A0A5K4EFY9_SCHMA Loading...

PUA domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4EFY9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 454 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	41.2	Very low	55.9	Low	236 Å²	236	157.2 Å²	157.2	100%	1.163	80%	0.798	S	S	*	*				0	98.5	0	-73.5	178.2	163.1	0	0	109.7	K3	M1-K3 PolarHBondContact O-N 3.33Å; M1-K3 VanDerWaalsContact O-N 3.09Å
2	K	41.6	Very low	58.2	Low	199 Å²	199	147.3 Å²	147.3	87%	0.865	77%	0.765	S	S	*	*			trans	-65.4	108.6	156.1	-81.3	-177.8	177.1	176.1	0	104.4	H4	K2-H4 VanDerWaalsContact C-N 3.31Å; K2-H4 PolarHBondContact O-N 3.33Å
3	K	43.5	Very low	60	Low	199 Å²	199	140.6 Å²	140.6	87%	0.865	75%	0.745	S	S	*	*			trans	-58.2	99.9	174.7	-78.8	-178.3	174.7	179.8	0	106.4	M1 K5	M1-K3 PolarHBondContact O-N 3.33Å; M1-K3 VanDerWaalsContact O-N 3.09Å; K3-K5 PolarHBondContact O-N 3.37Å
4	H	50.7	Low	61.6	Low	167 Å²	167	133.9 Å²	133.9	77%	0.773	71%	0.709	S	S	*	*			trans	-57.4	111.8	166	-88.5	-93	0	0	0	105.1	K2 V6	K2-H4 VanDerWaalsContact C-N 3.31Å; K2-H4 PolarHBondContact O-N 3.33Å; H4-V6 VanDerWaalsContact C-N 3.3Å; H4-V6 PolarHBondContact O-N 3.15Å
5	K	51.7	Low	63.1	Low	196 Å²	196	133.6 Å²	133.6	85%	0.852	70%	0.702	S	S	*	*			trans	-58	102.5	170.7	-86.9	-177.5	172.6	-179.9	0	105.3	K3 R7	K3-K5 PolarHBondContact O-N 3.37Å; K5-R7 PolarHBondContact O-N 3.38Å
6	V	55.6	Low	64.2	Low	129 Å²	129	130.8 Å²	130.8	78%	0.782	70%	0.704	S	S	*	*			trans	-55.7	107	173.6	179.8	0	0	0	0	105.4	H4 A8	H4-V6 VanDerWaalsContact C-N 3.3Å; H4-V6 PolarHBondContact O-N 3.15Å; V6-A8 PolarHBondContact O-N 3.37Å
7	R	54.2	Low	65.4	Low	220 Å²	220	128.1 Å²	128.1	83%	0.83	70%	0.704	S	S	*	*			trans	-65.3	119.6	177.4	-78.6	-179.2	170.1	178.8	-3.3	105.9	K5 G9	K5-R7 PolarHBondContact O-N 3.38Å; R7-G9 VanDerWaalsContact C-N 3.3Å; R7-G9 PolarHBondContact O-N 3.36Å
8	A	55.8	Low	66.3	Low	114 Å²	114	126.9 Å²	126.9	94%	0.942	69%	0.692	S	S	*	*			trans	-61.5	96.1	173.8	0	0	0	0	0	107.9	V6	V6-A8 PolarHBondContact O-N 3.37Å
9	G	64.9	Low	67	Low	41 Å²	41	125.9 Å²	125.9	42%	0.423	70%	0.696	S	S	.	*			trans	-144.3	152.6	-175.7	0	0	0	0	0	109.8	R7 V11 I14	R7-G9 VanDerWaalsContact C-N 3.3Å; R7-G9 PolarHBondContact O-N 3.36Å; G9-V11 PolarHBondContact O-N 3.18Å; G9-I14 WeakPolarHBondContact O-CD1 3.43Å
10	N	76.7	Confident	67.6	Low	132 Å²	132	126.4 Å²	126.4	71%	0.706	69%	0.69	S	S	*	*			trans	-50	129.6	175.5	-176.2	-10.9	0	0	0	109.6	G12 A13 I14	N10-G12 PolarHBondContact O-N 3.2Å; N10-G12 PolarHBondContact OD1-N 2.95Å; N10-A13 WeakPolarHBondContact O-CB 3.41Å; N10-A13 PolarHBondContact O-N 3.46Å; N10-I14 PolarHBondContact O-N 3.26Å
11	V	79.6	Confident	68.3	Low	96 Å²	96	123.2 Å²	123.2	58%	0.582	68%	0.681	S	S	*	*	H	α-helix	trans	-50.7	-37.5	-174.8	179.1	0	0	0	0	111.4	G9 A13 I14 Q15	G9-V11 PolarHBondContact O-N 3.18Å; V11-A13 VanDerWaalsContact C-N 3.32Å; V11-A13 PolarHBondContact O-N 2.99Å; V11-I14 PolarHBondContact O-N 3.05Å; V11-Q15 HydrophobicContact CG1-CG 4.3Å; V11-Q15 WeakPolarHBondContact O-CB 3.46Å; V11-Q15 WeakPolarHBondContact O-CG 3.33Å; V11-Q15 PolarHBondContact O-N 3.45Å
12	G	82.4	Confident	70	Confident	39 Å²	39	119.1 Å²	119.1	40%	0.402	67%	0.669	S	S	.	*	H	α-helix	trans	-62.6	-33.7	177.2	0	0	0	0	0	114.3	N10 A16	N10-G12 PolarHBondContact O-N 3.2Å; N10-G12 PolarHBondContact OD1-N 2.95Å; G12-A16 PolarHBondContact O-N 3.22Å; G12-A16 VanDerWaalsContact O-N 3.08Å
13	A	82.7	Confident	71.8	Confident	60 Å²	60	116.4 Å²	116.4	50%	0.496	66%	0.663	S	S	.	*	H	α-helix	trans	-74	-36.3	176.6	0	0	0	0	0	111.9	N10 V11 Q15 A16 A17	N10-A13 WeakPolarHBondContact O-CB 3.41Å; N10-A13 PolarHBondContact O-N 3.46Å; V11-A13 VanDerWaalsContact C-N 3.32Å; V11-A13 PolarHBondContact O-N 2.99Å; A13-Q15 VanDerWaalsContact C-N 3.35Å; A13-A16 PolarHBondContact O-N 2.94Å; A13-A17 VanDerWaalsContact O-CB 3.25Å; A13-A17 WeakPolarHBondContact O-CB 3.34Å; A13-A17 PolarHBondContact O-N 3.01Å
14	I	81.9	Confident	73.4	Confident	47 Å²	47	112.1 Å²	112.1	24%	0.241	66%	0.658	C	S	.	*	H	α-helix	trans	-67.1	-41.8	175	-53.9	177.3	0	0	0	109.4	G9 N10 V11 A16 A17 E18 F20	G9-I14 WeakPolarHBondContact O-CD1 3.43Å; N10-I14 PolarHBondContact O-N 3.26Å; V11-I14 PolarHBondContact O-N 3.05Å; I14-A16 VanDerWaalsContact C-N 3.32Å; I14-A16 PolarHBondContact O-N 3.45Å; I14-A17 PolarHBondContact O-N 3.02Å; I14-E18 HydrophobicContact CG2-CG 4.38Å; I14-E18 PolarHBondContact O-N 3.36Å; I14-F20 HydrophobicContact CG2-CZ 4.1Å
15	Q	84.2	Confident	74.7	Confident	129 Å²	129	111.8 Å²	111.8	60%	0.603	66%	0.656	S	S	*	*	H	α-helix	trans	-60.1	-37.5	175.3	-77.3	178.5	-18.2	0	0	113.4	V11 A13	V11-Q15 HydrophobicContact CG1-CG 4.3Å; V11-Q15 WeakPolarHBondContact O-CB 3.46Å; V11-Q15 WeakPolarHBondContact O-CG 3.33Å; V11-Q15 PolarHBondContact O-N 3.45Å; A13-Q15 VanDerWaalsContact C-N 3.35Å
16	A	81	Confident	75.8	Confident	89 Å²	89	110.5 Å²	110.5	74%	0.736	66%	0.659	S	S	*	*	H	α-helix	trans	-78.3	-28.6	177.2	0	0	0	0	0	113.5	G12 A13 I14	G12-A16 PolarHBondContact O-N 3.22Å; G12-A16 VanDerWaalsContact O-N 3.08Å; A13-A16 PolarHBondContact O-N 2.94Å; I14-A16 VanDerWaalsContact C-N 3.32Å; I14-A16 PolarHBondContact O-N 3.45Å
17	A	83.8	Confident	76.7	Confident	85 Å²	85	112.4 Å²	112.4	70%	0.702	66%	0.657	S	S	*	*	H	α-helix	trans	-89.4	-33.3	-174.4	0	0	0	0	0	113.8	A13 I14	A13-A17 VanDerWaalsContact O-CB 3.25Å; A13-A17 WeakPolarHBondContact O-CB 3.34Å; A13-A17 PolarHBondContact O-N 3.01Å; I14-A17 PolarHBondContact O-N 3.02Å
18	E	81.1	Confident	77.5	Confident	107 Å²	107	110.7 Å²	110.7	50%	0.5	66%	0.655	S	S	.	*			trans	-100.3	134.5	-177.5	-66	-174.4	176	0	0	110.3	I14 F20	I14-E18 HydrophobicContact CG2-CG 4.38Å; I14-E18 PolarHBondContact O-N 3.36Å; E18-F20 HydrophobicContact CB-CD2 4.08Å; E18-F20 HydrophobicContact CB-CE1 4.31Å; E18-F20 HydrophobicContact CB-CE2 3.59Å; E18-F20 HydrophobicContact CB-CZ 3.75Å; E18-F20 WeakPolarHBondContact O-CD2 3.33Å; E18-F20 WeakPolarHBondContact O-CE2 3.2Å; E18-F20 PolarHBondContact O-N 3.16Å
19	S	81.2	Confident	78.1	Confident	108 Å²	108	111.4 Å²	111.4	76%	0.755	65%	0.651	S	S	*	*			trans	-75.2	-11.4	179.8	59.5	0	0	0	0	113.5	A21	S19-A21 PolarHBondContact O-N 3.3Å
20	F	79.1	Confident	78.4	Confident	134 Å²	134	115.7 Å²	115.7	59%	0.588	67%	0.668	S	S	*	*			trans	42.5	31.6	-171.7	-59	-86.9	0	0	0	113.4	I14 E18	I14-F20 HydrophobicContact CG2-CZ 4.1Å; E18-F20 HydrophobicContact CB-CD2 4.08Å; E18-F20 HydrophobicContact CB-CE1 4.31Å; E18-F20 HydrophobicContact CB-CE2 3.59Å; E18-F20 HydrophobicContact CB-CZ 3.75Å; E18-F20 WeakPolarHBondContact O-CD2 3.33Å; E18-F20 WeakPolarHBondContact O-CE2 3.2Å; E18-F20 PolarHBondContact O-N 3.16Å
21	A	81.5	Confident	78.4	Confident	61 Å²	61	115 Å²	115	50%	0.504	66%	0.664	S	S	.	*			trans	-86.8	131.3	180	0	0	0	0	0	109.5	S19 I23	S19-A21 PolarHBondContact O-N 3.3Å; A21-I23 PolarHBondContact O-N 3.17Å; A21-I23 VanDerWaalsContact O-N 3.1Å
22	V	76.5	Confident	78.5	Confident	150 Å²	150	115.4 Å²	115.4	91%	0.909	66%	0.663	S	S	*	*			trans	-68.7	106.8	168.7	-179.5	0	0	0	0	107.3
23	I	79.8	Confident	78.6	Confident	141 Å²	141	113.7 Å²	113.7	72%	0.723	65%	0.645	S	S	*	*	P	Polyproline II helix	trans	-75.3	136.9	178	-52	174.5	0	0	0	108	A21 E25	A21-I23 PolarHBondContact O-N 3.17Å; A21-I23 VanDerWaalsContact O-N 3.1Å; I23-E25 PolarHBondContact O-N 3.19Å
24	S	76.1	Confident	78.9	Confident	109 Å²	109	112 Å²	112	76%	0.762	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-63.8	121.8	172.2	-175.8	0	0	0	0	109.4
25	E	78.2	Confident	79.1	Confident	160 Å²	160	117.6 Å²	117.6	75%	0.748	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-96.6	127.5	170.8	-67.7	-173.6	171.8	0	0	109.1	I23 K27	I23-E25 PolarHBondContact O-N 3.19Å; E25-K27 PolarHBondContact O-N 3.37Å; E25-K27 VanDerWaalsContact O-N 3.17Å
26	D	76.3	Confident	79.4	Confident	169 Å²	169	116.5 Å²	116.5	90%	0.904	65%	0.645	S	S	*	*	S	Bend	trans	-62.3	-23	176.3	-71.9	-28.4	0	0	0	112.5	K28	D26-K28 PolarHBondContact O-N 3.44Å
27	K	73	Confident	79.8	Confident	169 Å²	169	114.8 Å²	114.8	74%	0.735	63%	0.626	S	S	*	*	S	Bend	trans	-86.9	102	-175.6	-159.3	174.2	-173.5	178.1	0	110.2	E25 P29	E25-K27 PolarHBondContact O-N 3.37Å; E25-K27 VanDerWaalsContact O-N 3.17Å; K27-P29 WeakPolarHBondContact O-CD 3.33Å
28	K	71.6	Confident	80.3	Confident	184 Å²	184	111.9 Å²	111.9	80%	0.8	60%	0.599	S	S	*	*			trans	-58.7	124	167.6	-66.3	-179.5	-177.1	178.2	0	109	D26 T30	D26-K28 PolarHBondContact O-N 3.44Å; K28-T30 PolarHBondContact O-N 2.85Å; K28-T30 VanDerWaalsContact O-N 3.09Å
29	P	67.9	Low	81	Confident	130 Å²	130	106.9 Å²	106.9	84%	0.844	58%	0.576	S	S	*	*			trans	-63.3	116.5	174.5	24.4	-31.3	0	0	0	108.7	K27	K27-P29 WeakPolarHBondContact O-CD 3.33Å
30	T	72.3	Confident	81.6	Confident	130 Å²	130	102.6 Å²	102.6	80%	0.798	54%	0.544	S	S	*	.			trans	-85.7	116	172.5	39.9	0	0	0	0	108.1	K28 D32	K28-T30 PolarHBondContact O-N 2.85Å; K28-T30 VanDerWaalsContact O-N 3.09Å; T30-D32 PolarHBondContact O-N 3.41Å
31	L	76.7	Confident	82.2	Confident	118 Å²	118	100.8 Å²	100.8	62%	0.618	54%	0.536	S	S	*	.			trans	-67.1	107	176.2	-174.8	72.3	0	0	0	108.8	C33 W36	L31-C33 VanDerWaalsContact CD2-SG 3.51Å; L31-C33 PolarHBondContact O-N 2.91Å; L31-W36 HydrophobicContact CD2-CH2 4.08Å; L31-W36 HydrophobicContact CD2-CZ2 4.13Å
32	D	81.1	Confident	82.8	Confident	105 Å²	105	100.4 Å²	100.4	56%	0.561	53%	0.526	S	S	*	.			trans	-78.5	100.4	174.4	-176.9	11.9	0	0	0	110.4	T30 S34 H44	T30-D32 PolarHBondContact O-N 3.41Å; D32-S34 VanDerWaalsContact CG-OG 3.32Å; D32-S34 WeakPolarHBondContact OD1-CB 3.19Å; D32-S34 PolarHBondContact OD1-N 3.44Å; D32-S34 PolarHBondContact OD1-OG 3.08Å; D32-S34 PolarHBondContact OD2-OG 3.13Å; D32-H44 IonicContact OD1-CE1 3.53Å
33	C	85.4	Confident	83.4	Confident	3 Å²	3	93.8 Å²	93.8	2%	0.02	49%	0.485	C	S	.	.			trans	-95.4	16.5	173.1	-46.2	0	0	0	0	112.8	L31 Q35 W36 N42 H44	L31-C33 VanDerWaalsContact CD2-SG 3.51Å; L31-C33 PolarHBondContact O-N 2.91Å; C33-Q35 VanDerWaalsContact C-N 3.25Å; C33-Q35 PolarHBondContact O-N 3.08Å; C33-W36 HydrophobicContact CB-CB 4.38Å; C33-W36 HydrophobicContact CB-CD2 3.66Å; C33-W36 HydrophobicContact CB-CE3 3.97Å; C33-W36 HydrophobicContact CB-CG 3.82Å; C33-W36 WeakPolarHBondContact O-CB 3.46Å; C33-W36 PolarHBondContact O-N 3.37Å; C33-N42 PolarHBondContact O-N 3.31Å; C33-H44 WeakPolarHBondContact CB-ND1 3.37Å; C33-H44 PolarHBondContact N-ND1 3.44Å
34	S	87.4	Confident	83.8	Confident	25 Å²	25	90.6 Å²	90.6	18%	0.175	47%	0.467	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-28.6	-172.9	64.7	0	0	0	0	114	D32 K41 N42	D32-S34 VanDerWaalsContact CG-OG 3.32Å; D32-S34 WeakPolarHBondContact OD1-CB 3.19Å; D32-S34 PolarHBondContact OD1-N 3.44Å; D32-S34 PolarHBondContact OD1-OG 3.08Å; D32-S34 PolarHBondContact OD2-OG 3.13Å; S34-K41 WeakPolarHBondContact O-CE 3.33Å; S34-K41 VanDerWaalsContact O-CG 3.22Å; S34-K41 WeakPolarHBondContact O-CG 3.35Å; S34-N42 VanDerWaalsContact CA-OD1 3.27Å; S34-N42 WeakPolarHBondContact CA-OD1 3.47Å
35	Q	86.8	Confident	84.5	Confident	163 Å²	163	90.2 Å²	90.2	76%	0.762	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	4.9	179.6	-57.7	-56.1	-33.6	0	0	113.5	C33	C33-Q35 VanDerWaalsContact C-N 3.25Å; C33-Q35 PolarHBondContact O-N 3.08Å
36	W	90.5	Very high	85.2	Confident	106 Å²	106	83 Å²	83	40%	0.402	42%	0.422	S	S	.	.			trans	-65	147.3	178.1	-74.9	19.7	0	0	0	110.8	L31 C33 L40 K41	L31-W36 HydrophobicContact CD2-CH2 4.08Å; L31-W36 HydrophobicContact CD2-CZ2 4.13Å; C33-W36 HydrophobicContact CB-CB 4.38Å; C33-W36 HydrophobicContact CB-CD2 3.66Å; C33-W36 HydrophobicContact CB-CE3 3.97Å; C33-W36 HydrophobicContact CB-CG 3.82Å; C33-W36 WeakPolarHBondContact O-CB 3.46Å; C33-W36 PolarHBondContact O-N 3.37Å; W36-L40 HydrophobicContact CB-CB 4.15Å; W36-L40 WeakPolarHBondContact CB-O 3.39Å; W36-L40 HydrophobicContact CE3-CB 4.08Å; W36-L40 HydrophobicContact CE3-CD1 4.48Å; W36-K41 VanDerWaalsContact O-CA 3.27Å; W36-K41 WeakPolarHBondContact O-CA 3.38Å; W36-K41 VanDerWaalsContact O-CB 3.22Å; W36-K41 WeakPolarHBondContact O-CB 3.37Å; W36-K41 PolarHBondContact O-N 3.19Å
37	P	90.5	Very high	86.1	Confident	53 Å²	53	77.1 Å²	77.1	34%	0.344	39%	0.391	S	S	.	.			trans	-74.5	149.6	-170.4	29.1	-35.1	0	0	0	112.4	L39 L40 L63	P37-L39 PolarHBondContact O-N 2.8Å; P37-L40 WeakPolarHBondContact O-CB 3.48Å; P37-L40 PolarHBondContact O-N 2.96Å; P37-L63 HydrophobicContact CB-CD1 3.48Å; P37-L63 VanDerWaalsContact CB-CD1 3.48Å; P37-L63 HydrophobicContact CG-CD1 3.9Å
38	L	93.8	Very high	87	Confident	25 Å²	25	72.2 Å²	72.2	13%	0.131	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	54.9	-127.5	164.9	-52.4	165.8	0	0	0	112.6	L40 K41 P62 L63 P272 E274 K275 I278	L38-L40 PolarHBondContact O-N 3.5Å; L38-K41 WeakPolarHBondContact O-CB 3.3Å; L38-K41 PolarHBondContact O-N 3.19Å; L38-P62 HydrophobicContact CD1-CB 3.73Å; L38-P62 HydrophobicContact CD1-CG 4.24Å; L38-L63 HydrophobicContact CD1-CD2 4.27Å; L38-L63 HydrophobicContact CD1-CG 4.07Å; L38-P272 HydrophobicContact CD1-CB 4.29Å; L38-P272 HydrophobicContact CD1-CG 3.41Å; L38-P272 VanDerWaalsContact CD1-CG 3.41Å; L38-P272 HydrophobicContact CD2-CG 4.2Å; L38-P272 HydrophobicContact CG-CG 4.44Å; L38-E274 HydrophobicContact CB-CB 4.27Å; L38-E274 HydrophobicContact CD1-CB 4.16Å; L38-K275 HydrophobicContact CD2-CB 4.08Å; L38-K275 HydrophobicContact CD2-CD 3.97Å; L38-I278 HydrophobicContact CD2-CD1 3.98Å
39	L	94.8	Very high	87.9	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.005	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-70.5	-13.3	-178.9	-62.8	180	0	0	0	113.2	P37 K41 E274 L277 R282 V318 M320 A326	P37-L39 PolarHBondContact O-N 2.8Å; L39-K41 VanDerWaalsContact C-N 3.34Å; L39-E274 HydrophobicContact CD1-CB 4.19Å; L39-E274 HydrophobicContact CD1-CG 3.83Å; L39-E274 HydrophobicContact CG-CB 4.18Å; L39-E274 HydrophobicContact CG-CG 4.31Å; L39-L277 HydrophobicContact CD2-CB 4.16Å; L39-R282 HydrophobicContact CD2-CG 4.37Å; L39-R282 WeakPolarHBondContact O-CD 3.35Å; L39-R282 PolarHBondContact O-NH1 3.41Å; L39-V318 HydrophobicContact CD1-CG2 4.17Å; L39-V318 HydrophobicContact CD2-CG1 4.1Å; L39-M320 HydrophobicContact CB-CE 3.61Å; L39-M320 HydrophobicContact CB-SD 3.93Å; L39-M320 HydrophobicContact CD1-CB 4.25Å; L39-M320 WeakPolarHBondContact O-CE 3.47Å; L39-A326 HydrophobicContact CD1-CB 4.1Å
40	L	93.9	Very high	88.6	Confident	18 Å²	18	63.5 Å²	63.5	9%	0.094	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-86.8	-5.6	176.4	-70.7	-179.9	0	0	0	113.6	W36 P37 L38 N42 V43 M284 M320	W36-L40 HydrophobicContact CB-CB 4.15Å; W36-L40 WeakPolarHBondContact CB-O 3.39Å; W36-L40 HydrophobicContact CE3-CB 4.08Å; W36-L40 HydrophobicContact CE3-CD1 4.48Å; P37-L40 WeakPolarHBondContact O-CB 3.48Å; P37-L40 PolarHBondContact O-N 2.96Å; L38-L40 PolarHBondContact O-N 3.5Å; L40-N42 PolarHBondContact O-N 3.1Å; L40-V43 HydrophobicContact CB-CG2 4.3Å; L40-V43 HydrophobicContact CD2-CG2 3.97Å; L40-V43 WeakPolarHBondContact O-CG2 3.31Å; L40-V43 PolarHBondContact O-N 2.96Å; L40-M284 HydrophobicContact CD2-CE 4.25Å; L40-M320 HydrophobicContact CD2-CE 3.82Å; L40-M320 HydrophobicContact CG-CE 4.46Å
41	K	92.9	Very high	88.9	Confident	96 Å²	96	62.8 Å²	62.8	42%	0.417	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	133	176.2	-165.3	175.9	-179	174.2	0	111	S34 W36 L38 L39 V43 R282	S34-K41 WeakPolarHBondContact O-CE 3.33Å; S34-K41 VanDerWaalsContact O-CG 3.22Å; S34-K41 WeakPolarHBondContact O-CG 3.35Å; W36-K41 VanDerWaalsContact O-CA 3.27Å; W36-K41 WeakPolarHBondContact O-CA 3.38Å; W36-K41 VanDerWaalsContact O-CB 3.22Å; W36-K41 WeakPolarHBondContact O-CB 3.37Å; W36-K41 PolarHBondContact O-N 3.19Å; L38-K41 WeakPolarHBondContact O-CB 3.3Å; L38-K41 PolarHBondContact O-N 3.19Å; L39-K41 VanDerWaalsContact C-N 3.34Å; K41-V43 PolarHBondContact O-N 3.24Å; K41-R282 PolarHBondContact O-NH1 3.24Å
42	N	92.3	Very high	88.8	Confident	54 Å²	54	63.1 Å²	63.1	29%	0.289	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.8	27.6	177.8	-60.3	-29.8	0	0	0	114.8	C33 S34 L40 H44 L45	C33-N42 PolarHBondContact O-N 3.31Å; S34-N42 VanDerWaalsContact CA-OD1 3.27Å; S34-N42 WeakPolarHBondContact CA-OD1 3.47Å; L40-N42 PolarHBondContact O-N 3.1Å; N42-H44 PolarHBondContact O-N 3.11Å; N42-L45 HydrophobicContact CB-CD1 3.93Å; N42-L45 HydrophobicContact CB-CG 4.23Å; N42-L45 WeakPolarHBondContact O-CB 3.32Å; N42-L45 PolarHBondContact O-N 2.9Å
43	V	90.6	Very high	88.4	Confident	10 Å²	10	67 Å²	67	6%	0.061	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-61.2	-24.3	178.8	161.7	0	0	0	0	113.4	L40 K41 L45 M46 M284 R306	L40-V43 HydrophobicContact CB-CG2 4.3Å; L40-V43 HydrophobicContact CD2-CG2 3.97Å; L40-V43 WeakPolarHBondContact O-CG2 3.31Å; L40-V43 PolarHBondContact O-N 2.96Å; K41-V43 PolarHBondContact O-N 3.24Å; V43-L45 PolarHBondContact O-N 3.21Å; V43-M46 HydrophobicContact CB-SD 4.44Å; V43-M46 HydrophobicContact CG1-SD 4.46Å; V43-M46 HydrophobicContact CG2-SD 4.04Å; V43-M46 WeakPolarHBondContact O-CB 3.43Å; V43-M46 PolarHBondContact O-N 3.43Å; V43-M284 HydrophobicContact CG1-CE 4.26Å; V43-M284 HydrophobicContact CG2-CE 4.36Å; V43-R306 PolarHBondContact O-NH1 3.49Å
44	H	88.2	Confident	87.8	Confident	75 Å²	75	68.9 Å²	68.9	35%	0.347	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-67.6	-19.4	173.8	65.9	-84.4	0	0	0	113.5	D32 C33 N42	D32-H44 IonicContact OD1-CE1 3.53Å; C33-H44 WeakPolarHBondContact CB-ND1 3.37Å; C33-H44 PolarHBondContact N-ND1 3.44Å; N42-H44 PolarHBondContact O-N 3.11Å
45	L	90.4	Very high	86.9	Confident	101 Å²	101	71.5 Å²	71.5	53%	0.529	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-86.3	-7.9	175.6	-57.9	-177.7	0	0	0	113	N42 V43	N42-L45 HydrophobicContact CB-CD1 3.93Å; N42-L45 HydrophobicContact CB-CG 4.23Å; N42-L45 WeakPolarHBondContact O-CB 3.32Å; N42-L45 PolarHBondContact O-N 2.9Å; V43-L45 PolarHBondContact O-N 3.21Å
46	M	93.7	Very high	86.4	Confident	7 Å²	7	65.5 Å²	65.5	3%	0.034	34%	0.337	C	S	.	.	S	Bend	trans	-74.1	144	176.9	-62.4	-178.5	74.2	0	0	110.4	V43 R282 M284 R306 D308	V43-M46 HydrophobicContact CB-SD 4.44Å; V43-M46 HydrophobicContact CG1-SD 4.46Å; V43-M46 HydrophobicContact CG2-SD 4.04Å; V43-M46 WeakPolarHBondContact O-CB 3.43Å; V43-M46 PolarHBondContact O-N 3.43Å; M46-R282 HydrophobicContact CE-CB 3.89Å; M46-M284 HydrophobicContact CE-CB 4.5Å; M46-R306 HydrophobicContact CB-CB 4.14Å; M46-R306 HydrophobicContact CE-CB 4.05Å; M46-R306 HydrophobicContact SD-CB 4.46Å; M46-D308 WeakPolarHBondContact CG-OD1 3.45Å
47	N	93.9	Very high	86	Confident	47 Å²	47	66.5 Å²	66.5	25%	0.251	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	140.8	171.2	-64.1	-43.2	0	0	0	109.9	R306 Y307 N309	N47-R306 WeakPolarHBondContact O-CA 3.44Å; N47-R306 WeakPolarHBondContact O-CB 3.41Å; N47-Y307 HydrophobicContact CB-CD1 4.23Å; N47-Y307 HydrophobicContact CB-CD2 4.06Å; N47-Y307 HydrophobicContact CB-CE1 3.82Å; N47-Y307 HydrophobicContact CB-CE2 3.66Å; N47-Y307 HydrophobicContact CB-CG 4.33Å; N47-Y307 PolarHBondContact N-O 2.82Å; N47-Y307 WeakPolarHBondContact ND2-CE2 3.43Å; N47-Y307 PolarHBondContact O-N 3.29Å; N47-Y307 VanDerWaalsContact O-N 3.08Å; N47-N309 PolarHBondContact ND2-OD1 2.99Å; N47-N309 PolarHBondContact OD1-OD1 3.36Å
48	V	92.3	Very high	85.9	Confident	65 Å²	65	66 Å²	66	39%	0.394	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	118.3	178.5	-170.1	0	0	0	0	108.7	E50 C51 R306	V48-E50 VanDerWaalsContact CG1-O 3.28Å; V48-E50 WeakPolarHBondContact CG1-O 3.36Å; V48-C51 WeakPolarHBondContact CG1-SG 3.5Å; V48-R306 HydrophobicContact CG2-CG 4.48Å
49	R	89.6	Confident	85.7	Confident	77 Å²	77	65.4 Å²	65.4	29%	0.291	35%	0.351	S	S	.	.	S	Bend	trans	-86	-43.4	170.5	-164.4	68	177.3	93.5	-2.7	110.3	L305 Y307 I339 C342	R49-L305 PolarHBondContact N-O 2.77Å; R49-Y307 HydrophobicContact CB-CE1 4.09Å; R49-I339 PolarHBondContact NE-O 2.88Å; R49-C342 PolarHBondContact NH2-O 3.42Å
50	E	83	Confident	85.6	Confident	54 Å²	54	70 Å²	70	25%	0.252	37%	0.369	S	S	.	.			trans	-141	146.8	177.9	-69.4	-174.9	-154.1	0	0	110.8	V48 H52 K286 L305	V48-E50 VanDerWaalsContact CG1-O 3.28Å; V48-E50 WeakPolarHBondContact CG1-O 3.36Å; E50-H52 IonicContact OE2-CE1 2.74Å; E50-H52 PolarHBondContact OE2-CE1 3.33Å; E50-H52 IonicContact OE2-CG 3.91Å; E50-H52 IonicContact OE2-ND1 2.77Å; E50-H52 PolarHBondContact OE2-ND1 3.23Å; E50-K286 IonicContact OE1-NZ 3.37Å; E50-K286 PolarHBondContact OE1-NZ 2.91Å; E50-K286 WeakPolarHBondContact OE2-CE 3.45Å; E50-K286 IonicContact OE2-NZ 2.9Å; E50-K286 PolarHBondContact OE2-NZ 3.18Å; E50-L305 HydrophobicContact CB-CD1 4.19Å; E50-L305 PolarHBondContact N-O 2.68Å; E50-L305 WeakPolarHBondContact O-CD1 3.38Å
51	C	78.5	Confident	85.5	Confident	115 Å²	115	71.2 Å²	71.2	78%	0.777	38%	0.379	S	S	*	.			trans	-104.9	23.4	179.6	-68.4	0	0	0	0	112.9	V48 F53	V48-C51 WeakPolarHBondContact CG1-SG 3.5Å; C51-F53 PolarHBondContact O-N 3.48Å
52	H	75.3	Confident	85.6	Confident	126 Å²	126	66.9 Å²	66.9	58%	0.583	36%	0.36	S	S	*	.			trans	-65.3	129.9	-178.4	-72.1	100.7	0	0	0	110.9	E50 E54	E50-H52 IonicContact OE2-CE1 2.74Å; E50-H52 PolarHBondContact OE2-CE1 3.33Å; E50-H52 IonicContact OE2-CG 3.91Å; E50-H52 IonicContact OE2-ND1 2.77Å; E50-H52 PolarHBondContact OE2-ND1 3.23Å; H52-E54 PolarHBondContact O-N 3.13Å
53	F	73.2	Confident	85.7	Confident	186 Å²	186	68.1 Å²	68.1	82%	0.816	37%	0.367	S	S	*	.			trans	-75.2	117.7	172	177	-103.6	0	0	0	109.1	C51 A55	C51-F53 PolarHBondContact O-N 3.48Å; F53-A55 HydrophobicContact CD1-CB 4.27Å; F53-A55 HydrophobicContact CE1-CB 3.93Å; F53-A55 PolarHBondContact O-N 3.37Å
54	E	72.7	Confident	85.8	Confident	43 Å²	43	74.9 Å²	74.9	20%	0.201	40%	0.397	C	S	.	.			trans	-83.9	107	173.4	-64.6	-72.8	178	0	0	108.4	H52 D56 K286 D287 T322	H52-E54 PolarHBondContact O-N 3.13Å; E54-D56 PolarHBondContact O-N 3.18Å; E54-K286 WeakPolarHBondContact OE1-CA 3.43Å; E54-K286 WeakPolarHBondContact OE1-CB 3.29Å; E54-D287 PolarHBondContact OE1-N 2.66Å; E54-T322 HydrophobicContact CB-CG2 4.45Å; E54-T322 HydrophobicContact CG-CG2 4.07Å
55	A	68.5	Low	86.2	Confident	79 Å²	79	71.7 Å²	71.7	65%	0.653	38%	0.382	S	S	*	.			trans	-77.2	0.3	178.3	0	0	0	0	0	113.3	F53 T57	F53-A55 HydrophobicContact CD1-CB 4.27Å; F53-A55 HydrophobicContact CE1-CB 3.93Å; F53-A55 PolarHBondContact O-N 3.37Å; A55-T57 PolarHBondContact O-N 3.27Å
56	D	76.1	Confident	86.4	Confident	37 Å²	37	69.6 Å²	69.6	20%	0.198	37%	0.374	C	S	.	.			trans	-69	121.3	-175.8	-170.6	11.8	0	0	0	111.3	E54 T58 D287 K323 Y360	E54-D56 PolarHBondContact O-N 3.18Å; D56-T58 VanDerWaalsContact C-N 3.29Å; D56-T58 WeakPolarHBondContact OD1-CB 3.21Å; D56-T58 PolarHBondContact OD1-N 3.05Å; D56-T58 PolarHBondContact OD1-OG1 3.4Å; D56-T58 WeakPolarHBondContact OD2-CB 3.48Å; D56-T58 PolarHBondContact OD2-OG1 2.84Å; D56-D287 HydrophobicContact CB-CB 4.29Å; D56-K323 PolarHBondContact O-NZ 3.48Å; D56-Y360 WeakPolarHBondContact OD2-CD1 3.49Å
57	T	82.8	Confident	86.5	Confident	128 Å²	128	69.8 Å²	69.8	79%	0.785	38%	0.376	S	S	*	.			trans	-83.9	-6.8	178.1	54.9	0	0	0	0	112.4	A55 K323	A55-T57 PolarHBondContact O-N 3.27Å; T57-K323 PolarHBondContact O-NZ 3.09Å
58	T	88.4	Confident	86.5	Confident	42 Å²	42	72.1 Å²	72.1	26%	0.258	39%	0.388	S	S	.	.			trans	-67.5	135.7	-177.7	-50.5	0	0	0	0	114.5	D56 K323 L359 Y360	D56-T58 VanDerWaalsContact C-N 3.29Å; D56-T58 WeakPolarHBondContact OD1-CB 3.21Å; D56-T58 PolarHBondContact OD1-N 3.05Å; D56-T58 PolarHBondContact OD1-OG1 3.4Å; D56-T58 WeakPolarHBondContact OD2-CB 3.48Å; D56-T58 PolarHBondContact OD2-OG1 2.84Å; T58-K323 VanDerWaalsContact C-NZ 3.29Å; T58-K323 WeakPolarHBondContact O-CE 3.13Å; T58-K323 PolarHBondContact O-NZ 3.23Å; T58-L359 WeakPolarHBondContact CG2-O 3.45Å; T58-Y360 HydrophobicContact CG2-CD1 4.24Å; T58-Y360 HydrophobicContact CG2-CG 4.28Å; T58-Y360 WeakPolarHBondContact O-CE1 3.45Å; T58-Y360 VanDerWaalsContact O-CZ 3.32Å; T58-Y360 PolarHBondContact O-OH 3.2Å
59	G	89.4	Confident	86.6	Confident	13 Å²	13	71.2 Å²	71.2	13%	0.134	38%	0.379	C	S	.	.	S	Bend	trans	90.5	178.2	-178.3	0	0	0	0	0	113.2	E325	G59-E325 WeakPolarHBondContact CA-OE2 3.46Å
60	Y	91.1	Very high	86.9	Confident	98 Å²	98	67.9 Å²	67.9	38%	0.384	37%	0.367	S	S	.	.			trans	-138	153.4	-169.8	-57.6	-81.1	0	0	0	111.9	R65 P66 E325	Y60-R65 HydrophobicContact CD2-CG 4.32Å; Y60-R65 HydrophobicContact CG-CG 4.21Å; Y60-P66 HydrophobicContact CD1-CG 4.49Å; Y60-P66 HydrophobicContact CE1-CG 3.88Å; Y60-P66 HydrophobicContact CE2-CG 4.24Å; Y60-E325 PolarHBondContact N-OE2 2.95Å; Y60-E325 VanDerWaalsContact N-OE2 3.09Å; Y60-E325 WeakPolarHBondContact O-CG 2.9Å
61	S	92.8	Very high	87.6	Confident	43 Å²	43	66.5 Å²	66.5	30%	0.301	36%	0.361	S	S	.	.			trans	-63.6	136.3	158.6	175.5	0	0	0	0	108.8	L63 H64 R65 K323	S61-L63 PolarHBondContact O-N 2.9Å; S61-H64 CarbonylContact O-C 3.54Å; S61-H64 WeakPolarHBondContact O-CA 3.34Å; S61-H64 PolarHBondContact O-N 3.36Å; S61-R65 PolarHBondContact O-N 3.5Å; S61-K323 WeakPolarHBondContact CA-O 3.27Å
62	P	95.5	Very high	88.4	Confident	4 Å²	4	63.9 Å²	63.9	3%	0.026	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-53	-34.3	-174.5	-29.5	33.5	0	0	0	115.1	L38 Y70 P272 E274 K323 G324	L38-P62 HydrophobicContact CD1-CB 3.73Å; L38-P62 HydrophobicContact CD1-CG 4.24Å; P62-Y70 WeakPolarHBondContact O-CD2 3.28Å; P62-P272 HydrophobicContact CB-CB 3.88Å; P62-P272 HydrophobicContact CB-CG 4.27Å; P62-E274 HydrophobicContact CB-CG 4.28Å; P62-E274 HydrophobicContact CG-CB 4.46Å; P62-E274 HydrophobicContact CG-CG 3.83Å; P62-K323 WeakPolarHBondContact CD-O 3.41Å; P62-G324 WeakPolarHBondContact CG-O 3.49Å
63	L	94.1	Very high	89.4	Confident	81 Å²	81	58 Å²	58	42%	0.424	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-79.9	-19.9	178	-65.7	176.6	0	0	0	113.6	P37 L38 S61 R267 P272	P37-L63 HydrophobicContact CB-CD1 3.48Å; P37-L63 VanDerWaalsContact CB-CD1 3.48Å; P37-L63 HydrophobicContact CG-CD1 3.9Å; L38-L63 HydrophobicContact CD1-CD2 4.27Å; L38-L63 HydrophobicContact CD1-CG 4.07Å; S61-L63 PolarHBondContact O-N 2.9Å; L63-R267 PolarHBondContact O-NH1 3.12Å; L63-P272 HydrophobicContact CD2-CG 3.9Å
64	H	93.5	Very high	90.5	Very high	152 Å²	152	49.1 Å²	49.1	70%	0.704	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-106.2	18.6	-178.6	-162.3	45	0	0	0	112.8	S61	S61-H64 CarbonylContact O-C 3.54Å; S61-H64 WeakPolarHBondContact O-CA 3.34Å; S61-H64 PolarHBondContact O-N 3.36Å
65	R	94.9	Very high	91.7	Very high	7 Å²	7	47.1 Å²	47.1	3%	0.026	26%	0.261	C	S	.	.	S	Bend	trans	-63.5	144.4	171.1	-73.4	174.7	-177.5	136.9	7.8	110.6	Y60 S61 E69 Y70 S73 R267 E274 E325	Y60-R65 HydrophobicContact CD2-CG 4.32Å; Y60-R65 HydrophobicContact CG-CG 4.21Å; S61-R65 PolarHBondContact O-N 3.5Å; R65-E69 HydrophobicContact CB-CB 4.44Å; R65-Y70 HydrophobicContact CB-CD2 4.31Å; R65-S73 PolarHBondContact NH1-OG 3.33Å; R65-S73 VanDerWaalsContact NH1-OG 3.15Å; R65-R267 PolarHBondContact O-NH1 3.4Å; R65-R267 PolarHBondContact O-NH2 2.95Å; R65-E274 IonicContact CZ-OE1 3.53Å; R65-E274 IonicContact CZ-OE2 3.6Å; R65-E274 IonicContact NH1-OE1 3.51Å; R65-E274 PolarHBondContact NH1-OE1 3.35Å; R65-E274 IonicContact NH1-OE2 2.84Å; R65-E274 PolarHBondContact NH1-OE2 3.11Å; R65-E274 IonicContact NH2-OE1 2.77Å; R65-E274 PolarHBondContact NH2-OE1 3.1Å; R65-E274 IonicContact NH2-OE2 3.51Å; R65-E325 IonicContact CZ-OE1 3.33Å; R65-E325 IonicContact NE-OE1 3.83Å; R65-E325 PolarHBondContact NE-OE1 3.27Å; R65-E325 IonicContact NH2-OE1 2.75Å; R65-E325 PolarHBondContact NH2-OE1 2.89Å
66	P	95.5	Very high	93.1	Very high	57 Å²	57	43.3 Å²	43.3	37%	0.37	23%	0.23	S	C	.	.			trans	-50.4	144	161.9	-23.6	33.5	0	0	0	109.9	Y60 D68 E69 Y70	Y60-P66 HydrophobicContact CD1-CG 4.49Å; Y60-P66 HydrophobicContact CE1-CG 3.88Å; Y60-P66 HydrophobicContact CE2-CG 4.24Å; P66-D68 VanDerWaalsContact C-N 3.28Å; P66-D68 PolarHBondContact O-N 2.99Å; P66-E69 PolarHBondContact O-N 3.41Å; P66-E69 VanDerWaalsContact O-N 3.13Å; P66-Y70 WeakPolarHBondContact O-CB 3.22Å; P66-Y70 PolarHBondContact O-N 3.11Å
67	L	95	Very high	94.1	Very high	12 Å²	12	41.6 Å²	41.6	6%	0.063	22%	0.221	C	C	.	.	H	α-helix	trans	-56.5	-41	-168.8	-175.3	66.7	0	0	0	113.2	E69 Y70 I71 Y257 E263 L266 R267	L67-E69 PolarHBondContact O-N 3.15Å; L67-Y70 WeakPolarHBondContact O-CB 3.47Å; L67-Y70 PolarHBondContact O-N 3.29Å; L67-Y70 VanDerWaalsContact O-N 3.17Å; L67-I71 HydrophobicContact CD1-CD1 4.18Å; L67-I71 HydrophobicContact CD1-CG1 4.24Å; L67-I71 HydrophobicContact CD2-CD1 4.35Å; L67-I71 HydrophobicContact CG-CD1 3.87Å; L67-I71 HydrophobicContact CG-CG1 4.31Å; L67-I71 VanDerWaalsContact O-CG1 3.32Å; L67-I71 WeakPolarHBondContact O-CG1 3.32Å; L67-I71 PolarHBondContact O-N 3.21Å; L67-Y257 HydrophobicContact CD2-CD2 3.75Å; L67-Y257 HydrophobicContact CD2-CE1 4.16Å; L67-Y257 HydrophobicContact CD2-CE2 3.24Å; L67-Y257 HydrophobicContact CD2-CG 4.39Å; L67-Y257 VanDerWaalsContact CD2-CZ 3.46Å; L67-E263 HydrophobicContact CD1-CB 4.3Å; L67-E263 HydrophobicContact CD2-CB 4.32Å; L67-E263 HydrophobicContact CD2-CG 3.88Å; L67-L266 HydrophobicContact CD2-CD1 4.27Å; L67-R267 HydrophobicContact CD1-CG 4.23Å
68	D	94.6	Very high	94.8	Very high	95 Å²	95	35.5 Å²	35.5	51%	0.508	18%	0.183	S	C	.	.	H	α-helix	trans	-59	-48.7	178.5	178.5	54.6	0	0	0	112.1	P66 Y70 I71 K72	P66-D68 VanDerWaalsContact C-N 3.28Å; P66-D68 PolarHBondContact O-N 2.99Å; D68-Y70 VanDerWaalsContact C-N 3.32Å; D68-Y70 PolarHBondContact O-N 2.92Å; D68-I71 PolarHBondContact O-N 3.45Å; D68-K72 WeakPolarHBondContact O-CB 3.36Å; D68-K72 VanDerWaalsContact O-CG 3.31Å; D68-K72 WeakPolarHBondContact O-CG 3.48Å; D68-K72 PolarHBondContact O-N 3.39Å; D68-K72 WeakPolarHBondContact OD1-CE 3.43Å; D68-K72 IonicContact OD1-NZ 3.85Å; D68-K72 WeakPolarHBondContact OD2-CE 3.44Å; D68-K72 IonicContact OD2-NZ 2.83Å; D68-K72 PolarHBondContact OD2-NZ 2.91Å
69	E	94.2	Very high	95.3	Very high	46 Å²	46	35.2 Å²	35.2	22%	0.215	18%	0.18	C	C	.	.	H	α-helix	trans	-67.3	-33.2	174.9	-75.4	-63.1	128.4	0	0	112.4	R65 P66 L67 K72 S73 R122	R65-E69 HydrophobicContact CB-CB 4.44Å; P66-E69 PolarHBondContact O-N 3.41Å; P66-E69 VanDerWaalsContact O-N 3.13Å; L67-E69 PolarHBondContact O-N 3.15Å; E69-K72 IonicContact OE1-NZ 2.92Å; E69-S73 WeakPolarHBondContact O-CB 3.37Å; E69-S73 PolarHBondContact O-N 3.35Å; E69-S73 PolarHBondContact O-OG 3.49Å; E69-R122 IonicContact OE1-NH2 2.67Å; E69-R122 IonicContact OE2-CZ 3.86Å; E69-R122 IonicContact OE2-NH1 3.5Å; E69-R122 PolarHBondContact OE2-NH1 3.44Å; E69-R122 VanDerWaalsContact OE2-NH1 3.07Å; E69-R122 IonicContact OE2-NH2 2.64Å; E69-R122 PolarHBondContact OE2-NH2 3.4Å
70	Y	96.6	Very high	95.6	Very high	7 Å²	7	34.6 Å²	34.6	3%	0.027	17%	0.174	C	C	.	.	H	α-helix	trans	-62.8	-46.6	175.4	-173.3	-91.3	0	0	0	111.2	P62 R65 P66 L67 D68 S73 G74 R267 I270 P272	P62-Y70 WeakPolarHBondContact O-CD2 3.28Å; R65-Y70 HydrophobicContact CB-CD2 4.31Å; P66-Y70 WeakPolarHBondContact O-CB 3.22Å; P66-Y70 PolarHBondContact O-N 3.11Å; L67-Y70 WeakPolarHBondContact O-CB 3.47Å; L67-Y70 PolarHBondContact O-N 3.29Å; L67-Y70 VanDerWaalsContact O-N 3.17Å; D68-Y70 VanDerWaalsContact C-N 3.32Å; D68-Y70 PolarHBondContact O-N 2.92Å; Y70-S73 CarbonylContact O-C 3.45Å; Y70-S73 PolarHBondContact O-N 3.12Å; Y70-S73 PolarHBondContact O-OG 2.91Å; Y70-G74 WeakPolarHBondContact O-CA 3Å; Y70-G74 PolarHBondContact O-N 3.43Å; Y70-G74 VanDerWaalsContact O-N 3.1Å; Y70-R267 HydrophobicContact CD1-CG 4.48Å; Y70-R267 HydrophobicContact CE1-CB 4.45Å; Y70-R267 HydrophobicContact CE1-CG 4.23Å; Y70-R267 PolarHBondContact OH-O 3.05Å; Y70-I270 HydrophobicContact CD1-CG2 4.26Å; Y70-I270 HydrophobicContact CE1-CB 4.03Å; Y70-I270 HydrophobicContact CE1-CG2 3.96Å; Y70-I270 WeakPolarHBondContact CE1-O 3.38Å; Y70-I270 VanDerWaalsContact CZ-O 3.29Å; Y70-I270 PolarHBondContact OH-O 3.06Å; Y70-P272 HydrophobicContact CE2-CB 4.36Å; Y70-P272 WeakPolarHBondContact OH-CD 3.15Å
71	I	97	Very high	95.9	Very high	26 Å²	26	32.5 Å²	32.5	13%	0.133	17%	0.172	C	C	.	.	H	α-helix	trans	-65.9	-46.5	177.2	-65.6	171.7	0	0	0	110.6	L67 D68 S73 G74 V99 I120 L266 I270	L67-I71 HydrophobicContact CD1-CD1 4.18Å; L67-I71 HydrophobicContact CD1-CG1 4.24Å; L67-I71 HydrophobicContact CD2-CD1 4.35Å; L67-I71 HydrophobicContact CG-CD1 3.87Å; L67-I71 HydrophobicContact CG-CG1 4.31Å; L67-I71 VanDerWaalsContact O-CG1 3.32Å; L67-I71 WeakPolarHBondContact O-CG1 3.32Å; L67-I71 PolarHBondContact O-N 3.21Å; D68-I71 PolarHBondContact O-N 3.45Å; I71-S73 PolarHBondContact O-N 2.92Å; I71-G74 WeakPolarHBondContact O-CA 2.92Å; I71-G74 PolarHBondContact O-N 2.89Å; I71-V99 HydrophobicContact CG2-CG1 3.61Å; I71-I120 HydrophobicContact CG2-CD1 4.44Å; I71-I120 HydrophobicContact CG2-CG2 4.31Å; I71-I120 WeakPolarHBondContact O-CB 3.37Å; I71-I120 VanDerWaalsContact O-CG2 3.25Å; I71-I120 WeakPolarHBondContact O-CG2 3.47Å; I71-L266 HydrophobicContact CD1-CD1 4.5Å; I71-I270 HydrophobicContact CB-CD1 4.48Å; I71-I270 HydrophobicContact CG1-CD1 3.83Å; I71-I270 HydrophobicContact CG2-CD1 4.29Å
72	K	96	Very high	96	Very high	60 Å²	60	33 Å²	33	26%	0.261	18%	0.175	S	C	.	.	H	α-helix	trans	-59.8	-29.9	177.7	-74.9	169.2	177.7	167.8	0	113.1	D68 E69 I120 D121 R122	D68-K72 WeakPolarHBondContact O-CB 3.36Å; D68-K72 VanDerWaalsContact O-CG 3.31Å; D68-K72 WeakPolarHBondContact O-CG 3.48Å; D68-K72 PolarHBondContact O-N 3.39Å; D68-K72 WeakPolarHBondContact OD1-CE 3.43Å; D68-K72 IonicContact OD1-NZ 3.85Å; D68-K72 WeakPolarHBondContact OD2-CE 3.44Å; D68-K72 IonicContact OD2-NZ 2.83Å; D68-K72 PolarHBondContact OD2-NZ 2.91Å; E69-K72 IonicContact OE1-NZ 2.92Å; K72-I120 VanDerWaalsContact O-O 3.1Å; K72-D121 HydrophobicContact CB-CB 4.34Å; K72-D121 HydrophobicContact CG-CB 4.48Å; K72-R122 VanDerWaalsContact O-CB 3.23Å; K72-R122 WeakPolarHBondContact O-CB 3.47Å; K72-R122 PolarHBondContact O-N 3.37Å
73	S	95.6	Very high	95.9	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.007	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	20.7	175	62.3	0	0	0	0	112.9	R65 E69 Y70 I71 L273	R65-S73 PolarHBondContact NH1-OG 3.33Å; R65-S73 VanDerWaalsContact NH1-OG 3.15Å; E69-S73 WeakPolarHBondContact O-CB 3.37Å; E69-S73 PolarHBondContact O-N 3.35Å; E69-S73 PolarHBondContact O-OG 3.49Å; Y70-S73 CarbonylContact O-C 3.45Å; Y70-S73 PolarHBondContact O-N 3.12Å; Y70-S73 PolarHBondContact O-OG 2.91Å; I71-S73 PolarHBondContact O-N 2.92Å; S73-L273 VanDerWaalsContact O-CB 3.28Å; S73-L273 WeakPolarHBondContact O-CB 3.37Å; S73-L273 PolarHBondContact O-N 2.68Å
74	G	97	Very high	96	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	152.1	-170.3	0	0	0	0	0	115	Y70 I71 I120 A123 I270 M271	Y70-G74 WeakPolarHBondContact O-CA 3Å; Y70-G74 PolarHBondContact O-N 3.43Å; Y70-G74 VanDerWaalsContact O-N 3.1Å; I71-G74 WeakPolarHBondContact O-CA 2.92Å; I71-G74 PolarHBondContact O-N 2.89Å; G74-I120 PolarHBondContact O-N 3.37Å; G74-A123 VanDerWaalsContact O-CB 3.23Å; G74-A123 WeakPolarHBondContact O-CB 3.21Å; G74-I270 VanDerWaalsContact CA-CG2 3.47Å; G74-M271 CarbonylContact C-O 3.54Å; G74-M271 WeakPolarHBondContact CA-O 3.41Å
75	V	97.4	Very high	96	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.006	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	136.8	174.9	177.1	0	0	0	0	108.8	I117 V118 A123 M238 M271 L273 L276	V75-I117 HydrophobicContact CG1-CG2 3.33Å; V75-V118 CarbonylContact C-O 3.59Å; V75-V118 WeakPolarHBondContact CA-O 3.34Å; V75-A123 HydrophobicContact CG2-CB 3.77Å; V75-M238 HydrophobicContact CG1-SD 4.48Å; V75-M271 PolarHBondContact N-O 3.41Å; V75-M271 PolarHBondContact O-N 2.78Å; V75-L273 HydrophobicContact CG2-CB 3.95Å; V75-L276 HydrophobicContact CB-CD1 4.39Å; V75-L276 HydrophobicContact CG1-CD1 3.87Å; V75-L276 HydrophobicContact CG1-CD2 4.13Å; V75-L276 HydrophobicContact CG1-CG 4.05Å; V75-L276 HydrophobicContact CG2-CD1 3.71Å; V75-L276 HydrophobicContact CG2-CG 4.22Å
76	I	97.8	Very high	96	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	132.9	178.1	-60	173.5	0	0	0	108.4	L78 V93 L97 I117 V118 I120 V245 I250 V269 I270	I76-L78 HydrophobicContact CG2-CB 4.28Å; I76-L78 PolarHBondContact O-N 3.39Å; I76-V93 HydrophobicContact CD1-CG1 4.01Å; I76-L97 HydrophobicContact CD1-CD1 3.75Å; I76-I117 CarbonylContact O-C 3.6Å; I76-I117 VanDerWaalsContact O-CA 3.31Å; I76-I117 WeakPolarHBondContact O-CA 3.44Å; I76-V118 HydrophobicContact CB-CB 4.41Å; I76-V118 PolarHBondContact N-O 3.33Å; I76-V118 PolarHBondContact O-N 2.72Å; I76-I120 HydrophobicContact CD1-CD1 4.06Å; I76-I120 HydrophobicContact CG1-CD1 4.36Å; I76-V245 HydrophobicContact CG2-CG2 3.38Å; I76-I250 HydrophobicContact CD1-CD1 4.15Å; I76-I250 HydrophobicContact CG2-CD1 4.17Å; I76-V269 HydrophobicContact CD1-CG1 4.46Å; I76-I270 HydrophobicContact CD1-CG1 4.02Å; I76-I270 HydrophobicContact CG1-CG1 4.01Å
77	N	97.6	Very high	95.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	91.5	167.8	-173.1	21.2	0	0	0	108.4	M238 S239 D242 L244 V245 M271	N77-M238 HydrophobicContact CB-CE 3.52Å; N77-M238 HydrophobicContact CB-SD 3.97Å; N77-S239 PolarHBondContact ND2-O 3.2Å; N77-D242 PolarHBondContact ND2-O 3.3Å; N77-L244 WeakPolarHBondContact O-CA 3.31Å; N77-V245 WeakPolarHBondContact O-CG2 3.3Å; N77-V245 PolarHBondContact O-N 2.66Å; N77-M271 HydrophobicContact CB-CE 3.93Å
78	L	97.8	Very high	96	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	132.7	-172.9	-177.5	69.7	0	0	0	110.6	I76 K80 V89 V93 C115 L116 V118 V245 M247 I250	I76-L78 HydrophobicContact CG2-CB 4.28Å; I76-L78 PolarHBondContact O-N 3.39Å; L78-K80 PolarHBondContact O-N 3.24Å; L78-V89 HydrophobicContact CD2-CG1 3.16Å; L78-V89 HydrophobicContact CG-CG1 4.43Å; L78-V93 HydrophobicContact CD2-CG2 4.04Å; L78-C115 CarbonylContact O-C 3.48Å; L78-L116 WeakPolarHBondContact CB-O 3.38Å; L78-L116 PolarHBondContact N-O 3.31Å; L78-L116 PolarHBondContact O-N 3.17Å; L78-V118 HydrophobicContact CB-CG2 4.19Å; L78-V118 HydrophobicContact CD2-CG2 4.16Å; L78-V245 CarbonylContact C-O 3.59Å; L78-V245 WeakPolarHBondContact CA-O 3.29Å; L78-M247 HydrophobicContact CD1-CG 4.17Å; L78-M247 HydrophobicContact CD1-SD 3.87Å; L78-M247 HydrophobicContact CD2-SD 3.97Å; L78-I250 HydrophobicContact CD1-CD1 3.7Å
79	D	97.8	Very high	96.1	Very high	37 Å²	37	31.7 Å²	31.7	20%	0.198	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	99.4	160.5	-158.7	-14.9	0	0	0	108.1	P81 G114 R231 L244 V245	D79-P81 WeakPolarHBondContact O-CD 3.44Å; D79-G114 VanDerWaalsContact OD1-CA 3.23Å; D79-G114 WeakPolarHBondContact OD1-CA 3.38Å; D79-G114 PolarHBondContact OD1-N 3.22Å; D79-G114 VanDerWaalsContact OD1-N 3.15Å; D79-R231 IonicContact OD1-CZ 3.19Å; D79-R231 IonicContact OD1-NH1 3.7Å; D79-R231 PolarHBondContact OD1-NH1 3.04Å; D79-R231 IonicContact OD1-NH2 2.64Å; D79-R231 IonicContact OD2-CZ 3.39Å; D79-R231 IonicContact OD2-NH1 3.54Å; D79-R231 PolarHBondContact OD2-NH1 2.9Å; D79-R231 IonicContact OD2-NH2 3.15Å; D79-R231 PolarHBondContact OD2-NH2 3.11Å; D79-L244 HydrophobicContact CB-CD1 4.16Å; D79-L244 HydrophobicContact CB-CD2 3.75Å; D79-L244 HydrophobicContact CB-CG 3.81Å; D79-L244 WeakPolarHBondContact OD2-CD2 3.47Å; D79-V245 PolarHBondContact N-O 3.32Å
80	K	97	Very high	96.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	124.6	177.7	-176.4	-161.1	162.2	-73	0	108.2	L78 P84 V89 L108 D109 P110 V112 S113 G114 L116	L78-K80 PolarHBondContact O-N 3.24Å; K80-P84 WeakPolarHBondContact CE-O 3.42Å; K80-P84 PolarHBondContact NZ-O 3.29Å; K80-V89 HydrophobicContact CG-CG2 4.16Å; K80-L108 HydrophobicContact CB-CD1 4.17Å; K80-L108 HydrophobicContact CD-CB 3.72Å; K80-L108 HydrophobicContact CD-CD1 3.74Å; K80-L108 HydrophobicContact CD-CG 4.3Å; K80-D109 PolarHBondContact NZ-O 3.5Å; K80-P110 PolarHBondContact NZ-O 2.81Å; K80-P110 VanDerWaalsContact NZ-O 3.07Å; K80-V112 PolarHBondContact NZ-O 2.86Å; K80-S113 WeakPolarHBondContact O-CA 3.09Å; K80-S113 VanDerWaalsContact O-CB 3.28Å; K80-S113 WeakPolarHBondContact O-CB 3.17Å; K80-G114 PolarHBondContact N-O 3.4Å; K80-G114 PolarHBondContact O-N 3.48Å; K80-L116 HydrophobicContact CB-CB 4.1Å; K80-L116 HydrophobicContact CB-CD2 4.27Å; K80-L116 HydrophobicContact CD-CD2 4.39Å; K80-L116 HydrophobicContact CG-CD2 4.33Å
81	P	96.3	Very high	96.2	Very high	53 Å²	53	31.5 Å²	31.5	34%	0.344	17%	0.174	S	C	.	.	P	Polyproline II helix	trans	-70.6	161	174.6	28.6	-33.6	0	0	0	112.1	D79 P84	D79-P81 WeakPolarHBondContact O-CD 3.44Å; P81-P84 HydrophobicContact CG-CG 3.81Å
82	C	94.9	Very high	96.2	Very high	54 Å²	54	34.9 Å²	34.9	37%	0.365	19%	0.185	S	C	.	.	S	Bend	trans	-70	146	170	-65.2	0	0	0	0	111.1	P84	C82-P84 WeakPolarHBondContact O-CD 3.36Å
83	N	94.4	Very high	96.3	Very high	124 Å²	124	32 Å²	32	66%	0.663	17%	0.173	S	C	*	.	S	Bend	trans	93	-49	178	-52.9	-38.2	0	0	0	117.5	P110	N83-P110 CarbonylContact C-O 3.56Å; N83-P110 WeakPolarHBondContact CA-O 3.16Å; N83-P110 PolarHBondContact N-O 2.87Å; N83-P110 VanDerWaalsContact O-CB 3.32Å; N83-P110 WeakPolarHBondContact O-CB 3.34Å
84	P	94.7	Very high	96.4	Very high	18 Å²	18	36.1 Å²	36.1	12%	0.117	19%	0.19	C	C	.	.	S	Bend	trans	-74.4	148.9	175.9	30.6	-31.6	0	0	0	110.1	K80 P81 C82 V89 W92	K80-P84 WeakPolarHBondContact CE-O 3.42Å; K80-P84 PolarHBondContact NZ-O 3.29Å; P81-P84 HydrophobicContact CG-CG 3.81Å; C82-P84 WeakPolarHBondContact O-CD 3.36Å; P84-V89 HydrophobicContact CB-CG2 3.81Å; P84-V89 HydrophobicContact CG-CG2 3.59Å; P84-W92 HydrophobicContact CB-CH2 3.78Å; P84-W92 HydrophobicContact CB-CZ2 4.45Å; P84-W92 HydrophobicContact CB-CZ3 4.18Å; P84-W92 HydrophobicContact CG-CH2 4.17Å; P84-W92 HydrophobicContact CG-CZ3 4.16Å
85	S	94.2	Very high	96.4	Very high	28 Å²	28	44.6 Å²	44.6	20%	0.196	22%	0.223	C	C	.	.			trans	-67.5	157.1	171.3	70.9	0	0	0	0	111	H87 E88 V89	S85-H87 PolarHBondContact O-N 3.27Å; S85-E88 VanDerWaalsContact CB-OE2 3.3Å; S85-E88 WeakPolarHBondContact CB-OE2 3.41Å; S85-E88 PolarHBondContact N-OE2 2.87Å; S85-E88 PolarHBondContact O-N 3.32Å; S85-E88 VanDerWaalsContact OG-CG 3.29Å; S85-E88 WeakPolarHBondContact OG-CG 3.36Å; S85-E88 PolarHBondContact OG-N 2.87Å; S85-E88 PolarHBondContact OG-OE2 2.78Å; S85-V89 WeakPolarHBondContact O-CG2 3.38Å; S85-V89 PolarHBondContact O-N 2.72Å
86	S	94.8	Very high	96.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.4	-32.7	174	-62.7	0	0	0	0	113.3	V90 L108	S86-V90 WeakPolarHBondContact O-CB 3.41Å; S86-V90 WeakPolarHBondContact O-CG2 3.2Å; S86-V90 PolarHBondContact O-N 3.19Å; S86-L108 PolarHBondContact OG-N 2.82Å; S86-L108 PolarHBondContact OG-O 2.71Å
87	H	93.7	Very high	96.2	Very high	115 Å²	115	46 Å²	46	53%	0.532	23%	0.233	S	C	.	.	H	α-helix	trans	-69.8	-42.3	-179.3	-66.4	97.2	0	0	0	111.8	S85 V90 A91 H104	S85-H87 PolarHBondContact O-N 3.27Å; H87-V90 PolarHBondContact O-N 3.33Å; H87-A91 WeakPolarHBondContact O-CB 3.48Å; H87-A91 PolarHBondContact O-N 2.88Å; H87-H104 AromaticContact CD2-NE2 3.85Å; H87-H104 AromaticContact NE2-NE2 3.62Å
88	E	95.8	Very high	96.1	Very high	95 Å²	95	49.1 Å²	49.1	44%	0.444	27%	0.265	S	S	.	.	H	α-helix	trans	-61	-48.2	175.7	-72.5	162.8	133.4	0	0	110.9	S85 V90 A91 W92	S85-E88 VanDerWaalsContact CB-OE2 3.3Å; S85-E88 WeakPolarHBondContact CB-OE2 3.41Å; S85-E88 PolarHBondContact N-OE2 2.87Å; S85-E88 PolarHBondContact O-N 3.32Å; S85-E88 VanDerWaalsContact OG-CG 3.29Å; S85-E88 WeakPolarHBondContact OG-CG 3.36Å; S85-E88 PolarHBondContact OG-N 2.87Å; S85-E88 PolarHBondContact OG-OE2 2.78Å; E88-V90 VanDerWaalsContact C-N 3.33Å; E88-V90 PolarHBondContact O-N 3.47Å; E88-A91 CarbonylContact O-C 3.57Å; E88-A91 WeakPolarHBondContact O-CB 3.48Å; E88-A91 PolarHBondContact O-N 2.78Å; E88-A91 VanDerWaalsContact O-N 3.12Å; E88-W92 HydrophobicContact CB-CZ2 4.42Å; E88-W92 PolarHBondContact O-N 2.74Å
89	V	96.7	Very high	96	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-59.4	-44.3	178.7	174.2	0	0	0	0	111.3	L78 K80 P84 S85 A91 W92 V93 M247	L78-V89 HydrophobicContact CD2-CG1 3.16Å; L78-V89 HydrophobicContact CG-CG1 4.43Å; K80-V89 HydrophobicContact CG-CG2 4.16Å; P84-V89 HydrophobicContact CB-CG2 3.81Å; P84-V89 HydrophobicContact CG-CG2 3.59Å; S85-V89 WeakPolarHBondContact O-CG2 3.38Å; S85-V89 PolarHBondContact O-N 2.72Å; V89-A91 VanDerWaalsContact C-N 3.32Å; V89-A91 PolarHBondContact O-N 3.39Å; V89-W92 HydrophobicContact CG2-CE3 4.38Å; V89-W92 HydrophobicContact CG2-CZ3 4.36Å; V89-W92 WeakPolarHBondContact O-CB 3.47Å; V89-W92 PolarHBondContact O-N 2.95Å; V89-W92 VanDerWaalsContact O-N 3.15Å; V89-V93 WeakPolarHBondContact O-CG2 3.46Å; V89-V93 PolarHBondContact O-N 3.22Å; V89-M247 HydrophobicContact CG1-SD 4.11Å
90	V	96.5	Very high	95.9	Very high	8 Å²	8	54.1 Å²	54.1	5%	0.048	29%	0.292	C	S	.	.	H	α-helix	trans	-66.7	-33.9	177.9	171	0	0	0	0	112.1	S86 H87 E88 W92 V93 K94 T102 H104 L116 V118	S86-V90 WeakPolarHBondContact O-CB 3.41Å; S86-V90 WeakPolarHBondContact O-CG2 3.2Å; S86-V90 PolarHBondContact O-N 3.19Å; H87-V90 PolarHBondContact O-N 3.33Å; E88-V90 VanDerWaalsContact C-N 3.33Å; E88-V90 PolarHBondContact O-N 3.47Å; V90-W92 VanDerWaalsContact C-N 3.35Å; V90-V93 PolarHBondContact O-N 3.41Å; V90-K94 PolarHBondContact O-N 3.23Å; V90-T102 WeakPolarHBondContact CG1-OG1 3.38Å; V90-T102 PolarHBondContact O-OG1 3.07Å; V90-H104 HydrophobicContact CG2-CB 3.71Å; V90-L116 HydrophobicContact CG2-CD2 4.09Å; V90-V118 HydrophobicContact CG1-CG1 4.34Å; V90-V118 HydrophobicContact CG2-CG1 4.46Å; V90-V118 HydrophobicContact CG2-CG2 4.03Å
91	A	96.8	Very high	95.9	Very high	41 Å²	41	60 Å²	60	34%	0.339	32%	0.317	S	S	.	.	H	α-helix	trans	-68.5	-34.8	172.5	0	0	0	0	0	111.8	H87 E88 V89 K94 R95	H87-A91 WeakPolarHBondContact O-CB 3.48Å; H87-A91 PolarHBondContact O-N 2.88Å; E88-A91 CarbonylContact O-C 3.57Å; E88-A91 WeakPolarHBondContact O-CB 3.48Å; E88-A91 PolarHBondContact O-N 2.78Å; E88-A91 VanDerWaalsContact O-N 3.12Å; V89-A91 VanDerWaalsContact C-N 3.32Å; V89-A91 PolarHBondContact O-N 3.39Å; A91-K94 PolarHBondContact O-N 2.77Å; A91-R95 PolarHBondContact O-N 2.73Å
92	W	97.4	Very high	95.9	Very high	97 Å²	97	58.7 Å²	58.7	37%	0.367	31%	0.308	S	S	.	.	H	α-helix	trans	-65.9	-44.4	173.5	-60.6	-6.4	0	0	0	111.2	P84 E88 V89 V90 K94 R95 A96 M247	P84-W92 HydrophobicContact CB-CH2 3.78Å; P84-W92 HydrophobicContact CB-CZ2 4.45Å; P84-W92 HydrophobicContact CB-CZ3 4.18Å; P84-W92 HydrophobicContact CG-CH2 4.17Å; P84-W92 HydrophobicContact CG-CZ3 4.16Å; E88-W92 HydrophobicContact CB-CZ2 4.42Å; E88-W92 PolarHBondContact O-N 2.74Å; V89-W92 HydrophobicContact CG2-CE3 4.38Å; V89-W92 HydrophobicContact CG2-CZ3 4.36Å; V89-W92 WeakPolarHBondContact O-CB 3.47Å; V89-W92 PolarHBondContact O-N 2.95Å; V89-W92 VanDerWaalsContact O-N 3.15Å; V90-W92 VanDerWaalsContact C-N 3.35Å; W92-K94 VanDerWaalsContact C-N 3.31Å; W92-K94 PolarHBondContact O-N 3.45Å; W92-R95 PolarHBondContact O-N 3.22Å; W92-A96 VanDerWaalsContact O-CB 3.28Å; W92-A96 WeakPolarHBondContact O-CB 3.28Å; W92-A96 PolarHBondContact O-N 3.33Å; W92-M247 HydrophobicContact CB-CE 3.71Å
93	V	97.5	Very high	96	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-58.3	-44.2	174	175.6	0	0	0	0	111	I76 L78 V89 V90 R95 A96 L97 V118 M247 I250	I76-V93 HydrophobicContact CD1-CG1 4.01Å; L78-V93 HydrophobicContact CD2-CG2 4.04Å; V89-V93 WeakPolarHBondContact O-CG2 3.46Å; V89-V93 PolarHBondContact O-N 3.22Å; V90-V93 PolarHBondContact O-N 3.41Å; V93-R95 PolarHBondContact O-N 3.24Å; V93-A96 PolarHBondContact O-N 3.2Å; V93-L97 HydrophobicContact CG1-CD1 3.87Å; V93-L97 HydrophobicContact CG1-CG 4.49Å; V93-L97 PolarHBondContact O-N 3.41Å; V93-V118 HydrophobicContact CG1-CG1 4.14Å; V93-M247 HydrophobicContact CG2-CE 4.12Å; V93-M247 HydrophobicContact CG2-SD 3.59Å; V93-M247 VanDerWaalsContact CG2-SD 3.59Å; V93-I250 HydrophobicContact CG1-CD1 4.44Å; V93-I250 HydrophobicContact CG2-CD1 3.84Å
94	K	97.7	Very high	96	Very high	87 Å²	87	51.6 Å²	51.6	38%	0.378	27%	0.269	S	S	.	.	H	α-helix	trans	-56.8	-49.1	176.7	-177.5	178.2	160.4	170.8	0	111.7	V90 A91 W92 G98 V99 N100 T102	V90-K94 PolarHBondContact O-N 3.23Å; A91-K94 PolarHBondContact O-N 2.77Å; W92-K94 VanDerWaalsContact C-N 3.31Å; W92-K94 PolarHBondContact O-N 3.45Å; K94-G98 PolarHBondContact O-N 3.28Å; K94-V99 HydrophobicContact CB-CG2 4.46Å; K94-V99 WeakPolarHBondContact CE-O 3.48Å; K94-V99 HydrophobicContact CG-CG2 4.17Å; K94-V99 WeakPolarHBondContact CG-O 3.43Å; K94-V99 PolarHBondContact O-N 2.71Å; K94-N100 WeakPolarHBondContact CE-O 3.46Å; K94-N100 PolarHBondContact NZ-O 3.27Å; K94-T102 HydrophobicContact CB-CG2 3.76Å; K94-T102 HydrophobicContact CG-CG2 4.28Å
95	R	97.2	Very high	95.8	Very high	179 Å²	179	50.7 Å²	50.7	68%	0.675	26%	0.264	S	S	*	.	H	α-helix	trans	-66.6	-44.6	179.5	-74.3	-169.5	-76	117.2	-14.2	112.2	A91 W92 V93 L97 G98	A91-R95 PolarHBondContact O-N 2.73Å; W92-R95 PolarHBondContact O-N 3.22Å; V93-R95 PolarHBondContact O-N 3.24Å; R95-L97 PolarHBondContact O-N 3.38Å; R95-G98 PolarHBondContact O-N 3.42Å
96	A	95.7	Very high	95.6	Very high	20 Å²	20	50.1 Å²	50.1	17%	0.165	26%	0.262	C	S	.	.	H	α-helix	trans	-60.2	-44.3	-179.9	0	0	0	0	0	111.7	W92 V93 I250 L251 K254	W92-A96 VanDerWaalsContact O-CB 3.28Å; W92-A96 WeakPolarHBondContact O-CB 3.28Å; W92-A96 PolarHBondContact O-N 3.33Å; V93-A96 PolarHBondContact O-N 3.2Å; A96-I250 HydrophobicContact CB-CG2 4.14Å; A96-L251 HydrophobicContact CB-CD2 3.82Å; A96-K254 WeakPolarHBondContact O-CG 3.16Å
97	L	96	Very high	95.4	Very high	11 Å²	11	54.1 Å²	54.1	6%	0.058	29%	0.287	C	S	.	.	H	α-helix	trans	-84.3	-12.7	-179.1	-64.3	176.6	0	0	0	113.9	I76 V93 R95 V99 I120 I250 L266 I270	I76-L97 HydrophobicContact CD1-CD1 3.75Å; V93-L97 HydrophobicContact CG1-CD1 3.87Å; V93-L97 HydrophobicContact CG1-CG 4.49Å; V93-L97 PolarHBondContact O-N 3.41Å; R95-L97 PolarHBondContact O-N 3.38Å; L97-V99 VanDerWaalsContact C-N 3.33Å; L97-V99 HydrophobicContact CB-CG1 3.82Å; L97-V99 HydrophobicContact CB-CG2 4.25Å; L97-I120 HydrophobicContact CD1-CD1 3.73Å; L97-I250 HydrophobicContact CD2-CG2 3.9Å; L97-I250 HydrophobicContact CG-CG2 4.04Å; L97-L266 HydrophobicContact CD2-CD2 4Å; L97-I270 HydrophobicContact CD1-CD1 4.12Å; L97-I270 HydrophobicContact CD2-CD1 4.27Å
98	G	95.1	Very high	95.3	Very high	65 Å²	65	48.9 Å²	48.9	67%	0.67	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.9	32.9	-176.3	0	0	0	0	0	113.3	K94 R95	K94-G98 PolarHBondContact O-N 3.28Å; R95-G98 PolarHBondContact O-N 3.42Å
99	V	96.3	Very high	95	Very high	15 Å²	15	47.1 Å²	47.1	9%	0.091	26%	0.256	C	S	.	.			trans	-97.8	158.1	-175.8	-62.9	0	0	0	0	112	I71 K94 L97 T102 I120	I71-V99 HydrophobicContact CG2-CG1 3.61Å; K94-V99 HydrophobicContact CB-CG2 4.46Å; K94-V99 WeakPolarHBondContact CE-O 3.48Å; K94-V99 HydrophobicContact CG-CG2 4.17Å; K94-V99 WeakPolarHBondContact CG-O 3.43Å; K94-V99 PolarHBondContact O-N 2.71Å; L97-V99 VanDerWaalsContact C-N 3.33Å; L97-V99 HydrophobicContact CB-CG1 3.82Å; L97-V99 HydrophobicContact CB-CG2 4.25Å; V99-T102 HydrophobicContact CG2-CG2 3.75Å; V99-I120 HydrophobicContact CB-CG2 3.89Å; V99-I120 HydrophobicContact CG1-CG2 3.79Å; V99-I120 HydrophobicContact CG2-CG2 3.98Å
100	N	95.7	Very high	94.8	Very high	126 Å²	126	50.1 Å²	50.1	67%	0.674	28%	0.276	S	S	*	.	S	Bend	trans	-76.2	-39.8	-172.5	-65.6	-51.7	0	0	0	112.6	K94 D121	K94-N100 WeakPolarHBondContact CE-O 3.46Å; K94-N100 PolarHBondContact NZ-O 3.27Å; N100-D121 WeakPolarHBondContact CB-OD1 3.27Å; N100-D121 PolarHBondContact N-OD1 3.03Å
101	K	96.5	Very high	94.6	Very high	123 Å²	123	57.4 Å²	57.4	54%	0.535	31%	0.307	S	S	.	.			trans	-143.9	139.6	-172.8	-170.1	177.8	-178.1	176.3	0	111.1	D121 T124	K101-D121 WeakPolarHBondContact CA-OD1 3.14Å; K101-D121 WeakPolarHBondContact CB-OD1 3.42Å; K101-D121 PolarHBondContact N-OD1 2.96Å; K101-D121 PolarHBondContact O-N 3.21Å; K101-T124 HydrophobicContact CD-CG2 4.26Å; K101-T124 HydrophobicContact CG-CG2 3.99Å
102	T	96.8	Very high	94.5	Very high	26 Å²	26	55.5 Å²	55.5	16%	0.16	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	156.4	170	54.3	0	0	0	0	109.7	V90 K94 V99 V118 C119	V90-T102 WeakPolarHBondContact CG1-OG1 3.38Å; V90-T102 PolarHBondContact O-OG1 3.07Å; K94-T102 HydrophobicContact CB-CG2 3.76Å; K94-T102 HydrophobicContact CG-CG2 4.28Å; V99-T102 HydrophobicContact CG2-CG2 3.75Å; T102-V118 HydrophobicContact CG2-CG1 4.43Å; T102-C119 CarbonylContact C-O 3.54Å; T102-C119 VanDerWaalsContact CA-O 3.29Å; T102-C119 WeakPolarHBondContact CA-O 3.47Å
103	G	95.7	Very high	94.5	Very high	13 Å²	13	51.4 Å²	51.4	13%	0.134	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	159.7	172.5	0	0	0	0	0	110.4	V118 C119	G103-V118 CarbonylContact O-C 3.54Å; G103-V118 WeakPolarHBondContact O-CA 3.42Å; G103-C119 PolarHBondContact N-O 2.82Å; G103-C119 PolarHBondContact O-N 2.84Å
104	H	94.7	Very high	94.5	Very high	16 Å²	16	51.4 Å²	51.4	7%	0.074	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	153.7	-172.6	65.3	86.4	0	0	0	114.2	H87 V90 G106 T107 L116 I117 V127 Q131	H87-H104 AromaticContact CD2-NE2 3.85Å; H87-H104 AromaticContact NE2-NE2 3.62Å; V90-H104 HydrophobicContact CG2-CB 3.71Å; H104-G106 VanDerWaalsContact ND1-C 3.29Å; H104-G106 PolarHBondContact ND1-N 2.88Å; H104-G106 PolarHBondContact ND1-O 2.92Å; H104-G106 PolarHBondContact O-N 3.15Å; H104-T107 PolarHBondContact CE1-N 2.8Å; H104-T107 PolarHBondContact CE1-OG1 3.41Å; H104-L116 HydrophobicContact CB-CD1 3.85Å; H104-L116 HydrophobicContact CB-CG 4.23Å; H104-I117 CarbonylContact C-O 3.56Å; H104-I117 WeakPolarHBondContact CA-O 3.39Å; H104-V127 VanDerWaalsContact O-CG1 3.25Å; H104-V127 WeakPolarHBondContact O-CG1 3.48Å; H104-Q131 PolarHBondContact O-NE2 3.32Å
105	S	91	Very high	94.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.259	C	S	.	.	S	Bend	trans	-74.6	24.7	-175.8	68	0	0	0	0	115.9	I117 Q131 T235	S105-I117 PolarHBondContact N-O 2.92Å; S105-I117 WeakPolarHBondContact OG-CB 3.28Å; S105-I117 PolarHBondContact OG-N 2.81Å; S105-Q131 WeakPolarHBondContact O-CA 3.31Å; S105-T235 PolarHBondContact OG-OG1 3.29Å
106	G	89.4	Confident	94.4	Very high	15 Å²	15	38.7 Å²	38.7	16%	0.155	23%	0.227	C	C	.	.	S	Bend	trans	119.9	138	178.4	0	0	0	0	0	113.4	H104 L116 R232	H104-G106 VanDerWaalsContact ND1-C 3.29Å; H104-G106 PolarHBondContact ND1-N 2.88Å; H104-G106 PolarHBondContact ND1-O 2.92Å; H104-G106 PolarHBondContact O-N 3.15Å; G106-L116 WeakPolarHBondContact O-CD1 3.47Å; G106-R232 PolarHBondContact O-NH1 2.89Å; G106-R232 PolarHBondContact O-NH2 2.87Å
107	T	90.9	Very high	94.5	Very high	85 Å²	85	37.8 Å²	37.8	52%	0.521	22%	0.219	S	C	.	.	P	Polyproline II helix	trans	-67.3	134.2	-173.6	-44.9	0	0	0	0	111.3	H104	H104-T107 PolarHBondContact CE1-N 2.8Å; H104-T107 PolarHBondContact CE1-OG1 3.41Å
108	L	91.9	Very high	94.6	Very high	5 Å²	5	37.2 Å²	37.2	3%	0.026	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-100	140.8	162	-69.5	172.5	0	0	0	108.1	K80 S86 V112 Y137 R232	K80-L108 HydrophobicContact CB-CD1 4.17Å; K80-L108 HydrophobicContact CD-CB 3.72Å; K80-L108 HydrophobicContact CD-CD1 3.74Å; K80-L108 HydrophobicContact CD-CG 4.3Å; S86-L108 PolarHBondContact OG-N 2.82Å; S86-L108 PolarHBondContact OG-O 2.71Å; L108-V112 HydrophobicContact CB-CB 4.29Å; L108-V112 HydrophobicContact CB-CG1 4.35Å; L108-V112 HydrophobicContact CD2-CG1 3.72Å; L108-V112 HydrophobicContact CG-CG1 4.44Å; L108-Y137 HydrophobicContact CD2-CE1 4.13Å; L108-R232 HydrophobicContact CD1-CB 4.41Å; L108-R232 HydrophobicContact CD2-CB 3.92Å
109	D	89.7	Confident	94.7	Very high	57 Å²	57	34.1 Å²	34.1	31%	0.305	18%	0.184	S	C	.	.	P	Polyproline II helix	trans	-56.3	152.7	170.7	-72.3	-7.1	0	0	0	109.6	K80 K111 V112 R211	K80-D109 PolarHBondContact NZ-O 3.5Å; D109-K111 VanDerWaalsContact C-N 3.29Å; D109-K111 PolarHBondContact O-N 2.84Å; D109-V112 HydrophobicContact CB-CB 4.39Å; D109-V112 HydrophobicContact CB-CG2 3.73Å; D109-V112 WeakPolarHBondContact O-CB 3.33Å; D109-V112 PolarHBondContact O-N 3.45Å; D109-R211 IonicContact OD2-NH2 3.12Å; D109-R211 PolarHBondContact OD2-NH2 2.84Å; D109-R211 VanDerWaalsContact OD2-NH2 3.12Å
110	P	92.1	Very high	94.8	Very high	64 Å²	64	33.4 Å²	33.4	42%	0.416	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.6	-45	-178.5	-30.6	36.5	0	0	0	113.9	K80 N83 V112	K80-P110 PolarHBondContact NZ-O 2.81Å; K80-P110 VanDerWaalsContact NZ-O 3.07Å; N83-P110 CarbonylContact C-O 3.56Å; N83-P110 WeakPolarHBondContact CA-O 3.16Å; N83-P110 PolarHBondContact N-O 2.87Å; N83-P110 VanDerWaalsContact O-CB 3.32Å; N83-P110 WeakPolarHBondContact O-CB 3.34Å; P110-V112 PolarHBondContact O-N 3Å
111	K	92.3	Very high	94.8	Very high	160 Å²	160	28.7 Å²	28.7	70%	0.696	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-3.3	179.9	-63.5	-171.1	176.6	-171.9	0	115.1	D109	D109-K111 VanDerWaalsContact C-N 3.29Å; D109-K111 PolarHBondContact O-N 2.84Å
112	V	95.1	Very high	94.7	Very high	2 Å²	2	24.2 Å²	24.2	1%	0.012	13%	0.134	C	C	.	.			trans	-104	133.9	-171.9	-179.3	0	0	0	0	110	K80 L108 D109 P110 L230	K80-V112 PolarHBondContact NZ-O 2.86Å; L108-V112 HydrophobicContact CB-CB 4.29Å; L108-V112 HydrophobicContact CB-CG1 4.35Å; L108-V112 HydrophobicContact CD2-CG1 3.72Å; L108-V112 HydrophobicContact CG-CG1 4.44Å; D109-V112 HydrophobicContact CB-CB 4.39Å; D109-V112 HydrophobicContact CB-CG2 3.73Å; D109-V112 WeakPolarHBondContact O-CB 3.33Å; D109-V112 PolarHBondContact O-N 3.45Å; P110-V112 PolarHBondContact O-N 3Å; V112-L230 HydrophobicContact CG1-CB 4.04Å; V112-L230 HydrophobicContact CG1-CD2 3.87Å; V112-L230 HydrophobicContact CG1-CG 3.92Å; V112-L230 WeakPolarHBondContact CG1-O 3.28Å; V112-L230 HydrophobicContact CG2-CB 4Å; V112-L230 HydrophobicContact CG2-CD2 4.01Å; V112-L230 HydrophobicContact CG2-CG 4.43Å
113	S	97.1	Very high	94.7	Very high	10 Å²	10	23 Å²	23	7%	0.07	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	179.3	-179.5	67.4	0	0	0	0	113.3	K80 L230 R231 R232	K80-S113 WeakPolarHBondContact O-CA 3.09Å; K80-S113 VanDerWaalsContact O-CB 3.28Å; K80-S113 WeakPolarHBondContact O-CB 3.17Å; S113-L230 PolarHBondContact N-O 3.38Å; S113-R231 WeakPolarHBondContact O-CA 3.38Å; S113-R231 PolarHBondContact OG-NH1 2.85Å; S113-R232 PolarHBondContact O-N 2.88Å
114	G	97.1	Very high	94.7	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	104.8	-163.1	172.2	0	0	0	0	0	113.6	D79 K80 L116 R232	D79-G114 VanDerWaalsContact OD1-CA 3.23Å; D79-G114 WeakPolarHBondContact OD1-CA 3.38Å; D79-G114 PolarHBondContact OD1-N 3.22Å; D79-G114 VanDerWaalsContact OD1-N 3.15Å; K80-G114 PolarHBondContact N-O 3.4Å; K80-G114 PolarHBondContact O-N 3.48Å; G114-L116 PolarHBondContact O-N 3.43Å; G114-R232 CarbonylContact C-O 3.58Å; G114-R232 WeakPolarHBondContact CA-O 3.39Å
115	C	97.4	Very high	94.6	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	120.2	-168.3	-58.6	0	0	0	0	112.7	L78 R232 S233 T235 S239 E240 L244	L78-C115 CarbonylContact O-C 3.48Å; C115-R232 PolarHBondContact N-O 2.91Å; C115-R232 PolarHBondContact O-NE 3.03Å; C115-R232 PolarHBondContact O-NH2 2.81Å; C115-S233 PolarHBondContact SG-O 2.91Å; C115-T235 HydrophobicContact CB-CG2 3.87Å; C115-S239 VanDerWaalsContact SG-C 3.5Å; C115-E240 WeakPolarHBondContact SG-CG 3.41Å; C115-E240 PolarHBondContact SG-N 3Å; C115-L244 HydrophobicContact CB-CD1 4.36Å
116	L	96.9	Very high	94.8	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	107.1	170	-179.6	69.3	0	0	0	108	L78 K80 V90 H104 G106 G114 V118	L78-L116 WeakPolarHBondContact CB-O 3.38Å; L78-L116 PolarHBondContact N-O 3.31Å; L78-L116 PolarHBondContact O-N 3.17Å; K80-L116 HydrophobicContact CB-CB 4.1Å; K80-L116 HydrophobicContact CB-CD2 4.27Å; K80-L116 HydrophobicContact CD-CD2 4.39Å; K80-L116 HydrophobicContact CG-CD2 4.33Å; V90-L116 HydrophobicContact CG2-CD2 4.09Å; H104-L116 HydrophobicContact CB-CD1 3.85Å; H104-L116 HydrophobicContact CB-CG 4.23Å; G106-L116 WeakPolarHBondContact O-CD1 3.47Å; G114-L116 PolarHBondContact O-N 3.43Å; L116-V118 HydrophobicContact CD2-CG2 4.49Å; L116-V118 HydrophobicContact CG-CG2 4.38Å; L116-V118 PolarHBondContact O-N 2.86Å
117	I	97.4	Very high	95	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	119.2	176.3	-60.7	163.4	0	0	0	107.8	V75 I76 H104 S105 T235 M238 L276	V75-I117 HydrophobicContact CG1-CG2 3.33Å; I76-I117 CarbonylContact O-C 3.6Å; I76-I117 VanDerWaalsContact O-CA 3.31Å; I76-I117 WeakPolarHBondContact O-CA 3.44Å; H104-I117 CarbonylContact C-O 3.56Å; H104-I117 WeakPolarHBondContact CA-O 3.39Å; S105-I117 PolarHBondContact N-O 2.92Å; S105-I117 WeakPolarHBondContact OG-CB 3.28Å; S105-I117 PolarHBondContact OG-N 2.81Å; I117-T235 HydrophobicContact CD1-CG2 3.67Å; I117-T235 WeakPolarHBondContact CD1-O 3.27Å; I117-T235 HydrophobicContact CG1-CG2 3.65Å; I117-M238 HydrophobicContact CD1-CB 3.95Å; I117-M238 HydrophobicContact CD1-CG 3.81Å; I117-M238 HydrophobicContact CD1-SD 4.08Å; I117-M238 HydrophobicContact CG1-CB 4.16Å; I117-M238 HydrophobicContact CG1-CG 4.18Å; I117-M238 HydrophobicContact CG1-SD 3.92Å; I117-L276 HydrophobicContact CD1-CD2 3.95Å; I117-L276 HydrophobicContact CG2-CD1 4.27Å; I117-L276 HydrophobicContact CG2-CD2 4.16Å
118	V	97.6	Very high	95.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	119.3	173.3	-173.7	0	0	0	0	108.3	V75 I76 L78 V90 V93 T102 G103 L116	V75-V118 CarbonylContact C-O 3.59Å; V75-V118 WeakPolarHBondContact CA-O 3.34Å; I76-V118 HydrophobicContact CB-CB 4.41Å; I76-V118 PolarHBondContact N-O 3.33Å; I76-V118 PolarHBondContact O-N 2.72Å; L78-V118 HydrophobicContact CB-CG2 4.19Å; L78-V118 HydrophobicContact CD2-CG2 4.16Å; V90-V118 HydrophobicContact CG1-CG1 4.34Å; V90-V118 HydrophobicContact CG2-CG1 4.46Å; V90-V118 HydrophobicContact CG2-CG2 4.03Å; V93-V118 HydrophobicContact CG1-CG1 4.14Å; T102-V118 HydrophobicContact CG2-CG1 4.43Å; G103-V118 CarbonylContact O-C 3.54Å; G103-V118 WeakPolarHBondContact O-CA 3.42Å; L116-V118 HydrophobicContact CD2-CG2 4.49Å; L116-V118 HydrophobicContact CG-CG2 4.38Å; L116-V118 PolarHBondContact O-N 2.86Å
119	C	97.4	Very high	95	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	138.2	174.5	-62	0	0	0	0	109.4	T102 G103 A123 T124 V127	T102-C119 CarbonylContact C-O 3.54Å; T102-C119 VanDerWaalsContact CA-O 3.29Å; T102-C119 WeakPolarHBondContact CA-O 3.47Å; G103-C119 PolarHBondContact N-O 2.82Å; G103-C119 PolarHBondContact O-N 2.84Å; C119-A123 HydrophobicContact CB-CB 3.92Å; C119-A123 WeakPolarHBondContact CB-O 3.49Å; C119-T124 HydrophobicContact CB-CG2 4.47Å; C119-T124 WeakPolarHBondContact O-CG2 3.49Å; C119-V127 HydrophobicContact CB-CG2 3.83Å
120	I	97.7	Very high	95.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	141	179.8	-58.2	166.5	0	0	0	109.2	I71 K72 G74 I76 L97 V99 R122 A123 I270	I71-I120 HydrophobicContact CG2-CD1 4.44Å; I71-I120 HydrophobicContact CG2-CG2 4.31Å; I71-I120 WeakPolarHBondContact O-CB 3.37Å; I71-I120 VanDerWaalsContact O-CG2 3.25Å; I71-I120 WeakPolarHBondContact O-CG2 3.47Å; K72-I120 VanDerWaalsContact O-O 3.1Å; G74-I120 PolarHBondContact O-N 3.37Å; I76-I120 HydrophobicContact CD1-CD1 4.06Å; I76-I120 HydrophobicContact CG1-CD1 4.36Å; L97-I120 HydrophobicContact CD1-CD1 3.73Å; V99-I120 HydrophobicContact CB-CG2 3.89Å; V99-I120 HydrophobicContact CG1-CG2 3.79Å; V99-I120 HydrophobicContact CG2-CG2 3.98Å; I120-R122 PolarHBondContact O-N 2.97Å; I120-A123 WeakPolarHBondContact O-CA 3.32Å; I120-A123 VanDerWaalsContact O-CB 3.26Å; I120-A123 WeakPolarHBondContact O-CB 3.44Å; I120-A123 PolarHBondContact O-N 3.05Å; I120-I270 HydrophobicContact CD1-CD1 4.27Å; I120-I270 HydrophobicContact CD1-CG1 4.45Å; I120-I270 HydrophobicContact CD1-CG2 4.35Å
121	D	96.2	Very high	95.1	Very high	27 Å²	27	28.6 Å²	28.6	14%	0.144	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	35.8	-100.9	172.7	-66.5	-26	0	0	0	114.8	K72 N100 K101 A123 T124	K72-D121 HydrophobicContact CB-CB 4.34Å; K72-D121 HydrophobicContact CG-CB 4.48Å; N100-D121 WeakPolarHBondContact CB-OD1 3.27Å; N100-D121 PolarHBondContact N-OD1 3.03Å; K101-D121 WeakPolarHBondContact CA-OD1 3.14Å; K101-D121 WeakPolarHBondContact CB-OD1 3.42Å; K101-D121 PolarHBondContact N-OD1 2.96Å; K101-D121 PolarHBondContact O-N 3.21Å; D121-A123 VanDerWaalsContact C-N 3.33Å; D121-A123 PolarHBondContact O-N 2.91Å; D121-T124 VanDerWaalsContact O-CB 3.27Å; D121-T124 WeakPolarHBondContact O-CB 3.4Å; D121-T124 VanDerWaalsContact O-CG2 3.3Å; D121-T124 WeakPolarHBondContact O-CG2 3.4Å; D121-T124 PolarHBondContact O-N 3.37Å; D121-T124 PolarHBondContact O-OG1 3.04Å
122	R	94	Very high	95	Very high	29 Å²	29	24.9 Å²	24.9	11%	0.109	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-63.6	-39.1	-177.7	-169.6	-179.2	-63.5	159.4	4.7	111.6	E69 K72 I120 T124 R125 I354	E69-R122 IonicContact OE1-NH2 2.67Å; E69-R122 IonicContact OE2-CZ 3.86Å; E69-R122 IonicContact OE2-NH1 3.5Å; E69-R122 PolarHBondContact OE2-NH1 3.44Å; E69-R122 VanDerWaalsContact OE2-NH1 3.07Å; E69-R122 IonicContact OE2-NH2 2.64Å; E69-R122 PolarHBondContact OE2-NH2 3.4Å; K72-R122 VanDerWaalsContact O-CB 3.23Å; K72-R122 WeakPolarHBondContact O-CB 3.47Å; K72-R122 PolarHBondContact O-N 3.37Å; I120-R122 PolarHBondContact O-N 2.97Å; R122-T124 PolarHBondContact O-N 3.15Å; R122-R125 WeakPolarHBondContact O-CB 3.48Å; R122-R125 WeakPolarHBondContact O-CD 3.28Å; R122-R125 VanDerWaalsContact O-CG 3.29Å; R122-R125 WeakPolarHBondContact O-CG 3.23Å; R122-R125 PolarHBondContact O-N 3.48Å; R122-I354 WeakPolarHBondContact CD-O 3.4Å; R122-I354 WeakPolarHBondContact CG-O 3.34Å
123	A	96.1	Very high	94.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-64.2	-19.4	176.8	0	0	0	0	0	112.3	G74 V75 C119 I120 D121 R125 L126 L273	G74-A123 VanDerWaalsContact O-CB 3.23Å; G74-A123 WeakPolarHBondContact O-CB 3.21Å; V75-A123 HydrophobicContact CG2-CB 3.77Å; C119-A123 HydrophobicContact CB-CB 3.92Å; C119-A123 WeakPolarHBondContact CB-O 3.49Å; I120-A123 WeakPolarHBondContact O-CA 3.32Å; I120-A123 VanDerWaalsContact O-CB 3.26Å; I120-A123 WeakPolarHBondContact O-CB 3.44Å; I120-A123 PolarHBondContact O-N 3.05Å; D121-A123 VanDerWaalsContact C-N 3.33Å; D121-A123 PolarHBondContact O-N 2.91Å; A123-R125 PolarHBondContact O-N 2.86Å; A123-L126 WeakPolarHBondContact O-CB 3.25Å; A123-L126 PolarHBondContact O-N 3.25Å; A123-L273 HydrophobicContact CB-CB 3.89Å; A123-L273 HydrophobicContact CB-CD2 4.16Å
124	T	96.1	Very high	94.7	Very high	20 Å²	20	27 Å²	27	12%	0.123	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-58.8	-22	176	68.7	0	0	0	0	112.9	K101 C119 D121 R122 L126 V127	K101-T124 HydrophobicContact CD-CG2 4.26Å; K101-T124 HydrophobicContact CG-CG2 3.99Å; C119-T124 HydrophobicContact CB-CG2 4.47Å; C119-T124 WeakPolarHBondContact O-CG2 3.49Å; D121-T124 VanDerWaalsContact O-CB 3.27Å; D121-T124 WeakPolarHBondContact O-CB 3.4Å; D121-T124 VanDerWaalsContact O-CG2 3.3Å; D121-T124 WeakPolarHBondContact O-CG2 3.4Å; D121-T124 PolarHBondContact O-N 3.37Å; D121-T124 PolarHBondContact O-OG1 3.04Å; R122-T124 PolarHBondContact O-N 3.15Å; T124-L126 PolarHBondContact O-N 3.12Å; T124-V127 VanDerWaalsContact O-CB 3.3Å; T124-V127 WeakPolarHBondContact O-CB 3.41Å; T124-V127 VanDerWaalsContact O-CG2 3.28Å; T124-V127 WeakPolarHBondContact O-CG2 3.48Å; T124-V127 PolarHBondContact O-N 3.22Å; T124-V127 VanDerWaalsContact O-N 3.09Å
125	R	94.2	Very high	94.6	Very high	94 Å²	94	27.6 Å²	27.6	36%	0.355	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	-58.5	-29.1	171.9	-62.4	171.1	-177.2	-102.4	7.3	111.6	R122 A123 R352 V353 I354 E356	R122-R125 WeakPolarHBondContact O-CB 3.48Å; R122-R125 WeakPolarHBondContact O-CD 3.28Å; R122-R125 VanDerWaalsContact O-CG 3.29Å; R122-R125 WeakPolarHBondContact O-CG 3.23Å; R122-R125 PolarHBondContact O-N 3.48Å; A123-R125 PolarHBondContact O-N 2.86Å; R125-R352 WeakPolarHBondContact O-CD 3.36Å; R125-R352 PolarHBondContact O-NH1 3.43Å; R125-V353 WeakPolarHBondContact CD-O 3.44Å; R125-I354 WeakPolarHBondContact CD-O 3.3Å; R125-E356 IonicContact CZ-OE1 3.59Å; R125-E356 IonicContact NE-OE1 2.79Å; R125-E356 IonicContact NH2-OE1 2.75Å; R125-E356 PolarHBondContact NH2-OE1 2.93Å; R125-E356 IonicContact NH2-OE2 3.43Å
126	L	94.1	Very high	94.6	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-82.6	-8.9	178.7	-63.9	178.7	0	0	0	114.4	A123 T124 K128 S129 Q130 L273 L276 L277 L329 I354	A123-L126 WeakPolarHBondContact O-CB 3.25Å; A123-L126 PolarHBondContact O-N 3.25Å; T124-L126 PolarHBondContact O-N 3.12Å; L126-K128 VanDerWaalsContact C-N 3.32Å; L126-K128 PolarHBondContact O-N 2.77Å; L126-S129 PolarHBondContact O-N 2.83Å; L126-S129 VanDerWaalsContact O-N 3.1Å; L126-S129 PolarHBondContact O-OG 2.86Å; L126-Q130 WeakPolarHBondContact O-CG 3.21Å; L126-Q130 PolarHBondContact O-N 2.95Å; L126-Q130 VanDerWaalsContact O-N 3.09Å; L126-L273 HydrophobicContact CD1-CB 4.05Å; L126-L273 HydrophobicContact CD1-CD1 4.23Å; L126-L276 HydrophobicContact CD1-CB 4.49Å; L126-L276 HydrophobicContact CD1-CD1 4.14Å; L126-L277 HydrophobicContact CD1-CD1 4.34Å; L126-L277 HydrophobicContact CD1-CD2 4.29Å; L126-L277 HydrophobicContact CD1-CG 4.36Å; L126-L277 HydrophobicContact CD2-CD2 4.13Å; L126-L329 HydrophobicContact CD2-CD1 3.81Å; L126-L329 HydrophobicContact CD2-CG 4.45Å; L126-I354 HydrophobicContact CD2-CD1 3.69Å; L126-I354 HydrophobicContact CD2-CG1 3.92Å; L126-I354 HydrophobicContact CG-CD1 4.49Å
127	V	94.5	Very high	94.7	Very high	19 Å²	19	30.1 Å²	30.1	12%	0.115	16%	0.161	C	C	.	.	H	α-helix	trans	-54.6	-45.6	-173	165.4	0	0	0	0	112.6	H104 C119 T124 S129 Q130 Q131	H104-V127 VanDerWaalsContact O-CG1 3.25Å; H104-V127 WeakPolarHBondContact O-CG1 3.48Å; C119-V127 HydrophobicContact CB-CG2 3.83Å; T124-V127 VanDerWaalsContact O-CB 3.3Å; T124-V127 WeakPolarHBondContact O-CB 3.41Å; T124-V127 VanDerWaalsContact O-CG2 3.28Å; T124-V127 WeakPolarHBondContact O-CG2 3.48Å; T124-V127 PolarHBondContact O-N 3.22Å; T124-V127 VanDerWaalsContact O-N 3.09Å; V127-S129 PolarHBondContact O-N 2.89Å; V127-Q130 PolarHBondContact O-N 2.95Å; V127-Q131 HydrophobicContact CG1-CG 4.2Å; V127-Q131 VanDerWaalsContact CG1-NE2 3.3Å; V127-Q131 WeakPolarHBondContact O-CB 3.36Å; V127-Q131 VanDerWaalsContact O-CG 3.28Å; V127-Q131 WeakPolarHBondContact O-CG 3.38Å; V127-Q131 PolarHBondContact O-N 3.29Å
128	K	91.5	Very high	94.7	Very high	132 Å²	132	32.2 Å²	32.2	57%	0.574	17%	0.173	S	C	*	.	H	α-helix	trans	-63.7	-37.8	-178.7	-164.9	177.3	-177.4	174.6	0	112.9	L126 S132 R352	L126-K128 VanDerWaalsContact C-N 3.32Å; L126-K128 PolarHBondContact O-N 2.77Å; K128-S132 PolarHBondContact O-N 2.86Å; K128-S132 PolarHBondContact O-OG 2.87Å; K128-R352 VanDerWaalsContact CB-NH1 3.3Å
129	S	89.9	Confident	94.8	Very high	27 Å²	27	32.2 Å²	32.2	19%	0.189	17%	0.173	C	C	.	.	H	α-helix	trans	-69.7	-40.2	177.6	60.8	0	0	0	0	110.6	L126 V127 Q131 S132 A133	L126-S129 PolarHBondContact O-N 2.83Å; L126-S129 VanDerWaalsContact O-N 3.1Å; L126-S129 PolarHBondContact O-OG 2.86Å; V127-S129 PolarHBondContact O-N 2.89Å; S129-Q131 PolarHBondContact O-N 2.89Å; S129-S132 PolarHBondContact O-N 3.49Å; S129-A133 PolarHBondContact O-N 2.85Å
130	Q	91.7	Very high	94.8	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.009	19%	0.186	C	C	.	.	H	α-helix	trans	-69	-33.3	177	-59.8	-51.3	-49.8	0	0	113.5	L126 V127 S132 A133 K135 L276	L126-Q130 WeakPolarHBondContact O-CG 3.21Å; L126-Q130 PolarHBondContact O-N 2.95Å; L126-Q130 VanDerWaalsContact O-N 3.09Å; V127-Q130 PolarHBondContact O-N 2.95Å; Q130-S132 VanDerWaalsContact C-N 3.31Å; Q130-S132 PolarHBondContact O-N 2.7Å; Q130-A133 PolarHBondContact O-N 3.22Å; Q130-K135 PolarHBondContact O-NZ 3.38Å; Q130-L276 HydrophobicContact CG-CD1 3.88Å
131	Q	92.9	Very high	94.8	Very high	78 Å²	78	34.7 Å²	34.7	36%	0.364	19%	0.186	S	C	.	.	H	α-helix	trans	-60.5	-42.9	174.2	-79	173.4	-7.3	0	0	111.6	H104 S105 V127 S129 A133 K135 A206	H104-Q131 PolarHBondContact O-NE2 3.32Å; S105-Q131 WeakPolarHBondContact O-CA 3.31Å; V127-Q131 HydrophobicContact CG1-CG 4.2Å; V127-Q131 VanDerWaalsContact CG1-NE2 3.3Å; V127-Q131 WeakPolarHBondContact O-CB 3.36Å; V127-Q131 VanDerWaalsContact O-CG 3.28Å; V127-Q131 WeakPolarHBondContact O-CG 3.38Å; V127-Q131 PolarHBondContact O-N 3.29Å; S129-Q131 PolarHBondContact O-N 2.89Å; Q131-A133 VanDerWaalsContact C-N 3.31Å; Q131-A133 PolarHBondContact O-N 3.48Å; Q131-K135 PolarHBondContact O-NZ 3.33Å; Q131-A206 WeakPolarHBondContact O-CB 3.36Å
132	S	90.4	Very high	94.9	Very high	83 Å²	83	37.9 Å²	37.9	58%	0.58	20%	0.196	S	C	*	.	H	α-helix	trans	-75	-19	-177.4	-49.8	0	0	0	0	113.4	K128 S129 Q130	K128-S132 PolarHBondContact O-N 2.86Å; K128-S132 PolarHBondContact O-OG 2.87Å; S129-S132 PolarHBondContact O-N 3.49Å; Q130-S132 VanDerWaalsContact C-N 3.31Å; Q130-S132 PolarHBondContact O-N 2.7Å
133	A	91.7	Very high	95	Very high	23 Å²	23	36.6 Å²	36.6	19%	0.19	19%	0.192	C	C	.	.	S	Bend	trans	-65.9	153.9	-178.8	0	0	0	0	0	112.5	S129 Q130 Q131 K135 G236	S129-A133 PolarHBondContact O-N 2.85Å; Q130-A133 PolarHBondContact O-N 3.22Å; Q131-A133 VanDerWaalsContact C-N 3.31Å; Q131-A133 PolarHBondContact O-N 3.48Å; A133-K135 PolarHBondContact O-NZ 2.99Å; A133-G236 VanDerWaalsContact CB-CA 3.48Å
134	G	93.2	Very high	95	Very high	33 Å²	33	42.4 Å²	42.4	34%	0.34	22%	0.218	S	C	.	.			trans	-58.4	155.2	177.1	0	0	0	0	0	113.4	C204 G236	G134-C204 WeakPolarHBondContact CA-O 3.39Å; G134-G236 WeakPolarHBondContact O-CA 3.38Å; G134-G236 PolarHBondContact O-N 3.43Å
135	K	96.4	Very high	94.9	Very high	12 Å²	12	47.6 Å²	47.6	5%	0.052	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	150.8	-176.3	-55.7	-62.3	-171	-89.1	0	110.1	Q130 Q131 A133 Y137 R203 C204 T235	Q130-K135 PolarHBondContact O-NZ 3.38Å; Q131-K135 PolarHBondContact O-NZ 3.33Å; A133-K135 PolarHBondContact O-NZ 2.99Å; K135-Y137 HydrophobicContact CB-CD2 4.32Å; K135-Y137 HydrophobicContact CB-CE2 3.51Å; K135-Y137 HydrophobicContact CG-CE2 4.43Å; K135-R203 WeakPolarHBondContact O-CA 3.35Å; K135-C204 PolarHBondContact N-O 3.26Å; K135-C204 PolarHBondContact O-N 3Å; K135-T235 WeakPolarHBondContact CD-OG1 3.48Å; K135-T235 WeakPolarHBondContact CE-OG1 3.3Å
136	E	97.7	Very high	94.7	Very high	31 Å²	31	46.4 Å²	46.4	15%	0.145	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	138.3	173	-164.2	179.1	115.1	0	0	109.5	M201 V202 R203 R232 S233 K234	E136-M201 HydrophobicContact CG-CG 4.25Å; E136-M201 HydrophobicContact CG-SD 3.87Å; E136-V202 CarbonylContact C-O 3.59Å; E136-V202 VanDerWaalsContact CA-O 3.27Å; E136-V202 WeakPolarHBondContact CA-O 3.4Å; E136-R203 HydrophobicContact CB-CG 4.29Å; E136-R203 HydrophobicContact CG-CG 3.73Å; E136-R203 IonicContact OE2-CZ 2.68Å; E136-R203 IonicContact OE2-NE 3.53Å; E136-R203 PolarHBondContact OE2-NE 3.43Å; E136-R203 IonicContact OE2-NH2 2.85Å; E136-R203 PolarHBondContact OE2-NH2 2.74Å; E136-R232 CarbonylContact O-C 3.5Å; E136-R232 WeakPolarHBondContact O-CA 3.38Å; E136-R232 WeakPolarHBondContact O-CG 3.28Å; E136-S233 WeakPolarHBondContact CB-OG 3.27Å; E136-S233 WeakPolarHBondContact CG-OG 3.29Å; E136-S233 PolarHBondContact O-N 3.2Å; E136-S233 PolarHBondContact O-OG 2.74Å; E136-S233 PolarHBondContact OE1-OG 3.1Å; E136-S233 VanDerWaalsContact OE1-OG 3.11Å; E136-K234 HydrophobicContact CB-CB 3.52Å; E136-K234 HydrophobicContact CB-CD 4.42Å; E136-K234 PolarHBondContact N-O 2.77Å; E136-K234 PolarHBondContact O-N 2.82Å
137	Y	98.1	Very high	94.4	Very high	23 Å²	23	47.4 Å²	47.4	9%	0.09	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	148	-179.3	-61.8	-90.2	0	0	0	111	L108 K135 M201 V202 V210 L230 R231 R232	L108-Y137 HydrophobicContact CD2-CE1 4.13Å; K135-Y137 HydrophobicContact CB-CD2 4.32Å; K135-Y137 HydrophobicContact CB-CE2 3.51Å; K135-Y137 HydrophobicContact CG-CE2 4.43Å; Y137-M201 CarbonylContact O-C 3.51Å; Y137-M201 WeakPolarHBondContact O-CA 3.45Å; Y137-V202 PolarHBondContact N-O 2.98Å; Y137-V202 PolarHBondContact O-N 2.79Å; Y137-V210 HydrophobicContact CD2-CG2 3.77Å; Y137-V210 HydrophobicContact CE2-CG2 4.25Å; Y137-V210 HydrophobicContact CG-CG2 3.93Å; Y137-L230 HydrophobicContact CD1-CD1 3.94Å; Y137-L230 HydrophobicContact CD1-CD2 3.95Å; Y137-L230 HydrophobicContact CD1-CG 3.9Å; Y137-L230 HydrophobicContact CE1-CD2 4.21Å; Y137-L230 HydrophobicContact CG-CD1 4.13Å; Y137-R231 CarbonylContact C-O 3.59Å; Y137-R231 VanDerWaalsContact CA-O 3.28Å; Y137-R231 WeakPolarHBondContact CA-O 3.48Å; Y137-R232 HydrophobicContact CD1-CB 3.71Å; Y137-R232 HydrophobicContact CD1-CG 3.96Å; Y137-R232 HydrophobicContact CE1-CB 3.59Å; Y137-R232 HydrophobicContact CE1-CG 3.63Å
138	V	98	Very high	94	Very high	43 Å²	43	52.5 Å²	52.5	26%	0.261	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126	162.9	178.5	0	0	0	0	106.6	L199 I200 R231	V138-L199 HydrophobicContact CG1-CD1 3.47Å; V138-L199 VanDerWaalsContact CG1-CD1 3.47Å; V138-L199 HydrophobicContact CG1-CG 4.25Å; V138-I200 WeakPolarHBondContact CA-O 3.11Å; V138-R231 PolarHBondContact N-O 3.4Å; V138-R231 PolarHBondContact O-N 2.92Å
139	C	98.1	Very high	93.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	132.3	-170.7	-178.5	0	0	0	0	110.2	L199 I200 V210 E229 L230	C139-L199 WeakPolarHBondContact O-CA 3.03Å; C139-I200 HydrophobicContact CB-CD1 4.27Å; C139-I200 HydrophobicContact CB-CG1 3.72Å; C139-I200 PolarHBondContact N-O 2.97Å; C139-I200 PolarHBondContact O-N 2.83Å; C139-V210 HydrophobicContact CB-CG1 3.85Å; C139-E229 WeakPolarHBondContact CA-O 3.47Å; C139-L230 HydrophobicContact CB-CD1 3.59Å
140	I	98.1	Very high	93.9	Very high	51 Å²	51	53.4 Å²	53.4	26%	0.262	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	120.2	166.7	-58.4	177.5	0	0	0	107.2	L197 G198 L199 E228 E229	I140-L197 HydrophobicContact CG2-CD2 3.94Å; I140-G198 CarbonylContact C-O 3.56Å; I140-G198 WeakPolarHBondContact CA-O 3.21Å; I140-L199 HydrophobicContact CG1-CD1 3.83Å; I140-E228 HydrophobicContact CB-CB 4.35Å; I140-E228 HydrophobicContact CG2-CB 4.04Å; I140-E228 PolarHBondContact O-N 2.86Å; I140-E229 HydrophobicContact CB-CB 4.16Å; I140-E229 HydrophobicContact CD1-CB 4.18Å; I140-E229 HydrophobicContact CG1-CB 4.36Å; I140-E229 PolarHBondContact N-O 3.2Å; I140-E229 PolarHBondContact O-N 3.24Å
141	F	97.6	Very high	94	Very high	1 Å²	1	60.6 Å²	60.6	0%	0.004	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	149.7	172.6	73.2	-87.8	0	0	0	110	L143 I153 L188 Y191 L197 G198 I200 C214 L217 V226	F141-L143 HydrophobicContact CD2-CD2 3.83Å; F141-L143 HydrophobicContact CD2-CG 4.12Å; F141-L143 HydrophobicContact CE2-CD1 4.24Å; F141-L143 HydrophobicContact CE2-CD2 3.73Å; F141-L143 HydrophobicContact CE2-CG 3.78Å; F141-I153 HydrophobicContact CZ-CG2 3.97Å; F141-L188 HydrophobicContact CE1-CD1 3.99Å; F141-L188 HydrophobicContact CZ-CD1 4.23Å; F141-Y191 HydrophobicContact CE2-CE2 4.28Å; F141-Y191 HydrophobicContact CZ-CD2 4.12Å; F141-Y191 HydrophobicContact CZ-CE2 4.29Å; F141-L197 CarbonylContact O-C 3.56Å; F141-L197 WeakPolarHBondContact O-CA 3.38Å; F141-G198 WeakPolarHBondContact CD1-O 3.28Å; F141-G198 VanDerWaalsContact CE1-C 3.45Å; F141-G198 VanDerWaalsContact CE1-CA 3.4Å; F141-G198 PolarHBondContact N-O 3.09Å; F141-G198 PolarHBondContact O-N 3.5Å; F141-I200 HydrophobicContact CD1-CD1 4.44Å; F141-I200 HydrophobicContact CD1-CG1 4.4Å; F141-I200 HydrophobicContact CD1-CG2 3.86Å; F141-I200 HydrophobicContact CE1-CG2 3.56Å; F141-C214 HydrophobicContact CB-CB 4.29Å; F141-L217 HydrophobicContact CD1-CD2 4.1Å; F141-L217 HydrophobicContact CD2-CD2 3.76Å; F141-L217 HydrophobicContact CE1-CD2 4.01Å; F141-L217 HydrophobicContact CE2-CD2 3.64Å; F141-L217 HydrophobicContact CG-CD2 3.99Å; F141-L217 HydrophobicContact CZ-CD2 3.77Å; F141-V226 CarbonylContact C-O 3.59Å; F141-V226 VanDerWaalsContact CA-O 3.31Å; F141-V226 WeakPolarHBondContact CA-O 3.43Å
142	R	97.7	Very high	94	Very high	95 Å²	95	61.6 Å²	61.6	36%	0.358	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	129.6	172.8	-173.6	-174.6	-69.9	-102.6	4.2	109.2	N196 L197 G225 V226 E228	R142-N196 CarbonylContact C-O 3.58Å; R142-N196 WeakPolarHBondContact CA-O 3.44Å; R142-L197 HydrophobicContact CB-CD2 3.63Å; R142-L197 HydrophobicContact CG-CD2 3.92Å; R142-G225 CarbonylContact O-C 3.58Å; R142-G225 WeakPolarHBondContact O-CA 3.34Å; R142-V226 HydrophobicContact CB-CG1 3.9Å; R142-V226 PolarHBondContact N-O 3.43Å; R142-V226 PolarHBondContact O-N 3.16Å; R142-E228 IonicContact CZ-OE2 3.66Å; R142-E228 IonicContact NE-OE2 2.9Å; R142-E228 PolarHBondContact NE-OE2 3.35Å; R142-E228 IonicContact NH2-OE2 3.44Å
143	L	97.3	Very high	94.2	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.01	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	143.8	168.9	-56.6	-179.7	0	0	0	109.5	F141 E145 V147 I153 Y191 N196 L221	F141-L143 HydrophobicContact CD2-CD2 3.83Å; F141-L143 HydrophobicContact CD2-CG 4.12Å; F141-L143 HydrophobicContact CE2-CD1 4.24Å; F141-L143 HydrophobicContact CE2-CD2 3.73Å; F141-L143 HydrophobicContact CE2-CG 3.78Å; L143-E145 VanDerWaalsContact C-N 3.34Å; L143-E145 WeakPolarHBondContact CB-O 3.37Å; L143-V147 HydrophobicContact CD1-CG2 3.87Å; L143-I153 HydrophobicContact CD1-CD1 4.15Å; L143-Y191 HydrophobicContact CD1-CE2 4.22Å; L143-N196 HydrophobicContact CB-CB 4.28Å; L143-N196 PolarHBondContact N-O 2.98Å; L143-N196 WeakPolarHBondContact O-CB 3.45Å; L143-L221 HydrophobicContact CD1-CD1 3.79Å; L143-L221 HydrophobicContact CD2-CD1 3.96Å
144	H	95.8	Very high	94.4	Very high	121 Å²	121	60.6 Å²	60.6	56%	0.56	30%	0.302	S	S	*	.	S	Bend	trans	-74.1	-31.1	179.5	-51.9	161.1	0	0	0	111.8	C223 G224	H144-C223 WeakPolarHBondContact CB-O 3.32Å; H144-G224 PolarHBondContact N-O 3.06Å
145	E	93.2	Very high	94.5	Very high	129 Å²	129	66.4 Å²	66.4	60%	0.603	32%	0.318	S	S	*	.	S	Bend	trans	-123.8	150.4	175.7	-53.1	177.5	176.2	0	0	110.6	L143 C223	L143-E145 VanDerWaalsContact C-N 3.34Å; L143-E145 WeakPolarHBondContact CB-O 3.37Å; E145-C223 HydrophobicContact CB-CB 3.75Å; E145-C223 HydrophobicContact CG-CB 4.35Å
146	S	90.2	Very high	94.5	Very high	70 Å²	70	66.5 Å²	66.5	49%	0.49	32%	0.321	S	S	.	.			trans	-70.5	133.1	177.7	57.8	0	0	0	0	110.8	N196	S146-N196 VanDerWaalsContact CA-OD1 3.3Å; S146-N196 WeakPolarHBondContact CA-OD1 3.28Å; S146-N196 WeakPolarHBondContact CB-OD1 3.47Å
147	V	89.2	Confident	94.5	Very high	20 Å²	20	65.1 Å²	65.1	12%	0.121	31%	0.314	C	S	.	.			trans	-98.8	134.1	171.9	179.1	0	0	0	0	109.1	L143 E149 K152 I153 L221	L143-V147 HydrophobicContact CD1-CG2 3.87Å; V147-E149 PolarHBondContact O-N 2.71Å; V147-K152 HydrophobicContact CG1-CB 4.3Å; V147-I153 HydrophobicContact CB-CD1 4.14Å; V147-I153 HydrophobicContact CB-CG1 4.15Å; V147-I153 HydrophobicContact CG1-CG1 4.15Å; V147-L221 HydrophobicContact CG2-CB 4.45Å
148	D	84.6	Confident	94.3	Very high	126 Å²	126	68.4 Å²	68.4	67%	0.674	33%	0.33	S	S	*	.	S	Bend	trans	-63.4	-41	-173.2	-67.2	-44.2	0	0	0	113.6	K193	D148-K193 PolarHBondContact O-NZ 2.81Å; D148-K193 VanDerWaalsContact O-NZ 3.08Å
149	E	88.7	Confident	94.2	Very high	93 Å²	93	68.9 Å²	68.9	44%	0.435	34%	0.344	S	S	.	.			trans	-113.5	118.7	-172.5	-68.9	171.8	-129.1	0	0	112.5	V147 K151 K152	V147-E149 PolarHBondContact O-N 2.71Å; E149-K151 PolarHBondContact O-N 2.83Å; E149-K152 HydrophobicContact CB-CB 4.42Å; E149-K152 HydrophobicContact CB-CD 4.05Å; E149-K152 HydrophobicContact CB-CG 3.97Å; E149-K152 VanDerWaalsContact CD-CE 3.44Å; E149-K152 WeakPolarHBondContact O-CB 3.48Å; E149-K152 PolarHBondContact O-N 3.23Å; E149-K152 WeakPolarHBondContact OE1-CE 3.36Å; E149-K152 IonicContact OE1-NZ 2.85Å; E149-K152 PolarHBondContact OE1-NZ 3.15Å; E149-K152 WeakPolarHBondContact OE2-CE 3.22Å
150	I	91.4	Very high	94.1	Very high	86 Å²	86	69.4 Å²	69.4	44%	0.441	35%	0.347	S	S	.	.	H	α-helix	trans	-58.7	-33.2	174.2	-58.4	173.3	0	0	0	111.4	K152 I153 Q154 L188 Y191	I150-K152 VanDerWaalsContact C-N 3.26Å; I150-K152 PolarHBondContact O-N 3.31Å; I150-I153 WeakPolarHBondContact O-CB 3.38Å; I150-I153 PolarHBondContact O-N 2.64Å; I150-I153 VanDerWaalsContact O-N 3.11Å; I150-Q154 PolarHBondContact O-N 2.83Å; I150-L188 HydrophobicContact CG2-CD2 4.47Å; I150-Y191 HydrophobicContact CG1-CD1 4.16Å
151	K	93.2	Very high	94.1	Very high	153 Å²	153	70 Å²	70	67%	0.665	35%	0.353	S	S	*	.	H	α-helix	trans	-60.4	-33.4	177.3	-69.4	-176.3	-179.9	177.4	0	112.7	E149 K155	E149-K151 PolarHBondContact O-N 2.83Å; K151-K155 WeakPolarHBondContact O-CG 3.4Å; K151-K155 PolarHBondContact O-N 2.92Å
152	K	94	Very high	94	Very high	99 Å²	99	71.3 Å²	71.3	43%	0.43	37%	0.367	S	S	.	.	H	α-helix	trans	-66.8	-42.3	175.6	-70	177.6	-179.2	159	0	110.7	V147 E149 I150 K155 A156	V147-K152 HydrophobicContact CG1-CB 4.3Å; E149-K152 HydrophobicContact CB-CB 4.42Å; E149-K152 HydrophobicContact CB-CD 4.05Å; E149-K152 HydrophobicContact CB-CG 3.97Å; E149-K152 VanDerWaalsContact CD-CE 3.44Å; E149-K152 WeakPolarHBondContact O-CB 3.48Å; E149-K152 PolarHBondContact O-N 3.23Å; E149-K152 WeakPolarHBondContact OE1-CE 3.36Å; E149-K152 IonicContact OE1-NZ 2.85Å; E149-K152 PolarHBondContact OE1-NZ 3.15Å; E149-K152 WeakPolarHBondContact OE2-CE 3.22Å; I150-K152 VanDerWaalsContact C-N 3.26Å; I150-K152 PolarHBondContact O-N 3.31Å; K152-K155 PolarHBondContact O-N 3.15Å; K152-A156 WeakPolarHBondContact O-CB 3.26Å; K152-A156 PolarHBondContact O-N 2.81Å
153	I	95	Very high	94	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-62.5	-48	176	-55	176.5	0	0	0	110.4	F141 L143 V147 I150 K155 A156 V157 L188 Y191 L221	F141-I153 HydrophobicContact CZ-CG2 3.97Å; L143-I153 HydrophobicContact CD1-CD1 4.15Å; V147-I153 HydrophobicContact CB-CD1 4.14Å; V147-I153 HydrophobicContact CB-CG1 4.15Å; V147-I153 HydrophobicContact CG1-CG1 4.15Å; I150-I153 WeakPolarHBondContact O-CB 3.38Å; I150-I153 PolarHBondContact O-N 2.64Å; I150-I153 VanDerWaalsContact O-N 3.11Å; I153-K155 PolarHBondContact O-N 3.22Å; I153-A156 PolarHBondContact O-N 3.24Å; I153-A156 VanDerWaalsContact O-N 3.15Å; I153-V157 HydrophobicContact CG2-CG2 4.39Å; I153-V157 WeakPolarHBondContact O-CG2 3.47Å; I153-V157 PolarHBondContact O-N 2.76Å; I153-L188 HydrophobicContact CG2-CD2 4.15Å; I153-Y191 HydrophobicContact CD1-CD1 3.83Å; I153-Y191 HydrophobicContact CD1-CD2 3.89Å; I153-Y191 HydrophobicContact CD1-CE1 3.42Å; I153-Y191 VanDerWaalsContact CD1-CE1 3.42Å; I153-Y191 HydrophobicContact CD1-CE2 3.52Å; I153-Y191 HydrophobicContact CD1-CG 4.05Å; I153-Y191 HydrophobicContact CG2-CD2 4.46Å; I153-L221 HydrophobicContact CG1-CD1 4.25Å; I153-L221 HydrophobicContact CG1-CD2 4.48Å; I153-L221 HydrophobicContact CG2-CD1 4.49Å
154	Q	95.4	Very high	93.9	Very high	84 Å²	84	71.4 Å²	71.4	39%	0.393	38%	0.384	S	S	.	.	H	α-helix	trans	-58.1	-47.5	179	-175.4	177.5	-7.3	0	0	111.8	I150 A156 V157 E158 L188	I150-Q154 PolarHBondContact O-N 2.83Å; Q154-A156 VanDerWaalsContact C-N 3.32Å; Q154-A156 PolarHBondContact O-N 2.94Å; Q154-V157 PolarHBondContact O-N 3.3Å; Q154-E158 WeakPolarHBondContact CG-OE1 3.36Å; Q154-E158 PolarHBondContact NE2-OE1 2.76Å; Q154-E158 WeakPolarHBondContact O-CG 3.47Å; Q154-E158 PolarHBondContact O-N 2.97Å; Q154-L188 HydrophobicContact CB-CD2 4.08Å
155	K	95.7	Very high	93.9	Very high	156 Å²	156	72.1 Å²	72.1	68%	0.678	39%	0.386	S	S	*	.	H	α-helix	trans	-60.8	-39.6	176	-73.7	-178	-179.9	-174.5	0	112.5	K151 K152 I153 G159	K151-K155 WeakPolarHBondContact O-CG 3.4Å; K151-K155 PolarHBondContact O-N 2.92Å; K152-K155 PolarHBondContact O-N 3.15Å; I153-K155 PolarHBondContact O-N 3.22Å; K155-G159 PolarHBondContact O-N 3.09Å
156	A	96	Very high	93.9	Very high	14 Å²	14	66 Å²	66	12%	0.116	36%	0.358	C	S	.	.	H	α-helix	trans	-67.1	-39	178	0	0	0	0	0	112.1	K152 I153 Q154 G159 L160 L217 L221	K152-A156 WeakPolarHBondContact O-CB 3.26Å; K152-A156 PolarHBondContact O-N 2.81Å; I153-A156 PolarHBondContact O-N 3.24Å; I153-A156 VanDerWaalsContact O-N 3.15Å; Q154-A156 VanDerWaalsContact C-N 3.32Å; Q154-A156 PolarHBondContact O-N 2.94Å; A156-G159 PolarHBondContact O-N 2.61Å; A156-L160 WeakPolarHBondContact O-CG 3.37Å; A156-L160 PolarHBondContact O-N 2.75Å; A156-L217 HydrophobicContact CB-CD1 3.68Å; A156-L221 HydrophobicContact CB-CD2 3.75Å; A156-L221 HydrophobicContact CB-CG 4.04Å
157	V	96.7	Very high	94	Very high	1 Å²	1	69 Å²	69	1%	0.006	36%	0.358	C	S	.	.	H	α-helix	trans	-64.9	-47.5	174.9	172.6	0	0	0	0	111	I153 Q154 G159 L160 C186 L188 I200 L217	I153-V157 HydrophobicContact CG2-CG2 4.39Å; I153-V157 WeakPolarHBondContact O-CG2 3.47Å; I153-V157 PolarHBondContact O-N 2.76Å; Q154-V157 PolarHBondContact O-N 3.3Å; V157-G159 VanDerWaalsContact C-N 3.28Å; V157-G159 PolarHBondContact O-N 2.94Å; V157-L160 WeakPolarHBondContact O-CB 3.42Å; V157-L160 PolarHBondContact O-N 2.74Å; V157-L160 VanDerWaalsContact O-N 3.12Å; V157-C186 HydrophobicContact CG1-CB 4.33Å; V157-L188 HydrophobicContact CB-CB 4.45Å; V157-L188 HydrophobicContact CG1-CB 4.28Å; V157-L188 HydrophobicContact CG2-CB 4.44Å; V157-I200 HydrophobicContact CG1-CG2 3.94Å; V157-I200 HydrophobicContact CG2-CG2 4.06Å; V157-L217 HydrophobicContact CG2-CD1 3.78Å; V157-L217 HydrophobicContact CG2-CD2 3.91Å
158	E	95.4	Very high	94	Very high	92 Å²	92	68.1 Å²	68.1	43%	0.43	35%	0.352	S	S	.	.	H	α-helix	trans	-64.6	-33.9	177.7	-71.2	170.1	-171.8	0	0	111.9	Q154 L160 T161	Q154-E158 WeakPolarHBondContact CG-OE1 3.36Å; Q154-E158 PolarHBondContact NE2-OE1 2.76Å; Q154-E158 WeakPolarHBondContact O-CG 3.47Å; Q154-E158 PolarHBondContact O-N 2.97Å; E158-L160 PolarHBondContact O-N 2.95Å; E158-T161 WeakPolarHBondContact O-CB 3.48Å; E158-T161 WeakPolarHBondContact O-CG2 3.49Å; E158-T161 PolarHBondContact O-N 2.76Å; E158-T161 PolarHBondContact O-OG1 3.2Å
159	G	95.5	Very high	94.2	Very high	53 Å²	53	63.1 Å²	63.1	55%	0.546	33%	0.327	S	S	.	.	H	α-helix	trans	-66.6	-16.5	174.3	0	0	0	0	0	114.4	K155 A156 V157 T161	K155-G159 PolarHBondContact O-N 3.09Å; A156-G159 PolarHBondContact O-N 2.61Å; V157-G159 VanDerWaalsContact C-N 3.28Å; V157-G159 PolarHBondContact O-N 2.94Å; G159-T161 PolarHBondContact O-N 2.83Å
160	L	95.7	Very high	94.1	Very high	11 Å²	11	65.3 Å²	65.3	6%	0.058	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	37.4	173.6	-68.1	169.8	0	0	0	112.2	A156 V157 E158 L164 I183 L213 H216 L217 L220	A156-L160 WeakPolarHBondContact O-CG 3.37Å; A156-L160 PolarHBondContact O-N 2.75Å; V157-L160 WeakPolarHBondContact O-CB 3.42Å; V157-L160 PolarHBondContact O-N 2.74Å; V157-L160 VanDerWaalsContact O-N 3.12Å; E158-L160 PolarHBondContact O-N 2.95Å; L160-L164 HydrophobicContact CB-CD1 4.21Å; L160-L164 HydrophobicContact CD2-CD1 4.01Å; L160-I183 WeakPolarHBondContact O-CG2 2.89Å; L160-L213 HydrophobicContact CB-CD1 3.87Å; L160-L213 HydrophobicContact CD1-CD1 3.93Å; L160-L213 HydrophobicContact CD1-CG 4.36Å; L160-L213 HydrophobicContact CD2-CD1 4.14Å; L160-L213 HydrophobicContact CG-CD1 4.21Å; L160-H216 HydrophobicContact CD2-CB 4.12Å; L160-L217 HydrophobicContact CD1-CB 3.7Å; L160-L217 HydrophobicContact CD1-CD1 3.99Å; L160-L217 HydrophobicContact CD1-CG 4.41Å; L160-L220 HydrophobicContact CD1-CD1 4.25Å; L160-L220 HydrophobicContact CD2-CD1 3.62Å; L160-L220 HydrophobicContact CG-CD1 3.79Å
161	T	96.8	Very high	93.6	Very high	63 Å²	63	68 Å²	68	39%	0.387	36%	0.361	S	S	.	.			trans	-112.7	153.1	172.2	57.2	0	0	0	0	110.6	E158 G159 C186	E158-T161 WeakPolarHBondContact O-CB 3.48Å; E158-T161 WeakPolarHBondContact O-CG2 3.49Å; E158-T161 PolarHBondContact O-N 2.76Å; E158-T161 PolarHBondContact O-OG1 3.2Å; G159-T161 PolarHBondContact O-N 2.83Å; T161-C186 HydrophobicContact CG2-CB 3.65Å; T161-C186 VanDerWaalsContact CG2-N 3.34Å
162	G	96.5	Very high	93	Very high	30 Å²	30	61.7 Å²	61.7	31%	0.309	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	94.2	-156.8	-175.3	0	0	0	0	0	113.8	L164 T182 I183	G162-L164 PolarHBondContact O-N 3.01Å; G162-T182 WeakPolarHBondContact O-CA 3.39Å; G162-I183 PolarHBondContact N-O 3.03Å; G162-I183 PolarHBondContact O-N 3.41Å
163	A	96.9	Very high	92.5	Very high	70 Å²	70	62.4 Å²	62.4	58%	0.579	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	108.4	-176	0	0	0	0	0	110.7	V180	A163-V180 HydrophobicContact CB-CG1 3.74Å
164	L	95.9	Very high	92	Very high	28 Å²	28	65.8 Å²	65.8	15%	0.147	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	139	-177.6	-57.8	-175.3	0	0	0	111.5	L160 G162 Q166 V180 R181 I183 L213	L160-L164 HydrophobicContact CB-CD1 4.21Å; L160-L164 HydrophobicContact CD2-CD1 4.01Å; G162-L164 PolarHBondContact O-N 3.01Å; L164-Q166 PolarHBondContact O-N 2.81Å; L164-V180 WeakPolarHBondContact O-CA 3.49Å; L164-R181 PolarHBondContact N-O 3.4Å; L164-R181 PolarHBondContact O-N 3.1Å; L164-I183 HydrophobicContact CD1-CD1 3.58Å; L164-I183 HydrophobicContact CD1-CG1 4.15Å; L164-L213 HydrophobicContact CD1-CD1 3.89Å
165	F	95.1	Very high	91.6	Very high	137 Å²	137	69.2 Å²	69.2	60%	0.601	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71	129	166.3	-67.4	-77.8	0	0	0	109.6	L178 R179 V180 H216	F165-L178 HydrophobicContact CB-CD1 3.99Å; F165-L178 HydrophobicContact CB-CD2 4.49Å; F165-L178 HydrophobicContact CB-CG 4.31Å; F165-L178 HydrophobicContact CD1-CD2 3.86Å; F165-L178 HydrophobicContact CD1-CG 4.01Å; F165-L178 HydrophobicContact CG-CD2 4.4Å; F165-R179 CarbonylContact C-O 3.6Å; F165-R179 WeakPolarHBondContact CA-O 3.41Å; F165-V180 HydrophobicContact CD1-CG2 3.75Å; F165-V180 HydrophobicContact CE1-CG2 3.52Å; F165-V180 HydrophobicContact CZ-CG2 4.16Å; F165-H216 PolarHBondContact O-CE1 3.45Å
166	Q	93.3	Very high	91.3	Very high	1 Å²	1	66.5 Å²	66.5	1%	0.005	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	143.1	173.7	-67.3	-164.3	-24.2	0	0	110.4	L164 R179 Y209 T212	L164-Q166 PolarHBondContact O-N 2.81Å; Q166-R179 PolarHBondContact N-O 2.79Å; Q166-R179 PolarHBondContact O-N 2.75Å; Q166-Y209 PolarHBondContact NE2-O 3.24Å; Q166-T212 HydrophobicContact CB-CG2 4.4Å; Q166-T212 HydrophobicContact CG-CG2 4.42Å
167	R	92.2	Very high	91.1	Very high	133 Å²	133	71.2 Å²	71.2	50%	0.502	40%	0.401	S	S	.	.			trans	-108.7	131.8	163.6	-164.7	174.1	-167.2	175.6	2.9	109	R176 T212	R167-R176 HydrophobicContact CG-CB 4.41Å; R167-R176 PolarHBondContact NE-O 3.43Å; R167-R176 PolarHBondContact NH2-O 3.37Å; R167-R176 VanDerWaalsContact NH2-O 3.15Å; R167-T212 PolarHBondContact O-OG1 3.14Å
168	P	91	Very high	90.9	Very high	0 Å²	0	76.7 Å²	76.7	0%	0	43%	0.43	C	S	.	.			trans	-54.9	143.2	173.6	-25.6	33.2	0	0	0	112.4	A172 R176 Q177 Y209	P168-A172 HydrophobicContact CB-CB 4.07Å; P168-R176 HydrophobicContact CB-CG 4.41Å; P168-R176 PolarHBondContact O-NE 3.22Å; P168-Q177 WeakPolarHBondContact CD-O 3.49Å; P168-Y209 HydrophobicContact CB-CD2 4.17Å; P168-Y209 HydrophobicContact CB-CE2 3.5Å; P168-Y209 HydrophobicContact CG-CD2 4.45Å; P168-Y209 HydrophobicContact CG-CE2 3.8Å
169	P	88.1	Confident	90.9	Very high	22 Å²	22	74.8 Å²	74.8	14%	0.143	42%	0.419	C	S	.	.			trans	-66	164.2	175.7	29	-34.4	0	0	0	111.3	V171 A172 Y209	P169-V171 VanDerWaalsContact C-N 3.26Å; P169-V171 PolarHBondContact O-N 3.06Å; P169-A172 HydrophobicContact CG-CB 4.06Å; P169-A172 WeakPolarHBondContact O-CB 3.45Å; P169-A172 PolarHBondContact O-N 3.45Å; P169-A172 VanDerWaalsContact O-N 3.16Å; P169-Y209 VanDerWaalsContact CD-CD1 3.44Å; P169-Y209 VanDerWaalsContact CD-CG 3.5Å; P169-Y209 HydrophobicContact CG-CD1 3.78Å; P169-Y209 HydrophobicContact CG-CE1 4Å; P169-Y209 HydrophobicContact CG-CG 4.27Å
170	L	85.6	Confident	90.9	Very high	139 Å²	139	75.5 Å²	75.5	73%	0.728	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-35.7	-178.8	-77.6	166.5	0	0	0	113.6	A172	L170-A172 PolarHBondContact O-N 3.3Å
171	V	81.6	Confident	90.9	Very high	142 Å²	142	77.7 Å²	77.7	86%	0.861	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-2.6	-176.7	-165	0	0	0	0	112.2	P169	P169-V171 VanDerWaalsContact C-N 3.26Å; P169-V171 PolarHBondContact O-N 3.06Å
172	A	81.1	Confident	91	Very high	20 Å²	20	77 Å²	77	17%	0.165	42%	0.415	C	S	.	.			trans	-73.8	139.7	178.9	0	0	0	0	0	111.4	P168 P169 L170 V174 Y209	P168-A172 HydrophobicContact CB-CB 4.07Å; P169-A172 HydrophobicContact CG-CB 4.06Å; P169-A172 WeakPolarHBondContact O-CB 3.45Å; P169-A172 PolarHBondContact O-N 3.45Å; P169-A172 VanDerWaalsContact O-N 3.16Å; L170-A172 PolarHBondContact O-N 3.3Å; A172-V174 PolarHBondContact O-N 2.68Å; A172-Y209 HydrophobicContact CB-CE1 4.01Å; A172-Y209 WeakPolarHBondContact CB-OH 3.46Å
173	A	82.4	Confident	91	Very high	114 Å²	114	75.6 Å²	75.6	94%	0.942	40%	0.401	S	S	*	.	S	Bend	trans	-67.5	-11.8	172.4	0	0	0	0	0	113.9
174	V	85	Confident	91	Very high	71 Å²	71	79 Å²	79	43%	0.43	40%	0.399	S	S	.	.	S	Bend	trans	-95.5	140.4	-175.2	-177.2	0	0	0	0	110.7	A172 R176	A172-V174 PolarHBondContact O-N 2.68Å; V174-R176 PolarHBondContact O-N 2.85Å
175	K	87.3	Confident	91.1	Very high	156 Å²	156	80.9 Å²	80.9	68%	0.678	41%	0.407	S	S	*	.			trans	-48.4	130.5	175.6	-170	177.7	-177	175.9	0	111.7	Q177	K175-Q177 VanDerWaalsContact C-N 3.33Å; K175-Q177 HydrophobicContact CD-CG 4.29Å; K175-Q177 HydrophobicContact CG-CG 4.22Å; K175-Q177 PolarHBondContact O-N 3.11Å
176	R	88.8	Confident	91.2	Very high	99 Å²	99	74.7 Å²	74.7	37%	0.374	38%	0.381	S	S	.	.			trans	-79.7	72.3	-175.3	-63.9	-175.3	69.5	-144	2	113.1	R167 P168 V174	R167-R176 HydrophobicContact CG-CB 4.41Å; R167-R176 PolarHBondContact NE-O 3.43Å; R167-R176 PolarHBondContact NH2-O 3.37Å; R167-R176 VanDerWaalsContact NH2-O 3.15Å; P168-R176 HydrophobicContact CB-CG 4.41Å; P168-R176 PolarHBondContact O-NE 3.22Å; V174-R176 PolarHBondContact O-N 2.85Å
177	Q	92.4	Very high	91.4	Very high	113 Å²	113	79.9 Å²	79.9	53%	0.528	40%	0.404	S	S	.	.			trans	-106.9	149.8	172.5	-71.8	172.5	-30.3	0	0	111.3	P168 K175	P168-Q177 WeakPolarHBondContact CD-O 3.49Å; K175-Q177 VanDerWaalsContact C-N 3.33Å; K175-Q177 HydrophobicContact CD-CG 4.29Å; K175-Q177 HydrophobicContact CG-CG 4.22Å; K175-Q177 PolarHBondContact O-N 3.11Å
178	L	93.4	Very high	91.7	Very high	117 Å²	117	74.8 Å²	74.8	61%	0.613	39%	0.386	S	S	*	.			trans	-67.8	132.1	173.3	-166.3	69.6	0	0	0	108.8	F165	F165-L178 HydrophobicContact CB-CD1 3.99Å; F165-L178 HydrophobicContact CB-CD2 4.49Å; F165-L178 HydrophobicContact CB-CG 4.31Å; F165-L178 HydrophobicContact CD1-CD2 3.86Å; F165-L178 HydrophobicContact CD1-CG 4.01Å; F165-L178 HydrophobicContact CG-CD2 4.4Å
179	R	94.6	Very high	92	Very high	52 Å²	52	78.7 Å²	78.7	20%	0.196	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	153	179.3	64	-170.7	-172.3	-166.5	6.7	110.9	F165 Q166 G207	F165-R179 CarbonylContact C-O 3.6Å; F165-R179 WeakPolarHBondContact CA-O 3.41Å; Q166-R179 PolarHBondContact N-O 2.79Å; Q166-R179 PolarHBondContact O-N 2.75Å; R179-G207 PolarHBondContact NH2-O 3.1Å
180	V	96	Very high	92.3	Very high	67 Å²	67	84.2 Å²	84.2	41%	0.406	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	132.7	174.2	-176.6	0	0	0	0	109.1	A163 L164 F165	A163-V180 HydrophobicContact CB-CG1 3.74Å; L164-V180 WeakPolarHBondContact O-CA 3.49Å; F165-V180 HydrophobicContact CD1-CG2 3.75Å; F165-V180 HydrophobicContact CE1-CG2 3.52Å; F165-V180 HydrophobicContact CZ-CG2 4.16Å
181	R	95.9	Very high	92.8	Very high	58 Å²	58	79.1 Å²	79.1	22%	0.219	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	140.2	170.7	-73.8	-64.9	179	-91.4	8.4	109.9	L164 A206	L164-R181 PolarHBondContact N-O 3.4Å; L164-R181 PolarHBondContact O-N 3.1Å; R181-A206 PolarHBondContact NE-O 3.11Å
182	T	97.3	Very high	93.4	Very high	47 Å²	47	76.5 Å²	76.5	29%	0.288	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	126.8	-177.8	-56.6	0	0	0	0	111.1	G162 Y184 E205	G162-T182 WeakPolarHBondContact O-CA 3.39Å; T182-Y184 HydrophobicContact CG2-CD1 3.9Å; T182-Y184 HydrophobicContact CG2-CE1 3.82Å; T182-E205 PolarHBondContact N-OE2 3.41Å; T182-E205 VanDerWaalsContact N-OE2 3.15Å; T182-E205 WeakPolarHBondContact O-CB 3.47Å; T182-E205 PolarHBondContact O-N 2.76Å
183	I	97.8	Very high	93.9	Very high	2 Å²	2	80.4 Å²	80.4	1%	0.01	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	114	165.8	-60	-169.8	0	0	0	107.4	L160 G162 L164 C186 V202 R203 C204 T208 L213	L160-I183 WeakPolarHBondContact O-CG2 2.89Å; G162-I183 PolarHBondContact N-O 3.03Å; G162-I183 PolarHBondContact O-N 3.41Å; L164-I183 HydrophobicContact CD1-CD1 3.58Å; L164-I183 HydrophobicContact CD1-CG1 4.15Å; I183-C186 HydrophobicContact CG2-CB 4.09Å; I183-V202 HydrophobicContact CD1-CG1 4.43Å; I183-V202 HydrophobicContact CG2-CG1 4.02Å; I183-R203 CarbonylContact C-O 3.57Å; I183-C204 HydrophobicContact CG1-CB 4.31Å; I183-T208 HydrophobicContact CD1-CG2 4.35Å; I183-T208 HydrophobicContact CG1-CG2 4.26Å; I183-L213 HydrophobicContact CD1-CD1 3.3Å; I183-L213 HydrophobicContact CD1-CD2 3.71Å; I183-L213 HydrophobicContact CD1-CG 4.1Å
184	Y	97	Very high	94.3	Very high	141 Å²	141	79.5 Å²	79.5	55%	0.553	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.2	-35.8	-178.6	-54.8	-62.4	0	0	0	111.8	T182 R203 C204 E205	T182-Y184 HydrophobicContact CG2-CD1 3.9Å; T182-Y184 HydrophobicContact CG2-CE1 3.82Å; Y184-R203 HydrophobicContact CD2-CB 4.5Å; Y184-R203 PolarHBondContact N-O 3.37Å; Y184-C204 VanDerWaalsContact CE2-C 3.42Å; Y184-E205 HydrophobicContact CE2-CB 4.48Å
185	E	97.5	Very high	94.7	Very high	67 Å²	67	81.1 Å²	81.1	31%	0.313	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156	135.9	-178.6	-166.4	178.6	171.7	0	0	109.4	M201 V202 R203	E185-M201 HydrophobicContact CG-CE 4.09Å; E185-V202 CarbonylContact O-C 3.59Å; E185-V202 WeakPolarHBondContact O-CA 3.34Å; E185-R203 HydrophobicContact CB-CB 4.03Å; E185-R203 HydrophobicContact CB-CG 4.37Å; E185-R203 PolarHBondContact N-O 3.37Å; E185-R203 PolarHBondContact O-N 2.83Å; E185-R203 WeakPolarHBondContact OE2-CD 3.49Å; E185-R203 IonicContact OE2-CZ 2.97Å; E185-R203 IonicContact OE2-NE 3.3Å; E185-R203 IonicContact OE2-NH1 2.83Å; E185-R203 PolarHBondContact OE2-NH1 2.75Å
186	C	97.5	Very high	95.1	Very high	7 Å²	7	75.1 Å²	75.1	5%	0.047	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	117.1	173.4	-160.7	0	0	0	0	108	V157 T161 I183 M201	V157-C186 HydrophobicContact CG1-CB 4.33Å; T161-C186 HydrophobicContact CG2-CB 3.65Å; T161-C186 VanDerWaalsContact CG2-N 3.34Å; I183-C186 HydrophobicContact CG2-CB 4.09Å; C186-M201 WeakPolarHBondContact CA-O 3.32Å
187	K	97.5	Very high	95.5	Very high	111 Å²	111	72 Å²	72	48%	0.483	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	129.3	-173	-174.4	176.5	-179.6	178.6	0	110.7	L189 I200 M201	K187-L189 HydrophobicContact CD-CD2 4.1Å; K187-L189 HydrophobicContact CG-CD2 4.21Å; K187-I200 CarbonylContact O-C 3.54Å; K187-I200 WeakPolarHBondContact O-CA 3.47Å; K187-M201 HydrophobicContact CB-CE 4.27Å; K187-M201 PolarHBondContact N-O 3.42Å; K187-M201 PolarHBondContact O-N 3.06Å
188	L	97.6	Very high	95.7	Very high	25 Å²	25	66.8 Å²	66.8	13%	0.131	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	121.3	166.9	-174.2	67.1	0	0	0	108.9	F141 I150 I153 Q154 V157 E190 I200	F141-L188 HydrophobicContact CE1-CD1 3.99Å; F141-L188 HydrophobicContact CZ-CD1 4.23Å; I150-L188 HydrophobicContact CG2-CD2 4.47Å; I153-L188 HydrophobicContact CG2-CD2 4.15Å; Q154-L188 HydrophobicContact CB-CD2 4.08Å; V157-L188 HydrophobicContact CB-CB 4.45Å; V157-L188 HydrophobicContact CG1-CB 4.28Å; V157-L188 HydrophobicContact CG2-CB 4.44Å; L188-E190 WeakPolarHBondContact CD1-O 3.29Å; L188-I200 HydrophobicContact CD1-CG2 4.01Å
189	L	96.9	Very high	95.9	Very high	83 Å²	83	63.2 Å²	63.2	44%	0.435	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	-50.9	177.5	-60.7	-176.4	0	0	0	110.5	K187 L199 M201	K187-L189 HydrophobicContact CD-CD2 4.1Å; K187-L189 HydrophobicContact CG-CD2 4.21Å; L189-L199 HydrophobicContact CB-CB 4.32Å; L189-L199 HydrophobicContact CB-CD2 4.02Å; L189-L199 HydrophobicContact CB-CG 4.13Å; L189-L199 HydrophobicContact CD1-CD2 3.99Å; L189-L199 HydrophobicContact CD1-CG 4.13Å; L189-L199 PolarHBondContact N-O 2.81Å; L189-M201 HydrophobicContact CD1-CB 4.1Å; L189-M201 HydrophobicContact CD2-CB 4.47Å; L189-M201 HydrophobicContact CG-CB 4.33Å
190	E	96	Very high	96.1	Very high	137 Å²	137	60.9 Å²	60.9	64%	0.64	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.4	152.6	-176.5	-63.8	-178.1	-174.8	0	0	110	L188 G198 L199	L188-E190 WeakPolarHBondContact CD1-O 3.29Å; E190-G198 CarbonylContact O-C 3.51Å; E190-G198 WeakPolarHBondContact O-CA 3.25Å; E190-L199 HydrophobicContact CB-CB 4.12Å; E190-L199 PolarHBondContact N-O 3.18Å; E190-L199 PolarHBondContact O-N 2.94Å
191	Y	95.8	Very high	96.2	Very high	33 Å²	33	58.6 Å²	58.6	13%	0.129	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	124.9	172.7	-174.6	-99.6	0	0	0	110.5	F141 L143 I150 I153 K193 L197	F141-Y191 HydrophobicContact CE2-CE2 4.28Å; F141-Y191 HydrophobicContact CZ-CD2 4.12Å; F141-Y191 HydrophobicContact CZ-CE2 4.29Å; L143-Y191 HydrophobicContact CD1-CE2 4.22Å; I150-Y191 HydrophobicContact CG1-CD1 4.16Å; I153-Y191 HydrophobicContact CD1-CD1 3.83Å; I153-Y191 HydrophobicContact CD1-CD2 3.89Å; I153-Y191 HydrophobicContact CD1-CE1 3.42Å; I153-Y191 VanDerWaalsContact CD1-CE1 3.42Å; I153-Y191 HydrophobicContact CD1-CE2 3.52Å; I153-Y191 HydrophobicContact CD1-CG 4.05Å; I153-Y191 HydrophobicContact CG2-CD2 4.46Å; Y191-K193 HydrophobicContact CE1-CB 4.17Å; Y191-L197 CarbonylContact C-O 3.55Å; Y191-L197 WeakPolarHBondContact CA-O 3.45Å; Y191-L197 VanDerWaalsContact CD2-O 3.22Å; Y191-L197 WeakPolarHBondContact CD2-O 3.5Å
192	E	94.1	Very high	96.3	Very high	87 Å²	87	55.8 Å²	55.8	41%	0.407	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	105.1	178	-176.1	166.2	-154.9	0	0	110.2	S194 K195 N196 L197	E192-S194 VanDerWaalsContact C-N 3.33Å; E192-S194 VanDerWaalsContact CG-OG 3.28Å; E192-S194 WeakPolarHBondContact CG-OG 3.26Å; E192-S194 PolarHBondContact O-N 3.46Å; E192-S194 PolarHBondContact OE1-OG 2.9Å; E192-K195 PolarHBondContact O-N 2.94Å; E192-K195 IonicContact OE1-NZ 2.78Å; E192-K195 PolarHBondContact OE1-NZ 2.86Å; E192-K195 WeakPolarHBondContact OE2-CD 3.23Å; E192-K195 WeakPolarHBondContact OE2-CE 3.41Å; E192-K195 IonicContact OE2-NZ 3.51Å; E192-K195 PolarHBondContact OE2-NZ 2.91Å; E192-N196 PolarHBondContact O-N 2.89Å; E192-N196 VanDerWaalsContact O-N 3.13Å; E192-L197 PolarHBondContact N-O 3.04Å; E192-L197 PolarHBondContact O-N 2.86Å
193	K	90.5	Very high	96.3	Very high	101 Å²	101	58.3 Å²	58.3	44%	0.439	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-32	-175.9	-170.9	172.7	-177.8	173	0	113.4	D148 Y191 K195 N196	D148-K193 PolarHBondContact O-NZ 2.81Å; D148-K193 VanDerWaalsContact O-NZ 3.08Å; Y191-K193 HydrophobicContact CE1-CB 4.17Å; K193-K195 VanDerWaalsContact C-N 3.26Å; K193-K195 PolarHBondContact O-N 3.32Å; K193-N196 PolarHBondContact O-N 3.31Å; K193-N196 PolarHBondContact O-OD1 3.17Å
194	S	91.5	Very high	96.3	Very high	95 Å²	95	58.3 Å²	58.3	66%	0.664	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-29.4	-179.3	56.9	0	0	0	0	113.2	E192	E192-S194 VanDerWaalsContact C-N 3.33Å; E192-S194 VanDerWaalsContact CG-OG 3.28Å; E192-S194 WeakPolarHBondContact CG-OG 3.26Å; E192-S194 PolarHBondContact O-N 3.46Å; E192-S194 PolarHBondContact OE1-OG 2.9Å
195	K	93.8	Very high	96.2	Very high	106 Å²	106	54.5 Å²	54.5	46%	0.461	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	-2.4	-177.8	-60.6	179.6	-166.4	138.2	0	113.5	E192 K193 L197	E192-K195 PolarHBondContact O-N 2.94Å; E192-K195 IonicContact OE1-NZ 2.78Å; E192-K195 PolarHBondContact OE1-NZ 2.86Å; E192-K195 WeakPolarHBondContact OE2-CD 3.23Å; E192-K195 WeakPolarHBondContact OE2-CE 3.41Å; E192-K195 IonicContact OE2-NZ 3.51Å; E192-K195 PolarHBondContact OE2-NZ 2.91Å; K193-K195 VanDerWaalsContact C-N 3.26Å; K193-K195 PolarHBondContact O-N 3.32Å; K195-L197 HydrophobicContact CB-CB 4.31Å; K195-L197 HydrophobicContact CB-CD1 3.87Å; K195-L197 HydrophobicContact CB-CG 3.86Å; K195-L197 HydrophobicContact CD-CD1 4.06Å; K195-L197 PolarHBondContact O-N 3.21Å
196	N	95.4	Very high	96	Very high	30 Å²	30	52.2 Å²	52.2	16%	0.16	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	32.9	-169.6	-61.4	-28.8	0	0	0	113.2	R142 L143 S146 E192 K193	R142-N196 CarbonylContact C-O 3.58Å; R142-N196 WeakPolarHBondContact CA-O 3.44Å; L143-N196 HydrophobicContact CB-CB 4.28Å; L143-N196 PolarHBondContact N-O 2.98Å; L143-N196 WeakPolarHBondContact O-CB 3.45Å; S146-N196 VanDerWaalsContact CA-OD1 3.3Å; S146-N196 WeakPolarHBondContact CA-OD1 3.28Å; S146-N196 WeakPolarHBondContact CB-OD1 3.47Å; E192-N196 PolarHBondContact O-N 2.89Å; E192-N196 VanDerWaalsContact O-N 3.13Å; K193-N196 PolarHBondContact O-N 3.31Å; K193-N196 PolarHBondContact O-OD1 3.17Å
197	L	96.8	Very high	95.7	Very high	34 Å²	34	53.7 Å²	53.7	18%	0.178	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	139.4	-178.1	-70.5	176.4	0	0	0	111	I140 F141 R142 Y191 E192 K195	I140-L197 HydrophobicContact CG2-CD2 3.94Å; F141-L197 CarbonylContact O-C 3.56Å; F141-L197 WeakPolarHBondContact O-CA 3.38Å; R142-L197 HydrophobicContact CB-CD2 3.63Å; R142-L197 HydrophobicContact CG-CD2 3.92Å; Y191-L197 CarbonylContact C-O 3.55Å; Y191-L197 WeakPolarHBondContact CA-O 3.45Å; Y191-L197 VanDerWaalsContact CD2-O 3.22Å; Y191-L197 WeakPolarHBondContact CD2-O 3.5Å; E192-L197 PolarHBondContact N-O 3.04Å; E192-L197 PolarHBondContact O-N 2.86Å; K195-L197 HydrophobicContact CB-CB 4.31Å; K195-L197 HydrophobicContact CB-CD1 3.87Å; K195-L197 HydrophobicContact CB-CG 3.86Å; K195-L197 HydrophobicContact CD-CD1 4.06Å; K195-L197 PolarHBondContact O-N 3.21Å
198	G	96.7	Very high	95.5	Very high	3 Å²	3	48.9 Å²	48.9	3%	0.031	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	148.8	171.8	0	0	0	0	0	112.6	I140 F141 E190	I140-G198 CarbonylContact C-O 3.56Å; I140-G198 WeakPolarHBondContact CA-O 3.21Å; F141-G198 WeakPolarHBondContact CD1-O 3.28Å; F141-G198 VanDerWaalsContact CE1-C 3.45Å; F141-G198 VanDerWaalsContact CE1-CA 3.4Å; F141-G198 PolarHBondContact N-O 3.09Å; F141-G198 PolarHBondContact O-N 3.5Å; E190-G198 CarbonylContact O-C 3.51Å; E190-G198 WeakPolarHBondContact O-CA 3.25Å
199	L	98	Very high	95.4	Very high	41 Å²	41	49.5 Å²	49.5	22%	0.215	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	120.9	177	-174.5	67.6	0	0	0	109.1	V138 C139 I140 L189 E190	V138-L199 HydrophobicContact CG1-CD1 3.47Å; V138-L199 VanDerWaalsContact CG1-CD1 3.47Å; V138-L199 HydrophobicContact CG1-CG 4.25Å; C139-L199 WeakPolarHBondContact O-CA 3.03Å; I140-L199 HydrophobicContact CG1-CD1 3.83Å; L189-L199 HydrophobicContact CB-CB 4.32Å; L189-L199 HydrophobicContact CB-CD2 4.02Å; L189-L199 HydrophobicContact CB-CG 4.13Å; L189-L199 HydrophobicContact CD1-CD2 3.99Å; L189-L199 HydrophobicContact CD1-CG 4.13Å; L189-L199 PolarHBondContact N-O 2.81Å; E190-L199 HydrophobicContact CB-CB 4.12Å; E190-L199 PolarHBondContact N-O 3.18Å; E190-L199 PolarHBondContact O-N 2.94Å
200	I	98.2	Very high	95.3	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.015	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	147.4	174.6	62.6	178.9	0	0	0	111.7	V138 C139 F141 V157 K187 L188 V202	V138-I200 WeakPolarHBondContact CA-O 3.11Å; C139-I200 HydrophobicContact CB-CD1 4.27Å; C139-I200 HydrophobicContact CB-CG1 3.72Å; C139-I200 PolarHBondContact N-O 2.97Å; C139-I200 PolarHBondContact O-N 2.83Å; F141-I200 HydrophobicContact CD1-CD1 4.44Å; F141-I200 HydrophobicContact CD1-CG1 4.4Å; F141-I200 HydrophobicContact CD1-CG2 3.86Å; F141-I200 HydrophobicContact CE1-CG2 3.56Å; V157-I200 HydrophobicContact CG1-CG2 3.94Å; V157-I200 HydrophobicContact CG2-CG2 4.06Å; K187-I200 CarbonylContact O-C 3.54Å; K187-I200 WeakPolarHBondContact O-CA 3.47Å; L188-I200 HydrophobicContact CD1-CG2 4.01Å; I200-V202 HydrophobicContact CD1-CG2 3.76Å; I200-V202 HydrophobicContact CG1-CG2 3.93Å
201	M	98.2	Very high	95.3	Very high	19 Å²	19	43 Å²	43	9%	0.094	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	133.3	164.5	-176.7	-78.9	-64.8	0	0	109.1	E136 Y137 E185 C186 K187 L189 R203	E136-M201 HydrophobicContact CG-CG 4.25Å; E136-M201 HydrophobicContact CG-SD 3.87Å; Y137-M201 CarbonylContact O-C 3.51Å; Y137-M201 WeakPolarHBondContact O-CA 3.45Å; E185-M201 HydrophobicContact CG-CE 4.09Å; C186-M201 WeakPolarHBondContact CA-O 3.32Å; K187-M201 HydrophobicContact CB-CE 4.27Å; K187-M201 PolarHBondContact N-O 3.42Å; K187-M201 PolarHBondContact O-N 3.06Å; L189-M201 HydrophobicContact CD1-CB 4.1Å; L189-M201 HydrophobicContact CD2-CB 4.47Å; L189-M201 HydrophobicContact CG-CB 4.33Å; M201-R203 HydrophobicContact SD-CG 3.8Å
202	V	98	Very high	95.2	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	118.1	-176.4	-171.3	0	0	0	0	110.2	E136 Y137 I183 E185 I200 C204 V210 L213	E136-V202 CarbonylContact C-O 3.59Å; E136-V202 VanDerWaalsContact CA-O 3.27Å; E136-V202 WeakPolarHBondContact CA-O 3.4Å; Y137-V202 PolarHBondContact N-O 2.98Å; Y137-V202 PolarHBondContact O-N 2.79Å; I183-V202 HydrophobicContact CD1-CG1 4.43Å; I183-V202 HydrophobicContact CG2-CG1 4.02Å; E185-V202 CarbonylContact O-C 3.59Å; E185-V202 WeakPolarHBondContact O-CA 3.34Å; I200-V202 HydrophobicContact CD1-CG2 3.76Å; I200-V202 HydrophobicContact CG1-CG2 3.93Å; V202-C204 HydrophobicContact CG1-CB 4.25Å; V202-V210 HydrophobicContact CG2-CG1 4.46Å; V202-L213 HydrophobicContact CG1-CD2 3.85Å; V202-L213 HydrophobicContact CG2-CD2 3.86Å
203	R	97.8	Very high	95.3	Very high	100 Å²	100	38 Å²	38	38%	0.377	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	123.3	165.7	-69.9	176.5	177.3	159.1	1.9	109.1	K135 E136 I183 Y184 E185 M201	K135-R203 WeakPolarHBondContact O-CA 3.35Å; E136-R203 HydrophobicContact CB-CG 4.29Å; E136-R203 HydrophobicContact CG-CG 3.73Å; E136-R203 IonicContact OE2-CZ 2.68Å; E136-R203 IonicContact OE2-NE 3.53Å; E136-R203 PolarHBondContact OE2-NE 3.43Å; E136-R203 IonicContact OE2-NH2 2.85Å; E136-R203 PolarHBondContact OE2-NH2 2.74Å; I183-R203 CarbonylContact C-O 3.57Å; Y184-R203 HydrophobicContact CD2-CB 4.5Å; Y184-R203 PolarHBondContact N-O 3.37Å; E185-R203 HydrophobicContact CB-CB 4.03Å; E185-R203 HydrophobicContact CB-CG 4.37Å; E185-R203 PolarHBondContact N-O 3.37Å; E185-R203 PolarHBondContact O-N 2.83Å; E185-R203 WeakPolarHBondContact OE2-CD 3.49Å; E185-R203 IonicContact OE2-CZ 2.97Å; E185-R203 IonicContact OE2-NE 3.3Å; E185-R203 IonicContact OE2-NH1 2.83Å; E185-R203 PolarHBondContact OE2-NH1 2.75Å; M201-R203 HydrophobicContact SD-CG 3.8Å
204	C	97	Very high	95.6	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.007	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	162.5	-172.7	60.1	0	0	0	0	113.3	G134 K135 I183 Y184 V202 T208	G134-C204 WeakPolarHBondContact CA-O 3.39Å; K135-C204 PolarHBondContact N-O 3.26Å; K135-C204 PolarHBondContact O-N 3Å; I183-C204 HydrophobicContact CG1-CB 4.31Å; Y184-C204 VanDerWaalsContact CE2-C 3.42Å; V202-C204 HydrophobicContact CG1-CB 4.25Å; C204-T208 HydrophobicContact CB-CG2 3.84Å
205	E	96.1	Very high	95.8	Very high	61 Å²	61	31.9 Å²	31.9	29%	0.285	16%	0.163	S	C	.	.			trans	-64.5	152.6	168.1	-164.6	-166.4	156	0	0	111	T182 Y184 G207 T208	T182-E205 PolarHBondContact N-OE2 3.41Å; T182-E205 VanDerWaalsContact N-OE2 3.15Å; T182-E205 WeakPolarHBondContact O-CB 3.47Å; T182-E205 PolarHBondContact O-N 2.76Å; Y184-E205 HydrophobicContact CE2-CB 4.48Å; E205-G207 PolarHBondContact O-N 3.38Å; E205-T208 WeakPolarHBondContact O-CB 3.29Å; E205-T208 PolarHBondContact O-N 3.02Å; E205-T208 PolarHBondContact O-OG1 3.24Å
206	A	92.8	Very high	95.9	Very high	19 Å²	19	29.3 Å²	29.3	16%	0.157	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	139.4	174.2	0	0	0	0	0	112.3	Q131 R181 T208	Q131-A206 WeakPolarHBondContact O-CB 3.36Å; R181-A206 PolarHBondContact NE-O 3.11Å; A206-T208 VanDerWaalsContact C-N 3.31Å
207	G	91	Very high	96	Very high	39 Å²	39	28 Å²	28	40%	0.402	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	8.1	-178.8	0	0	0	0	0	114.7	R179 E205	R179-G207 PolarHBondContact NH2-O 3.1Å; E205-G207 PolarHBondContact O-N 3.38Å
208	T	94.2	Very high	96	Very high	9 Å²	9	26.3 Å²	26.3	6%	0.055	14%	0.136	C	C	.	.			trans	-69.8	131	166.6	-54.9	0	0	0	0	109.9	I183 C204 E205 A206	I183-T208 HydrophobicContact CD1-CG2 4.35Å; I183-T208 HydrophobicContact CG1-CG2 4.26Å; C204-T208 HydrophobicContact CB-CG2 3.84Å; E205-T208 WeakPolarHBondContact O-CB 3.29Å; E205-T208 PolarHBondContact O-N 3.02Å; E205-T208 PolarHBondContact O-OG1 3.24Å; A206-T208 VanDerWaalsContact C-N 3.31Å
209	Y	94	Very high	95.9	Very high	39 Å²	39	32 Å²	32	15%	0.153	17%	0.166	C	C	.	.			trans	-95.7	104.1	175	-71.9	-79.7	0	0	0	110.1	Q166 P168 P169 A172 R211 T212 L213	Q166-Y209 PolarHBondContact NE2-O 3.24Å; P168-Y209 HydrophobicContact CB-CD2 4.17Å; P168-Y209 HydrophobicContact CB-CE2 3.5Å; P168-Y209 HydrophobicContact CG-CD2 4.45Å; P168-Y209 HydrophobicContact CG-CE2 3.8Å; P169-Y209 VanDerWaalsContact CD-CD1 3.44Å; P169-Y209 VanDerWaalsContact CD-CG 3.5Å; P169-Y209 HydrophobicContact CG-CD1 3.78Å; P169-Y209 HydrophobicContact CG-CE1 4Å; P169-Y209 HydrophobicContact CG-CG 4.27Å; A172-Y209 HydrophobicContact CB-CE1 4.01Å; A172-Y209 WeakPolarHBondContact CB-OH 3.46Å; Y209-R211 PolarHBondContact O-N 2.9Å; Y209-T212 WeakPolarHBondContact O-CB 3.26Å; Y209-T212 PolarHBondContact O-N 2.83Å; Y209-L213 PolarHBondContact O-N 3.21Å; Y209-L213 VanDerWaalsContact O-N 3.1Å
210	V	95.8	Very high	95.7	Very high	4 Å²	4	35.3 Å²	35.3	2%	0.024	18%	0.183	C	C	.	.	H	α-helix	trans	-61.6	-30.2	176.3	-173.7	0	0	0	0	111.3	Y137 C139 V202 T212 L213 C214 L230	Y137-V210 HydrophobicContact CD2-CG2 3.77Å; Y137-V210 HydrophobicContact CE2-CG2 4.25Å; Y137-V210 HydrophobicContact CG-CG2 3.93Å; C139-V210 HydrophobicContact CB-CG1 3.85Å; V202-V210 HydrophobicContact CG2-CG1 4.46Å; V210-T212 PolarHBondContact O-N 3.38Å; V210-L213 WeakPolarHBondContact O-CA 3.43Å; V210-L213 WeakPolarHBondContact O-CB 3.29Å; V210-L213 PolarHBondContact O-N 2.83Å; V210-L213 VanDerWaalsContact O-N 3.11Å; V210-C214 PolarHBondContact O-N 3.47Å; V210-C214 PolarHBondContact O-SG 3.21Å; V210-C214 VanDerWaalsContact O-SG 3.33Å; V210-L230 HydrophobicContact CB-CD1 3.85Å; V210-L230 HydrophobicContact CB-CD2 4.09Å; V210-L230 HydrophobicContact CG1-CD1 3.64Å; V210-L230 HydrophobicContact CG2-CD1 4.12Å; V210-L230 HydrophobicContact CG2-CD2 4.38Å
211	R	94.9	Very high	95.6	Very high	78 Å²	78	36.9 Å²	36.9	29%	0.294	19%	0.191	S	C	.	.	H	α-helix	trans	-56.8	-46.7	171.2	-170.5	-175.1	-55.6	-75.6	-2.8	112.7	D109 Y209 L213 C214 V215 M227	D109-R211 IonicContact OD2-NH2 3.12Å; D109-R211 PolarHBondContact OD2-NH2 2.84Å; D109-R211 VanDerWaalsContact OD2-NH2 3.12Å; Y209-R211 PolarHBondContact O-N 2.9Å; R211-L213 VanDerWaalsContact C-N 3.29Å; R211-C214 PolarHBondContact O-N 3.4Å; R211-V215 PolarHBondContact O-N 2.82Å; R211-M227 HydrophobicContact CB-CB 4.5Å; R211-M227 HydrophobicContact CB-CE 4.38Å; R211-M227 HydrophobicContact CB-SD 3.93Å; R211-M227 HydrophobicContact CG-CB 4.32Å
212	T	94.5	Very high	95.4	Very high	15 Å²	15	39.2 Å²	39.2	9%	0.092	22%	0.22	C	C	.	.	H	α-helix	trans	-66.8	-35	177	-57.2	0	0	0	0	110.8	Q166 R167 Y209 V210 C214 V215 H216	Q166-T212 HydrophobicContact CB-CG2 4.4Å; Q166-T212 HydrophobicContact CG-CG2 4.42Å; R167-T212 PolarHBondContact O-OG1 3.14Å; Y209-T212 WeakPolarHBondContact O-CB 3.26Å; Y209-T212 PolarHBondContact O-N 2.83Å; V210-T212 PolarHBondContact O-N 3.38Å; T212-C214 PolarHBondContact O-N 3.29Å; T212-V215 PolarHBondContact O-N 2.64Å; T212-H216 WeakPolarHBondContact CG2-NE2 3.48Å; T212-H216 PolarHBondContact O-CD2 2.81Å; T212-H216 VanDerWaalsContact O-CD2 3.31Å; T212-H216 PolarHBondContact O-N 2.67Å
213	L	96.5	Very high	95.2	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.005	22%	0.224	C	C	.	.	H	α-helix	trans	-59.2	-44.8	174	-170.9	66.5	0	0	0	112.3	L160 L164 I183 V202 Y209 V210 R211 V215 H216 L217	L160-L213 HydrophobicContact CB-CD1 3.87Å; L160-L213 HydrophobicContact CD1-CD1 3.93Å; L160-L213 HydrophobicContact CD1-CG 4.36Å; L160-L213 HydrophobicContact CD2-CD1 4.14Å; L160-L213 HydrophobicContact CG-CD1 4.21Å; L164-L213 HydrophobicContact CD1-CD1 3.89Å; I183-L213 HydrophobicContact CD1-CD1 3.3Å; I183-L213 HydrophobicContact CD1-CD2 3.71Å; I183-L213 HydrophobicContact CD1-CG 4.1Å; V202-L213 HydrophobicContact CG1-CD2 3.85Å; V202-L213 HydrophobicContact CG2-CD2 3.86Å; Y209-L213 PolarHBondContact O-N 3.21Å; Y209-L213 VanDerWaalsContact O-N 3.1Å; V210-L213 WeakPolarHBondContact O-CA 3.43Å; V210-L213 WeakPolarHBondContact O-CB 3.29Å; V210-L213 PolarHBondContact O-N 2.83Å; V210-L213 VanDerWaalsContact O-N 3.11Å; R211-L213 VanDerWaalsContact C-N 3.29Å; L213-V215 VanDerWaalsContact C-N 3.31Å; L213-V215 PolarHBondContact O-N 2.94Å; L213-H216 PolarHBondContact O-N 2.99Å; L213-L217 PolarHBondContact O-N 2.94Å
214	C	96.7	Very high	95.1	Very high	1 Å²	1	36 Å²	36	1%	0.007	22%	0.216	C	C	.	.	H	α-helix	trans	-62.8	-36.9	176.5	-61.1	0	0	0	0	112.5	F141 V210 R211 T212 L217 G218 M227	F141-C214 HydrophobicContact CB-CB 4.29Å; V210-C214 PolarHBondContact O-N 3.47Å; V210-C214 PolarHBondContact O-SG 3.21Å; V210-C214 VanDerWaalsContact O-SG 3.33Å; R211-C214 PolarHBondContact O-N 3.4Å; T212-C214 PolarHBondContact O-N 3.29Å; C214-L217 PolarHBondContact O-N 3.02Å; C214-G218 PolarHBondContact O-N 2.87Å; C214-G218 VanDerWaalsContact O-N 3.08Å; C214-M227 HydrophobicContact CB-CB 4.11Å
215	V	95.8	Very high	95	Very high	67 Å²	67	36.3 Å²	36.3	41%	0.406	22%	0.219	S	C	.	.	H	α-helix	trans	-64.6	-45	173.9	175.6	0	0	0	0	110.5	R211 T212 L213 L217 G218 L219 G225	R211-V215 PolarHBondContact O-N 2.82Å; T212-V215 PolarHBondContact O-N 2.64Å; L213-V215 VanDerWaalsContact C-N 3.31Å; L213-V215 PolarHBondContact O-N 2.94Å; V215-L217 VanDerWaalsContact C-N 3.33Å; V215-L217 PolarHBondContact O-N 3.49Å; V215-G218 PolarHBondContact O-N 2.91Å; V215-L219 HydrophobicContact CG1-CD1 4.28Å; V215-L219 WeakPolarHBondContact O-CG 3.49Å; V215-L219 PolarHBondContact O-N 2.66Å; V215-G225 WeakPolarHBondContact CA-O 3.25Å
216	H	96.2	Very high	95	Very high	51 Å²	51	36 Å²	36	24%	0.236	22%	0.222	C	C	.	.	H	α-helix	trans	-63.1	-39.5	177.3	-65.5	-179.6	0	0	0	112.2	L160 F165 T212 L213 G218 L219 L220	L160-H216 HydrophobicContact CD2-CB 4.12Å; F165-H216 PolarHBondContact O-CE1 3.45Å; T212-H216 WeakPolarHBondContact CG2-NE2 3.48Å; T212-H216 PolarHBondContact O-CD2 2.81Å; T212-H216 VanDerWaalsContact O-CD2 3.31Å; T212-H216 PolarHBondContact O-N 2.67Å; L213-H216 PolarHBondContact O-N 2.99Å; H216-G218 VanDerWaalsContact C-N 3.31Å; H216-G218 PolarHBondContact O-N 3.46Å; H216-L219 PolarHBondContact O-N 3.29Å; H216-L220 WeakPolarHBondContact O-CG 3.16Å; H216-L220 PolarHBondContact O-N 2.93Å
217	L	96.7	Very high	95.1	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-57.6	-46.1	173.4	-179.9	61	0	0	0	111.2	F141 A156 V157 L160 L213 C214 V215 L219 L220 L221	F141-L217 HydrophobicContact CD1-CD2 4.1Å; F141-L217 HydrophobicContact CD2-CD2 3.76Å; F141-L217 HydrophobicContact CE1-CD2 4.01Å; F141-L217 HydrophobicContact CE2-CD2 3.64Å; F141-L217 HydrophobicContact CG-CD2 3.99Å; F141-L217 HydrophobicContact CZ-CD2 3.77Å; A156-L217 HydrophobicContact CB-CD1 3.68Å; V157-L217 HydrophobicContact CG2-CD1 3.78Å; V157-L217 HydrophobicContact CG2-CD2 3.91Å; L160-L217 HydrophobicContact CD1-CB 3.7Å; L160-L217 HydrophobicContact CD1-CD1 3.99Å; L160-L217 HydrophobicContact CD1-CG 4.41Å; L213-L217 PolarHBondContact O-N 2.94Å; C214-L217 PolarHBondContact O-N 3.02Å; V215-L217 VanDerWaalsContact C-N 3.33Å; V215-L217 PolarHBondContact O-N 3.49Å; L217-L219 VanDerWaalsContact C-N 3.34Å; L217-L219 PolarHBondContact O-N 3.39Å; L217-L220 PolarHBondContact O-N 3.41Å; L217-L221 HydrophobicContact CD1-CD1 4.07Å; L217-L221 HydrophobicContact CG-CD1 4.16Å; L217-L221 WeakPolarHBondContact O-CG 3.17Å; L217-L221 PolarHBondContact O-N 3.24Å; L217-L221 VanDerWaalsContact O-N 3.13Å
218	G	96.3	Very high	95.4	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.6	-38.5	175	0	0	0	0	0	113.9	C214 V215 H216 L221 G222 C223 G224	C214-G218 PolarHBondContact O-N 2.87Å; C214-G218 VanDerWaalsContact O-N 3.08Å; V215-G218 PolarHBondContact O-N 2.91Å; H216-G218 VanDerWaalsContact C-N 3.31Å; H216-G218 PolarHBondContact O-N 3.46Å; G218-L221 PolarHBondContact O-N 3.12Å; G218-G222 PolarHBondContact O-N 3.38Å; G218-C223 PolarHBondContact O-N 3.29Å; G218-G224 PolarHBondContact O-N 3.21Å
219	L	95.1	Very high	95.4	Very high	123 Å²	123	43.1 Å²	43.1	64%	0.644	24%	0.24	S	C	*	.	H	α-helix	trans	-67.1	-42.5	176.3	-70.1	172	0	0	0	112.1	V215 H216 L217 L221 G222	V215-L219 HydrophobicContact CG1-CD1 4.28Å; V215-L219 WeakPolarHBondContact O-CG 3.49Å; V215-L219 PolarHBondContact O-N 2.66Å; H216-L219 PolarHBondContact O-N 3.29Å; L217-L219 VanDerWaalsContact C-N 3.34Å; L217-L219 PolarHBondContact O-N 3.39Å; L219-L221 PolarHBondContact O-N 2.81Å; L219-G222 PolarHBondContact O-N 2.84Å
220	L	94.6	Very high	95.6	Very high	110 Å²	110	41.9 Å²	41.9	58%	0.576	24%	0.237	S	C	*	.	H	α-helix	trans	-62.9	-32.9	176.6	-72.6	174.7	0	0	0	112.4	L160 H216 L217	L160-L220 HydrophobicContact CD1-CD1 4.25Å; L160-L220 HydrophobicContact CD2-CD1 3.62Å; L160-L220 HydrophobicContact CG-CD1 3.79Å; H216-L220 WeakPolarHBondContact O-CG 3.16Å; H216-L220 PolarHBondContact O-N 2.93Å; L217-L220 PolarHBondContact O-N 3.41Å
221	L	95.5	Very high	95.7	Very high	35 Å²	35	44.8 Å²	44.8	18%	0.183	25%	0.247	C	C	.	.	H	α-helix	trans	-86.1	-11.7	178.1	-67.4	171.9	0	0	0	113.6	L143 V147 I153 A156 L217 G218 L219 C223	L143-L221 HydrophobicContact CD1-CD1 3.79Å; L143-L221 HydrophobicContact CD2-CD1 3.96Å; V147-L221 HydrophobicContact CG2-CB 4.45Å; I153-L221 HydrophobicContact CG1-CD1 4.25Å; I153-L221 HydrophobicContact CG1-CD2 4.48Å; I153-L221 HydrophobicContact CG2-CD1 4.49Å; A156-L221 HydrophobicContact CB-CD2 3.75Å; A156-L221 HydrophobicContact CB-CG 4.04Å; L217-L221 HydrophobicContact CD1-CD1 4.07Å; L217-L221 HydrophobicContact CG-CD1 4.16Å; L217-L221 WeakPolarHBondContact O-CG 3.17Å; L217-L221 PolarHBondContact O-N 3.24Å; L217-L221 VanDerWaalsContact O-N 3.13Å; G218-L221 PolarHBondContact O-N 3.12Å; L219-L221 PolarHBondContact O-N 2.81Å; L221-C223 VanDerWaalsContact C-N 3.25Å; L221-C223 PolarHBondContact O-N 3.01Å
222	G	94.5	Very high	95.8	Very high	68 Å²	68	41.2 Å²	41.2	70%	0.701	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.7	0.7	-179.3	0	0	0	0	0	115.6	G218 L219	G218-G222 PolarHBondContact O-N 3.38Å; L219-G222 PolarHBondContact O-N 2.84Å
223	C	93.2	Very high	96	Very high	13 Å²	13	40.9 Å²	40.9	9%	0.088	23%	0.232	C	C	.	.	S	Bend	trans	-105	-10.2	-178.3	57.8	0	0	0	0	114.2	H144 E145 G218 L221	H144-C223 WeakPolarHBondContact CB-O 3.32Å; E145-C223 HydrophobicContact CB-CB 3.75Å; E145-C223 HydrophobicContact CG-CB 4.35Å; G218-C223 PolarHBondContact O-N 3.29Å; L221-C223 VanDerWaalsContact C-N 3.25Å; L221-C223 PolarHBondContact O-N 3.01Å
224	G	94.8	Very high	96	Very high	21 Å²	21	43.7 Å²	43.7	22%	0.216	24%	0.244	C	C	.	.			trans	74.1	157.4	-169.4	0	0	0	0	0	112.7	H144 G218	H144-G224 PolarHBondContact N-O 3.06Å; G218-G224 PolarHBondContact O-N 3.21Å
225	G	95.6	Very high	95.9	Very high	6 Å²	6	43.7 Å²	43.7	6%	0.062	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	144.3	-171.6	0	0	0	0	0	112.2	R142 V215	R142-G225 CarbonylContact O-C 3.58Å; R142-G225 WeakPolarHBondContact O-CA 3.34Å; V215-G225 WeakPolarHBondContact CA-O 3.25Å
226	V	96.1	Very high	95.5	Very high	56 Å²	56	41 Å²	41	34%	0.339	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	152	-178.3	67.2	0	0	0	0	110.5	F141 R142	F141-V226 CarbonylContact C-O 3.59Å; F141-V226 VanDerWaalsContact CA-O 3.31Å; F141-V226 WeakPolarHBondContact CA-O 3.43Å; R142-V226 HydrophobicContact CB-CG1 3.9Å; R142-V226 PolarHBondContact N-O 3.43Å; R142-V226 PolarHBondContact O-N 3.16Å
227	M	96.2	Very high	95	Very high	15 Å²	15	41.7 Å²	41.7	7%	0.074	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	118.9	171.8	-174.3	-175.4	91.3	0	0	109.2	R211 C214 L230	R211-M227 HydrophobicContact CB-CB 4.5Å; R211-M227 HydrophobicContact CB-CE 4.38Å; R211-M227 HydrophobicContact CB-SD 3.93Å; R211-M227 HydrophobicContact CG-CB 4.32Å; C214-M227 HydrophobicContact CB-CB 4.11Å; M227-L230 HydrophobicContact CE-CB 3.88Å; M227-L230 HydrophobicContact CE-CD2 4.26Å; M227-L230 HydrophobicContact CG-CB 4.5Å; M227-L230 HydrophobicContact SD-CB 3.82Å; M227-L230 HydrophobicContact SD-CD1 4.33Å; M227-L230 HydrophobicContact SD-CD2 3.89Å; M227-L230 HydrophobicContact SD-CG 4.24Å
228	E	95.4	Very high	94.9	Very high	104 Å²	104	41.7 Å²	41.7	49%	0.486	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-54.9	179	-169.6	74.8	-139.4	0	0	110.3	I140 R142	I140-E228 HydrophobicContact CB-CB 4.35Å; I140-E228 HydrophobicContact CG2-CB 4.04Å; I140-E228 PolarHBondContact O-N 2.86Å; R142-E228 IonicContact CZ-OE2 3.66Å; R142-E228 IonicContact NE-OE2 2.9Å; R142-E228 PolarHBondContact NE-OE2 3.35Å; R142-E228 IonicContact NH2-OE2 3.44Å
229	E	96.2	Very high	94.8	Very high	96 Å²	96	42.9 Å²	42.9	45%	0.449	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	148.2	-178.6	-169	175.6	169.2	0	0	110.4	C139 I140	C139-E229 WeakPolarHBondContact CA-O 3.47Å; I140-E229 HydrophobicContact CB-CB 4.16Å; I140-E229 HydrophobicContact CD1-CB 4.18Å; I140-E229 HydrophobicContact CG1-CB 4.36Å; I140-E229 PolarHBondContact N-O 3.2Å; I140-E229 PolarHBondContact O-N 3.24Å
230	L	97.2	Very high	94.9	Very high	14 Å²	14	40.2 Å²	40.2	7%	0.073	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	133.8	176.3	-174.7	71.9	0	0	0	109.5	V112 S113 Y137 C139 V210 M227	V112-L230 HydrophobicContact CG1-CB 4.04Å; V112-L230 HydrophobicContact CG1-CD2 3.87Å; V112-L230 HydrophobicContact CG1-CG 3.92Å; V112-L230 WeakPolarHBondContact CG1-O 3.28Å; V112-L230 HydrophobicContact CG2-CB 4Å; V112-L230 HydrophobicContact CG2-CD2 4.01Å; V112-L230 HydrophobicContact CG2-CG 4.43Å; S113-L230 PolarHBondContact N-O 3.38Å; Y137-L230 HydrophobicContact CD1-CD1 3.94Å; Y137-L230 HydrophobicContact CD1-CD2 3.95Å; Y137-L230 HydrophobicContact CD1-CG 3.9Å; Y137-L230 HydrophobicContact CE1-CD2 4.21Å; Y137-L230 HydrophobicContact CG-CD1 4.13Å; C139-L230 HydrophobicContact CB-CD1 3.59Å; V210-L230 HydrophobicContact CB-CD1 3.85Å; V210-L230 HydrophobicContact CB-CD2 4.09Å; V210-L230 HydrophobicContact CG1-CD1 3.64Å; V210-L230 HydrophobicContact CG2-CD1 4.12Å; V210-L230 HydrophobicContact CG2-CD2 4.38Å; M227-L230 HydrophobicContact CE-CB 3.88Å; M227-L230 HydrophobicContact CE-CD2 4.26Å; M227-L230 HydrophobicContact CG-CB 4.5Å; M227-L230 HydrophobicContact SD-CB 3.82Å; M227-L230 HydrophobicContact SD-CD1 4.33Å; M227-L230 HydrophobicContact SD-CD2 3.89Å; M227-L230 HydrophobicContact SD-CG 4.24Å
231	R	97.8	Very high	94.9	Very high	65 Å²	65	46.3 Å²	46.3	25%	0.245	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	129.2	173.6	-178.2	167.1	176.6	80.8	1.6	109.6	D79 S113 Y137 V138 S233 E240	D79-R231 IonicContact OD1-CZ 3.19Å; D79-R231 IonicContact OD1-NH1 3.7Å; D79-R231 PolarHBondContact OD1-NH1 3.04Å; D79-R231 IonicContact OD1-NH2 2.64Å; D79-R231 IonicContact OD2-CZ 3.39Å; D79-R231 IonicContact OD2-NH1 3.54Å; D79-R231 PolarHBondContact OD2-NH1 2.9Å; D79-R231 IonicContact OD2-NH2 3.15Å; D79-R231 PolarHBondContact OD2-NH2 3.11Å; S113-R231 WeakPolarHBondContact O-CA 3.38Å; S113-R231 PolarHBondContact OG-NH1 2.85Å; Y137-R231 CarbonylContact C-O 3.59Å; Y137-R231 VanDerWaalsContact CA-O 3.28Å; Y137-R231 WeakPolarHBondContact CA-O 3.48Å; V138-R231 PolarHBondContact N-O 3.4Å; V138-R231 PolarHBondContact O-N 2.92Å; R231-S233 PolarHBondContact O-N 3.24Å; R231-E240 IonicContact CZ-OE1 3.65Å; R231-E240 IonicContact NE-OE1 3.32Å; R231-E240 PolarHBondContact NE-OE1 3.37Å; R231-E240 IonicContact NH2-OE1 3.04Å; R231-E240 PolarHBondContact NH2-OE1 2.99Å; R231-E240 VanDerWaalsContact NH2-OE1 3.15Å
232	R	97.8	Very high	94.9	Very high	2 Å²	2	47 Å²	47	1%	0.008	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	102	175.3	-171.9	165	64.7	-162.2	-1.3	109.6	G106 L108 S113 G114 C115 E136 Y137 K234	G106-R232 PolarHBondContact O-NH1 2.89Å; G106-R232 PolarHBondContact O-NH2 2.87Å; L108-R232 HydrophobicContact CD1-CB 4.41Å; L108-R232 HydrophobicContact CD2-CB 3.92Å; S113-R232 PolarHBondContact O-N 2.88Å; G114-R232 CarbonylContact C-O 3.58Å; G114-R232 WeakPolarHBondContact CA-O 3.39Å; C115-R232 PolarHBondContact N-O 2.91Å; C115-R232 PolarHBondContact O-NE 3.03Å; C115-R232 PolarHBondContact O-NH2 2.81Å; E136-R232 CarbonylContact O-C 3.5Å; E136-R232 WeakPolarHBondContact O-CA 3.38Å; E136-R232 WeakPolarHBondContact O-CG 3.28Å; Y137-R232 HydrophobicContact CD1-CB 3.71Å; Y137-R232 HydrophobicContact CD1-CG 3.96Å; Y137-R232 HydrophobicContact CE1-CB 3.59Å; Y137-R232 HydrophobicContact CE1-CG 3.63Å; R232-K234 VanDerWaalsContact C-N 3.31Å; R232-K234 WeakPolarHBondContact CG-O 3.14Å
233	S	97.4	Very high	94.9	Very high	8 Å²	8	46.5 Å²	46.5	6%	0.056	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	-18.7	-179.5	60.9	0	0	0	0	113.4	C115 E136 R231 S239 E240	C115-S233 PolarHBondContact SG-O 2.91Å; E136-S233 WeakPolarHBondContact CB-OG 3.27Å; E136-S233 WeakPolarHBondContact CG-OG 3.29Å; E136-S233 PolarHBondContact O-N 3.2Å; E136-S233 PolarHBondContact O-OG 2.74Å; E136-S233 PolarHBondContact OE1-OG 3.1Å; E136-S233 VanDerWaalsContact OE1-OG 3.11Å; R231-S233 PolarHBondContact O-N 3.24Å; S233-S239 CarbonylContact O-C 3.53Å; S233-S239 VanDerWaalsContact O-CA 3.26Å; S233-S239 WeakPolarHBondContact O-CA 3.23Å; S233-E240 PolarHBondContact O-N 3.1Å
234	K	96.7	Very high	95.1	Very high	61 Å²	61	48 Å²	48	27%	0.265	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	142.7	179.6	-165.9	-179.7	171.2	-177.6	0	112.9	E136 R232 G236 M238	E136-K234 HydrophobicContact CB-CB 3.52Å; E136-K234 HydrophobicContact CB-CD 4.42Å; E136-K234 PolarHBondContact N-O 2.77Å; E136-K234 PolarHBondContact O-N 2.82Å; R232-K234 VanDerWaalsContact C-N 3.31Å; R232-K234 WeakPolarHBondContact CG-O 3.14Å; K234-G236 VanDerWaalsContact CE-O 3.28Å; K234-G236 WeakPolarHBondContact CE-O 3.43Å; K234-M238 CarbonylContact C-O 3.38Å; K234-M238 WeakPolarHBondContact CA-O 3.42Å; K234-M238 VanDerWaalsContact CG-O 3.22Å; K234-M238 WeakPolarHBondContact CG-O 3.14Å
235	T	94	Very high	95.2	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	119.2	167.6	168.1	0	0	0	0	110.4	S105 C115 I117 K135 F237 M238	S105-T235 PolarHBondContact OG-OG1 3.29Å; C115-T235 HydrophobicContact CB-CG2 3.87Å; I117-T235 HydrophobicContact CD1-CG2 3.67Å; I117-T235 WeakPolarHBondContact CD1-O 3.27Å; I117-T235 HydrophobicContact CG1-CG2 3.65Å; K135-T235 WeakPolarHBondContact CD-OG1 3.48Å; K135-T235 WeakPolarHBondContact CE-OG1 3.3Å; T235-F237 PolarHBondContact O-N 2.92Å; T235-F237 VanDerWaalsContact O-N 3.1Å; T235-M238 PolarHBondContact N-O 2.86Å; T235-M238 PolarHBondContact O-N 2.95Å; T235-M238 VanDerWaalsContact O-N 3.11Å
236	G	88.2	Confident	95.3	Very high	11 Å²	11	49.5 Å²	49.5	11%	0.113	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	-116.7	-176.6	0	0	0	0	0	111.4	A133 G134 K234	A133-G236 VanDerWaalsContact CB-CA 3.48Å; G134-G236 WeakPolarHBondContact O-CA 3.38Å; G134-G236 PolarHBondContact O-N 3.43Å; K234-G236 VanDerWaalsContact CE-O 3.28Å; K234-G236 WeakPolarHBondContact CE-O 3.43Å
237	F	86	Confident	95.3	Very high	65 Å²	65	48 Å²	48	29%	0.285	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-6	-176.5	-57.7	-63.4	0	0	0	114.5	T235 L276 K279 H280	T235-F237 PolarHBondContact O-N 2.92Å; T235-F237 VanDerWaalsContact O-N 3.1Å; F237-L276 WeakPolarHBondContact CD2-O 3.43Å; F237-K279 HydrophobicContact CD1-CB 3.94Å; F237-K279 HydrophobicContact CD1-CD 3.49Å; F237-K279 VanDerWaalsContact CD1-CD 3.49Å; F237-K279 HydrophobicContact CD1-CG 3.73Å; F237-K279 HydrophobicContact CE1-CB 3.66Å; F237-K279 HydrophobicContact CE1-CD 3.72Å; F237-K279 HydrophobicContact CE1-CG 3.96Å; F237-K279 HydrophobicContact CG-CG 4.46Å; F237-K279 HydrophobicContact CZ-CB 4.21Å; F237-H280 AromaticContact CE2-CE1 3.63Å
238	M	93.5	Very high	95.4	Very high	3 Å²	3	53.5 Å²	53.5	2%	0.015	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	132.3	-178.2	-53	-161.9	72.5	0	0	111.3	V75 N77 I117 K234 T235 D242 M271 K275 L276	V75-M238 HydrophobicContact CG1-SD 4.48Å; N77-M238 HydrophobicContact CB-CE 3.52Å; N77-M238 HydrophobicContact CB-SD 3.97Å; I117-M238 HydrophobicContact CD1-CB 3.95Å; I117-M238 HydrophobicContact CD1-CG 3.81Å; I117-M238 HydrophobicContact CD1-SD 4.08Å; I117-M238 HydrophobicContact CG1-CB 4.16Å; I117-M238 HydrophobicContact CG1-CG 4.18Å; I117-M238 HydrophobicContact CG1-SD 3.92Å; K234-M238 CarbonylContact C-O 3.38Å; K234-M238 WeakPolarHBondContact CA-O 3.42Å; K234-M238 VanDerWaalsContact CG-O 3.22Å; K234-M238 WeakPolarHBondContact CG-O 3.14Å; T235-M238 PolarHBondContact N-O 2.86Å; T235-M238 PolarHBondContact O-N 2.95Å; T235-M238 VanDerWaalsContact O-N 3.11Å; M238-D242 HydrophobicContact CB-CB 4.36Å; M238-D242 HydrophobicContact CE-CB 4.04Å; M238-D242 WeakPolarHBondContact CE-O 3.39Å; M238-M271 HydrophobicContact CE-CE 3.52Å; M238-M271 HydrophobicContact CE-SD 3.78Å; M238-K275 HydrophobicContact CE-CG 4.49Å; M238-L276 HydrophobicContact CG-CD2 3.82Å; M238-L276 HydrophobicContact SD-CD2 3.61Å
239	S	95.7	Very high	95.5	Very high	24 Å²	24	50.6 Å²	50.6	17%	0.168	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	178.1	172.9	68.7	0	0	0	0	111.1	N77 C115 S233 R241 D242	N77-S239 PolarHBondContact ND2-O 3.2Å; C115-S239 VanDerWaalsContact SG-C 3.5Å; S233-S239 CarbonylContact O-C 3.53Å; S233-S239 VanDerWaalsContact O-CA 3.26Å; S233-S239 WeakPolarHBondContact O-CA 3.23Å; S239-R241 PolarHBondContact O-N 3.02Å; S239-R241 VanDerWaalsContact O-N 3.17Å; S239-R241 PolarHBondContact OG-N 3.21Å; S239-D242 WeakPolarHBondContact CB-OD2 3.38Å; S239-D242 PolarHBondContact N-OD2 2.83Å; S239-D242 WeakPolarHBondContact O-CB 3.37Å; S239-D242 PolarHBondContact O-N 2.75Å; S239-D242 PolarHBondContact OG-OD2 3.39Å
240	E	96	Very high	95.6	Very high	68 Å²	68	46 Å²	46	32%	0.318	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-24.1	172.4	-65.9	173.8	161.8	0	0	113	C115 R231 S233 D242 L244	C115-E240 WeakPolarHBondContact SG-CG 3.41Å; C115-E240 PolarHBondContact SG-N 3Å; R231-E240 IonicContact CZ-OE1 3.65Å; R231-E240 IonicContact NE-OE1 3.32Å; R231-E240 PolarHBondContact NE-OE1 3.37Å; R231-E240 IonicContact NH2-OE1 3.04Å; R231-E240 PolarHBondContact NH2-OE1 2.99Å; R231-E240 VanDerWaalsContact NH2-OE1 3.15Å; S233-E240 PolarHBondContact O-N 3.1Å; E240-D242 VanDerWaalsContact C-N 3.27Å; E240-L244 HydrophobicContact CB-CD2 4.15Å; E240-L244 HydrophobicContact CG-CD2 4.05Å; E240-L244 WeakPolarHBondContact O-CB 3.44Å
241	R	95	Very high	95.6	Very high	237 Å²	237	49.5 Å²	49.5	89%	0.894	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-13.6	177.7	-56	178.9	-173.1	170.1	1.3	112.4	S239 N243	S239-R241 PolarHBondContact O-N 3.02Å; S239-R241 VanDerWaalsContact O-N 3.17Å; S239-R241 PolarHBondContact OG-N 3.21Å; R241-N243 PolarHBondContact O-N 2.86Å
242	D	94.7	Very high	95.6	Very high	51 Å²	51	50.5 Å²	50.5	27%	0.273	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.2	70.2	-175.3	-62.3	-68	0	0	0	110.9	N77 M238 S239 E240 L244	N77-D242 PolarHBondContact ND2-O 3.3Å; M238-D242 HydrophobicContact CB-CB 4.36Å; M238-D242 HydrophobicContact CE-CB 4.04Å; M238-D242 WeakPolarHBondContact CE-O 3.39Å; S239-D242 WeakPolarHBondContact CB-OD2 3.38Å; S239-D242 PolarHBondContact N-OD2 2.83Å; S239-D242 WeakPolarHBondContact O-CB 3.37Å; S239-D242 PolarHBondContact O-N 2.75Å; S239-D242 PolarHBondContact OG-OD2 3.39Å; E240-D242 VanDerWaalsContact C-N 3.27Å; D242-L244 PolarHBondContact O-N 3.45Å
243	N	95.4	Very high	95.5	Very high	57 Å²	57	50.4 Å²	50.4	31%	0.305	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	55.1	175.3	-170.4	52.3	0	0	0	112.6	R241 R268 M271	R241-N243 PolarHBondContact O-N 2.86Å; N243-R268 PolarHBondContact ND2-O 3.41Å; N243-M271 HydrophobicContact CB-CE 4.36Å; N243-M271 HydrophobicContact CB-SD 3.89Å
244	L	97.1	Very high	95.5	Very high	45 Å²	45	52.2 Å²	52.2	24%	0.236	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	130.3	174.9	-167.6	73.3	0	0	0	109.5	N77 D79 C115 E240 D242	N77-L244 WeakPolarHBondContact O-CA 3.31Å; D79-L244 HydrophobicContact CB-CD1 4.16Å; D79-L244 HydrophobicContact CB-CD2 3.75Å; D79-L244 HydrophobicContact CB-CG 3.81Å; D79-L244 WeakPolarHBondContact OD2-CD2 3.47Å; C115-L244 HydrophobicContact CB-CD1 4.36Å; E240-L244 HydrophobicContact CB-CD2 4.15Å; E240-L244 HydrophobicContact CG-CD2 4.05Å; E240-L244 WeakPolarHBondContact O-CB 3.44Å; D242-L244 PolarHBondContact O-N 3.45Å
245	V	97.6	Very high	95.5	Very high	7 Å²	7	56.1 Å²	56.1	4%	0.042	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	152.7	-178.1	-60.4	0	0	0	0	110.9	I76 N77 L78 D79 D249 V269	I76-V245 HydrophobicContact CG2-CG2 3.38Å; N77-V245 WeakPolarHBondContact O-CG2 3.3Å; N77-V245 PolarHBondContact O-N 2.66Å; L78-V245 CarbonylContact C-O 3.59Å; L78-V245 WeakPolarHBondContact CA-O 3.29Å; D79-V245 PolarHBondContact N-O 3.32Å; V245-D249 HydrophobicContact CB-CB 4.23Å; V245-V269 HydrophobicContact CG1-CG2 4.48Å; V245-V269 HydrophobicContact CG2-CG1 4.18Å
246	T	97.7	Very high	95.7	Very high	51 Å²	51	57.5 Å²	57.5	31%	0.313	27%	0.272	S	S	.	.			trans	-95.5	171.3	178.3	68.8	0	0	0	0	111.5	H248 D249 I250	T246-H248 PolarHBondContact O-N 3.15Å; T246-H248 PolarHBondContact OG1-N 2.87Å; T246-D249 WeakPolarHBondContact CB-OD2 3.33Å; T246-D249 PolarHBondContact N-OD2 3.27Å; T246-D249 PolarHBondContact O-N 3.42Å; T246-D249 PolarHBondContact OG1-N 2.93Å; T246-D249 PolarHBondContact OG1-OD2 2.85Å; T246-I250 PolarHBondContact O-N 3.44Å
247	M	96.2	Very high	96.1	Very high	23 Å²	23	59.8 Å²	59.8	11%	0.113	28%	0.278	C	S	.	.	H	α-helix	trans	-63.7	-31.4	171.1	-76.3	-59.3	-55.6	0	0	112.7	L78 V89 W92 V93 I250 L251	L78-M247 HydrophobicContact CD1-CG 4.17Å; L78-M247 HydrophobicContact CD1-SD 3.87Å; L78-M247 HydrophobicContact CD2-SD 3.97Å; V89-M247 HydrophobicContact CG1-SD 4.11Å; W92-M247 HydrophobicContact CB-CE 3.71Å; V93-M247 HydrophobicContact CG2-CE 4.12Å; V93-M247 HydrophobicContact CG2-SD 3.59Å; V93-M247 VanDerWaalsContact CG2-SD 3.59Å; M247-I250 PolarHBondContact O-N 2.8Å; M247-I250 HydrophobicContact SD-CD1 4.13Å; M247-L251 WeakPolarHBondContact O-CG 3.32Å; M247-L251 PolarHBondContact O-N 2.99Å; M247-L251 VanDerWaalsContact O-N 3.14Å
248	H	97.2	Very high	96.6	Very high	132 Å²	132	60 Å²	60	61%	0.611	28%	0.282	S	S	*	.	H	α-helix	trans	-64.8	-44.5	176.6	-61.4	-70.7	0	0	0	110.6	T246 I250 L251 D252	T246-H248 PolarHBondContact O-N 3.15Å; T246-H248 PolarHBondContact OG1-N 2.87Å; H248-I250 VanDerWaalsContact C-N 3.25Å; H248-I250 PolarHBondContact O-N 2.92Å; H248-L251 PolarHBondContact O-N 2.95Å; H248-L251 VanDerWaalsContact O-N 3.1Å; H248-D252 WeakPolarHBondContact O-CB 3.43Å; H248-D252 VanDerWaalsContact O-CG 3.28Å; H248-D252 PolarHBondContact O-N 3.46Å
249	D	97.9	Very high	96.8	Very high	42 Å²	42	64.9 Å²	64.9	23%	0.225	31%	0.308	C	S	.	.	H	α-helix	trans	-59	-37.6	177.4	-56.3	-47.4	0	0	0	112.1	V245 T246 A253 Y265 V269	V245-D249 HydrophobicContact CB-CB 4.23Å; T246-D249 WeakPolarHBondContact CB-OD2 3.33Å; T246-D249 PolarHBondContact N-OD2 3.27Å; T246-D249 PolarHBondContact O-N 3.42Å; T246-D249 PolarHBondContact OG1-N 2.93Å; T246-D249 PolarHBondContact OG1-OD2 2.85Å; D249-A253 WeakPolarHBondContact O-CB 3.36Å; D249-A253 PolarHBondContact O-N 3.3Å; D249-Y265 PolarHBondContact OD1-OH 3.5Å; D249-V269 HydrophobicContact CB-CG2 4.19Å
250	I	97.8	Very high	96.8	Very high	0 Å²	0	72.2 Å²	72.2	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-66.1	-44.9	176.9	-64.6	171.1	0	0	0	111.2	I76 L78 V93 A96 L97 T246 M247 H248 K254 V269	I76-I250 HydrophobicContact CD1-CD1 4.15Å; I76-I250 HydrophobicContact CG2-CD1 4.17Å; L78-I250 HydrophobicContact CD1-CD1 3.7Å; V93-I250 HydrophobicContact CG1-CD1 4.44Å; V93-I250 HydrophobicContact CG2-CD1 3.84Å; A96-I250 HydrophobicContact CB-CG2 4.14Å; L97-I250 HydrophobicContact CD2-CG2 3.9Å; L97-I250 HydrophobicContact CG-CG2 4.04Å; T246-I250 PolarHBondContact O-N 3.44Å; M247-I250 PolarHBondContact O-N 2.8Å; M247-I250 HydrophobicContact SD-CD1 4.13Å; H248-I250 VanDerWaalsContact C-N 3.25Å; H248-I250 PolarHBondContact O-N 2.92Å; I250-K254 WeakPolarHBondContact O-CB 3.29Å; I250-K254 PolarHBondContact O-N 3.23Å; I250-V269 HydrophobicContact CB-CG1 4.45Å; I250-V269 HydrophobicContact CG1-CG1 3.61Å
251	L	97.3	Very high	96.8	Very high	87 Å²	87	77.3 Å²	77.3	46%	0.455	35%	0.349	S	S	.	.	H	α-helix	trans	-66.1	-45.3	179.2	-71	171.2	0	0	0	111.2	A96 M247 H248 K254 W255	A96-L251 HydrophobicContact CB-CD2 3.82Å; M247-L251 WeakPolarHBondContact O-CG 3.32Å; M247-L251 PolarHBondContact O-N 2.99Å; M247-L251 VanDerWaalsContact O-N 3.14Å; H248-L251 PolarHBondContact O-N 2.95Å; H248-L251 VanDerWaalsContact O-N 3.1Å; L251-K254 PolarHBondContact O-N 2.84Å; L251-W255 WeakPolarHBondContact O-CB 3.41Å; L251-W255 PolarHBondContact O-N 2.65Å
252	D	97.8	Very high	96.9	Very high	86 Å²	86	68.7 Å²	68.7	46%	0.46	32%	0.32	S	S	.	.	H	α-helix	trans	-65.3	-40.8	179.2	-67.6	-14.2	0	0	0	111.2	H248 W255 L256 Y265	H248-D252 WeakPolarHBondContact O-CB 3.43Å; H248-D252 VanDerWaalsContact O-CG 3.28Å; H248-D252 PolarHBondContact O-N 3.46Å; D252-W255 PolarHBondContact O-N 2.87Å; D252-L256 VanDerWaalsContact O-CB 3.29Å; D252-L256 WeakPolarHBondContact O-CB 3.39Å; D252-L256 PolarHBondContact O-N 2.86Å; D252-Y265 HydrophobicContact CB-CD1 4.37Å; D252-Y265 HydrophobicContact CB-CE1 3.65Å
253	A	97.5	Very high	96.9	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-62.8	-43.3	175.3	0	0	0	0	0	111.9	D249 Y257 Y265 L266 V269	D249-A253 WeakPolarHBondContact O-CB 3.36Å; D249-A253 PolarHBondContact O-N 3.3Å; A253-Y257 PolarHBondContact O-N 3.42Å; A253-Y257 VanDerWaalsContact O-N 3.15Å; A253-Y265 VanDerWaalsContact CA-CD1 3.49Å; A253-Y265 HydrophobicContact CB-CD1 3.82Å; A253-Y265 HydrophobicContact CB-CD2 4.13Å; A253-Y265 HydrophobicContact CB-CE1 4.37Å; A253-Y265 HydrophobicContact CB-CG 3.68Å; A253-L266 HydrophobicContact CB-CD2 3.84Å; A253-L266 HydrophobicContact CB-CG 4.16Å; A253-V269 HydrophobicContact CB-CB 4.4Å; A253-V269 HydrophobicContact CB-CG2 3.84Å
254	K	96.8	Very high	96.9	Very high	47 Å²	47	71.1 Å²	71.1	20%	0.204	34%	0.335	C	S	.	.	H	α-helix	trans	-64.9	-45.5	175.8	-174.1	68.5	165.1	71.8	0	111.6	A96 I250 L251 L256 Y257 D258	A96-K254 WeakPolarHBondContact O-CG 3.16Å; I250-K254 WeakPolarHBondContact O-CB 3.29Å; I250-K254 PolarHBondContact O-N 3.23Å; L251-K254 PolarHBondContact O-N 2.84Å; K254-L256 VanDerWaalsContact C-N 3.33Å; K254-L256 PolarHBondContact O-N 3.29Å; K254-Y257 PolarHBondContact O-N 2.93Å; K254-D258 IonicContact NZ-OD1 3.72Å; K254-D258 PolarHBondContact NZ-OD1 2.68Å; K254-D258 IonicContact NZ-OD2 3.23Å; K254-D258 PolarHBondContact NZ-OD2 2.93Å; K254-D258 PolarHBondContact O-N 3.11Å
255	W	97.3	Very high	96.9	Very high	142 Å²	142	71.4 Å²	71.4	54%	0.538	33%	0.333	S	S	.	.	H	α-helix	trans	-59.3	-45.2	178.6	-179.8	91.6	0	0	0	111.3	L251 D252 Y257 D258 N259	L251-W255 WeakPolarHBondContact O-CB 3.41Å; L251-W255 PolarHBondContact O-N 2.65Å; D252-W255 PolarHBondContact O-N 2.87Å; W255-Y257 VanDerWaalsContact C-N 3.32Å; W255-Y257 PolarHBondContact O-N 2.87Å; W255-D258 PolarHBondContact O-N 3.04Å; W255-N259 VanDerWaalsContact CD1-ND2 3.27Å; W255-N259 HydrophobicContact CZ2-CB 4.4Å; W255-N259 PolarHBondContact NE1-ND2 3.5Å; W255-N259 WeakPolarHBondContact O-CB 3.42Å; W255-N259 PolarHBondContact O-N 2.82Å; W255-N259 PolarHBondContact O-ND2 3.42Å
256	L	97.4	Very high	96.9	Very high	29 Å²	29	71.1 Å²	71.1	15%	0.152	33%	0.331	C	S	.	.	H	α-helix	trans	-60.7	-43.5	178.9	-175.9	67.2	0	0	0	111.4	D252 K254 R260 D262 Y265	D252-L256 VanDerWaalsContact O-CB 3.29Å; D252-L256 WeakPolarHBondContact O-CB 3.39Å; D252-L256 PolarHBondContact O-N 2.86Å; K254-L256 VanDerWaalsContact C-N 3.33Å; K254-L256 PolarHBondContact O-N 3.29Å; L256-R260 HydrophobicContact CD1-CB 4.24Å; L256-R260 HydrophobicContact CD1-CG 4.16Å; L256-R260 WeakPolarHBondContact O-CA 3.39Å; L256-R260 WeakPolarHBondContact O-CB 3.38Å; L256-R260 PolarHBondContact O-N 3.36Å; L256-D262 HydrophobicContact CD2-CB 4.29Å; L256-D262 HydrophobicContact CG-CB 4.09Å; L256-Y265 HydrophobicContact CD2-CD1 4.28Å
257	Y	97.1	Very high	96.8	Very high	60 Å²	60	71.9 Å²	71.9	24%	0.235	33%	0.328	C	S	.	.	H	α-helix	trans	-65.3	-44.9	176.6	175.4	-106.8	0	0	0	112.6	L67 A253 K254 W255 N259 R261 D262 E263 L266	L67-Y257 HydrophobicContact CD2-CD2 3.75Å; L67-Y257 HydrophobicContact CD2-CE1 4.16Å; L67-Y257 HydrophobicContact CD2-CE2 3.24Å; L67-Y257 HydrophobicContact CD2-CG 4.39Å; L67-Y257 VanDerWaalsContact CD2-CZ 3.46Å; A253-Y257 PolarHBondContact O-N 3.42Å; A253-Y257 VanDerWaalsContact O-N 3.15Å; K254-Y257 PolarHBondContact O-N 2.93Å; W255-Y257 VanDerWaalsContact C-N 3.32Å; W255-Y257 PolarHBondContact O-N 2.87Å; Y257-N259 PolarHBondContact O-N 3.43Å; Y257-R261 WeakPolarHBondContact O-CA 3.48Å; Y257-R261 PolarHBondContact O-N 2.96Å; Y257-D262 WeakPolarHBondContact CA-O 3.39Å; Y257-E263 HydrophobicContact CD2-CG 4.15Å; Y257-E263 HydrophobicContact CE2-CG 4.04Å; Y257-L266 HydrophobicContact CD1-CD1 3.89Å; Y257-L266 HydrophobicContact CD2-CD1 4.13Å; Y257-L266 HydrophobicContact CG-CD1 3.52Å
258	D	96.2	Very high	96.8	Very high	70 Å²	70	78.6 Å²	78.6	37%	0.374	35%	0.352	S	S	.	.	H	α-helix	trans	-67.3	-38.1	-177.1	-69.9	-17.7	0	0	0	112.3	K254 W255	K254-D258 IonicContact NZ-OD1 3.72Å; K254-D258 PolarHBondContact NZ-OD1 2.68Å; K254-D258 IonicContact NZ-OD2 3.23Å; K254-D258 PolarHBondContact NZ-OD2 2.93Å; K254-D258 PolarHBondContact O-N 3.11Å; W255-D258 PolarHBondContact O-N 3.04Å
259	N	97.2	Very high	96.8	Very high	104 Å²	104	72.3 Å²	72.3	56%	0.556	32%	0.323	S	S	*	.	H	α-helix	trans	-91.3	-34.5	-174.6	-68.7	-88.6	0	0	0	113.4	W255 Y257	W255-N259 VanDerWaalsContact CD1-ND2 3.27Å; W255-N259 HydrophobicContact CZ2-CB 4.4Å; W255-N259 PolarHBondContact NE1-ND2 3.5Å; W255-N259 WeakPolarHBondContact O-CB 3.42Å; W255-N259 PolarHBondContact O-N 2.82Å; W255-N259 PolarHBondContact O-ND2 3.42Å; Y257-N259 PolarHBondContact O-N 3.43Å
260	R	96.6	Very high	96.8	Very high	178 Å²	178	70.3 Å²	70.3	67%	0.672	31%	0.313	S	S	*	.	H	α-helix	trans	-115.5	-3.5	-175.3	-58.6	-165.5	-179.9	175.1	-3.8	114.3	L256 D262	L256-R260 HydrophobicContact CD1-CB 4.24Å; L256-R260 HydrophobicContact CD1-CG 4.16Å; L256-R260 WeakPolarHBondContact O-CA 3.39Å; L256-R260 WeakPolarHBondContact O-CB 3.38Å; L256-R260 PolarHBondContact O-N 3.36Å; R260-D262 HydrophobicContact CB-CB 4.38Å; R260-D262 PolarHBondContact O-N 3.18Å; R260-D262 VanDerWaalsContact O-N 3.15Å
261	R	94.9	Very high	96.8	Very high	175 Å²	175	71 Å²	71	66%	0.66	32%	0.316	S	S	*	.			trans	55.5	25.3	-173.7	-56.5	-60.9	-175.8	-175.1	-1.5	113.3	Y257	Y257-R261 WeakPolarHBondContact O-CA 3.48Å; Y257-R261 PolarHBondContact O-N 2.96Å
262	D	96.4	Very high	96.8	Very high	57 Å²	57	67.1 Å²	67.1	31%	0.305	30%	0.296	S	S	.	.			trans	-91.9	115.2	177.7	-179.4	-0.7	0	0	0	110	L256 Y257 R260 T264	L256-D262 HydrophobicContact CD2-CB 4.29Å; L256-D262 HydrophobicContact CG-CB 4.09Å; Y257-D262 WeakPolarHBondContact CA-O 3.39Å; R260-D262 HydrophobicContact CB-CB 4.38Å; R260-D262 PolarHBondContact O-N 3.18Å; R260-D262 VanDerWaalsContact O-N 3.15Å; D262-T264 VanDerWaalsContact CG-OG1 3.23Å; D262-T264 VanDerWaalsContact OD1-CB 3.25Å; D262-T264 WeakPolarHBondContact OD1-CB 3.47Å; D262-T264 WeakPolarHBondContact OD1-CG2 3.13Å; D262-T264 PolarHBondContact OD1-N 2.98Å; D262-T264 PolarHBondContact OD1-OG1 3.14Å; D262-T264 PolarHBondContact OD2-OG1 3.12Å
263	E	95.6	Very high	96.7	Very high	66 Å²	66	63.1 Å²	63.1	31%	0.308	28%	0.275	S	S	.	.			trans	-84.2	-11.9	-178.1	-48.3	-167.6	165.3	0	0	113.5	L67 Y257 Y265 L266 R267	L67-E263 HydrophobicContact CD1-CB 4.3Å; L67-E263 HydrophobicContact CD2-CB 4.32Å; L67-E263 HydrophobicContact CD2-CG 3.88Å; Y257-E263 HydrophobicContact CD2-CG 4.15Å; Y257-E263 HydrophobicContact CE2-CG 4.04Å; E263-Y265 VanDerWaalsContact C-N 3.31Å; E263-Y265 PolarHBondContact O-N 3.36Å; E263-L266 PolarHBondContact O-N 3.29Å; E263-R267 HydrophobicContact CB-CG 4.47Å; E263-R267 WeakPolarHBondContact O-CG 3.49Å; E263-R267 PolarHBondContact O-N 3.33Å; E263-R267 IonicContact OE2-CZ 2.68Å; E263-R267 IonicContact OE2-NE 3.63Å; E263-R267 PolarHBondContact OE2-NE 3.41Å; E263-R267 IonicContact OE2-NH2 3.7Å; E263-R267 PolarHBondContact OE2-NH2 3.01Å
264	T	96.1	Very high	96.7	Very high	92 Å²	92	63.2 Å²	63.2	56%	0.564	28%	0.275	S	S	*	.	H	α-helix	trans	-58.7	-43.6	-167.7	55.9	0	0	0	0	111.9	D262 R267 R268	D262-T264 VanDerWaalsContact CG-OG1 3.23Å; D262-T264 VanDerWaalsContact OD1-CB 3.25Å; D262-T264 WeakPolarHBondContact OD1-CB 3.47Å; D262-T264 WeakPolarHBondContact OD1-CG2 3.13Å; D262-T264 PolarHBondContact OD1-N 2.98Å; D262-T264 PolarHBondContact OD1-OG1 3.14Å; D262-T264 PolarHBondContact OD2-OG1 3.12Å; T264-R267 PolarHBondContact O-N 3.37Å; T264-R268 PolarHBondContact O-N 2.9Å; T264-R268 VanDerWaalsContact O-N 3.1Å
265	Y	97.2	Very high	96.6	Very high	51 Å²	51	64.5 Å²	64.5	20%	0.2	28%	0.281	C	S	.	.	H	α-helix	trans	-72.3	-39.8	-178	-160.1	-173.9	0	0	0	112.1	D249 D252 A253 L256 E263 R267 R268 V269	D249-Y265 PolarHBondContact OD1-OH 3.5Å; D252-Y265 HydrophobicContact CB-CD1 4.37Å; D252-Y265 HydrophobicContact CB-CE1 3.65Å; A253-Y265 VanDerWaalsContact CA-CD1 3.49Å; A253-Y265 HydrophobicContact CB-CD1 3.82Å; A253-Y265 HydrophobicContact CB-CD2 4.13Å; A253-Y265 HydrophobicContact CB-CE1 4.37Å; A253-Y265 HydrophobicContact CB-CG 3.68Å; L256-Y265 HydrophobicContact CD2-CD1 4.28Å; E263-Y265 VanDerWaalsContact C-N 3.31Å; E263-Y265 PolarHBondContact O-N 3.36Å; Y265-R267 VanDerWaalsContact C-N 3.32Å; Y265-R267 PolarHBondContact O-N 3.16Å; Y265-R268 HydrophobicContact CD2-CB 4.44Å; Y265-R268 WeakPolarHBondContact O-CB 3.4Å; Y265-R268 PolarHBondContact O-N 2.74Å; Y265-R268 VanDerWaalsContact O-N 3.11Å; Y265-V269 HydrophobicContact CD2-CG2 3.93Å; Y265-V269 HydrophobicContact CE2-CG2 3.87Å; Y265-V269 WeakPolarHBondContact O-CG2 3.49Å; Y265-V269 PolarHBondContact O-N 3.22Å
266	L	96.5	Very high	96.5	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.005	26%	0.255	C	S	.	.	H	α-helix	trans	-60.8	-41.7	173.1	-80	176.7	0	0	0	111.9	L67 I71 L97 A253 Y257 E263 R268 V269 I270	L67-L266 HydrophobicContact CD2-CD1 4.27Å; I71-L266 HydrophobicContact CD1-CD1 4.5Å; L97-L266 HydrophobicContact CD2-CD2 4Å; A253-L266 HydrophobicContact CB-CD2 3.84Å; A253-L266 HydrophobicContact CB-CG 4.16Å; Y257-L266 HydrophobicContact CD1-CD1 3.89Å; Y257-L266 HydrophobicContact CD2-CD1 4.13Å; Y257-L266 HydrophobicContact CG-CD1 3.52Å; E263-L266 PolarHBondContact O-N 3.29Å; L266-R268 PolarHBondContact O-N 3.44Å; L266-V269 PolarHBondContact O-N 3.15Å; L266-I270 HydrophobicContact CD2-CD1 4.3Å; L266-I270 WeakPolarHBondContact O-CB 3.44Å; L266-I270 PolarHBondContact O-N 2.67Å
267	R	96.8	Very high	96.4	Very high	67 Å²	67	56.3 Å²	56.3	25%	0.253	25%	0.248	S	C	.	.	H	α-helix	trans	-67.5	-22.4	176.9	-71.8	179.4	178.7	-82.4	-2	113.2	L63 R65 L67 Y70 E263 T264 Y265	L63-R267 PolarHBondContact O-NH1 3.12Å; R65-R267 PolarHBondContact O-NH1 3.4Å; R65-R267 PolarHBondContact O-NH2 2.95Å; L67-R267 HydrophobicContact CD1-CG 4.23Å; Y70-R267 HydrophobicContact CD1-CG 4.48Å; Y70-R267 HydrophobicContact CE1-CB 4.45Å; Y70-R267 HydrophobicContact CE1-CG 4.23Å; Y70-R267 PolarHBondContact OH-O 3.05Å; E263-R267 HydrophobicContact CB-CG 4.47Å; E263-R267 WeakPolarHBondContact O-CG 3.49Å; E263-R267 PolarHBondContact O-N 3.33Å; E263-R267 IonicContact OE2-CZ 2.68Å; E263-R267 IonicContact OE2-NE 3.63Å; E263-R267 PolarHBondContact OE2-NE 3.41Å; E263-R267 IonicContact OE2-NH2 3.7Å; E263-R267 PolarHBondContact OE2-NH2 3.01Å; T264-R267 PolarHBondContact O-N 3.37Å; Y265-R267 VanDerWaalsContact C-N 3.32Å; Y265-R267 PolarHBondContact O-N 3.16Å
268	R	95.8	Very high	96.2	Very high	164 Å²	164	56.7 Å²	56.7	62%	0.619	25%	0.253	S	S	*	.	H	α-helix	trans	-79.1	-44.2	171.2	178.5	-178.6	172.4	-172.1	-3.6	111.8	N243 T264 Y265 L266	N243-R268 PolarHBondContact ND2-O 3.41Å; T264-R268 PolarHBondContact O-N 2.9Å; T264-R268 VanDerWaalsContact O-N 3.1Å; Y265-R268 HydrophobicContact CD2-CB 4.44Å; Y265-R268 WeakPolarHBondContact O-CB 3.4Å; Y265-R268 PolarHBondContact O-N 2.74Å; Y265-R268 VanDerWaalsContact O-N 3.11Å; L266-R268 PolarHBondContact O-N 3.44Å
269	V	97.2	Very high	95.9	Very high	1 Å²	1	60 Å²	60	1%	0.006	26%	0.264	C	S	.	.	H	α-helix	trans	-70.7	-42.7	-177.4	169	0	0	0	0	111.5	I76 V245 D249 I250 A253 Y265 L266	I76-V269 HydrophobicContact CD1-CG1 4.46Å; V245-V269 HydrophobicContact CG1-CG2 4.48Å; V245-V269 HydrophobicContact CG2-CG1 4.18Å; D249-V269 HydrophobicContact CB-CG2 4.19Å; I250-V269 HydrophobicContact CB-CG1 4.45Å; I250-V269 HydrophobicContact CG1-CG1 3.61Å; A253-V269 HydrophobicContact CB-CB 4.4Å; A253-V269 HydrophobicContact CB-CG2 3.84Å; Y265-V269 HydrophobicContact CD2-CG2 3.93Å; Y265-V269 HydrophobicContact CE2-CG2 3.87Å; Y265-V269 WeakPolarHBondContact O-CG2 3.49Å; Y265-V269 PolarHBondContact O-N 3.22Å; L266-V269 PolarHBondContact O-N 3.15Å
270	I	97.8	Very high	95.8	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	24%	0.243	C	C	.	.	S	Bend	trans	-96.7	125.7	-179.6	-57.9	171.1	0	0	0	108.3	Y70 I71 G74 I76 L97 I120 L266	Y70-I270 HydrophobicContact CD1-CG2 4.26Å; Y70-I270 HydrophobicContact CE1-CB 4.03Å; Y70-I270 HydrophobicContact CE1-CG2 3.96Å; Y70-I270 WeakPolarHBondContact CE1-O 3.38Å; Y70-I270 VanDerWaalsContact CZ-O 3.29Å; Y70-I270 PolarHBondContact OH-O 3.06Å; I71-I270 HydrophobicContact CB-CD1 4.48Å; I71-I270 HydrophobicContact CG1-CD1 3.83Å; I71-I270 HydrophobicContact CG2-CD1 4.29Å; G74-I270 VanDerWaalsContact CA-CG2 3.47Å; I76-I270 HydrophobicContact CD1-CG1 4.02Å; I76-I270 HydrophobicContact CG1-CG1 4.01Å; L97-I270 HydrophobicContact CD1-CD1 4.12Å; L97-I270 HydrophobicContact CD2-CD1 4.27Å; I120-I270 HydrophobicContact CD1-CD1 4.27Å; I120-I270 HydrophobicContact CD1-CG1 4.45Å; I120-I270 HydrophobicContact CD1-CG2 4.35Å; L266-I270 HydrophobicContact CD2-CD1 4.3Å; L266-I270 WeakPolarHBondContact O-CB 3.44Å; L266-I270 PolarHBondContact O-N 2.67Å
271	M	97	Very high	95.8	Very high	15 Å²	15	50.9 Å²	50.9	7%	0.074	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	151.3	173.3	-69.1	165.4	-76.6	0	0	110.1	G74 V75 N77 M238 N243 K275	G74-M271 CarbonylContact C-O 3.54Å; G74-M271 WeakPolarHBondContact CA-O 3.41Å; V75-M271 PolarHBondContact N-O 3.41Å; V75-M271 PolarHBondContact O-N 2.78Å; N77-M271 HydrophobicContact CB-CE 3.93Å; M238-M271 HydrophobicContact CE-CE 3.52Å; M238-M271 HydrophobicContact CE-SD 3.78Å; N243-M271 HydrophobicContact CB-CE 4.36Å; N243-M271 HydrophobicContact CB-SD 3.89Å; M271-K275 HydrophobicContact CB-CB 4.35Å; M271-K275 HydrophobicContact CB-CG 4.45Å; M271-K275 HydrophobicContact SD-CG 4.18Å
272	P	97.2	Very high	95.9	Very high	4 Å²	4	43.6 Å²	43.6	3%	0.026	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	145.2	173.8	28.6	-34	0	0	0	110.7	L38 P62 L63 Y70 E274 K275	L38-P272 HydrophobicContact CD1-CB 4.29Å; L38-P272 HydrophobicContact CD1-CG 3.41Å; L38-P272 VanDerWaalsContact CD1-CG 3.41Å; L38-P272 HydrophobicContact CD2-CG 4.2Å; L38-P272 HydrophobicContact CG-CG 4.44Å; P62-P272 HydrophobicContact CB-CB 3.88Å; P62-P272 HydrophobicContact CB-CG 4.27Å; L63-P272 HydrophobicContact CD2-CG 3.9Å; Y70-P272 HydrophobicContact CE2-CB 4.36Å; Y70-P272 WeakPolarHBondContact OH-CD 3.15Å; P272-E274 WeakPolarHBondContact CB-OE2 3.46Å; P272-E274 PolarHBondContact O-N 3.04Å; P272-K275 WeakPolarHBondContact O-CB 3.35Å; P272-K275 PolarHBondContact O-N 3.32Å
273	L	96.4	Very high	95.9	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.016	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-55.8	-26	-178.6	63.9	84.2	0	0	0	114.2	S73 V75 A123 L126 K275 L276 L277 A326 I354	S73-L273 VanDerWaalsContact O-CB 3.28Å; S73-L273 WeakPolarHBondContact O-CB 3.37Å; S73-L273 PolarHBondContact O-N 2.68Å; V75-L273 HydrophobicContact CG2-CB 3.95Å; A123-L273 HydrophobicContact CB-CB 3.89Å; A123-L273 HydrophobicContact CB-CD2 4.16Å; L126-L273 HydrophobicContact CD1-CB 4.05Å; L126-L273 HydrophobicContact CD1-CD1 4.23Å; L273-K275 PolarHBondContact O-N 3.19Å; L273-K275 VanDerWaalsContact O-N 3.11Å; L273-L276 WeakPolarHBondContact O-CB 3.4Å; L273-L276 PolarHBondContact O-N 2.71Å; L273-L277 HydrophobicContact CD1-CD1 4.29Å; L273-A326 HydrophobicContact CD1-CB 3.87Å; L273-I354 HydrophobicContact CD1-CG2 3.77Å; L273-I354 HydrophobicContact CD2-CG2 3.76Å; L273-I354 HydrophobicContact CG-CG2 4.49Å
274	E	96.9	Very high	96	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.009	17%	0.17	C	C	.	.	G	3₁₀ helix	trans	-57.4	-25.3	175.2	-73.8	77.2	-172.4	0	0	112.2	L38 L39 P62 R65 P272 L276 L277 I278 A326	L38-E274 HydrophobicContact CB-CB 4.27Å; L38-E274 HydrophobicContact CD1-CB 4.16Å; L39-E274 HydrophobicContact CD1-CB 4.19Å; L39-E274 HydrophobicContact CD1-CG 3.83Å; L39-E274 HydrophobicContact CG-CB 4.18Å; L39-E274 HydrophobicContact CG-CG 4.31Å; P62-E274 HydrophobicContact CB-CG 4.28Å; P62-E274 HydrophobicContact CG-CB 4.46Å; P62-E274 HydrophobicContact CG-CG 3.83Å; R65-E274 IonicContact CZ-OE1 3.53Å; R65-E274 IonicContact CZ-OE2 3.6Å; R65-E274 IonicContact NH1-OE1 3.51Å; R65-E274 PolarHBondContact NH1-OE1 3.35Å; R65-E274 IonicContact NH1-OE2 2.84Å; R65-E274 PolarHBondContact NH1-OE2 3.11Å; R65-E274 IonicContact NH2-OE1 2.77Å; R65-E274 PolarHBondContact NH2-OE1 3.1Å; R65-E274 IonicContact NH2-OE2 3.51Å; P272-E274 WeakPolarHBondContact CB-OE2 3.46Å; P272-E274 PolarHBondContact O-N 3.04Å; E274-L276 PolarHBondContact O-N 3.07Å; E274-L277 PolarHBondContact O-N 2.87Å; E274-I278 WeakPolarHBondContact O-CG1 3.42Å; E274-I278 PolarHBondContact O-N 3.13Å; E274-A326 HydrophobicContact CG-CB 3.99Å; E274-A326 PolarHBondContact OE1-N 2.85Å
275	K	95.5	Very high	95.9	Very high	73 Å²	73	33.8 Å²	33.8	32%	0.317	14%	0.143	S	C	.	.	G	3₁₀ helix	trans	-55.9	-35	174.3	-173.7	70.3	178.7	-176.1	0	112.2	L38 M238 M271 P272 L273 L277 I278	L38-K275 HydrophobicContact CD2-CB 4.08Å; L38-K275 HydrophobicContact CD2-CD 3.97Å; M238-K275 HydrophobicContact CE-CG 4.49Å; M271-K275 HydrophobicContact CB-CB 4.35Å; M271-K275 HydrophobicContact CB-CG 4.45Å; M271-K275 HydrophobicContact SD-CG 4.18Å; P272-K275 WeakPolarHBondContact O-CB 3.35Å; P272-K275 PolarHBondContact O-N 3.32Å; L273-K275 PolarHBondContact O-N 3.19Å; L273-K275 VanDerWaalsContact O-N 3.11Å; K275-L277 PolarHBondContact O-N 3.17Å; K275-I278 HydrophobicContact CD-CD1 3.83Å
276	L	94.7	Very high	95.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-75.6	-12.4	177.7	-62.9	-179.7	0	0	0	113.5	V75 I117 L126 Q130 F237 M238 L273 E274	V75-L276 HydrophobicContact CB-CD1 4.39Å; V75-L276 HydrophobicContact CG1-CD1 3.87Å; V75-L276 HydrophobicContact CG1-CD2 4.13Å; V75-L276 HydrophobicContact CG1-CG 4.05Å; V75-L276 HydrophobicContact CG2-CD1 3.71Å; V75-L276 HydrophobicContact CG2-CG 4.22Å; I117-L276 HydrophobicContact CD1-CD2 3.95Å; I117-L276 HydrophobicContact CG2-CD1 4.27Å; I117-L276 HydrophobicContact CG2-CD2 4.16Å; L126-L276 HydrophobicContact CD1-CB 4.49Å; L126-L276 HydrophobicContact CD1-CD1 4.14Å; Q130-L276 HydrophobicContact CG-CD1 3.88Å; F237-L276 WeakPolarHBondContact CD2-O 3.43Å; M238-L276 HydrophobicContact CG-CD2 3.82Å; M238-L276 HydrophobicContact SD-CD2 3.61Å; L273-L276 WeakPolarHBondContact O-CB 3.4Å; L273-L276 PolarHBondContact O-N 2.71Å; E274-L276 PolarHBondContact O-N 3.07Å
277	L	94.9	Very high	95.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-109	-4.7	-169.5	-57.3	179.8	0	0	0	113.4	L39 L126 L273 E274 K275 K279 H280 V318 A326 L329 I354	L39-L277 HydrophobicContact CD2-CB 4.16Å; L126-L277 HydrophobicContact CD1-CD1 4.34Å; L126-L277 HydrophobicContact CD1-CD2 4.29Å; L126-L277 HydrophobicContact CD1-CG 4.36Å; L126-L277 HydrophobicContact CD2-CD2 4.13Å; L273-L277 HydrophobicContact CD1-CD1 4.29Å; E274-L277 PolarHBondContact O-N 2.87Å; K275-L277 PolarHBondContact O-N 3.17Å; L277-K279 PolarHBondContact O-N 3.19Å; L277-H280 WeakPolarHBondContact CA-ND1 3.12Å; L277-H280 WeakPolarHBondContact O-CB 3.45Å; L277-H280 PolarHBondContact O-N 3.49Å; L277-H280 PolarHBondContact O-ND1 2.93Å; L277-H280 VanDerWaalsContact O-ND1 3.12Å; L277-V318 HydrophobicContact CB-CG2 4.33Å; L277-V318 HydrophobicContact CD1-CG2 3.92Å; L277-A326 HydrophobicContact CD1-CB 3.45Å; L277-A326 VanDerWaalsContact CD1-CB 3.45Å; L277-L329 HydrophobicContact CD2-CD1 4.48Å; L277-L329 HydrophobicContact CD2-CD2 3.97Å; L277-L329 HydrophobicContact CD2-CG 4.45Å; L277-I354 HydrophobicContact CD1-CD1 3.75Å
278	I	92.7	Very high	95.1	Very high	67 Å²	67	32.2 Å²	32.2	34%	0.344	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-30.5	-173.6	-61.7	175.3	0	0	0	113.9	L38 E274 K275	L38-I278 HydrophobicContact CD2-CD1 3.98Å; E274-I278 WeakPolarHBondContact O-CG1 3.42Å; E274-I278 PolarHBondContact O-N 3.13Å; K275-I278 HydrophobicContact CD-CD1 3.83Å
279	K	90.4	Very high	94.9	Very high	141 Å²	141	25.3 Å²	25.3	61%	0.613	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-6.5	-179	-60.7	-153	-169.5	178.9	0	114.7	F237 L277	F237-K279 HydrophobicContact CD1-CB 3.94Å; F237-K279 HydrophobicContact CD1-CD 3.49Å; F237-K279 VanDerWaalsContact CD1-CD 3.49Å; F237-K279 HydrophobicContact CD1-CG 3.73Å; F237-K279 HydrophobicContact CE1-CB 3.66Å; F237-K279 HydrophobicContact CE1-CD 3.72Å; F237-K279 HydrophobicContact CE1-CG 3.96Å; F237-K279 HydrophobicContact CG-CG 4.46Å; F237-K279 HydrophobicContact CZ-CB 4.21Å; L277-K279 PolarHBondContact O-N 3.19Å
280	H	94.5	Very high	94.7	Very high	26 Å²	26	25.2 Å²	25.2	12%	0.12	12%	0.121	C	C	.	.	S	Bend	trans	-79.1	145.6	176	-60.4	79.6	0	0	0	109.4	F237 L277 V318	F237-H280 AromaticContact CE2-CE1 3.63Å; L277-H280 WeakPolarHBondContact CA-ND1 3.12Å; L277-H280 WeakPolarHBondContact O-CB 3.45Å; L277-H280 PolarHBondContact O-N 3.49Å; L277-H280 PolarHBondContact O-ND1 2.93Å; L277-H280 VanDerWaalsContact O-ND1 3.12Å; H280-V318 HydrophobicContact CB-CB 4.07Å; H280-V318 HydrophobicContact CB-CG1 3.91Å
281	K	96.7	Very high	94.6	Very high	63 Å²	63	25.3 Å²	25.3	27%	0.274	12%	0.122	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	141.8	168.1	-61	174.1	-172.4	166.1	0	108.8	D308 D310 I311 D315 I317 V318	K281-D308 HydrophobicContact CB-CB 4.28Å; K281-D310 PolarHBondContact NZ-O 3.38Å; K281-I311 HydrophobicContact CB-CG1 4.13Å; K281-I311 HydrophobicContact CD-CG1 3.95Å; K281-D315 IonicContact NZ-OD2 3.07Å; K281-D315 PolarHBondContact NZ-OD2 3.12Å; K281-I317 HydrophobicContact CB-CG2 4.1Å; K281-I317 CarbonylContact O-C 3.55Å; K281-I317 VanDerWaalsContact O-CA 3.29Å; K281-I317 WeakPolarHBondContact O-CA 3.45Å; K281-I317 WeakPolarHBondContact O-CB 3.49Å; K281-V318 PolarHBondContact O-N 3.48Å
282	R	97.5	Very high	94.4	Very high	23 Å²	23	25.7 Å²	25.7	9%	0.087	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	142.8	-169.2	-59.1	160.9	-63.1	171.5	2.8	111.1	L39 K41 M46 Y307 D308 V318 M320	L39-R282 HydrophobicContact CD2-CG 4.37Å; L39-R282 WeakPolarHBondContact O-CD 3.35Å; L39-R282 PolarHBondContact O-NH1 3.41Å; K41-R282 PolarHBondContact O-NH1 3.24Å; M46-R282 HydrophobicContact CE-CB 3.89Å; R282-Y307 WeakPolarHBondContact O-CA 3.13Å; R282-D308 WeakPolarHBondContact CB-OD2 3.41Å; R282-D308 IonicContact CZ-OD1 2.68Å; R282-D308 IonicContact CZ-OD2 3.33Å; R282-D308 PolarHBondContact N-OD2 3.36Å; R282-D308 IonicContact NE-OD1 3.94Å; R282-D308 IonicContact NE-OD2 2.93Å; R282-D308 PolarHBondContact NE-OD2 3.29Å; R282-D308 IonicContact NH2-OD1 2.83Å; R282-D308 PolarHBondContact NH2-OD1 3.02Å; R282-D308 IonicContact NH2-OD2 2.85Å; R282-D308 PolarHBondContact O-N 3.31Å; R282-V318 WeakPolarHBondContact CA-O 3.34Å; R282-V318 HydrophobicContact CB-CG1 4.2Å; R282-V318 HydrophobicContact CG-CG1 3.58Å; R282-M320 HydrophobicContact CB-SD 3.78Å; R282-M320 HydrophobicContact CG-SD 3.93Å
283	I	97.4	Very high	94.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	120.6	161.9	-58.8	-172.1	0	0	0	107.9	L299 V304 R306 I311 I317 V318 L319 M320 I339 V347	I283-L299 HydrophobicContact CD1-CD2 4.47Å; I283-L299 HydrophobicContact CG2-CD2 3.95Å; I283-V304 HydrophobicContact CG2-CB 4.38Å; I283-V304 HydrophobicContact CG2-CG1 3.78Å; I283-V304 HydrophobicContact CG2-CG2 3.92Å; I283-R306 CarbonylContact C-O 3.53Å; I283-I311 HydrophobicContact CD1-CD1 4.13Å; I283-I311 HydrophobicContact CG1-CD1 3.94Å; I283-I317 HydrophobicContact CD1-CD1 3.38Å; I283-I317 HydrophobicContact CG1-CD1 3.87Å; I283-V318 PolarHBondContact N-O 2.93Å; I283-L319 HydrophobicContact CB-CD2 3.87Å; I283-L319 HydrophobicContact CG2-CD2 4.47Å; I283-L319 WeakPolarHBondContact O-CA 3.42Å; I283-M320 PolarHBondContact O-N 2.85Å; I283-I339 HydrophobicContact CD1-CD1 4.36Å; I283-V347 HydrophobicContact CD1-CG1 3.68Å
284	M	96.2	Very high	94.3	Very high	9 Å²	9	25.8 Å²	25.8	4%	0.044	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	129.1	175.8	-171.9	174.2	-76.9	0	0	109.6	L40 V43 M46 L305 R306 M320 T322	L40-M284 HydrophobicContact CD2-CE 4.25Å; V43-M284 HydrophobicContact CG1-CE 4.26Å; V43-M284 HydrophobicContact CG2-CE 4.36Å; M46-M284 HydrophobicContact CE-CB 4.5Å; M284-L305 HydrophobicContact CG-CB 4.37Å; M284-L305 HydrophobicContact CG-CD2 4.26Å; M284-L305 PolarHBondContact O-N 2.98Å; M284-L305 HydrophobicContact SD-CD2 3.89Å; M284-R306 HydrophobicContact CB-CB 3.94Å; M284-R306 PolarHBondContact N-O 2.91Å; M284-R306 PolarHBondContact O-N 2.72Å; M284-R306 HydrophobicContact SD-CB 4.48Å; M284-R306 HydrophobicContact SD-CG 4.45Å; M284-M320 CarbonylContact C-O 3.56Å; M284-M320 WeakPolarHBondContact CA-O 3.22Å; M284-M320 HydrophobicContact CB-CG 4.34Å; M284-M320 HydrophobicContact CE-CE 4.03Å; M284-T322 HydrophobicContact CG-CG2 4.46Å; M284-T322 HydrophobicContact SD-CG2 4.2Å
285	L	94.9	Very high	94.2	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	152.2	-177.1	-56.8	176.6	0	0	0	111	V290 I293 L299 G303 L319 M320 V327	L285-V290 HydrophobicContact CB-CG2 4.28Å; L285-V290 HydrophobicContact CD1-CG2 4.38Å; L285-I293 HydrophobicContact CD1-CD1 3.46Å; L285-I293 VanDerWaalsContact CD1-CD1 3.46Å; L285-I293 HydrophobicContact CD2-CD1 3.77Å; L285-I293 HydrophobicContact CG-CD1 4.21Å; L285-L299 HydrophobicContact CD2-CD1 3.41Å; L285-L299 VanDerWaalsContact CD2-CD1 3.41Å; L285-L299 HydrophobicContact CD2-CD2 3.86Å; L285-L299 HydrophobicContact CD2-CG 4.27Å; L285-G303 CarbonylContact C-O 3.53Å; L285-G303 WeakPolarHBondContact CA-O 3.35Å; L285-L319 HydrophobicContact CD1-CB 3.9Å; L285-L319 HydrophobicContact CD2-CB 4.39Å; L285-L319 HydrophobicContact CG-CB 4.24Å; L285-M320 PolarHBondContact N-O 3.26Å; L285-V327 HydrophobicContact CD1-CB 4.07Å; L285-V327 HydrophobicContact CD1-CG1 4.16Å; L285-V327 HydrophobicContact CD1-CG2 3.96Å
286	K	92.4	Very high	94.2	Very high	31 Å²	31	27.9 Å²	27.9	14%	0.135	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-66.7	141	157.8	-66.3	-176.2	-176.8	167.3	0	109.6	E50 E54 T288 A289 V290 P302 G303	E50-K286 IonicContact OE1-NZ 3.37Å; E50-K286 PolarHBondContact OE1-NZ 2.91Å; E50-K286 WeakPolarHBondContact OE2-CE 3.45Å; E50-K286 IonicContact OE2-NZ 2.9Å; E50-K286 PolarHBondContact OE2-NZ 3.18Å; E54-K286 WeakPolarHBondContact OE1-CA 3.43Å; E54-K286 WeakPolarHBondContact OE1-CB 3.29Å; K286-T288 PolarHBondContact O-N 3.28Å; K286-A289 WeakPolarHBondContact O-CB 3.44Å; K286-A289 PolarHBondContact O-N 2.89Å; K286-V290 PolarHBondContact O-N 2.88Å; K286-P302 WeakPolarHBondContact CD-O 3.34Å; K286-P302 WeakPolarHBondContact CE-O 3.37Å; K286-P302 PolarHBondContact NZ-O 3.02Å; K286-G303 PolarHBondContact N-O 3.03Å
287	D	90.7	Very high	94.2	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.011	17%	0.167	C	C	.	.	H	α-helix	trans	-61.9	-32.7	-177.3	-71.7	-6.6	0	0	0	111	E54 D56 A289 V290 Y360	E54-D287 PolarHBondContact OE1-N 2.66Å; D56-D287 HydrophobicContact CB-CB 4.29Å; D287-A289 PolarHBondContact O-N 2.9Å; D287-V290 WeakPolarHBondContact O-CB 3.32Å; D287-V290 PolarHBondContact O-N 3.33Å; D287-Y360 HydrophobicContact CB-CD1 4.17Å; D287-Y360 HydrophobicContact CB-CE1 3.98Å
288	T	89.8	Confident	94.2	Very high	52 Å²	52	35.5 Å²	35.5	32%	0.319	19%	0.191	S	C	.	.	H	α-helix	trans	-60.1	-25.7	174.3	67.5	0	0	0	0	114.4	K286	K286-T288 PolarHBondContact O-N 3.28Å
289	A	91.8	Very high	94.4	Very high	19 Å²	19	32.4 Å²	32.4	16%	0.157	18%	0.175	C	C	.	.	H	α-helix	trans	-91.7	-19.7	-179.2	0	0	0	0	0	113.3	K286 D287 C291 A292 I293	K286-A289 WeakPolarHBondContact O-CB 3.44Å; K286-A289 PolarHBondContact O-N 2.89Å; D287-A289 PolarHBondContact O-N 2.9Å; A289-C291 PolarHBondContact O-N 3.15Å; A289-A292 PolarHBondContact O-N 3.39Å; A289-I293 HydrophobicContact CB-CD1 4.36Å; A289-I293 WeakPolarHBondContact O-CG1 3.35Å; A289-I293 PolarHBondContact O-N 3.49Å; A289-I293 VanDerWaalsContact O-N 3.16Å
290	V	94.3	Very high	94.7	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-57.6	-51.1	-172.4	175.2	0	0	0	0	111.4	L285 K286 D287 A292 I293 C294 T321 V327 M355 Y360	L285-V290 HydrophobicContact CB-CG2 4.28Å; L285-V290 HydrophobicContact CD1-CG2 4.38Å; K286-V290 PolarHBondContact O-N 2.88Å; D287-V290 WeakPolarHBondContact O-CB 3.32Å; D287-V290 PolarHBondContact O-N 3.33Å; V290-A292 VanDerWaalsContact C-N 3.35Å; V290-A292 PolarHBondContact O-N 3.48Å; V290-I293 WeakPolarHBondContact O-CB 3.03Å; V290-I293 PolarHBondContact O-N 3.3Å; V290-I293 VanDerWaalsContact O-N 3.12Å; V290-C294 PolarHBondContact O-N 3.02Å; V290-C294 PolarHBondContact O-SG 3.02Å; V290-C294 VanDerWaalsContact O-SG 3.37Å; V290-T321 HydrophobicContact CG1-CG2 4.3Å; V290-T321 HydrophobicContact CG2-CG2 3.83Å; V290-V327 HydrophobicContact CG1-CG1 4.11Å; V290-V327 HydrophobicContact CG1-CG2 3.97Å; V290-V327 HydrophobicContact CG2-CG2 4.42Å; V290-M355 HydrophobicContact CG1-CE 4.39Å; V290-M355 HydrophobicContact CG1-SD 3.4Å; V290-M355 WeakPolarHBondContact CG1-SD 3.4Å; V290-Y360 HydrophobicContact CB-CD1 4.4Å; V290-Y360 HydrophobicContact CB-CD2 4.27Å; V290-Y360 HydrophobicContact CB-CG 4.04Å; V290-Y360 HydrophobicContact CG1-CD2 3.57Å; V290-Y360 HydrophobicContact CG1-CE2 4.08Å; V290-Y360 HydrophobicContact CG1-CG 3.83Å
291	C	94.4	Very high	94.6	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.007	17%	0.165	C	C	.	.	H	α-helix	trans	-60.5	-43.8	-177.4	-168.2	0	0	0	0	111.7	A289 I293 C294 F295 Y360 R362	A289-C291 PolarHBondContact O-N 3.15Å; C291-I293 VanDerWaalsContact C-N 3.29Å; C291-I293 PolarHBondContact O-N 2.76Å; C291-C294 WeakPolarHBondContact O-CB 3.36Å; C291-C294 PolarHBondContact O-N 3.16Å; C291-C294 VanDerWaalsContact O-N 3.14Å; C291-F295 VanDerWaalsContact O-CD2 3.27Å; C291-F295 WeakPolarHBondContact O-CD2 3.34Å; C291-F295 PolarHBondContact O-N 3.25Å; C291-Y360 WeakPolarHBondContact CB-O 3.45Å; C291-Y360 PolarHBondContact SG-O 3.43Å; C291-R362 VanDerWaalsContact SG-CG 3.54Å
292	A	94.2	Very high	94.4	Very high	24 Å²	24	30.1 Å²	30.1	20%	0.198	18%	0.176	C	C	.	.	H	α-helix	trans	-59.1	-40.6	177.1	0	0	0	0	0	112.3	A289 V290 F295 G296 A297	A289-A292 PolarHBondContact O-N 3.39Å; V290-A292 VanDerWaalsContact C-N 3.35Å; V290-A292 PolarHBondContact O-N 3.48Å; A292-F295 PolarHBondContact O-N 2.97Å; A292-G296 PolarHBondContact O-N 3.24Å; A292-A297 HydrophobicContact CB-CB 4.06Å; A292-A297 WeakPolarHBondContact O-CB 3.44Å; A292-A297 PolarHBondContact O-N 2.79Å
293	I	95.8	Very high	94.1	Very high	4 Å²	4	29.5 Å²	29.5	2%	0.021	18%	0.177	C	C	.	.	H	α-helix	trans	-66.7	-38.5	177.3	-70.7	163.7	0	0	0	111.2	L285 A289 V290 C291 F295 G296 L299 L319 V327 A328 L350	L285-I293 HydrophobicContact CD1-CD1 3.46Å; L285-I293 VanDerWaalsContact CD1-CD1 3.46Å; L285-I293 HydrophobicContact CD2-CD1 3.77Å; L285-I293 HydrophobicContact CG-CD1 4.21Å; A289-I293 HydrophobicContact CB-CD1 4.36Å; A289-I293 WeakPolarHBondContact O-CG1 3.35Å; A289-I293 PolarHBondContact O-N 3.49Å; A289-I293 VanDerWaalsContact O-N 3.16Å; V290-I293 WeakPolarHBondContact O-CB 3.03Å; V290-I293 PolarHBondContact O-N 3.3Å; V290-I293 VanDerWaalsContact O-N 3.12Å; C291-I293 VanDerWaalsContact C-N 3.29Å; C291-I293 PolarHBondContact O-N 2.76Å; I293-F295 PolarHBondContact O-N 3.4Å; I293-G296 PolarHBondContact O-N 2.83Å; I293-L299 HydrophobicContact CD1-CD1 3.88Å; I293-L319 HydrophobicContact CD1-CD1 4.44Å; I293-L319 HydrophobicContact CG2-CD1 4.16Å; I293-V327 HydrophobicContact CB-CG1 4.35Å; I293-V327 HydrophobicContact CG2-CG1 3.76Å; I293-A328 HydrophobicContact CG2-CB 4.24Å; I293-L350 HydrophobicContact CG2-CD1 4.11Å; I293-L350 HydrophobicContact CG2-CD2 3.78Å; I293-L350 WeakPolarHBondContact O-CD1 3.12Å
294	C	95.5	Very high	94	Very high	5 Å²	5	29.5 Å²	29.5	3%	0.034	18%	0.177	C	C	.	.	H	α-helix	trans	-60.8	-28.2	173.5	-65	0	0	0	0	113.1	V290 C291 G296 V353 R357	V290-C294 PolarHBondContact O-N 3.02Å; V290-C294 PolarHBondContact O-SG 3.02Å; V290-C294 VanDerWaalsContact O-SG 3.37Å; C291-C294 WeakPolarHBondContact O-CB 3.36Å; C291-C294 PolarHBondContact O-N 3.16Å; C291-C294 VanDerWaalsContact O-N 3.14Å; C294-G296 VanDerWaalsContact C-N 3.29Å; C294-V353 HydrophobicContact CB-CG1 4.35Å; C294-R357 HydrophobicContact CB-CG 4.48Å
295	F	94.6	Very high	93.9	Very high	73 Å²	73	29.6 Å²	29.6	32%	0.32	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	0.2	173.4	-80.5	-81.3	0	0	0	114.2	C291 A292 I293 R357 D358 W364	C291-F295 VanDerWaalsContact O-CD2 3.27Å; C291-F295 WeakPolarHBondContact O-CD2 3.34Å; C291-F295 PolarHBondContact O-N 3.25Å; A292-F295 PolarHBondContact O-N 2.97Å; I293-F295 PolarHBondContact O-N 3.4Å; F295-R357 HydrophobicContact CE1-CB 4.42Å; F295-R357 HydrophobicContact CE1-CG 4.24Å; F295-R357 HydrophobicContact CE2-CB 4.12Å; F295-R357 HydrophobicContact CE2-CG 4.39Å; F295-R357 HydrophobicContact CZ-CB 3.88Å; F295-R357 HydrophobicContact CZ-CG 4.15Å; F295-D358 WeakPolarHBondContact CE2-OD1 3.48Å; F295-W364 HydrophobicContact CB-CZ2 4.4Å; F295-W364 AromaticContact CD2-CH2 3.94Å; F295-W364 HydrophobicContact CD2-CH2 3.94Å; F295-W364 AromaticContact CD2-CZ2 3.56Å; F295-W364 HydrophobicContact CD2-CZ2 3.56Å; F295-W364 HydrophobicContact CE2-CH2 4.14Å; F295-W364 HydrophobicContact CE2-CZ2 4.03Å; F295-W364 HydrophobicContact CG-CH2 4.17Å; F295-W364 HydrophobicContact CG-CZ2 4.01Å
296	G	94.2	Very high	93.9	Very high	46 Å²	46	32.8 Å²	32.8	47%	0.474	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	98.6	7.9	177.6	0	0	0	0	0	114.5	A292 I293 C294	A292-G296 PolarHBondContact O-N 3.24Å; I293-G296 PolarHBondContact O-N 2.83Å; C294-G296 VanDerWaalsContact C-N 3.29Å
297	A	94.4	Very high	94.1	Very high	42 Å²	42	31.9 Å²	31.9	35%	0.347	19%	0.185	S	C	.	.			trans	-64.8	140.7	175.2	0	0	0	0	0	111	A292 L350	A292-A297 HydrophobicContact CB-CB 4.06Å; A292-A297 WeakPolarHBondContact O-CB 3.44Å; A292-A297 PolarHBondContact O-N 2.79Å; A297-L350 WeakPolarHBondContact O-CD1 3.38Å
298	K	96.5	Very high	94.4	Very high	118 Å²	118	32.9 Å²	32.9	51%	0.513	19%	0.19	S	C	.	.			trans	-69.1	150.7	173.3	-54.1	177.9	-175.2	174.7	0	109.8	M300 L346	K298-M300 PolarHBondContact O-N 2.77Å; K298-L346 HydrophobicContact CB-CD1 3.43Å; K298-L346 VanDerWaalsContact CB-CD1 3.43Å; K298-L346 HydrophobicContact CB-CG 4.47Å; K298-L346 HydrophobicContact CD-CD1 3.67Å; K298-L346 HydrophobicContact CD-CD2 3.83Å; K298-L346 HydrophobicContact CD-CG 4.34Å; K298-L346 HydrophobicContact CG-CD1 4.19Å
299	L	96.8	Very high	94.7	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	115.2	177.8	177.6	60	0	0	0	109.8	I283 L285 I293 V304 L319 V347 A348	I283-L299 HydrophobicContact CD1-CD2 4.47Å; I283-L299 HydrophobicContact CG2-CD2 3.95Å; L285-L299 HydrophobicContact CD2-CD1 3.41Å; L285-L299 VanDerWaalsContact CD2-CD1 3.41Å; L285-L299 HydrophobicContact CD2-CD2 3.86Å; L285-L299 HydrophobicContact CD2-CG 4.27Å; I293-L299 HydrophobicContact CD1-CD1 3.88Å; L299-V304 HydrophobicContact CD1-CG2 4.26Å; L299-V304 HydrophobicContact CD2-CG2 4.04Å; L299-V304 HydrophobicContact CG-CG2 4.22Å; L299-L319 HydrophobicContact CB-CD1 4.36Å; L299-L319 HydrophobicContact CD2-CD1 4.22Å; L299-L319 HydrophobicContact CD2-CD2 3.67Å; L299-V347 HydrophobicContact CD2-CB 4.17Å; L299-V347 HydrophobicContact CD2-CG1 4.06Å; L299-V347 HydrophobicContact CG-CB 4.08Å; L299-V347 PolarHBondContact O-N 3.24Å; L299-A348 HydrophobicContact CB-CB 4.12Å; L299-A348 HydrophobicContact CD2-CB 4.29Å; L299-A348 PolarHBondContact N-O 2.68Å; L299-A348 PolarHBondContact O-N 2.84Å
300	M	95.3	Very high	94.8	Very high	96 Å²	96	38.8 Å²	38.8	47%	0.473	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	150.7	172.2	-56.6	-57.5	-64.9	0	0	110.1	K298 P302 G303 L346	K298-M300 PolarHBondContact O-N 2.77Å; M300-P302 VanDerWaalsContact C-CD 3.44Å; M300-G303 PolarHBondContact O-N 2.94Å; M300-L346 HydrophobicContact SD-CD1 3.42Å; M300-L346 WeakPolarHBondContact SD-CD1 3.11Å
301	L	93.9	Very high	94.9	Very high	6 Å²	6	38.8 Å²	38.8	3%	0.031	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-52.8	-40.9	-177.4	-166.8	65.9	0	0	0	115	G303 V304 I339 C342 G345 V347	L301-G303 PolarHBondContact O-N 2.95Å; L301-V304 WeakPolarHBondContact O-CB 3.22Å; L301-V304 PolarHBondContact O-N 2.99Å; L301-I339 HydrophobicContact CD1-CB 4.47Å; L301-I339 HydrophobicContact CD1-CG2 3.92Å; L301-C342 HydrophobicContact CD2-CB 4.13Å; L301-C342 WeakPolarHBondContact CD2-O 3.22Å; L301-G345 PolarHBondContact N-O 3.3Å; L301-V347 HydrophobicContact CB-CG2 3.89Å; L301-V347 HydrophobicContact CD1-CG2 3.49Å; L301-V347 VanDerWaalsContact CD1-CG2 3.49Å; L301-V347 HydrophobicContact CG-CG2 4.3Å
302	P	91	Very high	95.1	Very high	80 Å²	80	43 Å²	43	52%	0.519	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-62.2	-14.6	177.7	-25.1	36.1	0	0	0	115.1	K286 M300	K286-P302 WeakPolarHBondContact CD-O 3.34Å; K286-P302 WeakPolarHBondContact CE-O 3.37Å; K286-P302 PolarHBondContact NZ-O 3.02Å; M300-P302 VanDerWaalsContact C-CD 3.44Å
303	G	92.4	Very high	95.2	Very high	9 Å²	9	45.3 Å²	45.3	9%	0.093	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-87.4	-3.3	176.7	0	0	0	0	0	114.3	L285 K286 M300 L301	L285-G303 CarbonylContact C-O 3.53Å; L285-G303 WeakPolarHBondContact CA-O 3.35Å; K286-G303 PolarHBondContact N-O 3.03Å; M300-G303 PolarHBondContact O-N 2.94Å; L301-G303 PolarHBondContact O-N 2.95Å
304	V	95.2	Very high	95.2	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	126.2	-177.9	178.9	0	0	0	0	110.5	I283 L299 L301 Y307 V347	I283-V304 HydrophobicContact CG2-CB 4.38Å; I283-V304 HydrophobicContact CG2-CG1 3.78Å; I283-V304 HydrophobicContact CG2-CG2 3.92Å; L299-V304 HydrophobicContact CD1-CG2 4.26Å; L299-V304 HydrophobicContact CD2-CG2 4.04Å; L299-V304 HydrophobicContact CG-CG2 4.22Å; L301-V304 WeakPolarHBondContact O-CB 3.22Å; L301-V304 PolarHBondContact O-N 2.99Å; V304-Y307 HydrophobicContact CG1-CD1 4Å; V304-V347 HydrophobicContact CG2-CB 4.47Å; V304-V347 HydrophobicContact CG2-CG1 4.29Å; V304-V347 HydrophobicContact CG2-CG2 4.04Å
305	L	93.5	Very high	95.3	Very high	12 Å²	12	52.6 Å²	52.6	6%	0.063	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	-52.6	173.8	-169.7	73.1	0	0	0	111	R49 E50 M284 T322	R49-L305 PolarHBondContact N-O 2.77Å; E50-L305 HydrophobicContact CB-CD1 4.19Å; E50-L305 PolarHBondContact N-O 2.68Å; E50-L305 WeakPolarHBondContact O-CD1 3.38Å; M284-L305 HydrophobicContact CG-CB 4.37Å; M284-L305 HydrophobicContact CG-CD2 4.26Å; M284-L305 PolarHBondContact O-N 2.98Å; M284-L305 HydrophobicContact SD-CD2 3.89Å; L305-T322 HydrophobicContact CD2-CG2 3.74Å
306	R	95.2	Very high	95.3	Very high	67 Å²	67	52.1 Å²	52.1	25%	0.253	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	157.3	179.6	-62.2	-172.2	164.9	-161.5	-4.2	111.5	V43 M46 N47 V48 I283 M284	V43-R306 PolarHBondContact O-NH1 3.49Å; M46-R306 HydrophobicContact CB-CB 4.14Å; M46-R306 HydrophobicContact CE-CB 4.05Å; M46-R306 HydrophobicContact SD-CB 4.46Å; N47-R306 WeakPolarHBondContact O-CA 3.44Å; N47-R306 WeakPolarHBondContact O-CB 3.41Å; V48-R306 HydrophobicContact CG2-CG 4.48Å; I283-R306 CarbonylContact C-O 3.53Å; M284-R306 HydrophobicContact CB-CB 3.94Å; M284-R306 PolarHBondContact N-O 2.91Å; M284-R306 PolarHBondContact O-N 2.72Å; M284-R306 HydrophobicContact SD-CB 4.48Å; M284-R306 HydrophobicContact SD-CG 4.45Å
307	Y	96.7	Very high	95.5	Very high	11 Å²	11	49.9 Å²	49.9	4%	0.043	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	149.2	178.2	55.5	-79.6	0	0	0	111.6	N47 R49 R282 V304 T336 I339 A340	N47-Y307 HydrophobicContact CB-CD1 4.23Å; N47-Y307 HydrophobicContact CB-CD2 4.06Å; N47-Y307 HydrophobicContact CB-CE1 3.82Å; N47-Y307 HydrophobicContact CB-CE2 3.66Å; N47-Y307 HydrophobicContact CB-CG 4.33Å; N47-Y307 PolarHBondContact N-O 2.82Å; N47-Y307 WeakPolarHBondContact ND2-CE2 3.43Å; N47-Y307 PolarHBondContact O-N 3.29Å; N47-Y307 VanDerWaalsContact O-N 3.08Å; R49-Y307 HydrophobicContact CB-CE1 4.09Å; R282-Y307 WeakPolarHBondContact O-CA 3.13Å; V304-Y307 HydrophobicContact CG1-CD1 4Å; Y307-T336 HydrophobicContact CD2-CG2 4.22Å; Y307-T336 HydrophobicContact CE2-CG2 3.77Å; Y307-I339 HydrophobicContact CD1-CG2 3.68Å; Y307-I339 HydrophobicContact CD2-CB 4.45Å; Y307-I339 HydrophobicContact CD2-CD1 4.41Å; Y307-I339 HydrophobicContact CD2-CG2 4.07Å; Y307-I339 HydrophobicContact CE1-CG2 3.57Å; Y307-I339 HydrophobicContact CE2-CB 4.15Å; Y307-I339 HydrophobicContact CE2-CG2 3.93Å; Y307-I339 HydrophobicContact CG-CG2 3.96Å; Y307-A340 WeakPolarHBondContact OH-CA 3.41Å; Y307-A340 VanDerWaalsContact OH-CB 3.3Å; Y307-A340 WeakPolarHBondContact OH-CB 3.27Å
308	D	96.9	Very high	95.6	Very high	23 Å²	23	47.9 Å²	47.9	12%	0.123	25%	0.25	C	C	.	.			trans	-70.2	161.3	173.7	-80.8	-32.5	0	0	0	112	M46 K281 R282 I311	M46-D308 WeakPolarHBondContact CG-OD1 3.45Å; K281-D308 HydrophobicContact CB-CB 4.28Å; R282-D308 WeakPolarHBondContact CB-OD2 3.41Å; R282-D308 IonicContact CZ-OD1 2.68Å; R282-D308 IonicContact CZ-OD2 3.33Å; R282-D308 PolarHBondContact N-OD2 3.36Å; R282-D308 IonicContact NE-OD1 3.94Å; R282-D308 IonicContact NE-OD2 2.93Å; R282-D308 PolarHBondContact NE-OD2 3.29Å; R282-D308 IonicContact NH2-OD1 2.83Å; R282-D308 PolarHBondContact NH2-OD1 3.02Å; R282-D308 IonicContact NH2-OD2 2.85Å; R282-D308 PolarHBondContact O-N 3.31Å; D308-I311 WeakPolarHBondContact O-CD1 3.45Å
309	N	95.3	Very high	95.7	Very high	74 Å²	74	42.3 Å²	42.3	40%	0.396	23%	0.225	S	C	.	.	S	Bend	trans	-73.2	167.4	171	-74	-53.7	0	0	0	112.2	N47 I311	N47-N309 PolarHBondContact ND2-OD1 2.99Å; N47-N309 PolarHBondContact OD1-OD1 3.36Å; N309-I311 PolarHBondContact O-N 3.34Å; N309-I311 VanDerWaalsContact O-N 3.11Å
310	D	95	Very high	95.7	Very high	121 Å²	121	42.2 Å²	42.2	65%	0.647	23%	0.225	S	C	*	.	S	Bend	trans	59.1	19.7	173.5	-52.3	-39.7	0	0	0	115.7	K281 N312 T336	K281-D310 PolarHBondContact NZ-O 3.38Å; D310-N312 PolarHBondContact O-N 3.2Å; D310-N312 PolarHBondContact O-ND2 3.19Å; D310-T336 PolarHBondContact N-OG1 2.88Å
311	I	97.1	Very high	95.7	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	20%	0.202	C	C	.	.			trans	-66.1	119.7	173.6	-60.1	173.4	0	0	0	108.1	K281 I283 D308 N309 I317 A332 T335 T336	K281-I311 HydrophobicContact CB-CG1 4.13Å; K281-I311 HydrophobicContact CD-CG1 3.95Å; I283-I311 HydrophobicContact CD1-CD1 4.13Å; I283-I311 HydrophobicContact CG1-CD1 3.94Å; D308-I311 WeakPolarHBondContact O-CD1 3.45Å; N309-I311 PolarHBondContact O-N 3.34Å; N309-I311 VanDerWaalsContact O-N 3.11Å; I311-I317 HydrophobicContact CG2-CG2 4.29Å; I311-A332 HydrophobicContact CG2-CB 3.55Å; I311-T335 CarbonylContact O-C 3.59Å; I311-T335 WeakPolarHBondContact O-CA 3.3Å; I311-T336 WeakPolarHBondContact CB-OG1 3.42Å; I311-T336 PolarHBondContact N-OG1 3.17Å; I311-T336 PolarHBondContact O-N 3.5Å
312	N	97.3	Very high	95.6	Very high	89 Å²	89	39.4 Å²	39.4	48%	0.476	21%	0.213	S	C	.	.			trans	-105	161.6	174.2	-64.8	-48.5	0	0	0	110.8	D310 N314 D315 A332	D310-N312 PolarHBondContact O-N 3.2Å; D310-N312 PolarHBondContact O-ND2 3.19Å; N312-N314 PolarHBondContact O-N 3.19Å; N312-D315 PolarHBondContact N-OD2 2.93Å; N312-D315 WeakPolarHBondContact O-CB 3.35Å; N312-D315 PolarHBondContact O-N 3.19Å; N312-A332 WeakPolarHBondContact O-CB 3.09Å
313	V	96.7	Very high	95.6	Very high	73 Å²	73	37.6 Å²	37.6	44%	0.442	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61	138.4	172.5	-174.7	0	0	0	0	109.1	D315 T335	V313-D315 VanDerWaalsContact C-N 3.26Å; V313-D315 PolarHBondContact O-N 3.31Å; V313-T335 HydrophobicContact CG2-CG2 3.77Å
314	N	96.7	Very high	95.7	Very high	119 Å²	119	37.2 Å²	37.2	64%	0.636	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.9	2.7	-175.6	-56.6	-45.9	0	0	0	116.6	N312 V331 A332	N312-N314 PolarHBondContact O-N 3.19Å; N314-V331 HydrophobicContact CB-CG1 4.41Å; N314-A332 PolarHBondContact N-O 3.35Å
315	D	96.8	Very high	95.7	Very high	42 Å²	42	37.3 Å²	37.3	23%	0.225	19%	0.194	C	C	.	.			trans	-64.1	139.8	171.7	-79.5	-9.6	0	0	0	111.4	K281 N312 V313 I317 V331 A332	K281-D315 IonicContact NZ-OD2 3.07Å; K281-D315 PolarHBondContact NZ-OD2 3.12Å; N312-D315 PolarHBondContact N-OD2 2.93Å; N312-D315 WeakPolarHBondContact O-CB 3.35Å; N312-D315 PolarHBondContact O-N 3.19Å; V313-D315 VanDerWaalsContact C-N 3.26Å; V313-D315 PolarHBondContact O-N 3.31Å; D315-I317 HydrophobicContact CB-CG2 4.31Å; D315-I317 PolarHBondContact O-N 3.21Å; D315-V331 WeakPolarHBondContact O-CA 3.46Å; D315-A332 HydrophobicContact CB-CB 4.49Å; D315-A332 PolarHBondContact O-N 3.15Å
316	E	95.5	Very high	95.9	Very high	63 Å²	63	36.9 Å²	36.9	29%	0.294	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	119	169.2	-172.2	164.9	-161.9	0	0	110	L329 K351	E316-L329 HydrophobicContact CG-CD2 4.46Å; E316-K351 WeakPolarHBondContact OE1-CD 3.41Å; E316-K351 WeakPolarHBondContact OE1-CE 3.43Å; E316-K351 IonicContact OE1-NZ 3.38Å; E316-K351 PolarHBondContact OE1-NZ 2.91Å; E316-K351 IonicContact OE2-NZ 3.65Å; E316-K351 PolarHBondContact OE2-NZ 2.92Å
317	I	97.2	Very high	96	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	157.9	-175.2	62.1	166.5	0	0	0	110.8	K281 I283 I311 D315 L319 A330 A332 A348	K281-I317 HydrophobicContact CB-CG2 4.1Å; K281-I317 CarbonylContact O-C 3.55Å; K281-I317 VanDerWaalsContact O-CA 3.29Å; K281-I317 WeakPolarHBondContact O-CA 3.45Å; K281-I317 WeakPolarHBondContact O-CB 3.49Å; I283-I317 HydrophobicContact CD1-CD1 3.38Å; I283-I317 HydrophobicContact CG1-CD1 3.87Å; I311-I317 HydrophobicContact CG2-CG2 4.29Å; D315-I317 HydrophobicContact CB-CG2 4.31Å; D315-I317 PolarHBondContact O-N 3.21Å; I317-L319 HydrophobicContact CD1-CD2 3.95Å; I317-L319 HydrophobicContact CG1-CD2 4.48Å; I317-A330 HydrophobicContact CD1-CB 4.39Å; I317-A330 HydrophobicContact CG1-CB 4Å; I317-A330 WeakPolarHBondContact CG1-O 2.96Å; I317-A330 PolarHBondContact N-O 3.13Å; I317-A330 PolarHBondContact O-N 3.45Å; I317-A332 HydrophobicContact CD1-CB 4.25Å; I317-A332 HydrophobicContact CG2-CB 4.24Å; I317-A348 HydrophobicContact CD1-CB 3.89Å
318	V	97.7	Very high	96	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	129.9	171.4	64.4	0	0	0	0	110	L39 L277 H280 K281 R282 I283 A326 L329	L39-V318 HydrophobicContact CD1-CG2 4.17Å; L39-V318 HydrophobicContact CD2-CG1 4.1Å; L277-V318 HydrophobicContact CB-CG2 4.33Å; L277-V318 HydrophobicContact CD1-CG2 3.92Å; H280-V318 HydrophobicContact CB-CB 4.07Å; H280-V318 HydrophobicContact CB-CG1 3.91Å; K281-V318 PolarHBondContact O-N 3.48Å; R282-V318 WeakPolarHBondContact CA-O 3.34Å; R282-V318 HydrophobicContact CB-CG1 4.2Å; R282-V318 HydrophobicContact CG-CG1 3.58Å; I283-V318 PolarHBondContact N-O 2.93Å; V318-A326 HydrophobicContact CG2-CB 4.17Å; V318-L329 HydrophobicContact CB-CD2 4.47Å
319	L	98	Very high	96	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	128.9	170.3	-53.1	-172.6	0	0	0	108.6	I283 L285 I293 L299 I317 V327 A328 A330 L350	I283-L319 HydrophobicContact CB-CD2 3.87Å; I283-L319 HydrophobicContact CG2-CD2 4.47Å; I283-L319 WeakPolarHBondContact O-CA 3.42Å; L285-L319 HydrophobicContact CD1-CB 3.9Å; L285-L319 HydrophobicContact CD2-CB 4.39Å; L285-L319 HydrophobicContact CG-CB 4.24Å; I293-L319 HydrophobicContact CD1-CD1 4.44Å; I293-L319 HydrophobicContact CG2-CD1 4.16Å; L299-L319 HydrophobicContact CB-CD1 4.36Å; L299-L319 HydrophobicContact CD2-CD1 4.22Å; L299-L319 HydrophobicContact CD2-CD2 3.67Å; I317-L319 HydrophobicContact CD1-CD2 3.95Å; I317-L319 HydrophobicContact CG1-CD2 4.48Å; L319-V327 HydrophobicContact CB-CB 4.47Å; L319-V327 PolarHBondContact O-N 3.38Å; L319-A328 HydrophobicContact CD1-CB 4.41Å; L319-A328 PolarHBondContact N-O 2.93Å; L319-A328 PolarHBondContact O-N 3.49Å; L319-A330 HydrophobicContact CD1-CB 3.96Å; L319-A330 HydrophobicContact CD2-CB 4.21Å; L319-A330 HydrophobicContact CG-CB 3.91Å; L319-L350 HydrophobicContact CD1-CD2 3.73Å
320	M	96.5	Very high	96.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	156.3	-174.6	64.2	179.6	-66	0	0	112.9	L39 L40 R282 I283 M284 L285 E325	L39-M320 HydrophobicContact CB-CE 3.61Å; L39-M320 HydrophobicContact CB-SD 3.93Å; L39-M320 HydrophobicContact CD1-CB 4.25Å; L39-M320 WeakPolarHBondContact O-CE 3.47Å; L40-M320 HydrophobicContact CD2-CE 3.82Å; L40-M320 HydrophobicContact CG-CE 4.46Å; R282-M320 HydrophobicContact CB-SD 3.78Å; R282-M320 HydrophobicContact CG-SD 3.93Å; I283-M320 PolarHBondContact O-N 2.85Å; M284-M320 CarbonylContact C-O 3.56Å; M284-M320 WeakPolarHBondContact CA-O 3.22Å; M284-M320 HydrophobicContact CB-CG 4.34Å; M284-M320 HydrophobicContact CE-CE 4.03Å; L285-M320 PolarHBondContact N-O 3.26Å; M320-E325 CarbonylContact C-O 3.6Å; M320-E325 WeakPolarHBondContact CA-O 3.49Å; M320-E325 WeakPolarHBondContact CB-O 3.49Å
321	T	95	Very high	96.2	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.134	C	C	.	.			trans	-83.1	172	172.5	69.2	0	0	0	0	111.5	V290 K323 G324 E325 V327 M355 Y360	V290-T321 HydrophobicContact CG1-CG2 4.3Å; V290-T321 HydrophobicContact CG2-CG2 3.83Å; T321-K323 PolarHBondContact O-N 3.23Å; T321-K323 PolarHBondContact OG1-N 3.16Å; T321-G324 PolarHBondContact O-N 2.83Å; T321-E325 HydrophobicContact CG2-CB 4.26Å; T321-E325 PolarHBondContact N-O 3.34Å; T321-E325 WeakPolarHBondContact OG1-CB 3.4Å; T321-E325 PolarHBondContact OG1-N 3.04Å; T321-V327 HydrophobicContact CG2-CG2 3.52Å; T321-M355 HydrophobicContact CG2-CE 3.89Å; T321-Y360 HydrophobicContact CG2-CE2 4.06Å
322	T	91.7	Very high	96.3	Very high	43 Å²	43	24.6 Å²	24.6	26%	0.264	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-25.1	172.1	56.6	0	0	0	0	113.1	E54 M284 L305	E54-T322 HydrophobicContact CB-CG2 4.45Å; E54-T322 HydrophobicContact CG-CG2 4.07Å; M284-T322 HydrophobicContact CG-CG2 4.46Å; M284-T322 HydrophobicContact SD-CG2 4.2Å; L305-T322 HydrophobicContact CD2-CG2 3.74Å
323	K	91.9	Very high	96.3	Very high	42 Å²	42	23.5 Å²	23.5	18%	0.183	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-4.6	-178.3	-59.8	176.4	-175.3	176.3	0	113.7	D56 T57 T58 S61 P62 T321 E325	D56-K323 PolarHBondContact O-NZ 3.48Å; T57-K323 PolarHBondContact O-NZ 3.09Å; T58-K323 VanDerWaalsContact C-NZ 3.29Å; T58-K323 WeakPolarHBondContact O-CE 3.13Å; T58-K323 PolarHBondContact O-NZ 3.23Å; S61-K323 WeakPolarHBondContact CA-O 3.27Å; P62-K323 WeakPolarHBondContact CD-O 3.41Å; T321-K323 PolarHBondContact O-N 3.23Å; T321-K323 PolarHBondContact OG1-N 3.16Å; K323-E325 HydrophobicContact CB-CG 4.42Å
324	G	93.5	Very high	96.2	Very high	1 Å²	1	21 Å²	21	1%	0.01	11%	0.111	C	C	.	.	S	Bend	trans	95.7	5.3	179.5	0	0	0	0	0	115.1	P62 T321	P62-G324 WeakPolarHBondContact CG-O 3.49Å; T321-G324 PolarHBondContact O-N 2.83Å
325	E	95.6	Very high	96.3	Very high	3 Å²	3	17.2 Å²	17.2	1%	0.014	9%	0.092	C	C	.	.			trans	-80	136.8	-176.9	-52.3	-165.5	89.7	0	0	111.3	G59 Y60 R65 M320 T321 K323 V327 M355 Y360	G59-E325 WeakPolarHBondContact CA-OE2 3.46Å; Y60-E325 PolarHBondContact N-OE2 2.95Å; Y60-E325 VanDerWaalsContact N-OE2 3.09Å; Y60-E325 WeakPolarHBondContact O-CG 2.9Å; R65-E325 IonicContact CZ-OE1 3.33Å; R65-E325 IonicContact NE-OE1 3.83Å; R65-E325 PolarHBondContact NE-OE1 3.27Å; R65-E325 IonicContact NH2-OE1 2.75Å; R65-E325 PolarHBondContact NH2-OE1 2.89Å; M320-E325 CarbonylContact C-O 3.6Å; M320-E325 WeakPolarHBondContact CA-O 3.49Å; M320-E325 WeakPolarHBondContact CB-O 3.49Å; T321-E325 HydrophobicContact CG2-CB 4.26Å; T321-E325 PolarHBondContact N-O 3.34Å; T321-E325 WeakPolarHBondContact OG1-CB 3.4Å; T321-E325 PolarHBondContact OG1-N 3.04Å; K323-E325 HydrophobicContact CB-CG 4.42Å; E325-V327 PolarHBondContact O-N 3.21Å; E325-M355 HydrophobicContact CB-CE 3.75Å; E325-Y360 PolarHBondContact OE2-OH 3.11Å
326	A	97	Very high	96.2	Very high	3 Å²	3	16.3 Å²	16.3	3%	0.025	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	117.3	174.9	0	0	0	0	0	110.9	L39 L273 E274 L277 V318 I354	L39-A326 HydrophobicContact CD1-CB 4.1Å; L273-A326 HydrophobicContact CD1-CB 3.87Å; E274-A326 HydrophobicContact CG-CB 3.99Å; E274-A326 PolarHBondContact OE1-N 2.85Å; L277-A326 HydrophobicContact CD1-CB 3.45Å; L277-A326 VanDerWaalsContact CD1-CB 3.45Å; V318-A326 HydrophobicContact CG2-CB 4.17Å; A326-I354 HydrophobicContact CB-CD1 4.11Å
327	V	97	Very high	96.2	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-52.2	178.5	-177.3	0	0	0	0	110.3	L285 V290 I293 L319 T321 E325 I354 M355	L285-V327 HydrophobicContact CD1-CB 4.07Å; L285-V327 HydrophobicContact CD1-CG1 4.16Å; L285-V327 HydrophobicContact CD1-CG2 3.96Å; V290-V327 HydrophobicContact CG1-CG1 4.11Å; V290-V327 HydrophobicContact CG1-CG2 3.97Å; V290-V327 HydrophobicContact CG2-CG2 4.42Å; I293-V327 HydrophobicContact CB-CG1 4.35Å; I293-V327 HydrophobicContact CG2-CG1 3.76Å; L319-V327 HydrophobicContact CB-CB 4.47Å; L319-V327 PolarHBondContact O-N 3.38Å; T321-V327 HydrophobicContact CG2-CG2 3.52Å; E325-V327 PolarHBondContact O-N 3.21Å; V327-I354 PolarHBondContact O-N 2.95Å; V327-M355 HydrophobicContact CG1-CB 4.41Å; V327-M355 HydrophobicContact CG1-SD 4.46Å; V327-M355 HydrophobicContact CG2-CE 3.81Å; V327-M355 HydrophobicContact CG2-SD 4.13Å; V327-M355 PolarHBondContact O-N 3.26Å
328	A	97.4	Very high	96.1	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	154.8	-175.9	0	0	0	0	0	112.5	I293 L319 L350 R352	I293-A328 HydrophobicContact CG2-CB 4.24Å; L319-A328 HydrophobicContact CD1-CB 4.41Å; L319-A328 PolarHBondContact N-O 2.93Å; L319-A328 PolarHBondContact O-N 3.49Å; A328-L350 HydrophobicContact CB-CD2 4.01Å; A328-R352 CarbonylContact C-O 3.57Å; A328-R352 VanDerWaalsContact CA-O 3.25Å; A328-R352 WeakPolarHBondContact CA-O 3.48Å; A328-R352 WeakPolarHBondContact CB-O 3.49Å
329	L	96.9	Very high	96	Very high	2 Å²	2	18.7 Å²	18.7	1%	0.01	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	133.8	157.6	-73.9	172.4	0	0	0	109	L126 L277 E316 V318 K351 R352 I354	L126-L329 HydrophobicContact CD2-CD1 3.81Å; L126-L329 HydrophobicContact CD2-CG 4.45Å; L277-L329 HydrophobicContact CD2-CD1 4.48Å; L277-L329 HydrophobicContact CD2-CD2 3.97Å; L277-L329 HydrophobicContact CD2-CG 4.45Å; E316-L329 HydrophobicContact CG-CD2 4.46Å; V318-L329 HydrophobicContact CB-CD2 4.47Å; L329-K351 WeakPolarHBondContact O-CB 3.37Å; L329-K351 PolarHBondContact O-N 3.35Å; L329-R352 HydrophobicContact CB-CB 4.42Å; L329-R352 PolarHBondContact N-O 2.87Å; L329-R352 PolarHBondContact O-N 3.3Å; L329-I354 HydrophobicContact CG-CD1 4.33Å
330	A	97.4	Very high	95.8	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	165.4	-178.6	0	0	0	0	0	111	I317 L319 A348 K349 L350	I317-A330 HydrophobicContact CD1-CB 4.39Å; I317-A330 HydrophobicContact CG1-CB 4Å; I317-A330 WeakPolarHBondContact CG1-O 2.96Å; I317-A330 PolarHBondContact N-O 3.13Å; I317-A330 PolarHBondContact O-N 3.45Å; L319-A330 HydrophobicContact CD1-CB 3.96Å; L319-A330 HydrophobicContact CD2-CB 4.21Å; L319-A330 HydrophobicContact CG-CB 3.91Å; A330-A348 HydrophobicContact CB-CB 3.9Å; A330-K349 CarbonylContact C-O 3.58Å; A330-K349 VanDerWaalsContact CA-O 3.29Å; A330-K349 WeakPolarHBondContact CA-O 3.34Å; A330-K349 WeakPolarHBondContact CB-O 2.94Å; A330-L350 HydrophobicContact CB-CD2 4.28Å
331	V	97.7	Very high	95.6	Very high	37 Å²	37	25.8 Å²	25.8	22%	0.224	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	124.5	173.2	179.3	0	0	0	0	107.3	N314 D315 A348 K349 K351	N314-V331 HydrophobicContact CB-CG1 4.41Å; D315-V331 WeakPolarHBondContact O-CA 3.46Å; V331-A348 CarbonylContact O-C 3.56Å; V331-A348 VanDerWaalsContact O-CA 3.26Å; V331-A348 WeakPolarHBondContact O-CA 3.17Å; V331-A348 WeakPolarHBondContact O-CB 3.25Å; V331-K349 PolarHBondContact N-O 2.87Å; V331-K349 PolarHBondContact O-N 3.49Å; V331-K351 HydrophobicContact CG2-CB 4.31Å; V331-K351 HydrophobicContact CG2-CD 4.34Å
332	A	98	Very high	95.5	Very high	0 Å²	0	28 Å²	28	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	136.4	179.1	0	0	0	0	0	110.9	I311 N312 N314 D315 I317	I311-A332 HydrophobicContact CG2-CB 3.55Å; N312-A332 WeakPolarHBondContact O-CB 3.09Å; N314-A332 PolarHBondContact N-O 3.35Å; D315-A332 HydrophobicContact CB-CB 4.49Å; D315-A332 PolarHBondContact O-N 3.15Å; I317-A332 HydrophobicContact CD1-CB 4.25Å; I317-A332 HydrophobicContact CG2-CB 4.24Å
333	L	97.4	Very high	95.5	Very high	65 Å²	65	32.4 Å²	32.4	34%	0.34	20%	0.199	S	C	.	.			trans	-113.1	-6.2	174.6	-62.1	179.1	0	0	0	112.1	L346 V347 K349	L333-L346 WeakPolarHBondContact CB-O 3.41Å; L333-L346 HydrophobicContact CD1-CD2 3.29Å; L333-L346 HydrophobicContact CD1-CG 3.79Å; L333-V347 PolarHBondContact N-O 3.2Å; L333-K349 HydrophobicContact CD1-CB 4.07Å; L333-K349 HydrophobicContact CG-CB 4.48Å
334	M	96.4	Very high	95.4	Very high	20 Å²	20	38.1 Å²	38.1	10%	0.099	23%	0.226	C	C	.	.	S	Bend	trans	-128	143.3	179.3	-71.5	-175.4	82.2	0	0	108.9	T338 I339 C342 L346 V347	M334-T338 WeakPolarHBondContact CB-OG1 3.45Å; M334-T338 WeakPolarHBondContact CE-O 3.35Å; M334-I339 HydrophobicContact CB-CD1 4.41Å; M334-I339 HydrophobicContact CB-CG1 3.77Å; M334-C342 HydrophobicContact CE-CB 3.82Å; M334-L346 WeakPolarHBondContact CG-O 3.21Å; M334-V347 PolarHBondContact N-O 2.83Å; M334-V347 HydrophobicContact SD-CB 4.47Å; M334-V347 HydrophobicContact SD-CG2 3.89Å
335	T	97.1	Very high	95.4	Very high	41 Å²	41	38.9 Å²	38.9	25%	0.252	23%	0.234	S	C	.	.			trans	-79.9	160.9	171.2	66	0	0	0	0	111	I311 V313 A337 T338 I339	I311-T335 CarbonylContact O-C 3.59Å; I311-T335 WeakPolarHBondContact O-CA 3.3Å; V313-T335 HydrophobicContact CG2-CG2 3.77Å; T335-A337 PolarHBondContact O-N 2.77Å; T335-A337 VanDerWaalsContact O-N 3.16Å; T335-T338 PolarHBondContact N-OG1 3.49Å; T335-T338 PolarHBondContact O-N 3Å; T335-T338 PolarHBondContact O-OG1 2.85Å; T335-T338 WeakPolarHBondContact OG1-CG2 3.17Å; T335-T338 PolarHBondContact OG1-N 2.85Å; T335-T338 PolarHBondContact OG1-OG1 3.44Å; T335-I339 WeakPolarHBondContact O-CG1 3.41Å; T335-I339 PolarHBondContact O-N 3.3Å
336	T	96.2	Very high	95.4	Very high	22 Å²	22	41.4 Å²	41.4	14%	0.135	25%	0.247	C	C	.	.	H	α-helix	trans	-49.2	-41.9	174.4	-63.6	0	0	0	0	112.8	Y307 D310 I311 I339 A340	Y307-T336 HydrophobicContact CD2-CG2 4.22Å; Y307-T336 HydrophobicContact CE2-CG2 3.77Å; D310-T336 PolarHBondContact N-OG1 2.88Å; I311-T336 WeakPolarHBondContact CB-OG1 3.42Å; I311-T336 PolarHBondContact N-OG1 3.17Å; I311-T336 PolarHBondContact O-N 3.5Å; T336-I339 PolarHBondContact O-N 2.94Å; T336-A340 PolarHBondContact O-N 2.73Å
337	A	95	Very high	95.4	Very high	66 Å²	66	41.2 Å²	41.2	55%	0.545	25%	0.246	S	C	.	.	H	α-helix	trans	-64.5	-45	178.1	0	0	0	0	0	112.1	T335 I339 A340 T341	T335-A337 PolarHBondContact O-N 2.77Å; T335-A337 VanDerWaalsContact O-N 3.16Å; A337-I339 PolarHBondContact O-N 3.03Å; A337-A340 WeakPolarHBondContact O-CB 3.27Å; A337-A340 PolarHBondContact O-N 3.22Å; A337-T341 PolarHBondContact O-N 3.37Å; A337-T341 VanDerWaalsContact O-N 3.15Å; A337-T341 PolarHBondContact O-OG1 3.17Å; A337-T341 VanDerWaalsContact O-OG1 3.13Å
338	T	95.2	Very high	95.4	Very high	47 Å²	47	41.2 Å²	41.2	29%	0.288	25%	0.246	S	C	.	.	H	α-helix	trans	-68.3	-33.8	179.3	58.3	0	0	0	0	112.9	M334 T335 A340 T341 C342	M334-T338 WeakPolarHBondContact CB-OG1 3.45Å; M334-T338 WeakPolarHBondContact CE-O 3.35Å; T335-T338 PolarHBondContact N-OG1 3.49Å; T335-T338 PolarHBondContact O-N 3Å; T335-T338 PolarHBondContact O-OG1 2.85Å; T335-T338 WeakPolarHBondContact OG1-CG2 3.17Å; T335-T338 PolarHBondContact OG1-N 2.85Å; T335-T338 PolarHBondContact OG1-OG1 3.44Å; T338-A340 PolarHBondContact O-N 3.08Å; T338-T341 PolarHBondContact O-N 3.24Å; T338-C342 VanDerWaalsContact O-CB 3.29Å; T338-C342 WeakPolarHBondContact O-CB 3.46Å; T338-C342 PolarHBondContact O-N 3.21Å; T338-C342 PolarHBondContact O-SG 2.89Å; T338-C342 VanDerWaalsContact O-SG 3.33Å
339	I	95.5	Very high	95.4	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-62.6	-36	174.1	-64.6	169.8	0	0	0	110.4	R49 I283 L301 Y307 M334 T335 T336 A337 V347	R49-I339 PolarHBondContact NE-O 2.88Å; I283-I339 HydrophobicContact CD1-CD1 4.36Å; L301-I339 HydrophobicContact CD1-CB 4.47Å; L301-I339 HydrophobicContact CD1-CG2 3.92Å; Y307-I339 HydrophobicContact CD1-CG2 3.68Å; Y307-I339 HydrophobicContact CD2-CB 4.45Å; Y307-I339 HydrophobicContact CD2-CD1 4.41Å; Y307-I339 HydrophobicContact CD2-CG2 4.07Å; Y307-I339 HydrophobicContact CE1-CG2 3.57Å; Y307-I339 HydrophobicContact CE2-CB 4.15Å; Y307-I339 HydrophobicContact CE2-CG2 3.93Å; Y307-I339 HydrophobicContact CG-CG2 3.96Å; M334-I339 HydrophobicContact CB-CD1 4.41Å; M334-I339 HydrophobicContact CB-CG1 3.77Å; T335-I339 WeakPolarHBondContact O-CG1 3.41Å; T335-I339 PolarHBondContact O-N 3.3Å; T336-I339 PolarHBondContact O-N 2.94Å; A337-I339 PolarHBondContact O-N 3.03Å; I339-V347 HydrophobicContact CD1-CG1 3.95Å; I339-V347 HydrophobicContact CG1-CG1 4.22Å
340	A	93.7	Very high	95.4	Very high	44 Å²	44	48.8 Å²	48.8	36%	0.364	28%	0.28	S	S	.	.	H	α-helix	trans	-71.9	-40.2	179.6	0	0	0	0	0	112.9	Y307 T336 A337 T338	Y307-A340 WeakPolarHBondContact OH-CA 3.41Å; Y307-A340 VanDerWaalsContact OH-CB 3.3Å; Y307-A340 WeakPolarHBondContact OH-CB 3.27Å; T336-A340 PolarHBondContact O-N 2.73Å; A337-A340 WeakPolarHBondContact O-CB 3.27Å; A337-A340 PolarHBondContact O-N 3.22Å; T338-A340 PolarHBondContact O-N 3.08Å
341	T	92.7	Very high	95.3	Very high	106 Å²	106	54.2 Å²	54.2	65%	0.65	30%	0.303	S	S	*	.	H	α-helix	trans	-96.8	-31.1	-168.2	56.4	0	0	0	0	114.7	A337 T338	A337-T341 PolarHBondContact O-N 3.37Å; A337-T341 VanDerWaalsContact O-N 3.15Å; A337-T341 PolarHBondContact O-OG1 3.17Å; A337-T341 VanDerWaalsContact O-OG1 3.13Å; T338-T341 PolarHBondContact O-N 3.24Å
342	C	93.2	Very high	95.2	Very high	45 Å²	45	56.4 Å²	56.4	30%	0.304	31%	0.308	S	S	.	.			trans	-76.9	151.2	-177.9	-62.9	0	0	0	0	111.7	R49 L301 M334 T338	R49-C342 PolarHBondContact NH2-O 3.42Å; L301-C342 HydrophobicContact CD2-CB 4.13Å; L301-C342 WeakPolarHBondContact CD2-O 3.22Å; M334-C342 HydrophobicContact CE-CB 3.82Å; T338-C342 VanDerWaalsContact O-CB 3.29Å; T338-C342 WeakPolarHBondContact O-CB 3.46Å; T338-C342 PolarHBondContact O-N 3.21Å; T338-C342 PolarHBondContact O-SG 2.89Å; T338-C342 VanDerWaalsContact O-SG 3.33Å
343	D	90.8	Very high	95.1	Very high	137 Å²	137	57.7 Å²	57.7	73%	0.733	32%	0.316	S	S	*	.	S	Bend	trans	-98.5	-22	175.7	-65.4	-39	0	0	0	113.2
344	H	90.6	Very high	95	Very high	161 Å²	161	54.7 Å²	54.7	75%	0.745	30%	0.3	S	S	*	.	S	Bend	trans	-141.8	153.1	176.7	62	-79.4	0	0	0	109.3
345	G	93.3	Very high	94.9	Very high	18 Å²	18	54 Å²	54	19%	0.186	30%	0.297	C	S	.	.			trans	159.7	165.2	-179.9	0	0	0	0	0	113.6	L301	L301-G345 PolarHBondContact N-O 3.3Å
346	L	95.6	Very high	94.7	Very high	55 Å²	55	55.4 Å²	55.4	29%	0.288	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	105.2	175.2	-170.1	73.4	0	0	0	108.6	K298 M300 L333 M334	K298-L346 HydrophobicContact CB-CD1 3.43Å; K298-L346 VanDerWaalsContact CB-CD1 3.43Å; K298-L346 HydrophobicContact CB-CG 4.47Å; K298-L346 HydrophobicContact CD-CD1 3.67Å; K298-L346 HydrophobicContact CD-CD2 3.83Å; K298-L346 HydrophobicContact CD-CG 4.34Å; K298-L346 HydrophobicContact CG-CD1 4.19Å; M300-L346 HydrophobicContact SD-CD1 3.42Å; M300-L346 WeakPolarHBondContact SD-CD1 3.11Å; L333-L346 WeakPolarHBondContact CB-O 3.41Å; L333-L346 HydrophobicContact CD1-CD2 3.29Å; L333-L346 HydrophobicContact CD1-CG 3.79Å; M334-L346 WeakPolarHBondContact CG-O 3.21Å
347	V	97	Very high	94.4	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	-42.9	-173	177.5	0	0	0	0	111.5	I283 L299 L301 V304 L333 M334 I339	I283-V347 HydrophobicContact CD1-CG1 3.68Å; L299-V347 HydrophobicContact CD2-CB 4.17Å; L299-V347 HydrophobicContact CD2-CG1 4.06Å; L299-V347 HydrophobicContact CG-CB 4.08Å; L299-V347 PolarHBondContact O-N 3.24Å; L301-V347 HydrophobicContact CB-CG2 3.89Å; L301-V347 HydrophobicContact CD1-CG2 3.49Å; L301-V347 VanDerWaalsContact CD1-CG2 3.49Å; L301-V347 HydrophobicContact CG-CG2 4.3Å; V304-V347 HydrophobicContact CG2-CB 4.47Å; V304-V347 HydrophobicContact CG2-CG1 4.29Å; V304-V347 HydrophobicContact CG2-CG2 4.04Å; L333-V347 PolarHBondContact N-O 3.2Å; M334-V347 PolarHBondContact N-O 2.83Å; M334-V347 HydrophobicContact SD-CB 4.47Å; M334-V347 HydrophobicContact SD-CG2 3.89Å; I339-V347 HydrophobicContact CD1-CG1 3.95Å; I339-V347 HydrophobicContact CG1-CG1 4.22Å
348	A	97.4	Very high	94.1	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	143.7	-176	0	0	0	0	0	113.1	L299 I317 A330 V331	L299-A348 HydrophobicContact CB-CB 4.12Å; L299-A348 HydrophobicContact CD2-CB 4.29Å; L299-A348 PolarHBondContact N-O 2.68Å; L299-A348 PolarHBondContact O-N 2.84Å; I317-A348 HydrophobicContact CD1-CB 3.89Å; A330-A348 HydrophobicContact CB-CB 3.9Å; V331-A348 CarbonylContact O-C 3.56Å; V331-A348 VanDerWaalsContact O-CA 3.26Å; V331-A348 WeakPolarHBondContact O-CA 3.17Å; V331-A348 WeakPolarHBondContact O-CB 3.25Å
349	K	97.2	Very high	93.8	Very high	129 Å²	129	62.8 Å²	62.8	56%	0.561	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.6	136.2	168.7	178.9	-179.1	176.5	-177.1	0	109.3	A330 V331 L333 K351	A330-K349 CarbonylContact C-O 3.58Å; A330-K349 VanDerWaalsContact CA-O 3.29Å; A330-K349 WeakPolarHBondContact CA-O 3.34Å; A330-K349 WeakPolarHBondContact CB-O 2.94Å; V331-K349 PolarHBondContact N-O 2.87Å; V331-K349 PolarHBondContact O-N 3.49Å; L333-K349 HydrophobicContact CD1-CB 4.07Å; L333-K349 HydrophobicContact CG-CB 4.48Å; K349-K351 PolarHBondContact O-N 3.11Å
350	L	96.8	Very high	93.7	Very high	31 Å²	31	63 Å²	63	16%	0.162	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	132.3	177.8	-57.7	-178.6	0	0	0	111.3	I293 A297 L319 A328 A330 V353	I293-L350 HydrophobicContact CG2-CD1 4.11Å; I293-L350 HydrophobicContact CG2-CD2 3.78Å; I293-L350 WeakPolarHBondContact O-CD1 3.12Å; A297-L350 WeakPolarHBondContact O-CD1 3.38Å; L319-L350 HydrophobicContact CD1-CD2 3.73Å; A328-L350 HydrophobicContact CB-CD2 4.01Å; A330-L350 HydrophobicContact CB-CD2 4.28Å; L350-V353 HydrophobicContact CD1-CG2 3.98Å
351	K	94.8	Very high	93.5	Very high	114 Å²	114	63.5 Å²	63.5	50%	0.496	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	-41.1	170	-174.1	178.6	179.1	-177	0	110.3	E316 L329 V331 K349	E316-K351 WeakPolarHBondContact OE1-CD 3.41Å; E316-K351 WeakPolarHBondContact OE1-CE 3.43Å; E316-K351 IonicContact OE1-NZ 3.38Å; E316-K351 PolarHBondContact OE1-NZ 2.91Å; E316-K351 IonicContact OE2-NZ 3.65Å; E316-K351 PolarHBondContact OE2-NZ 2.92Å; L329-K351 WeakPolarHBondContact O-CB 3.37Å; L329-K351 PolarHBondContact O-N 3.35Å; V331-K351 HydrophobicContact CG2-CB 4.31Å; V331-K351 HydrophobicContact CG2-CD 4.34Å; K349-K351 PolarHBondContact O-N 3.11Å
352	R	95.1	Very high	93.2	Very high	84 Å²	84	64.5 Å²	64.5	32%	0.317	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	125.8	178.6	-169.8	157.2	-63.9	-169.9	-6	113	R125 K128 A328 L329	R125-R352 WeakPolarHBondContact O-CD 3.36Å; R125-R352 PolarHBondContact O-NH1 3.43Å; K128-R352 VanDerWaalsContact CB-NH1 3.3Å; A328-R352 CarbonylContact C-O 3.57Å; A328-R352 VanDerWaalsContact CA-O 3.25Å; A328-R352 WeakPolarHBondContact CA-O 3.48Å; A328-R352 WeakPolarHBondContact CB-O 3.49Å; L329-R352 HydrophobicContact CB-CB 4.42Å; L329-R352 PolarHBondContact N-O 2.87Å; L329-R352 PolarHBondContact O-N 3.3Å
353	V	96.4	Very high	92.8	Very high	27 Å²	27	65.6 Å²	65.6	16%	0.164	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	131.9	170.7	179.4	0	0	0	0	109.8	R125 C294 L350 M355	R125-V353 WeakPolarHBondContact CD-O 3.44Å; C294-V353 HydrophobicContact CB-CG1 4.35Å; L350-V353 HydrophobicContact CD1-CG2 3.98Å; V353-M355 WeakPolarHBondContact CG1-O 3.46Å
354	I	95.2	Very high	92.1	Very high	1 Å²	1	65.2 Å²	65.2	1%	0.005	30%	0.298	C	S	.	.			trans	-105.8	-47.9	-179.7	-58.2	162.3	0	0	0	110.3	R122 R125 L126 L273 L277 A326 V327 L329	R122-I354 WeakPolarHBondContact CD-O 3.4Å; R122-I354 WeakPolarHBondContact CG-O 3.34Å; R125-I354 WeakPolarHBondContact CD-O 3.3Å; L126-I354 HydrophobicContact CD2-CD1 3.69Å; L126-I354 HydrophobicContact CD2-CG1 3.92Å; L126-I354 HydrophobicContact CG-CD1 4.49Å; L273-I354 HydrophobicContact CD1-CG2 3.77Å; L273-I354 HydrophobicContact CD2-CG2 3.76Å; L273-I354 HydrophobicContact CG-CG2 4.49Å; L277-I354 HydrophobicContact CD1-CD1 3.75Å; A326-I354 HydrophobicContact CB-CD1 4.11Å; V327-I354 PolarHBondContact O-N 2.95Å; L329-I354 HydrophobicContact CG-CD1 4.33Å
355	M	95.1	Very high	91.4	Very high	7 Å²	7	58.9 Å²	58.9	3%	0.034	28%	0.275	C	S	.	.	S	Bend	trans	-67.9	147.1	-178.4	-178.8	177.3	-76	0	0	111.6	V290 T321 E325 V327 V353 L359 Y360	V290-M355 HydrophobicContact CG1-CE 4.39Å; V290-M355 HydrophobicContact CG1-SD 3.4Å; V290-M355 WeakPolarHBondContact CG1-SD 3.4Å; T321-M355 HydrophobicContact CG2-CE 3.89Å; E325-M355 HydrophobicContact CB-CE 3.75Å; V327-M355 HydrophobicContact CG1-CB 4.41Å; V327-M355 HydrophobicContact CG1-SD 4.46Å; V327-M355 HydrophobicContact CG2-CE 3.81Å; V327-M355 HydrophobicContact CG2-SD 4.13Å; V327-M355 PolarHBondContact O-N 3.26Å; V353-M355 WeakPolarHBondContact CG1-O 3.46Å; M355-L359 HydrophobicContact CE-CD2 4.19Å; M355-L359 HydrophobicContact CG-CD2 3.95Å; M355-L359 HydrophobicContact SD-CD2 4.02Å; M355-Y360 HydrophobicContact CE-CD2 4.46Å; M355-Y360 HydrophobicContact CE-CE2 3.98Å; M355-Y360 HydrophobicContact SD-CD2 3.83Å; M355-Y360 HydrophobicContact SD-CE2 3.96Å
356	E	91.1	Very high	90.5	Very high	70 Å²	70	66.3 Å²	66.3	33%	0.327	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-71.2	154.1	175.9	-78.3	-59.2	151	0	0	112	R125	R125-E356 IonicContact CZ-OE1 3.59Å; R125-E356 IonicContact NE-OE1 2.79Å; R125-E356 IonicContact NH2-OE1 2.75Å; R125-E356 PolarHBondContact NH2-OE1 2.93Å; R125-E356 IonicContact NH2-OE2 3.43Å
357	R	91.1	Very high	89.6	Confident	154 Å²	154	65.4 Å²	65.4	58%	0.581	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	150.4	174.1	-64.2	170.9	-177	167.4	0.1	109	C294 F295 L359	C294-R357 HydrophobicContact CB-CG 4.48Å; F295-R357 HydrophobicContact CE1-CB 4.42Å; F295-R357 HydrophobicContact CE1-CG 4.24Å; F295-R357 HydrophobicContact CE2-CB 4.12Å; F295-R357 HydrophobicContact CE2-CG 4.39Å; F295-R357 HydrophobicContact CZ-CB 3.88Å; F295-R357 HydrophobicContact CZ-CG 4.15Å; R357-L359 PolarHBondContact O-N 3.46Å
358	D	88.7	Confident	88.8	Confident	84 Å²	84	70.3 Å²	70.3	45%	0.449	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	7.5	174.1	-55.4	-41.9	0	0	0	116.2	F295 Y360 R362	F295-D358 WeakPolarHBondContact CE2-OD1 3.48Å; D358-Y360 VanDerWaalsContact C-N 3.31Å; D358-R362 VanDerWaalsContact CG-NH2 3.26Å; D358-R362 IonicContact OD1-CZ 3.86Å; D358-R362 VanDerWaalsContact OD1-CZ 3.23Å; D358-R362 IonicContact OD1-NE 2.66Å; D358-R362 PolarHBondContact OD1-NE 3.24Å; D358-R362 IonicContact OD1-NH2 3.63Å; D358-R362 PolarHBondContact OD1-NH2 3.4Å; D358-R362 IonicContact OD2-CZ 2.71Å; D358-R362 IonicContact OD2-NH2 2.81Å; D358-R362 PolarHBondContact OD2-NH2 3.41Å
359	L	89.5	Confident	88	Confident	52 Å²	52	76.2 Å²	76.2	27%	0.272	37%	0.369	S	S	.	.	S	Bend	trans	-61.1	-43.6	168.6	-179.8	64.3	0	0	0	110.8	T58 M355 R357	T58-L359 WeakPolarHBondContact CG2-O 3.45Å; M355-L359 HydrophobicContact CE-CD2 4.19Å; M355-L359 HydrophobicContact CG-CD2 3.95Å; M355-L359 HydrophobicContact SD-CD2 4.02Å; R357-L359 PolarHBondContact O-N 3.46Å
360	Y	92.4	Very high	87.2	Confident	3 Å²	3	71.9 Å²	71.9	1%	0.012	36%	0.355	C	S	.	.	S	Bend	trans	-99.3	146.9	172.5	-80.6	-100.9	0	0	0	110.6	D56 T58 D287 V290 C291 T321 E325 M355 D358	D56-Y360 WeakPolarHBondContact OD2-CD1 3.49Å; T58-Y360 HydrophobicContact CG2-CD1 4.24Å; T58-Y360 HydrophobicContact CG2-CG 4.28Å; T58-Y360 WeakPolarHBondContact O-CE1 3.45Å; T58-Y360 VanDerWaalsContact O-CZ 3.32Å; T58-Y360 PolarHBondContact O-OH 3.2Å; D287-Y360 HydrophobicContact CB-CD1 4.17Å; D287-Y360 HydrophobicContact CB-CE1 3.98Å; V290-Y360 HydrophobicContact CB-CD1 4.4Å; V290-Y360 HydrophobicContact CB-CD2 4.27Å; V290-Y360 HydrophobicContact CB-CG 4.04Å; V290-Y360 HydrophobicContact CG1-CD2 3.57Å; V290-Y360 HydrophobicContact CG1-CE2 4.08Å; V290-Y360 HydrophobicContact CG1-CG 3.83Å; C291-Y360 WeakPolarHBondContact CB-O 3.45Å; C291-Y360 PolarHBondContact SG-O 3.43Å; T321-Y360 HydrophobicContact CG2-CE2 4.06Å; E325-Y360 PolarHBondContact OE2-OH 3.11Å; M355-Y360 HydrophobicContact CE-CD2 4.46Å; M355-Y360 HydrophobicContact CE-CE2 3.98Å; M355-Y360 HydrophobicContact SD-CD2 3.83Å; M355-Y360 HydrophobicContact SD-CE2 3.96Å; D358-Y360 VanDerWaalsContact C-N 3.31Å
361	P	89.4	Confident	86.6	Confident	56 Å²	56	75 Å²	75	36%	0.364	37%	0.37	S	S	.	.			trans	-64.5	143.5	-176.5	26	-34.5	0	0	0	112.4	Q363	P361-Q363 PolarHBondContact O-N 2.86Å
362	R	87.5	Confident	86.1	Confident	126 Å²	126	73.5 Å²	73.5	48%	0.475	37%	0.365	S	S	.	.			trans	-72	112.4	174.8	-65	-179.8	-171.2	179.1	7.9	110.3	C291 D358 W364	C291-R362 VanDerWaalsContact SG-CG 3.54Å; D358-R362 VanDerWaalsContact CG-NH2 3.26Å; D358-R362 IonicContact OD1-CZ 3.86Å; D358-R362 VanDerWaalsContact OD1-CZ 3.23Å; D358-R362 IonicContact OD1-NE 2.66Å; D358-R362 PolarHBondContact OD1-NE 3.24Å; D358-R362 IonicContact OD1-NH2 3.63Å; D358-R362 PolarHBondContact OD1-NH2 3.4Å; D358-R362 IonicContact OD2-CZ 2.71Å; D358-R362 IonicContact OD2-NH2 2.81Å; D358-R362 PolarHBondContact OD2-NH2 3.41Å; R362-W364 HydrophobicContact CG-CH2 4.44Å; R362-W364 HydrophobicContact CG-CZ2 4.27Å
363	Q	83.2	Confident	85.6	Confident	69 Å²	69	76 Å²	76	32%	0.322	37%	0.374	S	S	.	.			trans	-106.2	26.6	179.2	-60.5	-154.9	11	0	0	114.3	P361	P361-Q363 PolarHBondContact O-N 2.86Å
364	W	77.7	Confident	85	Confident	129 Å²	129	80.3 Å²	80.3	49%	0.489	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	138	-174.5	-51.5	-25.4	0	0	0	112.9	F295 R362 R366	F295-W364 HydrophobicContact CB-CZ2 4.4Å; F295-W364 AromaticContact CD2-CH2 3.94Å; F295-W364 HydrophobicContact CD2-CH2 3.94Å; F295-W364 AromaticContact CD2-CZ2 3.56Å; F295-W364 HydrophobicContact CD2-CZ2 3.56Å; F295-W364 HydrophobicContact CE2-CH2 4.14Å; F295-W364 HydrophobicContact CE2-CZ2 4.03Å; F295-W364 HydrophobicContact CG-CH2 4.17Å; F295-W364 HydrophobicContact CG-CZ2 4.01Å; R362-W364 HydrophobicContact CG-CH2 4.44Å; R362-W364 HydrophobicContact CG-CZ2 4.27Å; W364-R366 PolarHBondContact O-N 3.12Å
365	G	74.6	Confident	84.6	Confident	27 Å²	27	85.8 Å²	85.8	28%	0.278	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.5	24	175.5	0	0	0	0	0	114.9	S370 K374	G365-S370 WeakPolarHBondContact CA-OG 3.5Å; G365-S370 PolarHBondContact O-OG 3.15Å; G365-K374 PolarHBondContact O-NZ 3.24Å
366	R	75.4	Confident	84.3	Confident	175 Å²	175	88.3 Å²	88.3	66%	0.66	43%	0.428	S	S	*	.			trans	-94.3	-4.7	170.1	-65.7	-167.9	178.9	-134.8	2.4	113.5	W364 M371	W364-R366 PolarHBondContact O-N 3.12Å; R366-M371 WeakPolarHBondContact O-CE 3.39Å
367	G	75.9	Confident	84	Confident	36 Å²	36	87.1 Å²	87.1	37%	0.371	43%	0.425	S	S	.	.	S	Bend	trans	-65.3	155	176.1	0	0	0	0	0	112.2	V369 S370 M371	G367-V369 VanDerWaalsContact C-N 3.31Å; G367-V369 PolarHBondContact O-N 2.98Å; G367-S370 CarbonylContact O-C 3.59Å; G367-S370 WeakPolarHBondContact O-CA 3.45Å; G367-S370 PolarHBondContact O-N 3.42Å; G367-M371 PolarHBondContact O-N 3Å
368	P	80.3	Confident	83.8	Confident	103 Å²	103	84 Å²	84	67%	0.669	43%	0.433	S	S	*	.	H	α-helix	trans	-55.2	-44.9	-174.9	20.5	-32.3	0	0	0	112.3	S370 M371 E372	P368-S370 VanDerWaalsContact C-N 3.34Å; P368-S370 PolarHBondContact O-N 2.93Å; P368-M371 PolarHBondContact O-N 3.45Å; P368-E372 WeakPolarHBondContact O-CB 3.22Å; P368-E372 PolarHBondContact O-N 2.64Å
369	V	81.1	Confident	83.8	Confident	123 Å²	123	86 Å²	86	75%	0.745	44%	0.439	S	S	*	.	H	α-helix	trans	-64.3	-38.1	176.9	-177.6	0	0	0	0	111.9	G367 R373	G367-V369 VanDerWaalsContact C-N 3.31Å; G367-V369 PolarHBondContact O-N 2.98Å; V369-R373 WeakPolarHBondContact O-CB 3.44Å; V369-R373 PolarHBondContact O-N 3.34Å
370	S	80.2	Confident	83.4	Confident	38 Å²	38	86.5 Å²	86.5	27%	0.266	46%	0.457	S	S	.	.	H	α-helix	trans	-73.3	-33.4	178.4	-174.4	0	0	0	0	112.3	G365 G367 P368 K374	G365-S370 WeakPolarHBondContact CA-OG 3.5Å; G365-S370 PolarHBondContact O-OG 3.15Å; G367-S370 CarbonylContact O-C 3.59Å; G367-S370 WeakPolarHBondContact O-CA 3.45Å; G367-S370 PolarHBondContact O-N 3.42Å; P368-S370 VanDerWaalsContact C-N 3.34Å; P368-S370 PolarHBondContact O-N 2.93Å; S370-K374 WeakPolarHBondContact O-CB 3.49Å; S370-K374 VanDerWaalsContact O-CG 3.27Å; S370-K374 WeakPolarHBondContact O-CG 3.21Å; S370-K374 PolarHBondContact O-N 3.1Å
371	M	84.2	Confident	83	Confident	96 Å²	96	92.4 Å²	92.4	47%	0.473	49%	0.488	S	S	.	.	H	α-helix	trans	-68.1	-43.3	173.7	-70.2	-163.7	-72.6	0	0	110.5	R366 G367 P368 K374 K375	R366-M371 WeakPolarHBondContact O-CE 3.39Å; G367-M371 PolarHBondContact O-N 3Å; P368-M371 PolarHBondContact O-N 3.45Å; M371-K374 WeakPolarHBondContact O-CB 3.03Å; M371-K374 PolarHBondContact O-N 2.83Å; M371-K374 VanDerWaalsContact O-N 3.15Å; M371-K375 WeakPolarHBondContact O-CG 3.22Å; M371-K375 PolarHBondContact O-N 2.84Å
372	E	84.5	Confident	82.4	Confident	84 Å²	84	93.3 Å²	93.3	39%	0.393	49%	0.49	S	S	.	.	H	α-helix	trans	-63.5	-43	176	-163.1	55.7	-145.3	0	0	111.6	P368 K374 K375 L376	P368-E372 WeakPolarHBondContact O-CB 3.22Å; P368-E372 PolarHBondContact O-N 2.64Å; E372-K374 VanDerWaalsContact C-N 3.31Å; E372-K374 PolarHBondContact O-N 2.83Å; E372-K375 WeakPolarHBondContact O-CB 3.28Å; E372-K375 PolarHBondContact O-N 3.01Å; E372-K375 VanDerWaalsContact O-N 3.11Å; E372-K375 IonicContact OE2-NZ 3.43Å; E372-K375 PolarHBondContact OE2-NZ 3.03Å; E372-L376 WeakPolarHBondContact O-CG 3.25Å; E372-L376 PolarHBondContact O-N 2.63Å
373	R	83.1	Confident	82	Confident	135 Å²	135	95.9 Å²	95.9	51%	0.509	50%	0.504	S	S	.	.	H	α-helix	trans	-57.9	-43	171.8	-175.2	179.6	174.5	-176.2	-1.4	112	V369 K375 L376 V377 L382	V369-R373 WeakPolarHBondContact O-CB 3.44Å; V369-R373 PolarHBondContact O-N 3.34Å; R373-K375 VanDerWaalsContact C-N 3.33Å; R373-K375 PolarHBondContact O-N 2.77Å; R373-L376 PolarHBondContact O-N 2.99Å; R373-V377 HydrophobicContact CG-CG2 4.42Å; R373-V377 WeakPolarHBondContact O-CB 3.34Å; R373-V377 WeakPolarHBondContact O-CG2 3.45Å; R373-V377 PolarHBondContact O-N 3.37Å; R373-L382 HydrophobicContact CG-CD2 3.71Å
374	K	84.6	Confident	81.3	Confident	119 Å²	119	99.8 Å²	99.8	52%	0.517	52%	0.52	S	S	.	.	H	α-helix	trans	-62.8	-39.1	176.4	-77.1	170.2	178.1	173.7	0	111.6	G365 S370 M371 E372 A378	G365-K374 PolarHBondContact O-NZ 3.24Å; S370-K374 WeakPolarHBondContact O-CB 3.49Å; S370-K374 VanDerWaalsContact O-CG 3.27Å; S370-K374 WeakPolarHBondContact O-CG 3.21Å; S370-K374 PolarHBondContact O-N 3.1Å; M371-K374 WeakPolarHBondContact O-CB 3.03Å; M371-K374 PolarHBondContact O-N 2.83Å; M371-K374 VanDerWaalsContact O-N 3.15Å; E372-K374 VanDerWaalsContact C-N 3.31Å; E372-K374 PolarHBondContact O-N 2.83Å; K374-A378 WeakPolarHBondContact O-CB 3.47Å; K374-A378 PolarHBondContact O-N 3.37Å
375	K	87.7	Confident	80.6	Confident	116 Å²	116	101.5 Å²	101.5	50%	0.504	53%	0.531	S	S	.	.	H	α-helix	trans	-64.1	-47.2	173.8	-68.7	176.4	-172.2	170	0	112	M371 E372 R373 V377 A378 Q379	M371-K375 WeakPolarHBondContact O-CG 3.22Å; M371-K375 PolarHBondContact O-N 2.84Å; E372-K375 WeakPolarHBondContact O-CB 3.28Å; E372-K375 PolarHBondContact O-N 3.01Å; E372-K375 VanDerWaalsContact O-N 3.11Å; E372-K375 IonicContact OE2-NZ 3.43Å; E372-K375 PolarHBondContact OE2-NZ 3.03Å; R373-K375 VanDerWaalsContact C-N 3.33Å; R373-K375 PolarHBondContact O-N 2.77Å; K375-V377 VanDerWaalsContact C-N 3.33Å; K375-V377 PolarHBondContact O-N 3.18Å; K375-A378 CarbonylContact O-C 3.53Å; K375-A378 WeakPolarHBondContact O-CB 3.06Å; K375-A378 PolarHBondContact O-N 2.77Å; K375-A378 VanDerWaalsContact O-N 3.12Å; K375-Q379 WeakPolarHBondContact O-CG 3.46Å; K375-Q379 PolarHBondContact O-N 3.43Å
376	L	87.8	Confident	79.7	Confident	60 Å²	60	105.1 Å²	105.1	31%	0.314	55%	0.553	S	S	.	*	H	α-helix	trans	-63	-37.6	178	-69.3	171.9	0	0	0	112.6	E372 R373 Q379 G380 L381 L382	E372-L376 WeakPolarHBondContact O-CG 3.25Å; E372-L376 PolarHBondContact O-N 2.63Å; R373-L376 PolarHBondContact O-N 2.99Å; L376-Q379 PolarHBondContact O-N 3.43Å; L376-G380 PolarHBondContact O-N 3.44Å; L376-L381 HydrophobicContact CD2-CB 4.39Å; L376-L381 HydrophobicContact CD2-CD1 3.97Å; L376-L381 PolarHBondContact O-N 3.33Å; L376-L381 VanDerWaalsContact O-N 3.11Å; L376-L382 HydrophobicContact CB-CB 4.25Å; L376-L382 PolarHBondContact O-N 2.91Å
377	V	85.8	Confident	78.3	Confident	44 Å²	44	105 Å²	105	27%	0.267	56%	0.557	S	S	.	*	H	α-helix	trans	-66.2	-41.2	173	172.3	0	0	0	0	110.8	R373 K375 Q379 G380 L382 K384	R373-V377 HydrophobicContact CG-CG2 4.42Å; R373-V377 WeakPolarHBondContact O-CB 3.34Å; R373-V377 WeakPolarHBondContact O-CG2 3.45Å; R373-V377 PolarHBondContact O-N 3.37Å; K375-V377 VanDerWaalsContact C-N 3.33Å; K375-V377 PolarHBondContact O-N 3.18Å; V377-Q379 VanDerWaalsContact C-N 3.31Å; V377-Q379 PolarHBondContact O-N 2.71Å; V377-G380 PolarHBondContact O-N 3.18Å; V377-G380 VanDerWaalsContact O-N 3.12Å; V377-L382 WeakPolarHBondContact CA-O 3.41Å; V377-L382 HydrophobicContact CG2-CB 3.98Å; V377-L382 HydrophobicContact CG2-CD2 3.94Å; V377-L382 HydrophobicContact CG2-CG 4.38Å; V377-K384 HydrophobicContact CG1-CB 4.24Å; V377-K384 HydrophobicContact CG1-CG 4.48Å
378	A	85.5	Confident	76.6	Confident	89 Å²	89	109 Å²	109	74%	0.736	58%	0.579	S	S	*	*	H	α-helix	trans	-66.1	-33.1	176.2	0	0	0	0	0	112.6	K374 K375 G380	K374-A378 WeakPolarHBondContact O-CB 3.47Å; K374-A378 PolarHBondContact O-N 3.37Å; K375-A378 CarbonylContact O-C 3.53Å; K375-A378 WeakPolarHBondContact O-CB 3.06Å; K375-A378 PolarHBondContact O-N 2.77Å; K375-A378 VanDerWaalsContact O-N 3.12Å; A378-G380 PolarHBondContact O-N 3.31Å
379	Q	89.7	Confident	74.5	Confident	125 Å²	125	110.1 Å²	110.1	58%	0.584	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77	-2.6	173.5	-70.2	172.1	-6	0	0	113.4	K375 L376 V377 L381	K375-Q379 WeakPolarHBondContact O-CG 3.46Å; K375-Q379 PolarHBondContact O-N 3.43Å; L376-Q379 PolarHBondContact O-N 3.43Å; V377-Q379 VanDerWaalsContact C-N 3.31Å; V377-Q379 PolarHBondContact O-N 2.71Å; Q379-L381 HydrophobicContact CB-CD1 3.87Å; Q379-L381 HydrophobicContact CB-CG 4.5Å; Q379-L381 PolarHBondContact O-N 3.42Å
380	G	81.4	Confident	72.3	Confident	63 Å²	63	108 Å²	108	65%	0.649	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	74.6	-2.1	-179.8	0	0	0	0	0	115.3	L376 V377 A378 L382	L376-G380 PolarHBondContact O-N 3.44Å; V377-G380 PolarHBondContact O-N 3.18Å; V377-G380 VanDerWaalsContact O-N 3.12Å; A378-G380 PolarHBondContact O-N 3.31Å; G380-L382 PolarHBondContact O-N 3.17Å
381	L	82.8	Confident	70	Confident	128 Å²	128	112 Å²	112	67%	0.67	61%	0.605	S	S	*	*	S	Bend	trans	-68.1	-21.5	177.5	-75.5	149.7	0	0	0	112.6	L376 Q379	L376-L381 HydrophobicContact CD2-CB 4.39Å; L376-L381 HydrophobicContact CD2-CD1 3.97Å; L376-L381 PolarHBondContact O-N 3.33Å; L376-L381 VanDerWaalsContact O-N 3.11Å; Q379-L381 HydrophobicContact CB-CD1 3.87Å; Q379-L381 HydrophobicContact CB-CG 4.5Å; Q379-L381 PolarHBondContact O-N 3.42Å
382	L	77.5	Confident	67.3	Low	75 Å²	75	113 Å²	113	39%	0.393	62%	0.616	S	S	.	*	S	Bend	trans	-131.3	128.4	-178.9	-159.8	81.3	0	0	0	111.2	R373 L376 V377 G380	R373-L382 HydrophobicContact CG-CD2 3.71Å; L376-L382 HydrophobicContact CB-CB 4.25Å; L376-L382 PolarHBondContact O-N 2.91Å; V377-L382 WeakPolarHBondContact CA-O 3.41Å; V377-L382 HydrophobicContact CG2-CB 3.98Å; V377-L382 HydrophobicContact CG2-CD2 3.94Å; V377-L382 HydrophobicContact CG2-CG 4.38Å; G380-L382 PolarHBondContact O-N 3.17Å
383	K	79.8	Confident	64.7	Low	179 Å²	179	117 Å²	117	78%	0.778	64%	0.64	S	S	*	*			trans	-66.1	139.4	173.1	-67.8	-177.2	-179.4	177.2	0	110.5	F385	K383-F385 VanDerWaalsContact C-N 3.3Å; K383-F385 PolarHBondContact O-N 3.06Å
384	K	66.9	Low	61.9	Low	151 Å²	151	116.4 Å²	116.4	66%	0.657	65%	0.652	S	S	*	*	S	Bend	trans	-61.7	-36	-178.3	-168.4	175.3	-178.3	178.5	0	112.9	V377	V377-K384 HydrophobicContact CG1-CB 4.24Å; V377-K384 HydrophobicContact CG1-CG 4.48Å
385	F	64.7	Low	59.3	Low	165 Å²	165	116 Å²	116	72%	0.724	67%	0.665	S	S	*	*	S	Bend	trans	-128.2	115.6	173.8	-57.4	-76.9	0	0	0	107.9	K383 K387	K383-F385 VanDerWaalsContact C-N 3.3Å; K383-F385 PolarHBondContact O-N 3.06Å; F385-K387 PolarHBondContact O-N 3.35Å
386	S	54.9	Low	56.3	Low	104 Å²	104	117.1 Å²	117.1	73%	0.727	68%	0.676	S	S	*	*			trans	-75.5	102.4	165.1	59.1	0	0	0	0	107.2	S388	S386-S388 PolarHBondContact O-N 3.07Å
387	K	45.8	Very low	53.5	Low	172 Å²	172	120.1 Å²	120.1	75%	0.748	70%	0.702	S	S	*	*			trans	-65.9	124	152.2	-80.7	-173.9	174.8	-178.2	0	105.8	F385 D389	F385-K387 PolarHBondContact O-N 3.35Å; K387-D389 PolarHBondContact O-N 3.06Å
388	S	41.1	Very low	50.8	Low	120 Å²	120	123.8 Å²	123.8	84%	0.839	72%	0.724	S	S	*	*			trans	-70.1	67.5	171.4	53	0	0	0	0	108.5	S386 G390	S386-S388 PolarHBondContact O-N 3.07Å; S388-G390 PolarHBondContact O-N 3.09Å
389	D	35.3	Very low	48	Very low	127 Å²	127	122.2 Å²	122.2	68%	0.679	72%	0.716	S	S	*	*			trans	-80.9	107.5	168.3	-63.9	-27.4	0	0	0	105.2	K387 V391	K387-D389 PolarHBondContact O-N 3.06Å; D389-V391 PolarHBondContact O-N 3.29Å
390	G	36	Very low	45	Very low	77 Å²	77	124.3 Å²	124.3	79%	0.794	73%	0.731	S	S	*	*			trans	-57.9	105.6	-168.9	0	0	0	0	0	111.9	S388	S388-G390 PolarHBondContact O-N 3.09Å
391	V	30.5	Very low	42.4	Very low	124 Å²	124	130.8 Å²	130.8	75%	0.752	74%	0.741	S	S	*	*			trans	-147.2	103.4	164.6	-179	0	0	0	0	108.6	D389	D389-V391 PolarHBondContact O-N 3.29Å
392	T	28.2	Very low	39.8	Very low	116 Å²	116	130.5 Å²	130.5	71%	0.712	75%	0.745	S	S	*	*			trans	57.2	111.3	140.1	-18.8	0	0	0	0	119.3	T394	T392-T394 PolarHBondContact O-N 3.47Å
393	N	29.1	Very low	37.3	Very low	167 Å²	167	136.5 Å²	136.5	89%	0.893	77%	0.768	S	S	*	*			trans	-34.6	96.1	158.7	-67.5	-25	0	0	0	112.1
394	T	25.9	Very low	34.7	Very low	123 Å²	123	135.4 Å²	135.4	76%	0.755	77%	0.767	S	S	*	*			trans	-109.3	102	156.6	32.6	0	0	0	0	106.3	T392 N396	T392-T394 PolarHBondContact O-N 3.47Å; T394-N396 VanDerWaalsContact C-N 3.29Å; T394-N396 PolarHBondContact O-N 3.31Å
395	S	29	Very low	32.7	Very low	112 Å²	112	137.5 Å²	137.5	78%	0.783	78%	0.779	S	S	*	*			trans	-55	87	175	49.8	0	0	0	0	110.5
396	N	25.7	Very low	30.9	Very low	138 Å²	138	134.9 Å²	134.9	74%	0.738	78%	0.777	S	S	*	*			trans	-132.3	59.3	166.1	-88.8	-19.3	0	0	0	108.9	T394 V398	T394-N396 VanDerWaalsContact C-N 3.29Å; T394-N396 PolarHBondContact O-N 3.31Å; N396-V398 HydrophobicContact CB-CG2 4.34Å; N396-V398 PolarHBondContact O-N 3.17Å
397	S	28.3	Very low	29.7	Very low	123 Å²	123	135.3 Å²	135.3	86%	0.86	78%	0.78	S	S	*	*			trans	-71.9	72.1	153.1	58	0	0	0	0	107.9	G399	S397-G399 PolarHBondContact O-N 3.28Å
398	V	28	Very low	28.7	Very low	121 Å²	121	136.4 Å²	136.4	73%	0.733	79%	0.788	S	S	*	*			trans	-73	85.4	167.9	-178.2	0	0	0	0	105.9	N396 L400	N396-V398 HydrophobicContact CB-CG2 4.34Å; N396-V398 PolarHBondContact O-N 3.17Å; V398-L400 PolarHBondContact O-N 3.38Å
399	G	28.1	Very low	28.1	Very low	56 Å²	56	135.8 Å²	135.8	58%	0.577	79%	0.789	S	S	*	*			trans	-56.9	119.2	168	0	0	0	0	0	108.1	S397 K401	S397-G399 PolarHBondContact O-N 3.28Å; G399-K401 PolarHBondContact O-N 3.09Å
400	L	26.8	Very low	27.7	Very low	169 Å²	169	133.3 Å²	133.3	89%	0.885	79%	0.794	S	S	*	*			trans	-61.8	82.3	174.7	-160.2	77.1	0	0	0	108.4	V398 T402	V398-L400 PolarHBondContact O-N 3.38Å; L400-T402 PolarHBondContact O-N 2.82Å; L400-T402 VanDerWaalsContact O-N 3.1Å
401	K	27	Very low	27.2	Very low	200 Å²	200	139.2 Å²	139.2	87%	0.87	80%	0.801	S	S	*	*			trans	-74.7	95.3	171	-77.3	-175.5	177.3	-179.6	0	107.3	G399 K403	G399-K401 PolarHBondContact O-N 3.09Å; K401-K403 PolarHBondContact O-N 3.1Å
402	T	27.4	Very low	27.1	Very low	122 Å²	122	137.4 Å²	137.4	75%	0.748	80%	0.799	S	S	*	*			trans	-53.6	117.1	166	-15	0	0	0	0	107.9	L400 M404	L400-T402 PolarHBondContact O-N 2.82Å; L400-T402 VanDerWaalsContact O-N 3.1Å; T402-M404 VanDerWaalsContact C-N 3.33Å; T402-M404 PolarHBondContact O-N 2.98Å
403	K	24.8	Very low	27	Very low	201 Å²	201	138.1 Å²	138.1	87%	0.874	80%	0.803	S	S	*	*			trans	-61.3	95.3	169.2	-79	179.3	170.6	-176.6	0	108	K401	K401-K403 PolarHBondContact O-N 3.1Å
404	M	25	Very low	27	Very low	155 Å²	155	136.4 Å²	136.4	76%	0.764	80%	0.799	S	S	*	*			trans	-92.9	106.5	158.4	-83.7	177.6	67.9	0	0	106.5	T402 V406	T402-M404 VanDerWaalsContact C-N 3.33Å; T402-M404 PolarHBondContact O-N 2.98Å; M404-V406 VanDerWaalsContact C-N 3.34Å; M404-V406 HydrophobicContact CB-CG2 4.07Å; M404-V406 HydrophobicContact CE-CG2 4.44Å; M404-V406 PolarHBondContact O-N 2.85Å
405	E	24.6	Very low	27.1	Very low	195 Å²	195	141.4 Å²	141.4	91%	0.911	80%	0.804	S	S	*	*			trans	-64.6	99	161.4	-69.7	176.9	171.3	0	0	106.6
406	V	28	Very low	27	Very low	111 Å²	111	148 Å²	148	67%	0.673	81%	0.811	S	S	*	*			trans	-97.9	106.3	173.3	-177.5	0	0	0	0	106.2	M404 E408	M404-V406 VanDerWaalsContact C-N 3.34Å; M404-V406 HydrophobicContact CB-CG2 4.07Å; M404-V406 HydrophobicContact CE-CG2 4.44Å; M404-V406 PolarHBondContact O-N 2.85Å; V406-E408 PolarHBondContact O-N 2.93Å
407	S	29	Very low	27.1	Very low	112 Å²	112	149.3 Å²	149.3	78%	0.783	82%	0.817	S	S	*	*			trans	-59.8	129.2	168.3	51.2	0	0	0	0	109.7	A409	S407-A409 PolarHBondContact O-N 3.35Å
408	E	26	Very low	27	Very low	196 Å²	196	153.1 Å²	153.1	92%	0.916	82%	0.818	S	S	*	*			trans	-56.3	120	177.9	-62.2	172	153	0	0	111.5	V406	V406-E408 PolarHBondContact O-N 2.93Å
409	A	27.1	Very low	27	Very low	106 Å²	106	151.5 Å²	151.5	88%	0.876	82%	0.817	S	S	*	*			trans	-173.3	123.5	149.1	0	0	0	0	0	111.1	S407	S407-A409 PolarHBondContact O-N 3.35Å
410	G	27.9	Very low	27.2	Very low	76 Å²	76	154.7 Å²	154.7	78%	0.784	83%	0.828	S	S	*	*			trans	112.8	80.9	152.8	0	0	0	0	0	116	A412	G410-A412 PolarHBondContact O-N 2.9Å
411	E	24.7	Very low	27.2	Very low	200 Å²	200	154 Å²	154	94%	0.935	83%	0.825	S	S	*	*			trans	-55.5	117.7	162.5	-70.3	175.9	134.4	0	0	111.1
412	A	28.4	Very low	27.4	Very low	87 Å²	87	150.8 Å²	150.8	72%	0.719	82%	0.824	S	S	*	*			trans	-122.1	93.9	166.5	0	0	0	0	0	109.4	G410 T414	G410-A412 PolarHBondContact O-N 2.9Å; A412-T414 PolarHBondContact O-N 3.19Å; A412-T414 VanDerWaalsContact O-N 3.07Å
413	V	25.7	Very low	27.5	Very low	130 Å²	130	149.6 Å²	149.6	79%	0.788	82%	0.821	S	S	*	*			trans	-59.3	103.8	174.3	177.3	0	0	0	0	109.6
414	T	29.2	Very low	27.5	Very low	131 Å²	131	147.4 Å²	147.4	80%	0.804	82%	0.819	S	S	*	*			trans	-111	108.4	169	32.8	0	0	0	0	109.8	A412 R416	A412-T414 PolarHBondContact O-N 3.19Å; A412-T414 VanDerWaalsContact O-N 3.07Å; T414-R416 PolarHBondContact O-N 2.84Å
415	R	28.2	Very low	27.8	Very low	229 Å²	229	145.4 Å²	145.4	86%	0.864	82%	0.82	S	S	*	*			trans	-64.6	123.4	-179	-72.5	176.5	174.6	170.4	-1.9	110.4	I417	R415-I417 PolarHBondContact O-N 2.97Å
416	R	27.4	Very low	27.9	Very low	249 Å²	249	140.9 Å²	140.9	94%	0.94	81%	0.81	S	S	*	*			trans	-62.1	117.3	171.8	-79.6	176.1	171.1	171.4	-3.4	110.7	T414	T414-R416 PolarHBondContact O-N 2.84Å
417	I	28.2	Very low	28	Very low	167 Å²	167	143.3 Å²	143.3	86%	0.856	82%	0.82	S	S	*	*			trans	-87.3	113.4	163.4	-60.6	175	0	0	0	106.9	R415 A419	R415-I417 PolarHBondContact O-N 2.97Å; I417-A419 PolarHBondContact O-N 3.25Å
418	K	24.9	Very low	28	Very low	203 Å²	203	145.4 Å²	145.4	88%	0.883	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-71.5	117.1	172.6	-94.1	179.2	170.5	179.5	0	109
419	A	28.7	Very low	28	Very low	87 Å²	87	145 Å²	145	72%	0.719	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-83.6	143.5	164.6	0	0	0	0	0	109.8	I417	I417-A419 PolarHBondContact O-N 3.25Å
420	P	32	Very low	28.1	Very low	123 Å²	123	149.1 Å²	149.1	80%	0.799	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-84.4	143.5	-174	32.9	-31.8	0	0	0	112.4
421	N	27	Very low	28.2	Very low	155 Å²	155	150.1 Å²	150.1	83%	0.829	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-64.9	128.8	177.6	-70	-16.5	0	0	0	111.6
422	P	31.4	Very low	28.5	Very low	131 Å²	131	146.1 Å²	146.1	85%	0.851	82%	0.818	S	S	*	*			trans	-87.6	105.7	156.4	16	1.2	0	0	0	108.5
423	S	28.5	Very low	28.7	Very low	97 Å²	97	151.3 Å²	151.3	68%	0.678	83%	0.825	S	S	*	*			trans	-76.5	144.9	167.1	47.9	0	0	0	0	111.2
424	D	26.3	Very low	28.8	Very low	156 Å²	156	152.6 Å²	152.6	83%	0.834	83%	0.827	S	S	*	*			trans	60.7	99.6	152.7	-62.1	-19.6	0	0	0	119.8
425	S	30.9	Very low	28.9	Very low	112 Å²	112	153.5 Å²	153.5	78%	0.783	83%	0.826	S	S	*	*			trans	-140.7	91.6	139.3	63.4	0	0	0	0	108.5
426	S	25.6	Very low	29	Very low	101 Å²	101	149.8 Å²	149.8	71%	0.706	82%	0.824	S	S	*	*			trans	-60.4	123.7	159.5	48.8	0	0	0	0	109.4
427	D	31.2	Very low	29.3	Very low	162 Å²	162	144.8 Å²	144.8	87%	0.866	82%	0.816	S	S	*	*			trans	-139.6	124	158.3	-88.8	-35.3	0	0	0	108.8
428	D	29.4	Very low	29.5	Very low	155 Å²	155	145.9 Å²	145.9	83%	0.829	82%	0.817	S	S	*	*			trans	-71.6	159.3	-161.7	-76.6	-51.8	0	0	0	115.4
429	E	26	Very low	30	Very low	189 Å²	189	144 Å²	144	88%	0.883	82%	0.816	S	S	*	*			trans	-42.2	128	169.1	-61.6	175.9	143.1	0	0	114.3
430	M	28.3	Very low	30.1	Very low	192 Å²	192	143.4 Å²	143.4	95%	0.946	82%	0.818	S	S	*	*			trans	-115.5	101.1	149.9	-98.7	-154	-141.4	0	0	109.5	S432	M430-S432 PolarHBondContact O-N 3.03Å
431	A	30.4	Very low	30.1	Very low	97 Å²	97	146.7 Å²	146.7	80%	0.802	82%	0.823	S	S	*	*			trans	-63.8	106.7	168.2	0	0	0	0	0	110.8	K433	A431-K433 PolarHBondContact O-N 3.08Å
432	S	31.7	Very low	30.4	Very low	115 Å²	115	147 Å²	147	80%	0.804	83%	0.825	S	S	*	*			trans	-82.2	101.3	167.2	47.5	0	0	0	0	109.7	M430 N434	M430-S432 PolarHBondContact O-N 3.03Å; S432-N434 PolarHBondContact O-N 3.41Å
433	K	31.3	Very low	30.6	Very low	196 Å²	196	146.9 Å²	146.9	85%	0.852	82%	0.822	S	S	*	*			trans	-60.2	130.3	170.9	-81.1	176.3	173.8	174.5	0	110.6	A431 L435	A431-K433 PolarHBondContact O-N 3.08Å; K433-L435 PolarHBondContact O-N 3.42Å
434	N	28.7	Very low	30.7	Very low	157 Å²	157	146 Å²	146	84%	0.84	83%	0.829	S	S	*	*			trans	-56.1	115.7	168.5	-73.1	-32	0	0	0	110.5	S432	S432-N434 PolarHBondContact O-N 3.41Å
435	L	31.3	Very low	31.1	Very low	151 Å²	151	143.3 Å²	143.3	79%	0.791	83%	0.828	S	S	*	*			trans	-90.6	106.1	162	-79.3	156.5	0	0	0	107.1	K433 D437	K433-L435 PolarHBondContact O-N 3.42Å; L435-D437 PolarHBondContact O-N 3.24Å
436	N	30.6	Very low	31.1	Very low	151 Å²	151	147.2 Å²	147.2	81%	0.807	83%	0.834	S	S	*	*			trans	-77.1	100	164.2	-77.4	-18.6	0	0	0	107.1	H438	N436-H438 PolarHBondContact O-N 2.9Å
437	D	32.4	Very low	31.5	Very low	144 Å²	144	151.6 Å²	151.6	77%	0.77	84%	0.843	S	S	*	*			trans	-80.8	117.2	170.3	-76	-31.9	0	0	0	109	L435	L435-D437 PolarHBondContact O-N 3.24Å
438	H	33.8	Very low	31.8	Very low	189 Å²	189	149.7 Å²	149.7	88%	0.875	84%	0.842	S	S	*	*			trans	-60.4	125.8	174.5	-97.8	-79.8	0	0	0	111	N436 G440	N436-H438 PolarHBondContact O-N 2.9Å; H438-G440 PolarHBondContact O-N 3.33Å
439	D	34	Very low	32.2	Very low	164 Å²	164	147 Å²	147	88%	0.877	84%	0.836	S	S	*	*			trans	-61.7	110.9	166.6	-73	-46.7	0	0	0	109.8
440	G	31.9	Very low	32.8	Very low	74 Å²	74	143.2 Å²	143.2	76%	0.763	83%	0.83	S	S	*	*			trans	-74.2	124.8	174.3	0	0	0	0	0	111.2	H438 D442	H438-G440 PolarHBondContact O-N 3.33Å; G440-D442 PolarHBondContact O-N 3.37Å
441	Q	31.4	Very low	33.5	Very low	192 Å²	192	141.1 Å²	141.1	90%	0.897	82%	0.823	S	S	*	*			trans	-68.2	118.3	168.2	-73.9	172	-28.3	0	0	109.4
442	D	33.2	Very low	33.6	Very low	162 Å²	162	143.9 Å²	143.9	87%	0.866	82%	0.824	S	S	*	*			trans	-88.4	112.9	174.5	-155.8	3.9	0	0	0	108.8	G440 G444	G440-D442 PolarHBondContact O-N 3.37Å; D442-G444 PolarHBondContact O-N 2.84Å
443	T	35.1	Very low	33.8	Very low	128 Å²	128	143.7 Å²	143.7	79%	0.785	82%	0.822	S	S	*	*			trans	-78.6	104.9	177.7	48.1	0	0	0	0	109.2	A445	T443-A445 PolarHBondContact O-N 3.06Å
444	G	31.3	Very low	34.4	Very low	80 Å²	80	146.1 Å²	146.1	83%	0.825	85%	0.845	S	S	*	*			trans	-69.7	114.9	172.6	0	0	0	0	0	111	D442	D442-G444 PolarHBondContact O-N 2.84Å
445	A	34.8	Very low	34.7	Very low	98 Å²	98	145.6 Å²	145.6	81%	0.81	85%	0.845	S	S	*	*			trans	-74.5	138	175.1	0	0	0	0	0	111.3	T443	T443-A445 PolarHBondContact O-N 3.06Å
446	E	30.8	Very low	34.9	Very low	195 Å²	195	145.3 Å²	145.3	91%	0.911	85%	0.848	S	S	*	*			trans	-69.7	119.3	175.6	-63.1	170.9	156	0	0	110.1
447	E	34.2	Very low	35.1	Very low	193 Å²	193	144.9 Å²	144.9	90%	0.902	85%	0.85	S	S	*	*			trans	-103.8	109	163.3	-82	-175.1	167.5	0	0	108.5	S449	E447-S449 PolarHBondContact O-N 3.41Å
448	S	37	Very low	35.3	Very low	121 Å²	121	145 Å²	145	85%	0.846	86%	0.855	S	S	*	*			trans	-65.4	111.7	175.4	52.1	0	0	0	0	111.1
449	S	37.9	Very low	35.3	Very low	100 Å²	100	142.3 Å²	142.3	70%	0.699	85%	0.854	S	S	*	*			trans	-86.1	113.3	163	53.5	0	0	0	0	109.1	E447 D451	E447-S449 PolarHBondContact O-N 3.41Å; S449-D451 PolarHBondContact O-N 3.32Å
450	S	38.3	Very low	35.4	Very low	109 Å²	109	140.8 Å²	140.8	76%	0.762	85%	0.852	S	S	*	*			trans	-71	107.5	168.3	49	0	0	0	0	109.4
451	D	43.6	Very low	35.7	Very low	148 Å²	148	145.6 Å²	145.6	79%	0.791	86%	0.858	S	S	*	*			trans	-82	108.6	168.1	-78.2	-31.8	0	0	0	109	S449	S449-D451 PolarHBondContact O-N 3.32Å
452	D	33.1	Very low	36	Very low	154 Å²	154	142 Å²	142	82%	0.824	86%	0.855	S	S	*	*			trans	-83.7	107.4	162.7	-80.8	-37.5	0	0	0	108.1
453	S	35	Very low	36.3	Very low	111 Å²	111	140.3 Å²	140.3	78%	0.776	85%	0.854	S	S	*	*			trans	-163.9	112.5	162.7	-58.6	0	0	0	0	110.4
454	D	43.9	Very low	36.4	Very low	247 Å²	247	141.5 Å²	141.5	100%	1.321	86%	0.861	S	S	*	*			trans	55	0	164.8	-64.8	-20	0	0	0	121.1

Retrieved 454 of 454 residues in 254.1 ms (Link to these results)

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