å; W213-F221 HydrophobicContact CH2-CB 3.97Å; W213-F221 HydrophobicContact CH2-CD2 4.32Å; W213-F221 HydrophobicContact CZ3-CB 4.15Å; W213-F221 AromaticContact CZ3-CD2 3.65Å; W213-F221 HydrophobicContact CZ3-CD2 3.65Å; W213-F221 HydrophobicContact CZ3-CG 4.4Å; W213-I224 HydrophobicContact CH2-CD1 4.33Å; W213-I224 HydrophobicContact CZ3-CD1 4.11Å; W213-T447 PolarHBondContact N-O 3.04Å; W213-T447 VanDerWaalsContact N-O 3.08Å; W213-V448 HydrophobicContact CB-CG1 4.16Å; W213-V448 HydrophobicContact CB-CG2 3.96Å; W213-V448 HydrophobicContact CE3-CG1 4.34Å; W213-P449 WeakPolarHBondContact O-CD 3.42Å
214	P	77.6	Confident	89.2	Confident	96 Å²	96	29.1 Å²	29.1	62%	0.623	18%	0.18	S	C	*	.	S	Bend	trans	-74.6	-16.9	-165.4	29.5	-36.7	0	0	0	114.4	S212 P449	S212-P214 WeakPolarHBondContact O-CD 3.42Å; P214-P449 WeakPolarHBondContact O-CG 3.49Å
215	V	80.4	Confident	89.2	Confident	121 Å²	121	27.8 Å²	27.8	73%	0.733	17%	0.169	S	C	*	.	S	Bend	trans	-133.7	84.1	175.5	-173.8	0	0	0	0	108.3	W213 E217	W213-V215 VanDerWaalsContact C-N 3.31Å; W213-V215 PolarHBondContact NE1-O 3.15Å; W213-V215 PolarHBondContact O-N 3.44Å; V215-E217 PolarHBondContact O-N 3.16Å
216	P	82.2	Confident	89	Confident	24 Å²	24	28.4 Å²	28.4	16%	0.156	17%	0.173	C	C	.	.			trans	-76.8	119.6	-180	27.4	-29.1	0	0	0	111.9	W213 S218 F221 V448 P449	W213-P216 HydrophobicContact CD2-CB 3.96Å; W213-P216 HydrophobicContact CE3-CB 4.33Å; W213-P216 HydrophobicContact CG-CB 4.41Å; W213-P216 HydrophobicContact CH2-CB 4.37Å; W213-P216 HydrophobicContact CZ2-CB 4.02Å; P216-S218 PolarHBondContact O-N 3.5Å; P216-F221 HydrophobicContact CB-CB 4.32Å; P216-F221 HydrophobicContact CB-CD2 4.32Å; P216-V448 HydrophobicContact CB-CG1 4.24Å; P216-V448 HydrophobicContact CG-CG1 4.14Å; P216-P449 HydrophobicContact CG-CG 4.27Å; P216-P449 VanDerWaalsContact CG-O 3.28Å; P216-P449 WeakPolarHBondContact CG-O 3.49Å
217	E	86.8	Confident	88.8	Confident	39 Å²	39	26.8 Å²	26.8	18%	0.182	16%	0.161	C	C	.	.			trans	-59.3	109.5	165.5	-170.2	-158.6	141.5	0	0	107.9	S184 Q189 V215 A219 L220 F221	S184-E217 PolarHBondContact N-OE2 2.96Å; S184-E217 VanDerWaalsContact N-OE2 3.12Å; S184-E217 PolarHBondContact OG-OE2 3.5Å; Q189-E217 PolarHBondContact NE2-OE1 3.21Å; V215-E217 PolarHBondContact O-N 3.16Å; E217-A219 VanDerWaalsContact C-N 3.28Å; E217-A219 PolarHBondContact O-N 3.01Å; E217-L220 HydrophobicContact CB-CB 4.04Å; E217-L220 HydrophobicContact CG-CB 4.39Å; E217-L220 WeakPolarHBondContact O-CB 3.45Å; E217-L220 PolarHBondContact O-N 3.36Å; E217-F221 PolarHBondContact O-N 3.32Å
218	S	85.7	Confident	88.7	Confident	33 Å²	33	24.6 Å²	24.6	23%	0.231	15%	0.151	C	C	.	.	H	α-helix	trans	-61.3	-36	-166.8	-71.6	0	0	0	0	112.5	P216 L220 F221 I222 S451	P216-S218 PolarHBondContact O-N 3.5Å; S218-L220 PolarHBondContact O-N 3.21Å; S218-F221 PolarHBondContact O-N 3.34Å; S218-I222 VanDerWaalsContact O-CB 3.24Å; S218-I222 WeakPolarHBondContact O-CB 3.24Å; S218-I222 WeakPolarHBondContact O-CD1 3.32Å; S218-I222 WeakPolarHBondContact O-CG1 3.36Å; S218-I222 PolarHBondContact O-N 2.95Å; S218-S451 PolarHBondContact OG-OG 2.99Å
219	A	86.8	Confident	88.4	Confident	57 Å²	57	24.9 Å²	24.9	47%	0.471	15%	0.154	S	C	.	.	H	α-helix	trans	-60.1	-41	173.1	0	0	0	0	0	113.2	E217 L223	E217-A219 VanDerWaalsContact C-N 3.28Å; E217-A219 PolarHBondContact O-N 3.01Å; A219-L223 VanDerWaalsContact O-CB 3.23Å; A219-L223 WeakPolarHBondContact O-CB 3.37Å; A219-L223 PolarHBondContact O-N 3.5Å
220	L	88.6	Confident	88.1	Confident	0 Å²	0	25 Å²	25	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-71.7	-39.5	178	-176.4	59.9	0	0	0	111.9	L151 L181 Q189 L192 W213 E217 S218 L223 I224	L151-L220 HydrophobicContact CD1-CD1 3.84Å; L151-L220 HydrophobicContact CD1-CD2 4.16Å; L181-L220 HydrophobicContact CD1-CD2 4.15Å; Q189-L220 HydrophobicContact CG-CD1 4.46Å; L192-L220 HydrophobicContact CD2-CD1 3.46Å; L192-L220 VanDerWaalsContact CD2-CD1 3.46Å; W213-L220 HydrophobicContact CH2-CB 4.14Å; W213-L220 HydrophobicContact CH2-CD2 3.96Å; W213-L220 HydrophobicContact CH2-CG 3.84Å; W213-L220 HydrophobicContact CZ2-CB 4.37Å; W213-L220 HydrophobicContact CZ2-CD2 3.83Å; W213-L220 HydrophobicContact CZ2-CG 4.17Å; E217-L220 HydrophobicContact CB-CB 4.04Å; E217-L220 HydrophobicContact CG-CB 4.39Å; E217-L220 WeakPolarHBondContact O-CB 3.45Å; E217-L220 PolarHBondContact O-N 3.36Å; S218-L220 PolarHBondContact O-N 3.21Å; L220-L223 HydrophobicContact CD1-CD2 4.31Å; L220-I224 HydrophobicContact CG-CD1 4.46Å; L220-I224 WeakPolarHBondContact O-CG1 3.28Å; L220-I224 PolarHBondContact O-N 3.17Å; L220-I224 VanDerWaalsContact O-N 3.12Å
221	F	89.9	Confident	87.7	Confident	2 Å²	2	25.5 Å²	25.5	1%	0.009	16%	0.157	C	C	.	.	H	α-helix	trans	-67.2	-47.1	177.2	-174	-95.1	0	0	0	111.7	L210 W213 P216 E217 S218 L223 I224 L225 L445 V448 L450 A454	L210-F221 HydrophobicContact CD1-CD2 3.82Å; L210-F221 HydrophobicContact CD1-CE2 3.5Å; L210-F221 HydrophobicContact CD1-CZ 4.43Å; W213-F221 HydrophobicContact CE3-CD2 4.09Å; W213-F221 HydrophobicContact CH2-CB 3.97Å; W213-F221 HydrophobicContact CH2-CD2 4.32Å; W213-F221 HydrophobicContact CZ3-CB 4.15Å; W213-F221 AromaticContact CZ3-CD2 3.65Å; W213-F221 HydrophobicContact CZ3-CD2 3.65Å; W213-F221 HydrophobicContact CZ3-CG 4.4Å; P216-F221 HydrophobicContact CB-CB 4.32Å; P216-F221 HydrophobicContact CB-CD2 4.32Å; E217-F221 PolarHBondContact O-N 3.32Å; S218-F221 PolarHBondContact O-N 3.34Å; F221-L223 VanDerWaalsContact C-N 3.33Å; F221-L223 PolarHBondContact O-N 2.95Å; F221-I224 PolarHBondContact O-N 2.62Å; F221-L225 HydrophobicContact CD1-CD1 3.9Å; F221-L225 HydrophobicContact CD1-CG 4.25Å; F221-L225 HydrophobicContact CE1-CD1 3.42Å; F221-L225 VanDerWaalsContact CE1-CD1 3.42Å; F221-L225 HydrophobicContact CE1-CG 3.96Å; F221-L225 HydrophobicContact CZ-CD1 4.15Å; F221-L225 HydrophobicContact CZ-CG 4.39Å; F221-L225 PolarHBondContact O-N 3.02Å; F221-L445 HydrophobicContact CE2-CD2 4.12Å; F221-L445 HydrophobicContact CZ-CD1 4.03Å; F221-L445 HydrophobicContact CZ-CD2 4.14Å; F221-V448 HydrophobicContact CD2-CG1 4.11Å; F221-V448 HydrophobicContact CE2-CG1 3.68Å; F221-L450 HydrophobicContact CE1-CD2 3.74Å; F221-L450 HydrophobicContact CZ-CD2 3.52Å; F221-A454 HydrophobicContact CD1-CB 3.62Å; F221-A454 HydrophobicContact CE1-CB 3.75Å
222	I	90.4	Very high	87.3	Confident	14 Å²	14	24.6 Å²	24.6	7%	0.072	15%	0.153	C	C	.	.	H	α-helix	trans	-60.8	-40.9	175.2	-72.3	165.8	0	0	0	111	S218 I224 L225 T226 E453 T457	S218-I222 VanDerWaalsContact O-CB 3.24Å; S218-I222 WeakPolarHBondContact O-CB 3.24Å; S218-I222 WeakPolarHBondContact O-CD1 3.32Å; S218-I222 WeakPolarHBondContact O-CG1 3.36Å; S218-I222 PolarHBondContact O-N 2.95Å; I222-I224 PolarHBondContact O-N 3.41Å; I222-L225 PolarHBondContact O-N 2.87Å; I222-T226 HydrophobicContact CG2-CG2 4.14Å; I222-T226 WeakPolarHBondContact O-CB 3.39Å; I222-T226 VanDerWaalsContact O-CG2 3.3Å; I222-T226 WeakPolarHBondContact O-CG2 3.3Å; I222-T226 PolarHBondContact O-N 3.14Å; I222-T226 PolarHBondContact O-OG1 2.97Å; I222-E453 HydrophobicContact CD1-CB 4.49Å; I222-E453 VanDerWaalsContact CD1-CD 3.47Å; I222-E453 HydrophobicContact CD1-CG 3.68Å; I222-T457 HydrophobicContact CG1-CG2 4.39Å; I222-T457 HydrophobicContact CG2-CG2 4.19Å
223	L	90.6	Very high	86.7	Confident	15 Å²	15	25.9 Å²	25.9	8%	0.079	16%	0.155	C	C	.	.	H	α-helix	trans	-56.3	-49.3	172.5	166.6	61.9	0	0	0	112.1	L192 R193 A219 L220 F221 L225 T226 M227	L192-L223 HydrophobicContact CD2-CD2 4.29Å; R193-L223 HydrophobicContact CG-CD1 3.51Å; R193-L223 HydrophobicContact CG-CD2 3.83Å; R193-L223 HydrophobicContact CG-CG 4.31Å; A219-L223 VanDerWaalsContact O-CB 3.23Å; A219-L223 WeakPolarHBondContact O-CB 3.37Å; A219-L223 PolarHBondContact O-N 3.5Å; L220-L223 HydrophobicContact CD1-CD2 4.31Å; F221-L223 VanDerWaalsContact C-N 3.33Å; F221-L223 PolarHBondContact O-N 2.95Å; L223-L225 PolarHBondContact O-N 3.13Å; L223-T226 PolarHBondContact O-OG1 2.96Å; L223-M227 HydrophobicContact CD1-CG 3.98Å; L223-M227 HydrophobicContact CD1-SD 3.85Å; L223-M227 WeakPolarHBondContact O-CG 3.43Å; L223-M227 PolarHBondContact O-N 2.85Å; L223-M227 VanDerWaalsContact O-N 3.15Å
224	I	92.3	Very high	85.8	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.7	-42.6	179.7	-65.2	163.1	0	0	0	110.9	F178 L181 L192 L196 V208 L210 W213 L220 F221 I222 S228	F178-I224 HydrophobicContact CD1-CD1 4.46Å; F178-I224 HydrophobicContact CE1-CD1 4.5Å; F178-I224 HydrophobicContact CE2-CG2 4.32Å; F178-I224 HydrophobicContact CG-CD1 4.48Å; L181-I224 HydrophobicContact CD1-CD1 4.07Å; L192-I224 HydrophobicContact CD2-CD1 4.19Å; L192-I224 HydrophobicContact CD2-CG1 3.95Å; L196-I224 HydrophobicContact CD1-CG1 4.29Å; V208-I224 HydrophobicContact CG1-CG2 4.16Å; L210-I224 HydrophobicContact CD1-CG2 4.33Å; L210-I224 HydrophobicContact CD2-CG2 4.11Å; W213-I224 HydrophobicContact CH2-CD1 4.33Å; W213-I224 HydrophobicContact CZ3-CD1 4.11Å; L220-I224 HydrophobicContact CG-CD1 4.46Å; L220-I224 WeakPolarHBondContact O-CG1 3.28Å; L220-I224 PolarHBondContact O-N 3.17Å; L220-I224 VanDerWaalsContact O-N 3.12Å; F221-I224 PolarHBondContact O-N 2.62Å; I222-I224 PolarHBondContact O-N 3.41Å; I224-S228 VanDerWaalsContact O-CB 3.23Å; I224-S228 WeakPolarHBondContact O-CB 3.36Å; I224-S228 PolarHBondContact O-N 3.35Å; I224-S228 PolarHBondContact O-OG 3.29Å
225	L	92.8	Very high	85.1	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.8	-51.8	177.4	-71.3	-172.7	0	0	0	112.7	F221 I222 L223 M227 S228 A229 L443 L458 L461	F221-L225 HydrophobicContact CD1-CD1 3.9Å; F221-L225 HydrophobicContact CD1-CG 4.25Å; F221-L225 HydrophobicContact CE1-CD1 3.42Å; F221-L225 VanDerWaalsContact CE1-CD1 3.42Å; F221-L225 HydrophobicContact CE1-CG 3.96Å; F221-L225 HydrophobicContact CZ-CD1 4.15Å; F221-L225 HydrophobicContact CZ-CG 4.39Å; F221-L225 PolarHBondContact O-N 3.02Å; I222-L225 PolarHBondContact O-N 2.87Å; L223-L225 PolarHBondContact O-N 3.13Å; L225-M227 PolarHBondContact O-N 3.08Å; L225-S228 WeakPolarHBondContact O-CB 3.29Å; L225-S228 PolarHBondContact O-N 2.98Å; L225-A229 WeakPolarHBondContact O-CB 3.14Å; L225-A229 PolarHBondContact O-N 3.29Å; L225-L443 HydrophobicContact CD2-CD1 4.41Å; L225-L443 HydrophobicContact CD2-CD2 3.61Å; L225-L458 HydrophobicContact CD1-CB 4.11Å; L225-L458 HydrophobicContact CD1-CD1 4.22Å; L225-L458 HydrophobicContact CD2-CD1 4.27Å; L225-L461 HydrophobicContact CB-CD1 3.77Å
226	T	91.4	Very high	83.9	Confident	14 Å²	14	26.8 Å²	26.8	9%	0.086	17%	0.167	C	C	.	.	H	α-helix	trans	-59.1	-44.1	-178.1	50.2	0	0	0	0	112.4	I222 L223 A229 G230 F231 T457 L461	I222-T226 HydrophobicContact CG2-CG2 4.14Å; I222-T226 WeakPolarHBondContact O-CB 3.39Å; I222-T226 VanDerWaalsContact O-CG2 3.3Å; I222-T226 WeakPolarHBondContact O-CG2 3.3Å; I222-T226 PolarHBondContact O-N 3.14Å; I222-T226 PolarHBondContact O-OG1 2.97Å; L223-T226 PolarHBondContact O-OG1 2.96Å; T226-A229 CarbonylContact O-C 3.51Å; T226-A229 PolarHBondContact O-N 2.74Å; T226-G230 PolarHBondContact O-N 3.37Å; T226-F231 WeakPolarHBondContact O-CB 3.35Å; T226-F231 PolarHBondContact O-N 3.46Å; T226-T457 HydrophobicContact CG2-CG2 4.46Å; T226-L461 HydrophobicContact CG2-CD1 4.14Å; T226-L461 HydrophobicContact CG2-CD2 4.38Å
227	M	91.7	Very high	82.6	Confident	3 Å²	3	29.7 Å²	29.7	2%	0.015	20%	0.202	C	C	.	.	H	α-helix	trans	-68.3	-40	175.5	-69	-158.2	65	0	0	112.7	R193 L196 H197 H201 L223 L225 A229 G230 W232	R193-M227 HydrophobicContact CG-SD 4.47Å; R193-M227 WeakPolarHBondContact O-CE 3.23Å; L196-M227 HydrophobicContact CB-CB 4.36Å; L196-M227 HydrophobicContact CB-CE 3.54Å; L196-M227 HydrophobicContact CB-SD 3.67Å; L196-M227 HydrophobicContact CD1-CB 4.13Å; L196-M227 HydrophobicContact CD1-CG 4.41Å; L196-M227 HydrophobicContact CD1-SD 3.86Å; L196-M227 HydrophobicContact CG-SD 4.42Å; H197-M227 HydrophobicContact CB-CE 4.02Å; H201-M227 PolarHBondContact CE1-O 3.31Å; H201-M227 VanDerWaalsContact NE2-CE 3.27Å; H201-M227 WeakPolarHBondContact NE2-CE 3.32Å; H201-M227 PolarHBondContact NE2-O 3.43Å; L223-M227 HydrophobicContact CD1-CG 3.98Å; L223-M227 HydrophobicContact CD1-SD 3.85Å; L223-M227 WeakPolarHBondContact O-CG 3.43Å; L223-M227 PolarHBondContact O-N 2.85Å; L223-M227 VanDerWaalsContact O-N 3.15Å; L225-M227 PolarHBondContact O-N 3.08Å; M227-A229 PolarHBondContact O-N 3.12Å; M227-G230 PolarHBondContact O-N 3.41Å; M227-W232 HydrophobicContact CE-CD2 4.35Å; M227-W232 HydrophobicContact CE-CE3 3.31Å; M227-W232 HydrophobicContact CE-CZ3 3.47Å; M227-W232 VanDerWaalsContact CE-CZ3 3.47Å; M227-W232 HydrophobicContact SD-CE3 3.79Å; M227-W232 HydrophobicContact SD-CZ3 3.7Å
228	S	92.9	Very high	81.2	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-58.2	-39.3	174.2	-63.5	0	0	0	0	111.9	I224 L225 G230 S439 I440	I224-S228 VanDerWaalsContact O-CB 3.23Å; I224-S228 WeakPolarHBondContact O-CB 3.36Å; I224-S228 PolarHBondContact O-N 3.35Å; I224-S228 PolarHBondContact O-OG 3.29Å; L225-S228 WeakPolarHBondContact O-CB 3.29Å; L225-S228 PolarHBondContact O-N 2.98Å; S228-G230 PolarHBondContact O-N 3.25Å; S228-S439 WeakPolarHBondContact O-CA 3.48Å; S228-S439 VanDerWaalsContact O-CB 3.24Å; S228-S439 WeakPolarHBondContact O-CB 3.28Å; S228-I440 PolarHBondContact O-N 3.31Å
229	A	90.6	Very high	79.8	Confident	7 Å²	7	33.4 Å²	33.4	6%	0.058	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	8	174.4	0	0	0	0	0	114.4	L225 T226 M227 F231 L461 W465	L225-A229 WeakPolarHBondContact O-CB 3.14Å; L225-A229 PolarHBondContact O-N 3.29Å; T226-A229 CarbonylContact O-C 3.51Å; T226-A229 PolarHBondContact O-N 2.74Å; M227-A229 PolarHBondContact O-N 3.12Å; A229-F231 HydrophobicContact CB-CD2 3.92Å; A229-F231 HydrophobicContact CB-CE2 4.18Å; A229-F231 WeakPolarHBondContact O-CD2 3.28Å; A229-F231 PolarHBondContact O-N 3Å; A229-L461 HydrophobicContact CB-CB 4.09Å; A229-L461 HydrophobicContact CB-CD1 4.11Å; A229-L461 HydrophobicContact CB-CD2 3.85Å; A229-L461 HydrophobicContact CB-CG 4.24Å; A229-W465 HydrophobicContact CB-CD2 3.65Å; A229-W465 HydrophobicContact CB-CE3 3.68Å; A229-W465 HydrophobicContact CB-CG 4.16Å; A229-W465 HydrophobicContact CB-CH2 4.23Å; A229-W465 HydrophobicContact CB-CZ2 4.25Å; A229-W465 HydrophobicContact CB-CZ3 3.97Å
230	G	87.4	Confident	78.7	Confident	2 Å²	2	35.8 Å²	35.8	2%	0.021	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.9	3.7	172.2	0	0	0	0	0	115.4	T226 M227 S228 F437	T226-G230 PolarHBondContact O-N 3.37Å; M227-G230 PolarHBondContact O-N 3.41Å; S228-G230 PolarHBondContact O-N 3.25Å; G230-F437 PolarHBondContact O-N 3.44Å
231	F	85.6	Confident	78	Confident	12 Å²	12	37 Å²	37	5%	0.053	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	114.1	177.9	-64.2	-93.6	0	0	0	110.4	T226 A229 L431 L461 S464	T226-F231 WeakPolarHBondContact O-CB 3.35Å; T226-F231 PolarHBondContact O-N 3.46Å; A229-F231 HydrophobicContact CB-CD2 3.92Å; A229-F231 HydrophobicContact CB-CE2 4.18Å; A229-F231 WeakPolarHBondContact O-CD2 3.28Å; A229-F231 PolarHBondContact O-N 3Å; F231-L431 HydrophobicContact CB-CD2 4.18Å; F231-L431 HydrophobicContact CD1-CB 4.19Å; F231-L431 HydrophobicContact CD1-CD2 3.73Å; F231-L431 HydrophobicContact CD1-CG 4.48Å; F231-L431 HydrophobicContact CE1-CB 4.02Å; F231-L431 HydrophobicContact CE1-CD2 4.22Å; F231-L431 HydrophobicContact CG-CD2 3.91Å; F231-L461 HydrophobicContact CD2-CD2 3.59Å; F231-L461 HydrophobicContact CE2-CD2 3.57Å; F231-L461 HydrophobicContact CG-CD2 4.5Å; F231-L461 HydrophobicContact CZ-CD2 4.45Å; F231-S464 WeakPolarHBondContact CZ-OG 3.49Å
232	W	80.3	Confident	77.1	Confident	30 Å²	30	45.8 Å²	45.8	11%	0.114	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	134.9	174.7	173.8	-116.7	0	0	0	111.2	R193 H197 M227 Q435 F437	R193-W232 HydrophobicContact CB-CH2 4.06Å; R193-W232 HydrophobicContact CB-CZ3 3.86Å; R193-W232 HydrophobicContact CG-CZ3 4.41Å; R193-W232 WeakPolarHBondContact O-CZ3 3.45Å; H197-W232 HydrophobicContact CB-CE3 4.45Å; H197-W232 HydrophobicContact CB-CH2 3.92Å; H197-W232 HydrophobicContact CB-CZ2 4.21Å; H197-W232 HydrophobicContact CB-CZ3 4.06Å; H197-W232 AromaticContact CE1-CD1 3.91Å; H197-W232 AromaticContact CE1-CE2 3.92Å; H197-W232 AromaticContact CE1-NE1 3.7Å; H197-W232 AromaticContact CG-CE2 3.96Å; H197-W232 AromaticContact CG-CZ2 3.88Å; H197-W232 AromaticContact ND1-CD2 3.79Å; H197-W232 AromaticContact ND1-CE2 3.73Å; H197-W232 AromaticContact ND1-NE1 3.94Å; M227-W232 HydrophobicContact CE-CD2 4.35Å; M227-W232 HydrophobicContact CE-CE3 3.31Å; M227-W232 HydrophobicContact CE-CZ3 3.47Å; M227-W232 VanDerWaalsContact CE-CZ3 3.47Å; M227-W232 HydrophobicContact SD-CE3 3.79Å; M227-W232 HydrophobicContact SD-CZ3 3.7Å; W232-Q435 PolarHBondContact N-O 2.86Å; W232-F437 HydrophobicContact CB-CD2 3.65Å; W232-F437 HydrophobicContact CB-CE2 3.74Å; W232-F437 AromaticContact CD1-CE2 3.65Å; W232-F437 HydrophobicContact CG-CD2 4.38Å; W232-F437 HydrophobicContact CG-CE2 4.08Å
233	Q	71.3	Confident	76.1	Confident	70 Å²	70	49 Å²	49	33%	0.327	30%	0.304	S	S	.	.			trans	-126.5	121.5	165.2	-63.9	-174.2	-3	0	0	107.8	G235 A430 S434	Q233-G235 PolarHBondContact O-N 3.34Å; Q233-A430 PolarHBondContact NE2-O 2.85Å; Q233-A430 VanDerWaalsContact NE2-O 3.16Å; Q233-S434 PolarHBondContact NE2-OG 3.1Å
234	P	65.8	Low	75.3	Confident	87 Å²	87	49.1 Å²	49.1	57%	0.565	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-62.5	130	175.4	26.8	-33.3	0	0	0	109.4
235	G	64.4	Low	73.8	Confident	22 Å²	22	50.2 Å²	50.2	23%	0.227	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-61	146.8	-178.3	0	0	0	0	0	112.2	Q233 G237 G238	Q233-G235 PolarHBondContact O-N 3.34Å; G235-G237 PolarHBondContact O-N 3.12Å; G235-G238 PolarHBondContact O-N 3.43Å
236	P	54.8	Low	72	Confident	131 Å²	131	56 Å²	56	85%	0.851	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	122.5	-179.2	24.3	-33.7	0	0	0	110.7	G238	P236-G238 VanDerWaalsContact C-N 3.34Å
237	G	55.3	Low	70	Confident	86 Å²	86	58.8 Å²	58.8	89%	0.887	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.2	-4.8	-176.3	0	0	0	0	0	115.8	G235	G235-G237 PolarHBondContact O-N 3.12Å
238	G	56.4	Low	67.9	Low	37 Å²	37	61.8 Å²	61.8	38%	0.381	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-71.9	139.4	176	0	0	0	0	0	112.5	G235 P236	G235-G238 PolarHBondContact O-N 3.43Å; P236-G238 VanDerWaalsContact C-N 3.34Å
239	P	56.7	Low	65.7	Low	113 Å²	113	71.9 Å²	71.9	73%	0.734	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-64.2	140.6	172.5	27.9	-34	0	0	0	110.2	C241	P239-C241 PolarHBondContact O-N 3.01Å
240	P	64.2	Low	63.3	Low	107 Å²	107	75.1 Å²	75.1	70%	0.695	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-63.8	137.9	179.1	26.5	-34.3	0	0	0	110.7	R242	P240-R242 PolarHBondContact O-N 2.97Å
241	C	73.8	Confident	61.1	Low	24 Å²	24	85.7 Å²	85.7	16%	0.162	50%	0.501	C	S	.	.	P	Polyproline II helix	trans	-58	126.9	174.4	-179.5	0	0	0	0	109.9	H197 H202 P239 L243 C244 G245	H197-C241 WeakPolarHBondContact NE2-CB 3.47Å; H197-C241 PolarHBondContact NE2-SG 3.45Å; H202-C241 PolarHBondContact NE2-SG 2.88Å; P239-C241 PolarHBondContact O-N 3.01Å; C241-L243 VanDerWaalsContact C-N 3.28Å; C241-L243 PolarHBondContact O-N 2.89Å; C241-C244 HydrophobicContact CB-CB 4.16Å; C241-C244 PolarHBondContact O-N 2.79Å; C241-C244 VanDerWaalsContact O-N 3.15Å; C241-G245 PolarHBondContact O-N 2.85Å
242	R	69.8	Low	58.4	Low	188 Å²	188	88.8 Å²	88.8	71%	0.709	53%	0.529	S	S	*	.	H	α-helix	trans	-57.8	-42.8	-176.4	-62.5	-172.3	-176	-171.6	2	111.6	P240 C244 G245 E246	P240-R242 PolarHBondContact O-N 2.97Å; R242-C244 PolarHBondContact O-N 3.35Å; R242-G245 CarbonylContact O-C 3.58Å; R242-G245 PolarHBondContact O-N 2.67Å; R242-G245 VanDerWaalsContact O-N 3.1Å; R242-E246 WeakPolarHBondContact O-CG 3.37Å; R242-E246 PolarHBondContact O-N 3.19Å
243	L	68.9	Low	56.5	Low	82 Å²	82	93.2 Å²	93.2	43%	0.429	56%	0.562	S	S	.	*	H	α-helix	trans	-61.6	-40.7	178.8	-56	175.4	0	0	0	112.1	H202 C241 A247	H202-L243 HydrophobicContact CB-CD1 3.99Å; H202-L243 VanDerWaalsContact CE1-CB 3.43Å; H202-L243 WeakPolarHBondContact CE1-CB 3.38Å; C241-L243 VanDerWaalsContact C-N 3.28Å; C241-L243 PolarHBondContact O-N 2.89Å; L243-A247 PolarHBondContact O-N 3.02Å
244	C	73.9	Confident	54.6	Low	16 Å²	16	95.6 Å²	95.6	11%	0.108	59%	0.586	C	S	.	*	H	α-helix	trans	-71.3	-36.2	172.7	-58.1	0	0	0	0	112.7	H197 H202 C241 R242 E246 S248 F437	H197-C244 PolarHBondContact CE1-SG 3.49Å; H197-C244 PolarHBondContact NE2-SG 2.99Å; H202-C244 PolarHBondContact NE2-SG 3Å; H202-C244 VanDerWaalsContact NE2-SG 3.45Å; C241-C244 HydrophobicContact CB-CB 4.16Å; C241-C244 PolarHBondContact O-N 2.79Å; C241-C244 VanDerWaalsContact O-N 3.15Å; R242-C244 PolarHBondContact O-N 3.35Å; C244-E246 VanDerWaalsContact C-N 3.34Å; C244-S248 WeakPolarHBondContact O-CB 3.41Å; C244-S248 PolarHBondContact O-N 3.16Å; C244-S248 PolarHBondContact O-OG 2.64Å; C244-F437 HydrophobicContact CB-CZ 4.45Å
245	G	62	Low	53.5	Low	24 Å²	24	102.7 Å²	102.7	25%	0.247	60%	0.601	C	S	.	*	H	α-helix	trans	-66.1	-34.8	177.2	0	0	0	0	0	113.1	C241 R242 S248 R249	C241-G245 PolarHBondContact O-N 2.85Å; R242-G245 CarbonylContact O-C 3.58Å; R242-G245 PolarHBondContact O-N 2.67Å; R242-G245 VanDerWaalsContact O-N 3.1Å; G245-S248 WeakPolarHBondContact CA-OG 3.45Å; G245-S248 PolarHBondContact O-OG 2.8Å; G245-R249 WeakPolarHBondContact O-CB 3.41Å; G245-R249 VanDerWaalsContact O-CG 3.28Å; G245-R249 WeakPolarHBondContact O-CG 3.33Å; G245-R249 PolarHBondContact O-N 3.35Å; G245-R249 VanDerWaalsContact O-N 3.08Å
246	E	55	Low	52	Low	120 Å²	120	109 Å²	109	56%	0.561	63%	0.63	S	S	*	*	H	α-helix	trans	-72.9	-46.3	175	-73.9	157.4	-161	0	0	111	R242 C244 S248 R249 G250	R242-E246 WeakPolarHBondContact O-CG 3.37Å; R242-E246 PolarHBondContact O-N 3.19Å; C244-E246 VanDerWaalsContact C-N 3.34Å; E246-S248 VanDerWaalsContact C-N 3.29Å; E246-S248 PolarHBondContact O-N 2.72Å; E246-R249 PolarHBondContact O-N 3.37Å; E246-G250 PolarHBondContact O-N 2.96Å; E246-G250 VanDerWaalsContact O-N 3.12Å
247	A	49	Very low	51.2	Low	73 Å²	73	111 Å²	111	60%	0.603	63%	0.628	S	S	*	*	H	α-helix	trans	-59.4	-36.4	175.2	0	0	0	0	0	113.3	L243	L243-A247 PolarHBondContact O-N 3.02Å
248	S	48.5	Very low	50	Low	66 Å²	66	110.8 Å²	110.8	46%	0.462	63%	0.626	S	S	.	*	H	α-helix	trans	-78.4	-29.7	176.7	48.8	0	0	0	0	113.6	C244 G245 E246 G250 R251	C244-S248 WeakPolarHBondContact O-CB 3.41Å; C244-S248 PolarHBondContact O-N 3.16Å; C244-S248 PolarHBondContact O-OG 2.64Å; G245-S248 WeakPolarHBondContact CA-OG 3.45Å; G245-S248 PolarHBondContact O-OG 2.8Å; E246-S248 VanDerWaalsContact C-N 3.29Å; E246-S248 PolarHBondContact O-N 2.72Å; S248-G250 VanDerWaalsContact C-N 3.29Å; S248-G250 PolarHBondContact O-N 2.97Å; S248-R251 CarbonylContact O-C 3.55Å; S248-R251 PolarHBondContact O-N 2.69Å
249	R	46.5	Very low	48.6	Very low	213 Å²	213	114.8 Å²	114.8	80%	0.804	65%	0.648	S	S	*	*	H	α-helix	trans	-64.7	-31.7	169.2	-80	175.8	177.1	-149.4	-1.7	112.8	G245 E246 R251	G245-R249 WeakPolarHBondContact O-CB 3.41Å; G245-R249 VanDerWaalsContact O-CG 3.28Å; G245-R249 WeakPolarHBondContact O-CG 3.33Å; G245-R249 PolarHBondContact O-N 3.35Å; G245-R249 VanDerWaalsContact O-N 3.08Å; E246-R249 PolarHBondContact O-N 3.37Å; R249-R251 PolarHBondContact O-N 2.92Å; R249-R251 VanDerWaalsContact O-N 3.16Å
250	G	39.8	Very low	47.5	Very low	74 Å²	74	117 Å²	117	76%	0.763	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-5.4	169.6	0	0	0	0	0	114.9	E246 S248	E246-G250 PolarHBondContact O-N 2.96Å; E246-G250 VanDerWaalsContact O-N 3.12Å; S248-G250 VanDerWaalsContact C-N 3.29Å; S248-G250 PolarHBondContact O-N 2.97Å
251	R	41.2	Very low	46.1	Very low	225 Å²	225	119.3 Å²	119.3	85%	0.849	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.8	33.5	-178.1	-150.4	-175.4	-170.1	-151.2	2.4	113.4	S248 R249	S248-R251 CarbonylContact O-C 3.55Å; S248-R251 PolarHBondContact O-N 2.69Å; R249-R251 PolarHBondContact O-N 2.92Å; R249-R251 VanDerWaalsContact O-N 3.16Å
252	A	29.2	Very low	44.1	Very low	77 Å²	77	126.8 Å²	126.8	64%	0.636	70%	0.696	S	S	*	*			trans	-65.9	132.8	167.2	0	0	0	0	0	110.2
253	P	40.4	Very low	42.1	Very low	122 Å²	122	121.2 Å²	121.2	79%	0.792	70%	0.697	S	S	*	*			trans	-65.7	140.9	169	28.9	-33.5	0	0	0	109.5	R255	P253-R255 PolarHBondContact O-N 3.38Å
254	S	30.8	Very low	40.6	Very low	120 Å²	120	123.5 Å²	123.5	84%	0.839	72%	0.72	S	S	*	*			trans	-61.4	108.7	175.9	50.4	0	0	0	0	110.1	D256	S254-D256 PolarHBondContact O-N 2.98Å
255	R	43	Very low	38.6	Very low	236 Å²	236	134 Å²	134	89%	0.891	76%	0.757	S	S	*	*			trans	-77.2	105.8	171	-179.4	-175.2	-179	-176.1	0.3	108.3	P253	P253-R255 PolarHBondContact O-N 3.38Å
256	D	31.8	Very low	37.5	Very low	154 Å²	154	143.8 Å²	143.8	82%	0.824	79%	0.786	S	S	*	*			trans	-126	152.2	166.8	-155.3	-2.4	0	0	0	109.5	S254	S254-D256 PolarHBondContact O-N 2.98Å
257	E	38.3	Very low	36.5	Very low	175 Å²	175	144.1 Å²	144.1	82%	0.818	80%	0.799	S	S	*	*			trans	-99.6	154.2	-178.1	-71.8	-166.9	96.4	0	0	111.9
258	G	31	Very low	36	Very low	81 Å²	81	150.7 Å²	150.7	84%	0.835	81%	0.808	S	S	*	*			trans	108	85.2	162	0	0	0	0	0	116.2
259	S	27.3	Very low	35.6	Very low	121 Å²	121	157 Å²	157	85%	0.846	82%	0.822	S	S	*	*				-156.7	146.6	111.6	-162.2	0	0	0	0	111.2
260	L	33.9	Very low	35.6	Very low	158 Å²	158	150.3 Å²	150.3	83%	0.827	80%	0.802	S	S	*	*			trans	-105.3	161.5	173.8	-77.7	166.2	0	0	0	110.3
261	L	34.7	Very low	35.8	Very low	157 Å²	157	149.5 Å²	149.5	82%	0.822	79%	0.788	S	S	*	*			trans	88.1	149.4	166.8	-49	178.4	0	0	0	118.3
262	L	32	Very low	35.8	Very low	180 Å²	180	142.2 Å²	142.2	94%	0.942	78%	0.776	S	S	*	*			trans	63.9	104.2	168.7	-68.6	140.3	0	0	0	117.7
263	G	26.2	Very low	36.6	Very low	71 Å²	71	145 Å²	145	73%	0.732	78%	0.776	S	S	*	*			trans	157.7	37	162	0	0	0	0	0	119.6	R265	G263-R265 VanDerWaalsContact C-N 3.35Å; G263-R265 PolarHBondContact O-N 3.43Å
264	S	38.7	Very low	36.9	Very low	130 Å²	130	147.2 Å²	147.2	91%	0.909	77%	0.769	S	S	*	*			trans	-68.6	88.6	175.2	-168.9	0	0	0	0	111.9
265	R	31.7	Very low	37.5	Very low	237 Å²	237	145.3 Å²	145.3	89%	0.894	75%	0.754	S	S	*	*			trans	-112.9	114.3	169.6	-75.7	-172.2	176.3	-110.5	1.1	109.7	G263	G263-R265 VanDerWaalsContact C-N 3.35Å; G263-R265 PolarHBondContact O-N 3.43Å
266	R	37.9	Very low	37.8	Very low	229 Å²	229	136.6 Å²	136.6	86%	0.864	73%	0.732	S	S	*	*			trans	-61.2	143.6	176.8	-62.7	174.3	178.4	167.8	-1.8	110.6
267	P	34.3	Very low	38.8	Very low	128 Å²	128	132.2 Å²	132.2	83%	0.831	72%	0.718	S	S	*	*			trans	-54.6	142.8	164.2	-25.9	35.8	0	0	0	111.7	R269	P267-R269 PolarHBondContact O-N 2.97Å
268	R	39	Very low	39.2	Very low	210 Å²	210	126.7 Å²	126.7	79%	0.792	70%	0.702	S	S	*	*			trans	-64.1	113.4	-166.3	-164.1	172.8	-167.9	167.6	4.6	112.2	D270	R268-D270 VanDerWaalsContact C-N 3.32Å; R268-D270 HydrophobicContact CG-CB 4.31Å; R268-D270 WeakPolarHBondContact CG-OD2 3.42Å; R268-D270 IonicContact CZ-OD2 3.78Å; R268-D270 IonicContact NE-OD2 2.75Å; R268-D270 PolarHBondContact NE-OD2 3.09Å
269	R	40.9	Very low	40	Very low	199 Å²	199	128.7 Å²	128.7	75%	0.751	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-18.2	-176.6	-139.6	178.6	-162.8	176.8	3.5	113.2	P267 A271 A272	P267-R269 PolarHBondContact O-N 2.97Å; R269-A271 PolarHBondContact O-N 2.87Å; R269-A272 PolarHBondContact O-N 2.71Å
270	D	46.2	Very low	41.5	Very low	73 Å²	73	128.5 Å²	128.5	39%	0.39	68%	0.68	S	S	.	*	H	α-helix	trans	-60.6	-13.8	-166.9	-20.7	-20.9	0	0	0	115	R268 R274	R268-D270 VanDerWaalsContact C-N 3.32Å; R268-D270 HydrophobicContact CG-CB 4.31Å; R268-D270 WeakPolarHBondContact CG-OD2 3.42Å; R268-D270 IonicContact CZ-OD2 3.78Å; R268-D270 IonicContact NE-OD2 2.75Å; R268-D270 PolarHBondContact NE-OD2 3.09Å; D270-R274 WeakPolarHBondContact O-CG 3.43Å; D270-R274 PolarHBondContact O-NE 3.01Å; D270-R274 PolarHBondContact O-NH2 3.24Å
271	A	42.4	Very low	42.4	Very low	56 Å²	56	123.9 Å²	123.9	46%	0.463	67%	0.665	S	S	.	*	H	α-helix	trans	-78.6	-58.9	178.7	0	0	0	0	0	111.8	R269 E273 R274 C275	R269-A271 PolarHBondContact O-N 2.87Å; A271-E273 VanDerWaalsContact C-N 3.25Å; A271-E273 PolarHBondContact O-N 2.94Å; A271-R274 PolarHBondContact O-N 2.98Å; A271-R274 VanDerWaalsContact O-N 3.15Å; A271-C275 PolarHBondContact O-N 2.7Å; A271-C275 VanDerWaalsContact O-N 3.1Å; A271-C275 PolarHBondContact O-SG 2.9Å
272	A	42.5	Very low	43.2	Very low	72 Å²	72	119.6 Å²	119.6	60%	0.595	65%	0.648	S	S	*	*	H	α-helix	trans	-60.5	-35.6	-178.6	0	0	0	0	0	112.5	R269 C275 A276	R269-A272 PolarHBondContact O-N 2.71Å; A272-C275 PolarHBondContact O-N 2.87Å; A272-A276 WeakPolarHBondContact O-CB 3.18Å; A272-A276 PolarHBondContact O-N 2.97Å
273	E	45.5	Very low	44	Very low	135 Å²	135	117.9 Å²	117.9	63%	0.631	63%	0.629	S	S	*	*	H	α-helix	trans	-69.4	-33.8	179.4	-160.6	155.1	-146.5	0	0	112.3	A271 A277	A271-E273 VanDerWaalsContact C-N 3.25Å; A271-E273 PolarHBondContact O-N 2.94Å; E273-A277 PolarHBondContact O-N 3.05Å; E273-A277 VanDerWaalsContact O-N 3.09Å
274	R	46.3	Very low	45.2	Very low	170 Å²	170	123.5 Å²	123.5	64%	0.642	63%	0.628	S	S	*	*	H	α-helix	trans	-70.6	-39.6	170.7	-78.9	-178.5	-69.2	150.6	4.1	112.5	D270 A271 A277 A278	D270-R274 WeakPolarHBondContact O-CG 3.43Å; D270-R274 PolarHBondContact O-NE 3.01Å; D270-R274 PolarHBondContact O-NH2 3.24Å; A271-R274 PolarHBondContact O-N 2.98Å; A271-R274 VanDerWaalsContact O-N 3.15Å; R274-A277 PolarHBondContact O-N 3.08Å; R274-A278 PolarHBondContact O-N 3.48Å
275	C	43.2	Very low	45.4	Very low	80 Å²	80	125.6 Å²	125.6	54%	0.541	62%	0.621	S	S	.	*	H	α-helix	trans	-62.5	-43.2	174.2	-64.2	0	0	0	0	111.7	A271 A272 A277 A278 L279	A271-C275 PolarHBondContact O-N 2.7Å; A271-C275 VanDerWaalsContact O-N 3.1Å; A271-C275 PolarHBondContact O-SG 2.9Å; A272-C275 PolarHBondContact O-N 2.87Å; C275-A277 PolarHBondContact O-N 3.06Å; C275-A278 PolarHBondContact O-N 2.97Å; C275-L279 WeakPolarHBondContact O-CG 3.1Å; C275-L279 PolarHBondContact O-N 2.83Å
276	A	50.5	Low	46	Very low	52 Å²	52	117.9 Å²	117.9	43%	0.43	60%	0.603	S	S	.	*	H	α-helix	trans	-61.3	-42.6	175.1	0	0	0	0	0	112.3	A272 A278 L279 M280	A272-A276 WeakPolarHBondContact O-CB 3.18Å; A272-A276 PolarHBondContact O-N 2.97Å; A276-A278 PolarHBondContact O-N 3.22Å; A276-L279 PolarHBondContact O-N 3.44Å; A276-M280 WeakPolarHBondContact O-CG 3.46Å; A276-M280 PolarHBondContact O-N 3.29Å; A276-M280 VanDerWaalsContact O-N 3.08Å
277	A	51.8	Low	46.3	Very low	62 Å²	62	112.1 Å²	112.1	51%	0.512	59%	0.586	S	S	.	*	H	α-helix	trans	-62.1	-41.6	175.3	0	0	0	0	0	112.6	E273 R274 C275 M280 A281	E273-A277 PolarHBondContact O-N 3.05Å; E273-A277 VanDerWaalsContact O-N 3.09Å; R274-A277 PolarHBondContact O-N 3.08Å; C275-A277 PolarHBondContact O-N 3.06Å; A277-M280 PolarHBondContact O-N 3.03Å; A277-A281 WeakPolarHBondContact O-CB 3.44Å; A277-A281 PolarHBondContact O-N 3.32Å
278	A	47.4	Very low	46.8	Very low	60 Å²	60	110.2 Å²	110.2	50%	0.496	58%	0.581	S	S	.	*	H	α-helix	trans	-64.5	-43.7	177.7	0	0	0	0	0	112.6	R274 C275 A276 M280 A281 S282	R274-A278 PolarHBondContact O-N 3.48Å; C275-A278 PolarHBondContact O-N 2.97Å; A276-A278 PolarHBondContact O-N 3.22Å; A278-M280 VanDerWaalsContact C-N 3.35Å; A278-M280 PolarHBondContact O-N 3.08Å; A278-A281 WeakPolarHBondContact O-CB 3.05Å; A278-A281 PolarHBondContact O-N 3.32Å; A278-S282 PolarHBondContact O-N 3.33Å
279	L	47.8	Very low	47	Very low	122 Å²	122	109.4 Å²	109.4	64%	0.639	58%	0.583	S	S	*	*	H	α-helix	trans	-65.7	-35	177.2	-70.1	169.7	0	0	0	112.7	C275 A276 A281 S282 R283	C275-L279 WeakPolarHBondContact O-CG 3.1Å; C275-L279 PolarHBondContact O-N 2.83Å; A276-L279 PolarHBondContact O-N 3.44Å; L279-A281 VanDerWaalsContact C-N 3.35Å; L279-S282 PolarHBondContact O-OG 3.42Å; L279-R283 PolarHBondContact O-N 2.73Å
280	M	59	Low	47	Very low	117 Å²	117	108.2 Å²	108.2	58%	0.576	59%	0.586	S	S	*	*	H	α-helix	trans	-74.5	-26	174.6	-66.4	-65.2	-82	0	0	112.5	A276 A277 A278 R284	A276-M280 WeakPolarHBondContact O-CG 3.46Å; A276-M280 PolarHBondContact O-N 3.29Å; A276-M280 VanDerWaalsContact O-N 3.08Å; A277-M280 PolarHBondContact O-N 3.03Å; A278-M280 VanDerWaalsContact C-N 3.35Å; A278-M280 PolarHBondContact O-N 3.08Å; M280-R284 WeakPolarHBondContact O-CG 3.07Å; M280-R284 PolarHBondContact O-N 2.96Å
281	A	51.6	Low	46.5	Very low	61 Å²	61	113.3 Å²	113.3	50%	0.504	61%	0.61	S	S	.	*	H	α-helix	trans	-74.1	-40.9	172.8	0	0	0	0	0	112.6	A277 A278 L279 R284 K285	A277-A281 WeakPolarHBondContact O-CB 3.44Å; A277-A281 PolarHBondContact O-N 3.32Å; A278-A281 WeakPolarHBondContact O-CB 3.05Å; A278-A281 PolarHBondContact O-N 3.32Å; L279-A281 VanDerWaalsContact C-N 3.35Å; A281-R284 PolarHBondContact O-N 3.05Å; A281-K285 PolarHBondContact O-N 2.93Å
282	S	52.4	Low	46.2	Very low	67 Å²	67	116.6 Å²	116.6	47%	0.469	63%	0.626	S	S	.	*	H	α-helix	trans	-65.5	-41.7	176.5	63.9	0	0	0	0	111.8	A278 L279 R284 K285 S286	A278-S282 PolarHBondContact O-N 3.33Å; L279-S282 PolarHBondContact O-OG 3.42Å; S282-R284 PolarHBondContact O-N 2.9Å; S282-K285 WeakPolarHBondContact O-CA 3.47Å; S282-K285 WeakPolarHBondContact O-CB 3.44Å; S282-K285 PolarHBondContact O-N 2.97Å; S282-S286 PolarHBondContact O-N 3.26Å; S282-S286 VanDerWaalsContact O-N 3.13Å
283	R	48.6	Very low	45.7	Very low	144 Å²	144	124.4 Å²	124.4	54%	0.543	64%	0.641	S	S	.	*	H	α-helix	trans	-58.3	-44	175.4	-178.2	175.8	171.5	166.9	3	113.2	L279 K285 S286 E287	L279-R283 PolarHBondContact O-N 2.73Å; R283-K285 PolarHBondContact O-N 2.82Å; R283-S286 PolarHBondContact O-N 2.91Å; R283-S286 PolarHBondContact O-OG 2.87Å; R283-E287 HydrophobicContact CG-CG 4.44Å; R283-E287 IonicContact CZ-OE1 2.69Å; R283-E287 IonicContact NE-OE1 3.95Å; R283-E287 PolarHBondContact NE-OE1 2.68Å; R283-E287 IonicContact NE-OE2 3.92Å; R283-E287 IonicContact NH2-OE1 3.72Å; R283-E287 PolarHBondContact NH2-OE1 3.37Å; R283-E287 PolarHBondContact O-N 3.39Å
284	R	50.8	Low	45	Very low	189 Å²	189	122.5 Å²	122.5	71%	0.713	65%	0.648	S	S	*	*	H	α-helix	trans	-63.8	-26.9	175.4	-73.9	178.1	176	179.6	-0.2	112.8	M280 A281 S282 A288	M280-R284 WeakPolarHBondContact O-CG 3.07Å; M280-R284 PolarHBondContact O-N 2.96Å; A281-R284 PolarHBondContact O-N 3.05Å; S282-R284 PolarHBondContact O-N 2.9Å; R284-A288 WeakPolarHBondContact O-CB 3.49Å; R284-A288 PolarHBondContact O-N 3.18Å
285	K	43.5	Very low	44.2	Very low	175 Å²	175	118.7 Å²	118.7	76%	0.761	65%	0.653	S	S	*	*	H	α-helix	trans	-80.3	-25.5	179.2	-159.6	174.1	-177.7	-178.8	0	113	A281 S282 R283	A281-K285 PolarHBondContact O-N 2.93Å; S282-K285 WeakPolarHBondContact O-CA 3.47Å; S282-K285 WeakPolarHBondContact O-CB 3.44Å; S282-K285 PolarHBondContact O-N 2.97Å; R283-K285 PolarHBondContact O-N 2.82Å
286	S	45.1	Very low	44.2	Very low	75 Å²	75	120.5 Å²	120.5	52%	0.524	66%	0.664	S	S	.	*	H	α-helix	trans	-83	-43.3	171	53.1	0	0	0	0	112.5	S282 R283 A288 K289	S282-S286 PolarHBondContact O-N 3.26Å; S282-S286 VanDerWaalsContact O-N 3.13Å; R283-S286 PolarHBondContact O-N 2.91Å; R283-S286 PolarHBondContact O-OG 2.87Å; S286-A288 PolarHBondContact O-N 3.29Å; S286-K289 PolarHBondContact O-N 2.96Å
287	E	43	Very low	43.4	Very low	107 Å²	107	122.6 Å²	122.6	50%	0.5	68%	0.681	S	S	.	*	H	α-helix	trans	-60.6	-29.2	176.9	-72.5	173.4	164.4	0	0	112.3	R283 K289	R283-E287 HydrophobicContact CG-CG 4.44Å; R283-E287 IonicContact CZ-OE1 2.69Å; R283-E287 IonicContact NE-OE1 3.95Å; R283-E287 PolarHBondContact NE-OE1 2.68Å; R283-E287 IonicContact NE-OE2 3.92Å; R283-E287 IonicContact NH2-OE1 3.72Å; R283-E287 PolarHBondContact NH2-OE1 3.37Å; R283-E287 PolarHBondContact O-N 3.39Å; E287-K289 VanDerWaalsContact C-N 3.27Å; E287-K289 PolarHBondContact O-N 2.91Å
288	A	44.1	Very low	42.3	Very low	89 Å²	89	126.8 Å²	126.8	74%	0.736	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-6.2	175.4	0	0	0	0	0	115.6	R284 S286	R284-A288 WeakPolarHBondContact O-CB 3.49Å; R284-A288 PolarHBondContact O-N 3.18Å; S286-A288 PolarHBondContact O-N 3.29Å
289	K	44.6	Very low	41.7	Very low	192 Å²	192	134.9 Å²	134.9	84%	0.835	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.4	8.2	-174.4	-141.7	-179.6	-177.5	-175	0	115.1	S286 E287	S286-K289 PolarHBondContact O-N 2.96Å; E287-K289 VanDerWaalsContact C-N 3.27Å; E287-K289 PolarHBondContact O-N 2.91Å
290	Q	41	Very low	40.9	Very low	174 Å²	174	136.3 Å²	136.3	81%	0.813	73%	0.731	S	S	*	*			trans	-129.5	89.5	172.6	-73.3	-170.3	-10.5	0	0	111.7
291	M	35.3	Very low	39.5	Very low	181 Å²	181	136.4 Å²	136.4	89%	0.892	74%	0.738	S	S	*	*			trans	-149.7	100.2	165.4	-170.5	173	68.6	0	0	113.5
292	P	35.4	Very low	38.5	Very low	124 Å²	124	143.3 Å²	143.3	81%	0.805	75%	0.751	S	S	*	*			trans	-113.5	99	157.9	32.3	-19.1	0	0	0	111.7
293	R	33.3	Very low	37.4	Very low	237 Å²	237	149.7 Å²	149.7	89%	0.894	77%	0.765	S	S	*	*			trans	10.6	116.6	147.4	-167.1	174.2	-171	171.4	2.9	118.7
294	A	30.2	Very low	36.5	Very low	94 Å²	94	147.6 Å²	147.6	78%	0.777	77%	0.773	S	S	*	*			trans	-76.3	171.8	160.9	0	0	0	0	0	111.2
295	A	30	Very low	35.5	Very low	90 Å²	90	144.8 Å²	144.8	74%	0.744	78%	0.777	S	S	*	*			cis	-157.8	-158.8	11.2	0	0	0	0	0	107.5
296	P	43.4	Very low	34.9	Very low	119 Å²	119	144.1 Å²	144.1	77%	0.773	78%	0.776	S	S	*	*			cis	-137.3	163	-10	41	-22.8	0	0	0	117.6
297	A	31.9	Very low	34.2	Very low	95 Å²	95	149.2 Å²	149.2	79%	0.785	79%	0.792	S	S	*	*			trans	23.1	134.5	145.5	0	0	0	0	0	124.7
298	T	30.7	Very low	33.6	Very low	151 Å²	151	147.9 Å²	147.9	93%	0.926	79%	0.794	S	S	*	*			trans	-139	154.1	136.3	-10.7	0	0	0	0	110.9
299	R	34.5	Very low	33.2	Very low	230 Å²	230	150.5 Å²	150.5	87%	0.868	80%	0.795	S	S	*	*			trans	-108.5	145.4	-177.8	-64	170.6	170.7	167.2	-5.4	112.3
300	V	29.7	Very low	32.5	Very low	152 Å²	152	147.1 Å²	147.1	92%	0.921	79%	0.791	S	S	*	*			trans	-142.8	152.7	142.3	-176.8	0	0	0	0	108.8
301	T	30.3	Very low	31.9	Very low	118 Å²	118	143.3 Å²	143.3	72%	0.724	79%	0.789	S	S	*	*			trans	-133.2	137.6	-167	-47.9	0	0	0	0	111.9
302	R	29.7	Very low	31.4	Very low	206 Å²	206	138.7 Å²	138.7	78%	0.777	79%	0.788	S	S	*	*			trans	-178.8	136.7	136.1	-109.5	177.9	174.3	-172.9	-0.6	117.4
303	R	29.9	Very low	31	Very low	202 Å²	202	135.8 Å²	135.8	76%	0.762	78%	0.781	S	S	*	*			trans	45.1	119.9	131.9	-77.9	-178.7	179.4	-170.8	-2.7	119.6
304	S	30.1	Very low	30.9	Very low	100 Å²	100	131.3 Å²	131.3	70%	0.699	78%	0.78	S	S	*	*				101.6	151.6	88.3	-161	0	0	0	0	110.1
305	T	30.7	Very low	31	Very low	130 Å²	130	133.3 Å²	133.3	80%	0.798	78%	0.778	S	S	*	*			cis	-140.6	158.8	17.2	-46	0	0	0	0	112.6
306	Q	30.6	Very low	30.9	Very low	160 Å²	160	136 Å²	136	75%	0.748	78%	0.779	S	S	*	*			trans	-78.4	142.3	173.5	156.8	-166.3	-11.7	0	0	113.3
307	E	28.8	Very low	30.3	Very low	182 Å²	182	139 Å²	139	85%	0.85	78%	0.779	S	S	*	*			trans	-163.1	133.9	144.4	-105.4	159.6	-174.5	0	0	106.2
308	S	30.4	Very low	30	Very low	79 Å²	79	144.2 Å²	144.2	55%	0.552	78%	0.779	S	S	*	*			cis	75.5	133.1	41.8	-58	0	0	0	0	112.8
309	L	36.1	Very low	29.7	Very low	144 Å²	144	143.1 Å²	143.1	75%	0.754	76%	0.763	S	S	*	*			cis	-160.5	170.9	1.8	-113.4	170.4	0	0	0	112
310	T	29.6	Very low	29.4	Very low	121 Å²	121	139.4 Å²	139.4	74%	0.742	76%	0.76	S	S	*	*			trans	-9.3	165.2	155.5	49.9	0	0	0	0	122.2
311	A	29.1	Very low	29.3	Very low	95 Å²	95	140.5 Å²	140.5	79%	0.785	76%	0.755	S	S	*	*			cis	178.1	168.1	-17.2	0	0	0	0	0	111.4
312	G	25.5	Very low	30.5	Very low	83 Å²	83	140.3 Å²	140.3	86%	0.856	76%	0.755	S	S	*	*			trans	80.6	161.3	154.5	0	0	0	0	0	117.7
313	G	27	Very low	31.2	Very low	64 Å²	64	136.4 Å²	136.4	66%	0.66	76%	0.757	S	S	*	*			cis	159.9	146.2	-9.1	0	0	0	0	0	113.4
314	T	29.6	Very low	31.1	Very low	143 Å²	143	130.5 Å²	130.5	88%	0.877	75%	0.751	S	S	*	*			trans	58.8	126	175	49.4	0	0	0	0	116.8
315	D	32.3	Very low	31	Very low	136 Å²	136	132.5 Å²	132.5	73%	0.727	76%	0.759	S	S	*	*			cis	78.1	119.5	47.8	-173.5	26.8	0	0	0	114.5
316	L	29.6	Very low	30.8	Very low	146 Å²	146	131.2 Å²	131.2	76%	0.764	76%	0.755	S	S	*	*			trans	171.8	103.7	138.4	-93.6	166.6	0	0	0	114.9
317	K	29.6	Very low	30.7	Very low	181 Å²	181	131.7 Å²	131.7	79%	0.787	76%	0.757	S	S	*	*				59.1	156.7	120.9	-151.5	173.9	-175.2	172.9	0	123.8
318	R	26.7	Very low	30.6	Very low	205 Å²	205	131.9 Å²	131.9	77%	0.774	76%	0.758	S	S	*	*			trans	84.3	146.4	168.3	-61.9	-171.1	108.6	134.2	-2.2	116.4
319	E	24.3	Very low	30.6	Very low	129 Å²	129	132.2 Å²	132.2	60%	0.603	77%	0.766	S	S	*	*			cis	-147.6	145	-7.8	-113.6	178.5	-174.7	0	0	109.7
320	L	26.6	Very low	31	Very low	151 Å²	151	131.2 Å²	131.2	79%	0.791	77%	0.768	S	S	*	*				61.6	149.9	100.2	-86.9	162.2	0	0	0	118.6
321	H	28.3	Very low	30.8	Very low	176 Å²	176	129.6 Å²	129.6	82%	0.815	78%	0.775	S	S	*	*			trans	-95.2	-152	-160.7	-61	-88.9	0	0	0	115.2
322	P	56.8	Low	30.9	Very low	114 Å²	114	131.5 Å²	131.5	74%	0.74	78%	0.777	S	S	*	*				-122.4	-173.7	-103	41.5	-23.1	0	0	0	113.7
323	P	42.9	Very low	31.1	Very low	124 Å²	124	137.9 Å²	137.9	81%	0.805	78%	0.781	S	S	*	*				-149.3	179.7	122.6	33.5	-15.2	0	0	0	113.4
324	A	28.8	Very low	31	Very low	78 Å²	78	145.6 Å²	145.6	65%	0.645	79%	0.79	S	S	*	*			cis	-175.7	166.3	-33.3	0	0	0	0	0	108.9
325	T	27.1	Very low	31.2	Very low	141 Å²	141	143.3 Å²	143.3	87%	0.865	78%	0.78	S	S	*	*			trans	63.7	153.8	164.9	53.9	0	0	0	0	118
326	S	27.7	Very low	31.7	Very low	103 Å²	103	143.1 Å²	143.1	72%	0.72	79%	0.786	S	S	*	*			cis	-143	171	9.5	59.7	0	0	0	0	114.3
327	H	27.3	Very low	31.6	Very low	171 Å²	171	141.2 Å²	141.2	79%	0.792	79%	0.786	S	S	*	*			trans	-24.7	160.6	156.5	-53.3	-96	0	0	0	117
328	E	26.3	Very low	31.8	Very low	185 Å²	185	137 Å²	137	86%	0.864	78%	0.784	S	S	*	*			cis	-161.8	170.6	31	-154	173.9	166.4	0	0	113.9
329	A	31.3	Very low	32.7	Very low	86 Å²	86	132.8 Å²	132.8	71%	0.711	78%	0.784	S	S	*	*			trans	-162.6	169.6	170.2	0	0	0	0	0	110.3
330	P	44.3	Very low	33	Very low	124 Å²	124	131.4 Å²	131.4	81%	0.805	79%	0.794	S	S	*	*			cis	-122.7	167.2	-22.3	38.7	-24.9	0	0	0	113.1
331	G	26.2	Very low	33.1	Very low	86 Å²	86	129.2 Å²	129.2	89%	0.887	80%	0.798	S	S	*	*			trans	-110.5	105.9	-177.9	0	0	0	0	0	116
332	T	31.3	Very low	33.3	Very low	135 Å²	135	127.7 Å²	127.7	83%	0.828	80%	0.801	S	S	*	*			trans	-89.6	144.3	171.5	16.7	0	0	0	0	113.3
333	K	28.5	Very low	32.1	Very low	217 Å²	217	128.2 Å²	128.2	94%	0.943	81%	0.808	S	S	*	*			trans	-162.5	163.3	148.5	-108.8	148.8	-170.2	173.8	0	112.5
334	R	25.2	Very low	31.5	Very low	226 Å²	226	127.9 Å²	127.9	85%	0.853	81%	0.808	S	S	*	*			trans	-154.7	141.2	-158.8	169.9	-176.2	177.6	-171.2	3.2	111
335	S	33.4	Very low	31.6	Very low	96 Å²	96	129.1 Å²	129.1	67%	0.671	82%	0.818	S	S	*	*			trans	67.3	168	164.1	-74.3	0	0	0	0	115.4
336	P	42.5	Very low	31.8	Very low	131 Å²	131	127.3 Å²	127.3	85%	0.851	81%	0.812	S	S	*	*			cis	-124.3	-157.7	19.4	43.5	-26.8	0	0	0	116.2
337	S	29.1	Very low	31.9	Very low	107 Å²	107	127.9 Å²	127.9	75%	0.748	82%	0.816	S	S	*	*			trans	-139.7	169.3	-153.1	-43.1	0	0	0	0	113.7
338	A	32.5	Very low	32	Very low	92 Å²	92	125.2 Å²	125.2	76%	0.76	82%	0.816	S	S	*	*			trans	73.9	173.2	152.4	0	0	0	0	0	117.7
339	P	47.1	Very low	32.1	Very low	117 Å²	117	123 Å²	123	76%	0.76	82%	0.816	S	S	*	*			cis	-134.7	174	-21.3	33	-13.8	0	0	0	115.8
340	A	29.3	Very low	32.1	Very low	100 Å²	100	124.5 Å²	124.5	83%	0.826	82%	0.821	S	S	*	*			trans	60.8	131.8	141.9	0	0	0	0	0	123.5
341	A	29.8	Very low	31.5	Very low	105 Å²	105	122.6 Å²	122.6	87%	0.868	81%	0.81	S	S	*	*			trans	-152.4	142.2	130.3	0	0	0	0	0	110.3
342	T	31.7	Very low	31.7	Very low	143 Å²	143	128.4 Å²	128.4	88%	0.877	81%	0.807	S	S	*	*			trans	-116.5	138.5	175.6	49.6	0	0	0	0	110.8
343	S	30.7	Very low	31.6	Very low	126 Å²	126	132 Å²	132	88%	0.881	81%	0.811	S	S	*	*			trans	-154.2	121	160	54.9	0	0	0	0	112
344	S	32	Very low	31.6	Very low	117 Å²	117	132.9 Å²	132.9	82%	0.818	81%	0.808	S	S	*	*			trans	-102.4	143.7	172	51.5	0	0	0	0	110.8
345	A	30.6	Very low	31.8	Very low	103 Å²	103	126.5 Å²	126.5	85%	0.851	80%	0.804	S	S	*	*			trans	-140.3	156.7	166.1	0	0	0	0	0	109.7
346	S	31.3	Very low	32.3	Very low	104 Å²	104	127.6 Å²	127.6	73%	0.727	81%	0.809	S	S	*	*			trans	-136.6	162.1	-163	-53.3	0	0	0	0	112.9
347	S	30	Very low	31.6	Very low	115 Å²	115	125.8 Å²	125.8	80%	0.804	81%	0.805	S	S	*	*			trans	64.9	154.8	167	45.9	0	0	0	0	115.5
348	S	29.6	Very low	31.4	Very low	115 Å²	115	126.2 Å²	126.2	80%	0.804	81%	0.808	S	S	*	*			cis	-142.8	166.1	28.8	-62.2	0	0	0	0	115.2
349	T	28.6	Very low	31.2	Very low	139 Å²	139	126.7 Å²	126.7	85%	0.853	81%	0.805	S	S	*	*			trans	-70	149.3	174	50.8	0	0	0	0	114.9
350	S	30.8	Very low	30.7	Very low	117 Å²	117	125.7 Å²	125.7	82%	0.818	81%	0.807	S	S	*	*			trans	-147.5	159.6	134	67.9	0	0	0	0	110
351	S	31	Very low	30.8	Very low	83 Å²	83	126.8 Å²	126.8	58%	0.58	81%	0.806	S	S	*	*			trans	-124.4	-145.6	-170	67.9	0	0	0	0	111.8
352	Y	29.9	Very low	31.1	Very low	208 Å²	208	129.3 Å²	129.3	82%	0.816	80%	0.8	S	S	*	*			trans	72.2	134.7	-178.8	-34.3	-61.3	0	0	0	113.6
353	K	29.3	Very low	31.2	Very low	212 Å²	212	128.2 Å²	128.2	92%	0.922	80%	0.795	S	S	*	*			cis	-138.8	173.4	6.6	-112.1	161.3	-173.2	177.9	0	110.9
354	R	29.9	Very low	31.2	Very low	235 Å²	235	130.7 Å²	130.7	89%	0.887	79%	0.79	S	S	*	*			trans	-131.8	124.9	-167.9	174.1	-166.9	-73.8	173.4	-3.9	112.8
355	A	28.4	Very low	31.5	Very low	92 Å²	92	130.2 Å²	130.2	76%	0.76	78%	0.784	S	S	*	*			trans	63.7	177	156.6	0	0	0	0	0	116.8
356	P	43.9	Very low	31.3	Very low	118 Å²	118	132 Å²	132	77%	0.766	78%	0.779	S	S	*	*			cis	-138.6	159.4	2.4	42.5	-24.9	0	0	0	119.4
357	A	27.7	Very low	31.2	Very low	94 Å²	94	135.5 Å²	135.5	78%	0.777	78%	0.781	S	S	*	*			trans	52.7	142.8	134.9	0	0	0	0	0	125.5
358	S	25.3	Very low	31.1	Very low	115 Å²	115	139.2 Å²	139.2	80%	0.804	78%	0.777	S	S	*	*			trans	72.7	156.5	150.7	-134	0	0	0	0	117.5
359	S	28.3	Very low	31.1	Very low	102 Å²	102	143.3 Å²	143.3	71%	0.713	78%	0.781	S	S	*	*			cis	-143.6	161	4.1	-59	0	0	0	0	111.1
360	A	37	Very low	31.1	Very low	97 Å²	97	143.7 Å²	143.7	80%	0.802	77%	0.771	S	S	*	*			trans	-86.9	153.6	160.8	0	0	0	0	0	111.4
361	P	31.4	Very low	30.9	Very low	122 Å²	122	149 Å²	149	79%	0.792	77%	0.773	S	S	*	*			trans	-141.4	144.6	136.7	35.3	-21	0	0	0	115.7
362	Q	35.5	Very low	30.8	Very low	159 Å²	159	149.2 Å²	149.2	74%	0.743	78%	0.779	S	S	*	*			trans	-116.4	147.8	152.8	-91.4	-80.1	-43	0	0	105.4
363	P	34.8	Very low	30.6	Very low	120 Å²	120	144 Å²	144	78%	0.779	78%	0.779	S	S	*	*				-153.5	179.3	67.4	40.2	-18.7	0	0	0	118.8
364	K	30.4	Very low	30.6	Very low	177 Å²	177	137.2 Å²	137.2	77%	0.77	77%	0.77	S	S	*	*			trans	-42.2	171.6	159.5	-55.1	161.9	-175.5	170.6	0	113.7
365	P	37.6	Very low	30.7	Very low	107 Å²	107	136 Å²	136	70%	0.695	77%	0.771	S	S	*	*			cis	-160.7	-171.7	32	48.5	-26.8	0	0	0	120.7
366	L	27.5	Very low	30.8	Very low	142 Å²	142	141.8 Å²	141.8	74%	0.743	78%	0.779	S	S	*	*			trans	66.3	159.4	157.6	-67.4	169.5	0	0	0	118.1
367	K	28.9	Very low	30	Very low	176 Å²	176	139.5 Å²	139.5	77%	0.765	78%	0.777	S	S	*	*			cis	-132.9	161.4	-8.9	-84.1	114.1	177	-176.4	0	107.1
368	R	26.7	Very low	30	Very low	193 Å²	193	139.8 Å²	139.8	73%	0.728	78%	0.779	S	S	*	*			cis	93.8	94	21.5	-162.9	-150.5	-158.7	-164.3	11.5	117.6
369	F	30.1	Very low	30.4	Very low	201 Å²	201	145.1 Å²	145.1	88%	0.882	78%	0.782	S	S	*	*			trans	-157.5	151.4	154.5	-88.7	-71.5	0	0	0	107.6
370	K	28	Very low	30.3	Very low	148 Å²	148	146 Å²	146	64%	0.643	78%	0.783	S	S	*	*			cis	74.2	134.5	6	-62.9	-170.1	173.2	-173.9	0	117
371	R	27.6	Very low	30	Very low	228 Å²	228	152.7 Å²	152.7	86%	0.86	79%	0.787	S	S	*	*			cis	-157.8	-178.1	-4.8	-124.9	-161.2	170.4	172.6	-2.6	107.5
372	A	27.9	Very low	29.8	Very low	87 Å²	87	156.3 Å²	156.3	72%	0.719	79%	0.794	S	S	*	*			cis	-134.9	-158	12.2	0	0	0	0	0	110
373	A	27.6	Very low	29.5	Very low	99 Å²	99	152 Å²	152	82%	0.818	79%	0.792	S	S	*	*			cis	-131.5	-142.2	3	0	0	0	0	0	109.4
374	G	27.3	Very low	30	Very low	70 Å²	70	153 Å²	153	72%	0.722	80%	0.798	S	S	*	*			cis	150.9	121.4	-12.3	0	0	0	0	0	109.3
375	K	33	Very low	29.8	Very low	209 Å²	209	148.4 Å²	148.4	91%	0.909	80%	0.801	S	S	*	*			cis	-137.6	-179.1	11.5	-66.6	171	178.5	168.4	0	111.8
376	K	30.3	Very low	29.9	Very low	213 Å²	213	148.2 Å²	148.2	93%	0.926	81%	0.809	S	S	*	*			trans	-23.9	151.7	168.9	-50.6	170.6	178.9	-178.5	0	117.6
377	G	26.3	Very low	29.9	Very low	71 Å²	71	150.7 Å²	150.7	73%	0.732	82%	0.817	S	S	*	*			cis	147.4	153.9	-8.5	0	0	0	0	0	115.4
378	A	29.2	Very low	30.3	Very low	99 Å²	99	146.8 Å²	146.8	82%	0.818	81%	0.811	S	S	*	*			trans	71.1	152.7	171	0	0	0	0	0	117.7
379	R	32.8	Very low	31.1	Very low	228 Å²	228	147.2 Å²	147.2	86%	0.86	82%	0.822	S	S	*	*			cis	-161.9	148.8	-16.5	-121.5	-174.5	-177	-176.1	1.4	111.6
380	T	27.6	Very low	31.5	Very low	120 Å²	120	144.3 Å²	144.3	74%	0.736	82%	0.815	S	S	*	*			trans	54.4	111.9	151.4	44.9	0	0	0	0	124.2
381	R	28.9	Very low	31.7	Very low	237 Å²	237	144.4 Å²	144.4	89%	0.894	82%	0.822	S	S	*	*				62.7	111	109.2	-170.7	-160.7	-163.8	-163.3	6.4	120.8
382	Q	28.1	Very low	32.1	Very low	199 Å²	199	143.2 Å²	143.2	93%	0.93	82%	0.819	S	S	*	*				-161.7	-175.7	125.3	-113.9	171.3	2.8	0	0	112.9
383	G	29.1	Very low	32.3	Very low	68 Å²	68	145.5 Å²	145.5	70%	0.701	82%	0.819	S	S	*	*			trans	-110.5	-159.1	-163.2	0	0	0	0	0	116.1
384	P	45.3	Very low	32.6	Very low	140 Å²	140	149.1 Å²	149.1	91%	0.909	82%	0.817	S	S	*	*			trans	-87.3	157.6	-165.8	35.4	-37	0	0	0	115.2
385	G	26.3	Very low	32.9	Very low	81 Å²	81	152 Å²	152	84%	0.835	82%	0.82	S	S	*	*			trans	-154.9	158.9	166.7	0	0	0	0	0	108.9
386	A	39.6	Very low	32.8	Very low	103 Å²	103	151 Å²	151	85%	0.851	82%	0.816	S	S	*	*			trans	-133.2	121.5	-169.5	0	0	0	0	0	112.9
387	E	28	Very low	33	Very low	194 Å²	194	148.5 Å²	148.5	91%	0.907	81%	0.811	S	S	*	*			trans	-150.8	149.6	168.5	-65.2	-177.6	-156.7	0	0	105.4
388	S	37.2	Very low	33.2	Very low	94 Å²	94	151 Å²	151	66%	0.657	81%	0.812	S	S	*	*			cis	-153.4	168.5	-7.7	40.7	0	0	0	0	108.8	D390	S388-D390 PolarHBondContact O-N 2.96Å
389	E	42.3	Very low	33.4	Very low	202 Å²	202	150.8 Å²	150.8	94%	0.944	81%	0.81	S	S	*	*			trans	-76.6	114	170.3	-64.9	174.8	127.2	0	0	109.6
390	D	39.1	Very low	33.3	Very low	140 Å²	140	143.2 Å²	143.2	75%	0.749	80%	0.803	S	S	*	*			trans	-109.8	134.7	172.4	-93.4	-45.5	0	0	0	112	S388	S388-D390 PolarHBondContact O-N 2.96Å
391	L	33.2	Very low	33.6	Very low	151 Å²	151	146.9 Å²	146.9	79%	0.791	81%	0.812	S	S	*	*			trans	-72.9	121.8	-170.6	-170.1	72.5	0	0	0	111.5	D393	L391-D393 PolarHBondContact O-N 2.71Å
392	Y	34.7	Very low	33.8	Very low	203 Å²	203	144 Å²	144	80%	0.796	81%	0.805	S	S	*	*			trans	-81.5	92.7	170.5	-85.1	-80.2	0	0	0	110.9	F394	Y392-F394 VanDerWaalsContact O-CD2 3.26Å; Y392-F394 WeakPolarHBondContact O-CD2 3.22Å; Y392-F394 PolarHBondContact O-N 2.65Å
393	D	33	Very low	34.2	Very low	134 Å²	134	141.4 Å²	141.4	72%	0.717	79%	0.793	S	S	*	*			trans	-66	112.9	168	-83.3	-29.7	0	0	0	110.8	L391 V395	L391-D393 PolarHBondContact O-N 2.71Å; D393-V395 PolarHBondContact O-N 3.34Å
394	F	33.7	Very low	34.3	Very low	176 Å²	176	146.3 Å²	146.3	77%	0.772	80%	0.804	S	S	*	*			trans	-81.9	99.5	174.9	-71	-84.5	0	0	0	110.6	Y392 F396	Y392-F394 VanDerWaalsContact O-CD2 3.26Å; Y392-F394 WeakPolarHBondContact O-CD2 3.22Å; Y392-F394 PolarHBondContact O-N 2.65Å; F394-F396 WeakPolarHBondContact O-CD2 3.24Å; F394-F396 PolarHBondContact O-N 3.09Å
395	V	33.4	Very low	33.8	Very low	131 Å²	131	143.2 Å²	143.2	79%	0.794	80%	0.797	S	S	*	*			trans	-68.1	113.7	175.7	179.6	0	0	0	0	110.5	D393 I397	D393-V395 PolarHBondContact O-N 3.34Å; V395-I397 PolarHBondContact O-N 3.1Å
396	F	31.9	Very low	34	Very low	186 Å²	186	148.7 Å²	148.7	82%	0.816	80%	0.801	S	S	*	*			trans	-75.7	116	171.8	-70.1	-92.1	0	0	0	110.6	F394 V398	F394-F396 WeakPolarHBondContact O-CD2 3.24Å; F394-F396 PolarHBondContact O-N 3.09Å; F396-V398 PolarHBondContact O-N 3.15Å
397	I	32.6	Very low	33.7	Very low	162 Å²	162	153.7 Å²	153.7	83%	0.831	81%	0.807	S	S	*	*			trans	-80.9	97.8	169.7	-57.6	177.9	0	0	0	108.3	V395 A399	V395-I397 PolarHBondContact O-N 3.1Å; I397-A399 PolarHBondContact O-N 3.27Å
398	V	31.8	Very low	33.9	Very low	124 Å²	124	153 Å²	153	75%	0.752	81%	0.805	S	S	*	*			trans	-79.6	110.9	166.1	-179.9	0	0	0	0	108.1	F396 G400	F396-V398 PolarHBondContact O-N 3.15Å; V398-G400 PolarHBondContact O-N 2.95Å
399	A	33	Very low	33.5	Very low	94 Å²	94	157.4 Å²	157.4	78%	0.777	82%	0.816	S	S	*	*			trans	-72.8	92.5	167.8	0	0	0	0	0	108.8	I397 E401	I397-A399 PolarHBondContact O-N 3.27Å; A399-E401 PolarHBondContact O-N 3.46Å
400	G	29.7	Very low	33	Very low	68 Å²	68	155.7 Å²	155.7	70%	0.701	81%	0.811	S	S	*	*			trans	-86.7	100.3	177.5	0	0	0	0	0	111.5	V398	V398-G400 PolarHBondContact O-N 2.95Å
401	E	34.5	Very low	32.4	Very low	197 Å²	197	151.5 Å²	151.5	92%	0.921	80%	0.801	S	S	*	*			trans	-86.3	118.8	164.3	-69.4	-170.8	144.3	0	0	109.8	A399	A399-E401 PolarHBondContact O-N 3.46Å
402	K	32.9	Very low	32.2	Very low	176 Å²	176	153.6 Å²	153.6	77%	0.765	81%	0.807	S	S	*	*			trans	-96.5	152.5	163.6	-85.4	174.3	157	-90.9	0	107.5
403	E	36.7	Very low	31.9	Very low	145 Å²	145	150.8 Å²	150.8	68%	0.678	81%	0.81	S	S	*	*			cis	-177.8	137.5	-6.8	165.9	169.6	-158.6	0	0	104.7
404	D	31.1	Very low	31.6	Very low	172 Å²	172	148.2 Å²	148.2	92%	0.92	81%	0.808	S	S	*	*			trans	-168.9	138.3	153.9	-98.7	-29.8	0	0	0	107.9
405	G	34.7	Very low	31.4	Very low	74 Å²	74	146.3 Å²	146.3	76%	0.763	82%	0.815	S	S	*	*			trans	-115.1	128.6	-165.2	0	0	0	0	0	114.3
406	E	31.9	Very low	31	Very low	196 Å²	196	143.2 Å²	143.2	92%	0.916	81%	0.809	S	S	*	*			trans	-119.3	121.8	151.5	-67.3	-166.7	150.2	0	0	108	M408	E406-M408 PolarHBondContact O-N 3.44Å
407	E	33.3	Very low	30.9	Very low	209 Å²	209	139 Å²	139	98%	0.977	81%	0.809	S	S	*	*			trans	-75	107.6	179.8	-66.1	-174.3	143.7	0	0	110.1
408	M	32	Very low	30.9	Very low	178 Å²	178	139.8 Å²	139.8	88%	0.877	81%	0.814	S	S	*	*			trans	-110.1	123.2	168.2	-156.1	174.1	-166.7	0	0	111	E406 I410	E406-M408 PolarHBondContact O-N 3.44Å; M408-I410 PolarHBondContact O-N 3.02Å
409	E	28.5	Very low	30.8	Very low	187 Å²	187	141.3 Å²	141.3	87%	0.874	82%	0.818	S	S	*	*			trans	-62.4	108	-169.5	-172	177.6	-173	0	0	112.8	G411	E409-G411 PolarHBondContact O-N 3.04Å
410	I	30.9	Very low	30.7	Very low	167 Å²	167	140.2 Å²	140.2	86%	0.856	82%	0.815	S	S	*	*			trans	-77.9	90	173.5	-55.6	179.3	0	0	0	109	M408	M408-I410 PolarHBondContact O-N 3.02Å
411	G	26.3	Very low	30.6	Very low	51 Å²	51	142.2 Å²	142.2	53%	0.526	82%	0.819	S	S	.	*			trans	-62.3	136.3	171.1	0	0	0	0	0	112.2	E409 V413	E409-G411 PolarHBondContact O-N 3.04Å; G411-V413 PolarHBondContact O-N 2.89Å
412	E	29.1	Very low	30.1	Very low	195 Å²	195	138.8 Å²	138.8	91%	0.911	81%	0.807	S	S	*	*			trans	-64.5	91.6	179	-68.6	-171.3	116.1	0	0	112.4	A414	E412-A414 PolarHBondContact O-N 3.23Å
413	V	30.1	Very low	30.3	Very low	144 Å²	144	136 Å²	136	87%	0.873	81%	0.807	S	S	*	*			trans	-77.7	82.2	163.3	-174	0	0	0	0	108.3	G411	G411-V413 PolarHBondContact O-N 2.89Å
414	A	26.3	Very low	30.1	Very low	80 Å²	80	134.2 Å²	134.2	66%	0.661	81%	0.81	S	S	*	*			trans	-53.4	146.4	176	0	0	0	0	0	111.5	E412 G416	E412-A414 PolarHBondContact O-N 3.23Å; A414-G416 VanDerWaalsContact C-N 3.26Å; A414-G416 PolarHBondContact O-N 3.33Å
415	C	28.4	Very low	30.2	Very low	137 Å²	137	131.4 Å²	131.4	93%	0.926	80%	0.803	S	S	*	*			trans	-65.4	85.3	172.4	-70.6	0	0	0	0	110.3	A417	C415-A417 PolarHBondContact O-N 3.03Å
416	G	25.2	Very low	30.5	Very low	66 Å²	66	133.1 Å²	133.1	68%	0.68	79%	0.794	S	S	*	*			trans	-60.1	109.6	177.4	0	0	0	0	0	110.4	A414 L418	A414-G416 VanDerWaalsContact C-N 3.26Å; A414-G416 PolarHBondContact O-N 3.33Å; G416-L418 PolarHBondContact O-N 2.8Å
417	A	30.7	Very low	30.6	Very low	97 Å²	97	127.5 Å²	127.5	80%	0.802	79%	0.788	S	S	*	*			trans	-59.7	120.5	173.2	0	0	0	0	0	109.1	C415 D419	C415-A417 PolarHBondContact O-N 3.03Å; A417-D419 PolarHBondContact O-N 3.44Å
418	L	32.6	Very low	31.2	Very low	179 Å²	179	120.1 Å²	120.1	94%	0.937	76%	0.755	S	S	*	*			trans	-70.2	103.1	172.4	-69.4	178.2	0	0	0	108.5	G416	G416-L418 PolarHBondContact O-N 2.8Å
419	D	29.4	Very low	31.9	Very low	156 Å²	156	114.2 Å²	114.2	83%	0.834	73%	0.73	S	S	*	*			trans	-71.2	142.8	-176.2	-169.8	17.1	0	0	0	112	A417 S421	A417-D419 PolarHBondContact O-N 3.44Å; D419-S421 PolarHBondContact O-N 2.77Å
420	G	31.1	Very low	32.7	Very low	70 Å²	70	108.5 Å²	108.5	72%	0.722	72%	0.715	S	S	*	*	S	Bend	trans	60.2	47.3	156.1	0	0	0	0	0	118.8
421	S	26.3	Very low	33.7	Very low	111 Å²	111	102 Å²	102	78%	0.776	68%	0.682	S	S	*	*			trans	-134.6	119.2	159.5	-76	0	0	0	0	111.7	D419	D419-S421 PolarHBondContact O-N 2.77Å
422	D	25.8	Very low	34.7	Very low	125 Å²	125	109.2 Å²	109.2	67%	0.668	70%	0.702	S	S	*	*			trans	-61.2	138.3	176.4	-72.1	-61.9	0	0	0	110.8	S424 C425	D422-S424 PolarHBondContact O-N 2.72Å; D422-C425 PolarHBondContact O-N 3.34Å
423	P	36	Very low	35.5	Very low	118 Å²	118	103.9 Å²	103.9	77%	0.766	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-65.1	-7.4	-179.5	27	-35	0	0	0	113.7	C425	P423-C425 PolarHBondContact O-N 3.29Å
424	S	33.2	Very low	36.7	Very low	107 Å²	107	97.7 Å²	97.7	75%	0.748	66%	0.655	S	S	*	*	G	3₁₀ helix	trans	-69.6	-10.7	176.3	-47.9	0	0	0	0	114.9	D422	D422-S424 PolarHBondContact O-N 2.72Å
425	C	33.6	Very low	38.4	Very low	113 Å²	113	99.5 Å²	99.5	76%	0.764	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-92.8	-8.3	-175.1	-73.9	0	0	0	0	114.9	D422 P423	D422-C425 PolarHBondContact O-N 3.34Å; P423-C425 PolarHBondContact O-N 3.29Å
426	L	40.2	Very low	40.3	Very low	109 Å²	109	102 Å²	102	57%	0.571	64%	0.639	S	S	*	*	S	Bend	trans	-90.1	134	161.6	-65.4	179.4	0	0	0	108.2	L428 L456	L426-L428 HydrophobicContact CB-CG 4.22Å; L426-L428 PolarHBondContact O-N 3.07Å; L426-L456 HydrophobicContact CD1-CD1 4.5Å
427	G	34.8	Very low	43	Very low	78 Å²	78	101.2 Å²	101.2	80%	0.804	62%	0.617	S	S	*	*			trans	-69.7	26.7	-174.1	0	0	0	0	0	116
428	L	45.1	Very low	45.6	Very low	54 Å²	54	101.3 Å²	101.3	28%	0.283	60%	0.597	S	S	.	*			trans	-60	130.1	176.2	-58.8	176.8	0	0	0	109.2	L426 A430 T457	L426-L428 HydrophobicContact CB-CG 4.22Å; L426-L428 PolarHBondContact O-N 3.07Å; L428-A430 PolarHBondContact O-N 3.26Å; L428-A430 VanDerWaalsContact O-N 3.15Å; L428-T457 WeakPolarHBondContact CD2-OG1 3.34Å
429	P	46.4	Very low	48.4	Very low	55 Å²	55	94 Å²	94	36%	0.357	56%	0.561	S	S	.	*			trans	-62.2	121.4	178.2	25.8	-33.5	0	0	0	109	L431	P429-L431 WeakPolarHBondContact O-CG 3.44Å; P429-L431 PolarHBondContact O-N 2.95Å
430	A	45.7	Very low	51.5	Low	67 Å²	67	86.6 Å²	86.6	55%	0.554	52%	0.521	S	S	*	.			trans	-50.2	96.7	-165.1	0	0	0	0	0	113.2	Q233 L428 E432 A433	Q233-A430 PolarHBondContact NE2-O 2.85Å; Q233-A430 VanDerWaalsContact NE2-O 3.16Å; L428-A430 PolarHBondContact O-N 3.26Å; L428-A430 VanDerWaalsContact O-N 3.15Å; A430-E432 PolarHBondContact O-N 3.17Å; A430-E432 VanDerWaalsContact O-N 3.15Å; A430-A433 PolarHBondContact O-N 3.47Å
431	L	52.6	Low	54.4	Low	30 Å²	30	84.3 Å²	84.3	16%	0.157	49%	0.494	C	S	.	.	G	3₁₀ helix	trans	-67.1	-21.5	-168	-67.7	174	0	0	0	112.6	F231 P429 A433 S434 H460 L461	F231-L431 HydrophobicContact CB-CD2 4.18Å; F231-L431 HydrophobicContact CD1-CB 4.19Å; F231-L431 HydrophobicContact CD1-CD2 3.73Å; F231-L431 HydrophobicContact CD1-CG 4.48Å; F231-L431 HydrophobicContact CE1-CB 4.02Å; F231-L431 HydrophobicContact CE1-CD2 4.22Å; F231-L431 HydrophobicContact CG-CD2 3.91Å; P429-L431 WeakPolarHBondContact O-CG 3.44Å; P429-L431 PolarHBondContact O-N 2.95Å; L431-A433 VanDerWaalsContact C-N 3.29Å; L431-A433 PolarHBondContact O-N 3.24Å; L431-S434 WeakPolarHBondContact O-CB 3.25Å; L431-S434 PolarHBondContact O-N 2.92Å; L431-S434 PolarHBondContact O-OG 3.5Å; L431-H460 VanDerWaalsContact CD1-CE1 3.47Å; L431-H460 WeakPolarHBondContact CD1-CE1 3.37Å; L431-H460 WeakPolarHBondContact CD1-ND1 3.29Å; L431-L461 HydrophobicContact CD1-CD2 4.35Å
432	E	45.7	Very low	57.7	Low	202 Å²	202	80.4 Å²	80.4	94%	0.944	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-66	-25.8	174.3	-55.4	-168.2	141.1	0	0	113.7	A430	A430-E432 PolarHBondContact O-N 3.17Å; A430-E432 VanDerWaalsContact O-N 3.15Å
433	A	45.9	Very low	61.1	Low	83 Å²	83	74.4 Å²	74.4	69%	0.686	43%	0.434	S	S	*	.	G	3₁₀ helix	trans	-88.9	-10.9	178.1	0	0	0	0	0	113.2	A430 L431	A430-A433 PolarHBondContact O-N 3.47Å; L431-A433 VanDerWaalsContact C-N 3.29Å; L431-A433 PolarHBondContact O-N 3.24Å
434	S	55.9	Low	63.8	Low	15 Å²	15	70.1 Å²	70.1	11%	0.105	40%	0.403	C	S	.	.	S	Bend	trans	-75.5	132.6	-178.7	-49.1	0	0	0	0	111.2	Q233 L431 R436	Q233-S434 PolarHBondContact NE2-OG 3.1Å; L431-S434 WeakPolarHBondContact O-CB 3.25Å; L431-S434 PolarHBondContact O-N 2.92Å; L431-S434 PolarHBondContact O-OG 3.5Å; S434-R436 PolarHBondContact O-N 2.89Å
435	Q	62.3	Low	66.7	Low	118 Å²	118	65 Å²	65	55%	0.551	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.5	127.2	165.3	-72.4	174.6	3.6	0	0	108.5	W232 F437	W232-Q435 PolarHBondContact N-O 2.86Å; Q435-F437 HydrophobicContact CB-CD2 4.14Å; Q435-F437 HydrophobicContact CB-CE2 3.44Å; Q435-F437 VanDerWaalsContact CB-CE2 3.44Å; Q435-F437 HydrophobicContact CB-CZ 3.93Å; Q435-F437 VanDerWaalsContact O-CD2 3.22Å; Q435-F437 WeakPolarHBondContact O-CD2 3.28Å
436	R	68	Low	69.3	Low	188 Å²	188	62.4 Å²	62.4	71%	0.709	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	125.7	171.3	-74.8	-175.8	177.5	161.1	1.1	109.7	S434	S434-R436 PolarHBondContact O-N 2.89Å
437	F	81.1	Confident	71.4	Confident	51 Å²	51	59.9 Å²	59.9	22%	0.224	33%	0.332	C	S	.	.			trans	-119.6	-177.5	175.6	-70.6	-84.2	0	0	0	110.6	H201 G230 W232 C244 Q435 S439	H201-F437 HydrophobicContact CB-CB 4.01Å; H201-F437 HydrophobicContact CB-CG 4.47Å; H201-F437 VanDerWaalsContact ND1-CB 3.26Å; H201-F437 WeakPolarHBondContact ND1-CB 3.34Å; G230-F437 PolarHBondContact O-N 3.44Å; W232-F437 HydrophobicContact CB-CD2 3.65Å; W232-F437 HydrophobicContact CB-CE2 3.74Å; W232-F437 AromaticContact CD1-CE2 3.65Å; W232-F437 HydrophobicContact CG-CD2 4.38Å; W232-F437 HydrophobicContact CG-CE2 4.08Å; C244-F437 HydrophobicContact CB-CZ 4.45Å; Q435-F437 HydrophobicContact CB-CD2 4.14Å; Q435-F437 HydrophobicContact CB-CE2 3.44Å; Q435-F437 VanDerWaalsContact CB-CE2 3.44Å; Q435-F437 HydrophobicContact CB-CZ 3.93Å; Q435-F437 VanDerWaalsContact O-CD2 3.22Å; Q435-F437 WeakPolarHBondContact O-CD2 3.28Å; F437-S439 PolarHBondContact O-N 3.05Å
438	R	86.7	Confident	73.8	Confident	99 Å²	99	56.1 Å²	56.1	37%	0.374	29%	0.294	S	S	.	.			trans	-51.8	131.6	168.1	178.3	177.8	-176.6	-81.8	-0.6	110.3	I200 H201 G203 A204 V205	I200-R438 WeakPolarHBondContact O-CD 3.45Å; I200-R438 PolarHBondContact O-NH1 3.49Å; H201-R438 PolarHBondContact ND1-O 2.87Å; G203-R438 PolarHBondContact O-NH1 2.84Å; A204-R438 PolarHBondContact O-NH2 3.47Å; V205-R438 PolarHBondContact O-NH1 2.96Å; V205-R438 PolarHBondContact O-NH2 2.89Å
439	S	89.8	Confident	75.7	Confident	26 Å²	26	54.7 Å²	54.7	18%	0.182	29%	0.288	C	S	.	.			trans	-113.8	165.4	174.7	40.8	0	0	0	0	109.9	S228 F437 S467	S228-S439 WeakPolarHBondContact O-CA 3.48Å; S228-S439 VanDerWaalsContact O-CB 3.24Å; S228-S439 WeakPolarHBondContact O-CB 3.28Å; F437-S439 PolarHBondContact O-N 3.05Å; S439-S467 VanDerWaalsContact CB-OG 3.28Å; S439-S467 WeakPolarHBondContact CB-OG 3.49Å; S439-S467 WeakPolarHBondContact OG-CB 3.47Å; S439-S467 PolarHBondContact OG-OG 3.28Å
440	I	94.6	Very high	77.5	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.275	C	S	.	.			trans	-82.4	166.2	178.3	69.2	175.4	0	0	0	111.7	I200 V205 S206 V208 S228 T442 W465 S467	I200-I440 HydrophobicContact CB-CG2 4.48Å; I200-I440 HydrophobicContact CD1-CG2 4Å; I200-I440 HydrophobicContact CG1-CG2 4.05Å; I200-I440 HydrophobicContact CG2-CG2 3.68Å; V205-I440 HydrophobicContact CG1-CG2 4.47Å; S206-I440 WeakPolarHBondContact O-CB 3.17Å; V208-I440 HydrophobicContact CB-CD1 3.46Å; V208-I440 VanDerWaalsContact CB-CD1 3.46Å; V208-I440 HydrophobicContact CG2-CD1 3.55Å; V208-I440 HydrophobicContact CG2-CG2 4.11Å; S228-I440 PolarHBondContact O-N 3.31Å; I440-T442 WeakPolarHBondContact CD1-O 3.36Å; I440-W465 HydrophobicContact CD1-CZ2 4.05Å; I440-W465 HydrophobicContact CG1-CZ2 3.64Å; I440-W465 PolarHBondContact O-NE1 2.99Å; I440-W465 VanDerWaalsContact O-NE1 3.09Å; I440-S467 PolarHBondContact O-OG 2.84Å
441	S	93.7	Very high	79.4	Confident	22 Å²	22	51.1 Å²	51.1	15%	0.154	26%	0.259	C	S	.	.	S	Bend	trans	-110.2	-17	178.1	75.8	0	0	0	0	115.7	S206 S467 E469 S470	S206-S441 PolarHBondContact O-N 3Å; S441-S467 WeakPolarHBondContact CA-O 3.36Å; S441-S467 WeakPolarHBondContact CB-O 3.47Å; S441-E469 WeakPolarHBondContact CB-OE2 3.46Å; S441-E469 PolarHBondContact O-N 2.85Å; S441-E469 PolarHBondContact OG-OE2 3.47Å; S441-S470 PolarHBondContact O-N 3.19Å
442	T	95.2	Very high	81	Confident	28 Å²	28	53.1 Å²	53.1	17%	0.172	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	121.1	173.6	-60.6	0	0	0	0	111.3	S206 Q207 V208 I440 E444 S470	S206-T442 PolarHBondContact O-N 3.08Å; Q207-T442 WeakPolarHBondContact CA-O 3.42Å; Q207-T442 HydrophobicContact CG-CG2 3.9Å; V208-T442 PolarHBondContact N-O 3.5Å; I440-T442 WeakPolarHBondContact CD1-O 3.36Å; T442-E444 HydrophobicContact CG2-CG 4.13Å; T442-S470 WeakPolarHBondContact CA-O 3.21Å
443	L	95.8	Very high	83	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	131.5	168.1	177.1	64.2	0	0	0	110.3	V208 L225 L445 L458 W465 L468 S470 L471 T472	V208-L443 WeakPolarHBondContact O-CA 3.49Å; L225-L443 HydrophobicContact CD2-CD1 4.41Å; L225-L443 HydrophobicContact CD2-CD2 3.61Å; L443-L445 HydrophobicContact CD1-CD2 4.08Å; L443-L445 HydrophobicContact CD2-CD1 4.42Å; L443-L445 HydrophobicContact CD2-CG 4.42Å; L443-L445 HydrophobicContact CG-CD2 4.4Å; L443-L445 HydrophobicContact CG-CG 4.3Å; L443-L458 HydrophobicContact CD2-CD1 4.14Å; L443-W465 HydrophobicContact CB-CH2 4.25Å; L443-W465 HydrophobicContact CD2-CH2 3.74Å; L443-W465 HydrophobicContact CD2-CZ3 3.99Å; L443-W465 HydrophobicContact CG-CH2 4.46Å; L443-L468 HydrophobicContact CB-CD1 4.09Å; L443-S470 PolarHBondContact N-O 3.46Å; L443-L471 HydrophobicContact CB-CD1 3.83Å; L443-L471 HydrophobicContact CD2-CD1 3.64Å; L443-L471 HydrophobicContact CG-CD1 3.77Å; L443-L471 WeakPolarHBondContact O-CA 3.43Å; L443-T472 PolarHBondContact O-N 3.04Å
444	E	94.6	Very high	85	Confident	27 Å²	27	44.3 Å²	44.3	13%	0.126	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	127.7	176.3	-65.3	169.7	-169.1	0	0	111.2	Q207 V208 S209 L210 Y211 T442 F446	Q207-E444 PolarHBondContact NE2-OE1 3.48Å; V208-E444 PolarHBondContact O-N 2.98Å; S209-E444 CarbonylContact C-O 3.28Å; S209-E444 WeakPolarHBondContact CA-O 3.4Å; S209-E444 VanDerWaalsContact CB-OE2 3.25Å; S209-E444 WeakPolarHBondContact CB-OE2 3.42Å; S209-E444 PolarHBondContact OG-OE2 3.49Å; L210-E444 PolarHBondContact N-O 3.28Å; Y211-E444 PolarHBondContact OH-OE2 2.78Å; T442-E444 HydrophobicContact CG2-CG 4.13Å; E444-F446 HydrophobicContact CB-CD2 3.98Å; E444-F446 HydrophobicContact CB-CE2 3.67Å; E444-F446 HydrophobicContact CG-CE2 4.04Å
445	L	92.1	Very high	86.6	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	108.9	176.9	-57.3	-178.9	0	0	0	109.2	L210 F221 L443 L450 L458 T472 L473 S474 N476	L210-L445 HydrophobicContact CB-CD2 3.83Å; L210-L445 HydrophobicContact CD1-CD2 3.57Å; L210-L445 HydrophobicContact CG-CD2 3.73Å; F221-L445 HydrophobicContact CE2-CD2 4.12Å; F221-L445 HydrophobicContact CZ-CD1 4.03Å; F221-L445 HydrophobicContact CZ-CD2 4.14Å; L443-L445 HydrophobicContact CD1-CD2 4.08Å; L443-L445 HydrophobicContact CD2-CD1 4.42Å; L443-L445 HydrophobicContact CD2-CG 4.42Å; L443-L445 HydrophobicContact CG-CD2 4.4Å; L443-L445 HydrophobicContact CG-CG 4.3Å; L445-L450 HydrophobicContact CD1-CD2 4.28Å; L445-L458 HydrophobicContact CD1-CD2 4.23Å; L445-T472 PolarHBondContact N-O 3.45Å; L445-L473 HydrophobicContact CB-CD2 3.92Å; L445-L473 HydrophobicContact CD1-CD2 3.68Å; L445-L473 HydrophobicContact CG-CD2 4.09Å; L445-S474 PolarHBondContact O-N 3.01Å; L445-N476 WeakPolarHBondContact CB-ND2 3.38Å; L445-N476 PolarHBondContact O-ND2 3.06Å; L445-N476 PolarHBondContact O-OD1 3.26Å
446	F	88.3	Confident	87.8	Confident	58 Å²	58	41.5 Å²	41.5	25%	0.254	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	120.1	-176.8	-70.4	-85.7	0	0	0	111.4	L210 Y211 S212 E444 V448 T472 S474	L210-F446 PolarHBondContact O-N 3.15Å; Y211-F446 CarbonylContact C-O 3.49Å; Y211-F446 WeakPolarHBondContact CA-O 3.46Å; Y211-F446 HydrophobicContact CD1-CB 3.68Å; Y211-F446 AromaticContact CD1-CD2 3.47Å; Y211-F446 HydrophobicContact CD1-CD2 3.47Å; Y211-F446 VanDerWaalsContact CD1-CD2 3.47Å; Y211-F446 HydrophobicContact CD1-CE2 4.28Å; Y211-F446 AromaticContact CD1-CG 3.82Å; Y211-F446 HydrophobicContact CD1-CG 3.82Å; Y211-F446 HydrophobicContact CE1-CB 4.33Å; Y211-F446 AromaticContact CE1-CD2 3.2Å; Y211-F446 HydrophobicContact CE1-CD2 3.2Å; Y211-F446 AromaticContact CE1-CE2 3.56Å; Y211-F446 HydrophobicContact CE1-CE2 3.56Å; Y211-F446 AromaticContact CE1-CG 3.96Å; Y211-F446 HydrophobicContact CE1-CG 3.96Å; Y211-F446 HydrophobicContact CG-CB 4.48Å; S212-F446 PolarHBondContact N-O 3.07Å; E444-F446 HydrophobicContact CB-CD2 3.98Å; E444-F446 HydrophobicContact CB-CE2 3.67Å; E444-F446 HydrophobicContact CG-CE2 4.04Å; F446-V448 VanDerWaalsContact C-N 3.34Å; F446-V448 PolarHBondContact O-N 3.34Å; F446-T472 HydrophobicContact CE1-CG2 4.02Å; F446-T472 HydrophobicContact CE2-CG2 4.27Å; F446-T472 HydrophobicContact CZ-CG2 3.67Å; F446-S474 WeakPolarHBondContact CA-O 3.4Å
447	T	85.8	Confident	88.8	Confident	56 Å²	56	32.8 Å²	32.8	34%	0.344	17%	0.173	S	C	.	.	S	Bend	trans	53.3	48.8	-178.2	54.1	0	0	0	0	112.6	S212 W213 S474 Y475 N476	S212-T447 WeakPolarHBondContact CA-OG1 3.38Å; S212-T447 PolarHBondContact N-OG1 2.91Å; S212-T447 VanDerWaalsContact N-OG1 3.08Å; S212-T447 PolarHBondContact OG-OG1 2.9Å; W213-T447 PolarHBondContact N-O 3.04Å; W213-T447 VanDerWaalsContact N-O 3.08Å; T447-S474 PolarHBondContact N-O 3.41Å; T447-Y475 HydrophobicContact CG2-CG 4.4Å; T447-N476 PolarHBondContact N-OD1 3.26Å; T447-N476 VanDerWaalsContact N-OD1 3.1Å
448	V	85.3	Confident	89.3	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.162	C	C	.	.			trans	-129.5	108.8	173.8	-170.2	0	0	0	0	108.6	L210 W213 P216 F221 F446 N476	L210-V448 HydrophobicContact CB-CG2 4.1Å; W213-V448 HydrophobicContact CB-CG1 4.16Å; W213-V448 HydrophobicContact CB-CG2 3.96Å; W213-V448 HydrophobicContact CE3-CG1 4.34Å; P216-V448 HydrophobicContact CB-CG1 4.24Å; P216-V448 HydrophobicContact CG-CG1 4.14Å; F221-V448 HydrophobicContact CD2-CG1 4.11Å; F221-V448 HydrophobicContact CE2-CG1 3.68Å; F446-V448 VanDerWaalsContact C-N 3.34Å; F446-V448 PolarHBondContact O-N 3.34Å; V448-N476 PolarHBondContact N-OD1 3.01Å; V448-N476 WeakPolarHBondContact O-CA 3.34Å; V448-N476 WeakPolarHBondContact O-CB 3.33Å; V448-N476 VanDerWaalsContact O-CG 3.26Å; V448-N476 PolarHBondContact O-OD1 2.79Å
449	P	84.3	Confident	89.4	Confident	24 Å²	24	27.7 Å²	27.7	16%	0.156	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-69.6	137.2	-178.8	28.7	-31.9	0	0	0	110.9	W213 P214 P216 N476	W213-P449 WeakPolarHBondContact O-CD 3.42Å; P214-P449 WeakPolarHBondContact O-CG 3.49Å; P216-P449 HydrophobicContact CG-CG 4.27Å; P216-P449 VanDerWaalsContact CG-O 3.28Å; P216-P449 WeakPolarHBondContact CG-O 3.49Å; P449-N476 WeakPolarHBondContact CA-O 3.27Å
450	L	84.6	Confident	89.3	Confident	17 Å²	17	30.7 Å²	30.7	9%	0.089	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-91.8	119.3	-179.8	-61.8	177.8	0	0	0	110.3	F221 L445 A455	F221-L450 HydrophobicContact CE1-CD2 3.74Å; F221-L450 HydrophobicContact CZ-CD2 3.52Å; L445-L450 HydrophobicContact CD1-CD2 4.28Å; L450-A455 HydrophobicContact CB-CB 4.41Å
451	S	86.1	Confident	89.1	Confident	30 Å²	30	30.7 Å²	30.7	21%	0.21	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-69.3	155.7	165.1	68.8	0	0	0	0	110.1	S218 E453 A454 A455	S218-S451 PolarHBondContact OG-OG 2.99Å; S451-E453 PolarHBondContact O-N 3.43Å; S451-A454 WeakPolarHBondContact O-CB 3.5Å; S451-A454 PolarHBondContact O-N 2.77Å; S451-A454 VanDerWaalsContact O-N 3.07Å; S451-A454 VanDerWaalsContact OG-CB 3.27Å; S451-A454 WeakPolarHBondContact OG-CB 3.45Å; S451-A454 PolarHBondContact OG-N 3.24Å; S451-A455 WeakPolarHBondContact O-CB 3.28Å; S451-A455 PolarHBondContact O-N 3.44Å
452	T	85.3	Confident	88.9	Confident	72 Å²	72	31 Å²	31	44%	0.442	17%	0.169	S	C	.	.	H	α-helix	trans	-57.3	-39.2	-180	-44.7	0	0	0	0	112.1	A455 L456 I485	T452-A455 PolarHBondContact O-N 3.24Å; T452-L456 HydrophobicContact CG2-CD1 4.2Å; T452-L456 WeakPolarHBondContact O-CB 3.19Å; T452-L456 VanDerWaalsContact O-CG 3.26Å; T452-L456 WeakPolarHBondContact O-CG 3.41Å; T452-L456 PolarHBondContact O-N 2.75Å; T452-I485 HydrophobicContact CG2-CD1 4.13Å
453	E	88.4	Confident	88.3	Confident	98 Å²	98	34.5 Å²	34.5	46%	0.458	19%	0.194	S	C	.	.	H	α-helix	trans	-62.9	-45.6	174.8	-171.6	-170.5	-160.7	0	0	111.9	I222 S451 T457	I222-E453 HydrophobicContact CD1-CB 4.49Å; I222-E453 VanDerWaalsContact CD1-CD 3.47Å; I222-E453 HydrophobicContact CD1-CG 3.68Å; S451-E453 PolarHBondContact O-N 3.43Å; E453-T457 VanDerWaalsContact O-CB 3.29Å; E453-T457 WeakPolarHBondContact O-CB 3.39Å; E453-T457 PolarHBondContact O-N 3.02Å; E453-T457 PolarHBondContact O-OG1 3.47Å
454	A	87.9	Confident	87.8	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.008	20%	0.203	C	C	.	.	H	α-helix	trans	-65.9	-39.4	177.7	0	0	0	0	0	112.5	F221 S451 T457 L458	F221-A454 HydrophobicContact CD1-CB 3.62Å; F221-A454 HydrophobicContact CE1-CB 3.75Å; S451-A454 WeakPolarHBondContact O-CB 3.5Å; S451-A454 PolarHBondContact O-N 2.77Å; S451-A454 VanDerWaalsContact O-N 3.07Å; S451-A454 VanDerWaalsContact OG-CB 3.27Å; S451-A454 WeakPolarHBondContact OG-CB 3.45Å; S451-A454 PolarHBondContact OG-N 3.24Å; A454-T457 PolarHBondContact O-N 3.19Å; A454-L458 WeakPolarHBondContact O-CB 3.16Å; A454-L458 PolarHBondContact O-N 3.04Å
455	A	88	Confident	87.6	Confident	3 Å²	3	35 Å²	35	3%	0.025	20%	0.199	C	C	.	.	H	α-helix	trans	-65.6	-48.4	176	0	0	0	0	0	111.6	L450 S451 T452 T457 L458 C459	L450-A455 HydrophobicContact CB-CB 4.41Å; S451-A455 WeakPolarHBondContact O-CB 3.28Å; S451-A455 PolarHBondContact O-N 3.44Å; T452-A455 PolarHBondContact O-N 3.24Å; A455-T457 VanDerWaalsContact C-N 3.32Å; A455-T457 PolarHBondContact O-N 3.4Å; A455-L458 PolarHBondContact O-N 3.01Å; A455-C459 PolarHBondContact O-N 2.88Å; A455-C459 PolarHBondContact O-SG 3Å
456	L	88.4	Confident	87.2	Confident	72 Å²	72	42 Å²	42	38%	0.377	24%	0.241	S	C	.	.	H	α-helix	trans	-61.9	-39.5	175.5	-71.1	171.7	0	0	0	112	L426 T452 C459 H460 I485	L426-L456 HydrophobicContact CD1-CD1 4.5Å; T452-L456 HydrophobicContact CG2-CD1 4.2Å; T452-L456 WeakPolarHBondContact O-CB 3.19Å; T452-L456 VanDerWaalsContact O-CG 3.26Å; T452-L456 WeakPolarHBondContact O-CG 3.41Å; T452-L456 PolarHBondContact O-N 2.75Å; L456-C459 WeakPolarHBondContact O-CB 3.26Å; L456-C459 PolarHBondContact O-N 3.21Å; L456-H460 PolarHBondContact O-N 2.98Å; L456-I485 HydrophobicContact CD2-CD1 4.3Å; L456-I485 HydrophobicContact CG-CD1 4.49Å
457	T	89.6	Confident	87.2	Confident	5 Å²	5	41 Å²	41	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-61.3	-45.7	173.2	-59.6	0	0	0	0	111	I222 T226 L428 E453 A454 A455 H460 L461	I222-T457 HydrophobicContact CG1-CG2 4.39Å; I222-T457 HydrophobicContact CG2-CG2 4.19Å; T226-T457 HydrophobicContact CG2-CG2 4.46Å; L428-T457 WeakPolarHBondContact CD2-OG1 3.34Å; E453-T457 VanDerWaalsContact O-CB 3.29Å; E453-T457 WeakPolarHBondContact O-CB 3.39Å; E453-T457 PolarHBondContact O-N 3.02Å; E453-T457 PolarHBondContact O-OG1 3.47Å; A454-T457 PolarHBondContact O-N 3.19Å; A455-T457 VanDerWaalsContact C-N 3.32Å; A455-T457 PolarHBondContact O-N 3.4Å; T457-H460 PolarHBondContact O-N 3.43Å; T457-L461 HydrophobicContact CG2-CD1 3.9Å; T457-L461 HydrophobicContact CG2-CG 4.25Å; T457-L461 WeakPolarHBondContact O-CB 3.48Å; T457-L461 VanDerWaalsContact O-CG 3.28Å; T457-L461 WeakPolarHBondContact O-CG 3.48Å; T457-L461 PolarHBondContact O-N 3.49Å
458	L	90.9	Very high	87.5	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-62	-45.3	177.3	-176.4	60.2	0	0	0	111.4	L225 L443 L445 A454 A455 H460 L461 L462 W465	L225-L458 HydrophobicContact CD1-CB 4.11Å; L225-L458 HydrophobicContact CD1-CD1 4.22Å; L225-L458 HydrophobicContact CD2-CD1 4.27Å; L443-L458 HydrophobicContact CD2-CD1 4.14Å; L445-L458 HydrophobicContact CD1-CD2 4.23Å; A454-L458 WeakPolarHBondContact O-CB 3.16Å; A454-L458 PolarHBondContact O-N 3.04Å; A455-L458 PolarHBondContact O-N 3.01Å; L458-H460 VanDerWaalsContact C-N 3.34Å; L458-H460 PolarHBondContact O-N 3.04Å; L458-L461 PolarHBondContact O-N 3.26Å; L458-L462 HydrophobicContact CD1-CD1 4.13Å; L458-L462 HydrophobicContact CD1-CG 4.1Å; L458-L462 HydrophobicContact CG-CD1 3.84Å; L458-L462 HydrophobicContact CG-CG 4.3Å; L458-L462 WeakPolarHBondContact O-CB 3.47Å; L458-L462 WeakPolarHBondContact O-CD1 3.32Å; L458-L462 WeakPolarHBondContact O-CG 3.39Å; L458-L462 PolarHBondContact O-N 2.94Å; L458-W465 HydrophobicContact CD1-CZ3 4.27Å
459	C	88.1	Confident	87.8	Confident	42 Å²	42	46 Å²	46	28%	0.284	26%	0.261	S	S	.	.	H	α-helix	trans	-53.1	-48.8	173.2	-67.6	0	0	0	0	112.2	A455 L456 S463 L487	A455-C459 PolarHBondContact O-N 2.88Å; A455-C459 PolarHBondContact O-SG 3Å; L456-C459 WeakPolarHBondContact O-CB 3.26Å; L456-C459 PolarHBondContact O-N 3.21Å; C459-S463 PolarHBondContact O-N 3.19Å; C459-L487 WeakPolarHBondContact SG-CD2 3.42Å
460	H	88.6	Confident	88.1	Confident	89 Å²	89	46.6 Å²	46.6	41%	0.412	27%	0.266	S	S	.	.	H	α-helix	trans	-67.3	-40.6	179.7	-174.9	-60.2	0	0	0	112.3	L431 L456 T457 L458 S463	L431-H460 VanDerWaalsContact CD1-CE1 3.47Å; L431-H460 WeakPolarHBondContact CD1-CE1 3.37Å; L431-H460 WeakPolarHBondContact CD1-ND1 3.29Å; L456-H460 PolarHBondContact O-N 2.98Å; T457-H460 PolarHBondContact O-N 3.43Å; L458-H460 VanDerWaalsContact C-N 3.34Å; L458-H460 PolarHBondContact O-N 3.04Å; H460-S463 PolarHBondContact O-OG 2.87Å
461	L	89.9	Confident	88.5	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-64.1	-47.1	177.7	-70.1	175.1	0	0	0	110.4	L225 T226 A229 F231 L431 T457 L458 S463 S464 W465	L225-L461 HydrophobicContact CB-CD1 3.77Å; T226-L461 HydrophobicContact CG2-CD1 4.14Å; T226-L461 HydrophobicContact CG2-CD2 4.38Å; A229-L461 HydrophobicContact CB-CB 4.09Å; A229-L461 HydrophobicContact CB-CD1 4.11Å; A229-L461 HydrophobicContact CB-CD2 3.85Å; A229-L461 HydrophobicContact CB-CG 4.24Å; F231-L461 HydrophobicContact CD2-CD2 3.59Å; F231-L461 HydrophobicContact CE2-CD2 3.57Å; F231-L461 HydrophobicContact CG-CD2 4.5Å; F231-L461 HydrophobicContact CZ-CD2 4.45Å; L431-L461 HydrophobicContact CD1-CD2 4.35Å; T457-L461 HydrophobicContact CG2-CD1 3.9Å; T457-L461 HydrophobicContact CG2-CG 4.25Å; T457-L461 WeakPolarHBondContact O-CB 3.48Å; T457-L461 VanDerWaalsContact O-CG 3.28Å; T457-L461 WeakPolarHBondContact O-CG 3.48Å; T457-L461 PolarHBondContact O-N 3.49Å; L458-L461 PolarHBondContact O-N 3.26Å; L461-S463 VanDerWaalsContact C-N 3.27Å; L461-S463 PolarHBondContact O-N 2.9Å; L461-S464 CarbonylContact O-C 3.4Å; L461-S464 WeakPolarHBondContact O-CA 3.42Å; L461-S464 PolarHBondContact O-N 3.04Å; L461-S464 PolarHBondContact O-OG 3.28Å; L461-W465 HydrophobicContact CB-CE3 4.21Å; L461-W465 WeakPolarHBondContact O-CB 3.46Å; L461-W465 PolarHBondContact O-N 2.88Å
462	L	89.2	Confident	88.7	Confident	30 Å²	30	46 Å²	46	16%	0.157	26%	0.262	C	S	.	.	H	α-helix	trans	-55.3	-36.5	179.6	-73.7	167.7	0	0	0	113.4	L458 S464 W465 L468 L471 L487 L489	L458-L462 HydrophobicContact CD1-CD1 4.13Å; L458-L462 HydrophobicContact CD1-CG 4.1Å; L458-L462 HydrophobicContact CG-CD1 3.84Å; L458-L462 HydrophobicContact CG-CG 4.3Å; L458-L462 WeakPolarHBondContact O-CB 3.47Å; L458-L462 WeakPolarHBondContact O-CD1 3.32Å; L458-L462 WeakPolarHBondContact O-CG 3.39Å; L458-L462 PolarHBondContact O-N 2.94Å; L462-S464 PolarHBondContact O-N 2.96Å; L462-W465 HydrophobicContact CD2-CE3 4.35Å; L462-W465 PolarHBondContact O-N 2.92Å; L462-L468 HydrophobicContact CD2-CD2 3.34Å; L462-L471 HydrophobicContact CD1-CD2 4.2Å; L462-L471 HydrophobicContact CD2-CD2 4.27Å; L462-L487 HydrophobicContact CD1-CD2 4.2Å; L462-L489 HydrophobicContact CD1-CD2 3.63Å
463	S	84.2	Confident	88.9	Confident	101 Å²	101	43.6 Å²	43.6	71%	0.706	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-6.8	175.9	76.7	0	0	0	0	114.3	C459 H460 L461	C459-S463 PolarHBondContact O-N 3.19Å; H460-S463 PolarHBondContact O-OG 2.87Å; L461-S463 VanDerWaalsContact C-N 3.27Å; L461-S463 PolarHBondContact O-N 2.9Å
464	S	84.1	Confident	88.5	Confident	26 Å²	26	39.8 Å²	39.8	18%	0.182	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.4	-1.2	-177.6	67.8	0	0	0	0	114.5	F231 L461 L462 V466	F231-S464 WeakPolarHBondContact CZ-OG 3.49Å; L461-S464 CarbonylContact O-C 3.4Å; L461-S464 WeakPolarHBondContact O-CA 3.42Å; L461-S464 PolarHBondContact O-N 3.04Å; L461-S464 PolarHBondContact O-OG 3.28Å; L462-S464 PolarHBondContact O-N 2.96Å; S464-V466 VanDerWaalsContact C-N 3.34Å; S464-V466 PolarHBondContact O-N 3.28Å
465	W	89.7	Confident	87.7	Confident	12 Å²	12	48.2 Å²	48.2	5%	0.045	26%	0.263	C	S	.	.			trans	-88.2	66.4	-170.4	-161.6	-25.2	0	0	0	111.8	A229 I440 L443 L458 L461 L462 S467 L468	A229-W465 HydrophobicContact CB-CD2 3.65Å; A229-W465 HydrophobicContact CB-CE3 3.68Å; A229-W465 HydrophobicContact CB-CG 4.16Å; A229-W465 HydrophobicContact CB-CH2 4.23Å; A229-W465 HydrophobicContact CB-CZ2 4.25Å; A229-W465 HydrophobicContact CB-CZ3 3.97Å; I440-W465 HydrophobicContact CD1-CZ2 4.05Å; I440-W465 HydrophobicContact CG1-CZ2 3.64Å; I440-W465 PolarHBondContact O-NE1 2.99Å; I440-W465 VanDerWaalsContact O-NE1 3.09Å; L443-W465 HydrophobicContact CB-CH2 4.25Å; L443-W465 HydrophobicContact CD2-CH2 3.74Å; L443-W465 HydrophobicContact CD2-CZ3 3.99Å; L443-W465 HydrophobicContact CG-CH2 4.46Å; L458-W465 HydrophobicContact CD1-CZ3 4.27Å; L461-W465 HydrophobicContact CB-CE3 4.21Å; L461-W465 WeakPolarHBondContact O-CB 3.46Å; L461-W465 PolarHBondContact O-N 2.88Å; L462-W465 HydrophobicContact CD2-CE3 4.35Å; L462-W465 PolarHBondContact O-N 2.92Å; W465-S467 PolarHBondContact O-N 3.13Å; W465-L468 HydrophobicContact CB-CB 4.32Å; W465-L468 HydrophobicContact CD2-CB 4.18Å; W465-L468 HydrophobicContact CD2-CD1 4.3Å; W465-L468 HydrophobicContact CD2-CD2 4.1Å; W465-L468 HydrophobicContact CD2-CG 4.45Å; W465-L468 HydrophobicContact CE3-CD2 4.19Å; W465-L468 HydrophobicContact CG-CB 3.81Å; W465-L468 HydrophobicContact CG-CD2 4.43Å; W465-L468 HydrophobicContact CZ2-CD1 3.96Å; W465-L468 PolarHBondContact O-N 3.29Å
466	V	84.2	Confident	87	Confident	146 Å²	146	49.3 Å²	49.3	89%	0.885	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-25.8	-170.8	-175.7	0	0	0	0	114.4	S464	S464-V466 VanDerWaalsContact C-N 3.34Å; S464-V466 PolarHBondContact O-N 3.28Å
467	S	88.3	Confident	85.4	Confident	38 Å²	38	47.9 Å²	47.9	27%	0.266	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-5.8	-179.9	64.9	0	0	0	0	115.4	S439 I440 S441 W465 E469	S439-S467 VanDerWaalsContact CB-OG 3.28Å; S439-S467 WeakPolarHBondContact CB-OG 3.49Å; S439-S467 WeakPolarHBondContact OG-CB 3.47Å; S439-S467 PolarHBondContact OG-OG 3.28Å; I440-S467 PolarHBondContact O-OG 2.84Å; S441-S467 WeakPolarHBondContact CA-O 3.36Å; S441-S467 WeakPolarHBondContact CB-O 3.47Å; W465-S467 PolarHBondContact O-N 3.13Å; S467-E469 PolarHBondContact O-N 3.02Å
468	L	91.6	Very high	83.5	Confident	26 Å²	26	55.3 Å²	55.3	14%	0.136	31%	0.306	C	S	.	.			trans	-78.2	108.7	-171.9	-165.6	70.6	0	0	0	111.2	L443 L462 W465 S470 L471	L443-L468 HydrophobicContact CB-CD1 4.09Å; L462-L468 HydrophobicContact CD2-CD2 3.34Å; W465-L468 HydrophobicContact CB-CB 4.32Å; W465-L468 HydrophobicContact CD2-CB 4.18Å; W465-L468 HydrophobicContact CD2-CD1 4.3Å; W465-L468 HydrophobicContact CD2-CD2 4.1Å; W465-L468 HydrophobicContact CD2-CG 4.45Å; W465-L468 HydrophobicContact CE3-CD2 4.19Å; W465-L468 HydrophobicContact CG-CB 3.81Å; W465-L468 HydrophobicContact CG-CD2 4.43Å; W465-L468 HydrophobicContact CZ2-CD1 3.96Å; W465-L468 PolarHBondContact O-N 3.29Å; L468-S470 WeakPolarHBondContact CD1-O 3.26Å; L468-L471 HydrophobicContact CD2-CB 4.26Å
469	E	91.9	Very high	81.3	Confident	133 Å²	133	60.6 Å²	60.6	62%	0.621	33%	0.33	S	S	*	.			trans	-87.3	-34.5	177.2	-65.3	164.5	157.6	0	0	111.1	S441 S467 S492	S441-E469 WeakPolarHBondContact CB-OE2 3.46Å; S441-E469 PolarHBondContact O-N 2.85Å; S441-E469 PolarHBondContact OG-OE2 3.47Å; S467-E469 PolarHBondContact O-N 3.02Å; E469-S492 WeakPolarHBondContact O-CB 3.5Å; E469-S492 PolarHBondContact O-OG 3.43Å
470	S	91.8	Very high	78.9	Confident	37 Å²	37	64.9 Å²	64.9	26%	0.259	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	131.4	-175.3	179.8	0	0	0	0	113	S441 T442 L443 L468	S441-S470 PolarHBondContact O-N 3.19Å; T442-S470 WeakPolarHBondContact CA-O 3.21Å; L443-S470 PolarHBondContact N-O 3.46Å; L468-S470 WeakPolarHBondContact CD1-O 3.26Å
471	L	92.8	Very high	76.4	Confident	3 Å²	3	63.6 Å²	63.6	2%	0.016	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	123.5	165	179.6	68.7	0	0	0	109	L443 L462 L468 L473 L489 T493	L443-L471 HydrophobicContact CB-CD1 3.83Å; L443-L471 HydrophobicContact CD2-CD1 3.64Å; L443-L471 HydrophobicContact CG-CD1 3.77Å; L443-L471 WeakPolarHBondContact O-CA 3.43Å; L462-L471 HydrophobicContact CD1-CD2 4.2Å; L462-L471 HydrophobicContact CD2-CD2 4.27Å; L468-L471 HydrophobicContact CD2-CB 4.26Å; L471-L473 HydrophobicContact CD1-CD2 4.04Å; L471-L473 HydrophobicContact CD2-CD1 4.28Å; L471-L473 HydrophobicContact CD2-CD2 4.24Å; L471-L473 HydrophobicContact CD2-CG 4.21Å; L471-L473 HydrophobicContact CG-CD2 4.1Å; L471-L473 HydrophobicContact CG-CG 4.17Å; L471-L489 HydrophobicContact CD2-CD1 4.43Å; L471-L489 HydrophobicContact CD2-CD2 3.69Å; L471-T493 HydrophobicContact CB-CG2 3.86Å
472	T	90.6	Very high	74.1	Confident	31 Å²	31	64.9 Å²	64.9	19%	0.19	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	124.1	171.7	-59.1	0	0	0	0	110.1	L443 L445 F446	L443-T472 PolarHBondContact O-N 3.04Å; L445-T472 PolarHBondContact N-O 3.45Å; F446-T472 HydrophobicContact CE1-CG2 4.02Å; F446-T472 HydrophobicContact CE2-CG2 4.27Å; F446-T472 HydrophobicContact CZ-CG2 3.67Å
473	L	88.9	Confident	71.6	Confident	23 Å²	23	67.5 Å²	67.5	12%	0.12	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	130.6	172.7	-55.7	-179.3	0	0	0	108.8	L445 L471 L487	L445-L473 HydrophobicContact CB-CD2 3.92Å; L445-L473 HydrophobicContact CD1-CD2 3.68Å; L445-L473 HydrophobicContact CG-CD2 4.09Å; L471-L473 HydrophobicContact CD1-CD2 4.04Å; L471-L473 HydrophobicContact CD2-CD1 4.28Å; L471-L473 HydrophobicContact CD2-CD2 4.24Å; L471-L473 HydrophobicContact CD2-CG 4.21Å; L471-L473 HydrophobicContact CG-CD2 4.1Å; L471-L473 HydrophobicContact CG-CG 4.17Å; L473-L487 HydrophobicContact CD1-CD1 3.94Å
474	S	80.9	Confident	69.2	Low	17 Å²	17	66.3 Å²	66.3	12%	0.119	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	127.5	-176.9	-69.9	0	0	0	0	112.9	L445 F446 T447 N476	L445-S474 PolarHBondContact O-N 3.01Å; F446-S474 WeakPolarHBondContact CA-O 3.4Å; T447-S474 PolarHBondContact N-O 3.41Å; S474-N476 PolarHBondContact N-ND2 3.42Å; S474-N476 PolarHBondContact O-N 3.15Å; S474-N476 PolarHBondContact O-OD1 3.24Å; S474-N476 VanDerWaalsContact O-OD1 3.05Å
475	Y	70.1	Confident	67.1	Low	179 Å²	179	67.5 Å²	67.5	70%	0.702	41%	0.41	S	S	*	.	S	Bend	trans	56.6	29.8	178.5	-50.6	-75.3	0	0	0	114.7	T447 G477	T447-Y475 HydrophobicContact CG2-CG 4.4Å; Y475-G477 PolarHBondContact O-N 3.46Å
476	N	72.9	Confident	64.7	Low	25 Å²	25	70.4 Å²	70.4	13%	0.134	44%	0.443	C	S	.	.			trans	-85.5	40.3	-171.9	-69.2	-24.6	0	0	0	114.1	L445 T447 V448 P449 S474	L445-N476 WeakPolarHBondContact CB-ND2 3.38Å; L445-N476 PolarHBondContact O-ND2 3.06Å; L445-N476 PolarHBondContact O-OD1 3.26Å; T447-N476 PolarHBondContact N-OD1 3.26Å; T447-N476 VanDerWaalsContact N-OD1 3.1Å; V448-N476 PolarHBondContact N-OD1 3.01Å; V448-N476 WeakPolarHBondContact O-CA 3.34Å; V448-N476 WeakPolarHBondContact O-CB 3.33Å; V448-N476 VanDerWaalsContact O-CG 3.26Å; V448-N476 PolarHBondContact O-OD1 2.79Å; P449-N476 WeakPolarHBondContact CA-O 3.27Å; S474-N476 PolarHBondContact N-ND2 3.42Å; S474-N476 PolarHBondContact O-N 3.15Å; S474-N476 PolarHBondContact O-OD1 3.24Å; S474-N476 VanDerWaalsContact O-OD1 3.05Å
477	G	56.1	Low	62.7	Low	42 Å²	42	66 Å²	66	43%	0.433	41%	0.414	S	S	.	.			trans	30.1	90	168.3	0	0	0	0	0	117.1	Y475 H479	Y475-G477 PolarHBondContact O-N 3.46Å; G477-H479 PolarHBondContact O-N 3.32Å
478	E	49.7	Very low	60.2	Low	162 Å²	162	75.9 Å²	75.9	76%	0.757	45%	0.446	S	S	*	.			trans	-64.8	117.6	177.8	-68	176.5	-166.1	0	0	111.9
479	H	43.7	Very low	57.7	Low	111 Å²	111	76.4 Å²	76.4	51%	0.514	45%	0.449	S	S	.	.			trans	-73.6	140.6	160	-74.9	-70.5	0	0	0	109.2	G477 G481 V482	G477-H479 PolarHBondContact O-N 3.32Å; H479-G481 PolarHBondContact O-N 3.23Å; H479-V482 HydrophobicContact CB-CG2 4.28Å; H479-V482 PolarHBondContact O-N 3.31Å
480	P	37.4	Very low	55	Low	131 Å²	131	73.3 Å²	73.3	85%	0.851	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-2.4	-171	24.2	-34.5	0	0	0	115.7
481	G	35.8	Very low	52.1	Low	63 Å²	63	78.2 Å²	78.2	65%	0.649	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-3.7	169.2	0	0	0	0	0	115.2	H479	H479-G481 PolarHBondContact O-N 3.23Å
482	V	42.9	Very low	49.4	Very low	26 Å²	26	81.3 Å²	81.3	16%	0.158	50%	0.496	C	S	.	.	S	Bend	trans	-99.6	-15.3	-173.8	-172.6	0	0	0	0	112.7	H479 G484 I485	H479-V482 HydrophobicContact CB-CG2 4.28Å; H479-V482 PolarHBondContact O-N 3.31Å; V482-G484 PolarHBondContact O-N 3.05Å; V482-I485 PolarHBondContact O-N 3.44Å
483	A	37.2	Very low	46.8	Very low	85 Å²	85	81.7 Å²	81.7	70%	0.702	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-12.3	-176.9	0	0	0	0	0	115.8
484	G	33.4	Very low	44.4	Very low	77 Å²	77	84.3 Å²	84.3	79%	0.794	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	-10.4	172.7	0	0	0	0	0	115.4	V482 G486	V482-G484 PolarHBondContact O-N 3.05Å; G484-G486 PolarHBondContact O-N 2.76Å; G484-G486 VanDerWaalsContact O-N 3.15Å
485	I	40.3	Very low	42.2	Very low	51 Å²	51	87 Å²	87	26%	0.262	54%	0.537	S	S	.	.			trans	-90.7	76.9	-177.8	-50.9	-177.7	0	0	0	109.3	T452 L456 V482 L487	T452-I485 HydrophobicContact CG2-CD1 4.13Å; L456-I485 HydrophobicContact CD2-CD1 4.3Å; L456-I485 HydrophobicContact CG-CD1 4.49Å; V482-I485 PolarHBondContact O-N 3.44Å; I485-L487 PolarHBondContact O-N 3.22Å
486	G	37.3	Very low	40.3	Very low	72 Å²	72	83.2 Å²	83.2	74%	0.742	53%	0.532	S	S	*	.			trans	-61.8	99.1	172.2	0	0	0	0	0	111.4	G484 R488	G484-G486 PolarHBondContact O-N 2.76Å; G484-G486 VanDerWaalsContact O-N 3.15Å; G486-R488 PolarHBondContact O-N 3.36Å
487	L	42.9	Very low	38.2	Very low	53 Å²	53	86.8 Å²	86.8	28%	0.277	56%	0.557	S	S	.	*			trans	-59.9	95	171	-84.5	160.3	0	0	0	109.5	C459 L462 L473 I485 L489	C459-L487 WeakPolarHBondContact SG-CD2 3.42Å; L462-L487 HydrophobicContact CD1-CD2 4.2Å; L473-L487 HydrophobicContact CD1-CD1 3.94Å; I485-L487 PolarHBondContact O-N 3.22Å; L487-L489 VanDerWaalsContact C-N 3.33Å; L487-L489 HydrophobicContact CB-CD1 4.42Å; L487-L489 HydrophobicContact CB-CD2 4.28Å; L487-L489 HydrophobicContact CB-CG 4.1Å; L487-L489 HydrophobicContact CD2-CD2 4.35Å; L487-L489 WeakPolarHBondContact O-CG 3.38Å; L487-L489 PolarHBondContact O-N 3.13Å
488	R	35.6	Very low	37.1	Very low	247 Å²	247	91.9 Å²	91.9	93%	0.932	57%	0.574	S	S	*	*			trans	-76.7	86.7	173.3	-175.6	177.3	-75	-176.4	-3.4	109.1	G486	G486-R488 PolarHBondContact O-N 3.36Å
489	L	40.3	Very low	36	Very low	36 Å²	36	88.9 Å²	88.9	19%	0.188	57%	0.571	C	S	.	*			trans	-82.5	152.7	-174.9	-64.3	170.6	0	0	0	112.6	L462 L471 L487 T493	L462-L489 HydrophobicContact CD1-CD2 3.63Å; L471-L489 HydrophobicContact CD2-CD1 4.43Å; L471-L489 HydrophobicContact CD2-CD2 3.69Å; L487-L489 VanDerWaalsContact C-N 3.33Å; L487-L489 HydrophobicContact CB-CD1 4.42Å; L487-L489 HydrophobicContact CB-CD2 4.28Å; L487-L489 HydrophobicContact CB-CG 4.1Å; L487-L489 HydrophobicContact CD2-CD2 4.35Å; L487-L489 WeakPolarHBondContact O-CG 3.38Å; L487-L489 PolarHBondContact O-N 3.13Å; L489-T493 HydrophobicContact CB-CG2 3.72Å; L489-T493 WeakPolarHBondContact CB-OG1 3.47Å; L489-T493 HydrophobicContact CD1-CG2 3.94Å; L489-T493 WeakPolarHBondContact CD1-OG1 3.41Å; L489-T493 HydrophobicContact CD2-CG2 4.34Å; L489-T493 HydrophobicContact CG-CG2 4.18Å
490	P	34.5	Very low	35.1	Very low	68 Å²	68	95.2 Å²	95.2	44%	0.442	59%	0.591	S	S	.	*			trans	-70.4	160.7	170.5	31	-34.9	0	0	0	111.9	S492 T493	P490-S492 PolarHBondContact O-N 2.88Å; P490-T493 PolarHBondContact O-N 2.97Å; P490-T493 PolarHBondContact O-OG1 3.45Å
491	S	31.2	Very low	34.5	Very low	140 Å²	140	98 Å²	98	98%	0.979	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	16.7	-157.4	-40.6	0	0	0	0	118.7
492	S	35.3	Very low	34.1	Very low	68 Å²	68	102.2 Å²	102.2	48%	0.476	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-118.4	2.3	179.7	61	0	0	0	0	114.5	E469 P490	E469-S492 WeakPolarHBondContact O-CB 3.5Å; E469-S492 PolarHBondContact O-OG 3.43Å; P490-S492 PolarHBondContact O-N 2.88Å
493	T	37.3	Very low	33.2	Very low	40 Å²	40	104.4 Å²	104.4	25%	0.245	63%	0.633	C	S	.	*			trans	-85.5	126.3	-172.5	57.3	0	0	0	0	114.1	L471 L489 P490	L471-T493 HydrophobicContact CB-CG2 3.86Å; L489-T493 HydrophobicContact CB-CG2 3.72Å; L489-T493 WeakPolarHBondContact CB-OG1 3.47Å; L489-T493 HydrophobicContact CD1-CG2 3.94Å; L489-T493 WeakPolarHBondContact CD1-OG1 3.41Å; L489-T493 HydrophobicContact CD2-CG2 4.34Å; L489-T493 HydrophobicContact CG-CG2 4.18Å; P490-T493 PolarHBondContact O-N 2.97Å; P490-T493 PolarHBondContact O-OG1 3.45Å
494	S	38.6	Very low	32.9	Very low	77 Å²	77	104.1 Å²	104.1	54%	0.538	64%	0.638	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-92.4	113.3	168.8	-172.7	0	0	0	0	110.4
495	C	32.7	Very low	32.5	Very low	74 Å²	74	104.2 Å²	104.2	50%	0.5	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-106.8	119.5	166.6	-65.6	0	0	0	0	108.2	P497	C495-P497 WeakPolarHBondContact O-CD 3.39Å
496	V	31.8	Very low	31.8	Very low	99 Å²	99	109.3 Å²	109.3	60%	0.6	66%	0.659	S	S	*	*			trans	-89.7	113.5	174.5	-179.2	0	0	0	0	108.4
497	P	28.8	Very low	31.3	Very low	100 Å²	100	116.8 Å²	116.8	65%	0.649	67%	0.665	S	S	*	*			trans	-70.7	153.9	-178.1	29.3	-35	0	0	0	112.1	C495 S499	C495-P497 WeakPolarHBondContact O-CD 3.39Å; P497-S499 PolarHBondContact O-N 3.44Å
498	N	33.1	Very low	30.4	Very low	149 Å²	149	117.2 Å²	117.2	80%	0.797	68%	0.682	S	S	*	*			trans	-84.2	69.4	-168.9	-167.9	28.9	0	0	0	113.2	R500	N498-R500 PolarHBondContact O-N 3.04Å
499	S	25.3	Very low	30	Very low	100 Å²	100	115.7 Å²	115.7	70%	0.699	68%	0.678	S	S	*	*			trans	-94.5	91.2	-176.1	-61.9	0	0	0	0	113.9	P497	P497-S499 PolarHBondContact O-N 3.44Å
500	R	25.3	Very low	29.3	Very low	244 Å²	244	121.9 Å²	121.9	92%	0.921	71%	0.712	S	S	*	*			trans	-166.6	118.7	133.6	-112	168.1	-173.6	173.1	2.9	113.5	N498	N498-R500 PolarHBondContact O-N 3.04Å
501	E	25.3	Very low	29	Very low	190 Å²	190	126 Å²	126	89%	0.888	73%	0.725	S	S	*	*			trans	-70.2	173.8	162.7	-65	-174.4	113.8	0	0	112	G503	E501-G503 PolarHBondContact O-N 3.04Å; E501-G503 VanDerWaalsContact O-N 3.13Å
502	V	27.8	Very low	28.9	Very low	150 Å²	150	128.6 Å²	128.6	91%	0.909	72%	0.721	S	S	*	*			trans	-71.1	103.4	-173.1	-179.6	0	0	0	0	112
503	G	23.1	Very low	28.6	Very low	73 Å²	73	130.7 Å²	130.7	75%	0.753	73%	0.731	S	S	*	*			trans	-99.1	111.2	155.9	0	0	0	0	0	109.3	E501	E501-G503 PolarHBondContact O-N 3.04Å; E501-G503 VanDerWaalsContact O-N 3.13Å
504	G	30.5	Very low	28.1	Very low	78 Å²	78	139.9 Å²	139.9	80%	0.804	76%	0.761	S	S	*	*			trans	-65.8	132.9	-165.7	0	0	0	0	0	115.5
505	A	24.4	Very low	27.7	Very low	79 Å²	79	144.5 Å²	144.5	65%	0.653	77%	0.774	S	S	*	*			trans	-134	124.6	163.5	0	0	0	0	0	109.1	W507	A505-W507 PolarHBondContact O-N 3.17Å
506	N	26.3	Very low	27.7	Very low	159 Å²	159	150.2 Å²	150.2	85%	0.85	79%	0.794	S	S	*	*			trans	-77.5	112.3	-171.6	-172.9	24.4	0	0	0	111.4
507	W	26.8	Very low	27.5	Very low	229 Å²	229	149.2 Å²	149.2	87%	0.867	80%	0.804	S	S	*	*			trans	-104.3	102	167.8	-71.4	96.9	0	0	0	108.8	A505	A505-W507 PolarHBondContact O-N 3.17Å
508	G	25.1	Very low	27.6	Very low	62 Å²	62	151.9 Å²	151.9	64%	0.639	81%	0.812	S	S	*	*			trans	-64.2	145.4	176.2	0	0	0	0	0	111.7	D510	G508-D510 PolarHBondContact O-N 3.23Å
509	Y	25.6	Very low	27.4	Very low	214 Å²	214	155.2 Å²	155.2	84%	0.839	82%	0.815	S	S	*	*			trans	-67.1	124.9	161.1	-86.5	-115.9	0	0	0	108.6
510	D	26.3	Very low	27.6	Very low	167 Å²	167	155 Å²	155	89%	0.893	82%	0.819	S	S	*	*			trans	-125.8	117.3	150	-96.8	-44.6	0	0	0	107.8	G508	G508-D510 PolarHBondContact O-N 3.23Å
511	Q	28.5	Very low	27.9	Very low	154 Å²	154	152.4 Å²	152.4	72%	0.72	84%	0.838	S	S	*	*			trans	-123.9	75.8	-174	-175.1	-169.8	-14.9	0	0	109.1
512	E	28.1	Very low	28	Very low	194 Å²	194	150.6 Å²	150.6	91%	0.907	84%	0.836	S	S	*	*			trans	-96	102.3	165.5	-77	-156.3	137	0	0	110.8
513	V	30.1	Very low	28	Very low	112 Å²	112	150.6 Å²	150.6	68%	0.679	83%	0.832	S	S	*	*			trans	-65.4	130.6	162.3	176.2	0	0	0	0	108	E515	V513-E515 HydrophobicContact CG1-CG 4.15Å
514	R	27.5	Very low	28.3	Very low	234 Å²	234	154.9 Å²	154.9	88%	0.883	84%	0.836	S	S	*	*			trans	-121.1	106.1	165.7	-145.6	-179.2	85.9	159.1	6.1	110.3
515	E	30	Very low	28.2	Very low	173 Å²	173	159.4 Å²	159.4	81%	0.808	84%	0.838	S	S	*	*			trans	-68	151	178.2	-58.6	175.1	122.3	0	0	111.3	V513	V513-E515 HydrophobicContact CG1-CG 4.15Å
516	E	31.8	Very low	28.4	Very low	194 Å²	194	164.4 Å²	164.4	91%	0.907	85%	0.85	S	S	*	*			trans	-108.3	130.3	159.2	-68.7	-159.6	149	0	0	109
517	G	27.6	Very low	28.6	Very low	79 Å²	79	164.8 Å²	164.8	81%	0.814	85%	0.85	S	S	*	*			trans	-174.8	89.9	-178.4	0	0	0	0	0	112
518	L	30.9	Very low	28.7	Very low	156 Å²	156	160.2 Å²	160.2	82%	0.817	85%	0.849	S	S	*	*			trans	-102.6	128.4	177.8	-89.2	162.3	0	0	0	111.3
519	Y	30.2	Very low	29	Very low	218 Å²	218	167.8 Å²	167.8	86%	0.855	87%	0.865	S	S	*	*			trans	57.9	117.1	162.2	-79.2	-86.1	0	0	0	120.4
520	A	29.3	Very low	29.3	Very low	95 Å²	95	163.9 Å²	163.9	79%	0.785	87%	0.867	S	S	*	*			trans	-154.2	134.2	132.9	0	0	0	0	0	110.6
521	S	30.9	Very low	29.5	Very low	191 Å²	191	163.6 Å²	163.6	100%	1.336	87%	0.865	S	S	*	*			trans	68.5	0	-178.9	-47.2	0	0	0	0	116.1

Retrieved 521 of 521 residues in 769.7 ms (Link to these results)

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