A0A087YFB5_POEFO Loading...

Angiopoietin 4

AlphaFold DB , UniProt , Accession A0A087YFB5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 407 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	Q	60.5	Low	66.8	Low	227 Å²	227	138.3 Å²	138.3	100%	1.061	65%	0.654	S	S	*	*				0	-33.5	0	-83.5	178.4	-12.5	0	0	113.1
2	L	59.9	Low	67.1	Low	133 Å²	133	141.7 Å²	141.7	70%	0.696	66%	0.656	S	S	*	*	H	α-helix	trans	-67.9	-39.9	179.1	-166.6	66	0	0	0	114.3	N4 F5 I6	L2-N4 PolarHBondContact O-N 3.1Å; L2-F5 PolarHBondContact O-N 3.44Å; L2-F5 VanDerWaalsContact O-N 3.15Å; L2-I6 HydrophobicContact CG-CD1 4.07Å; L2-I6 WeakPolarHBondContact O-CG1 3.4Å; L2-I6 PolarHBondContact O-N 2.94Å; L2-I6 VanDerWaalsContact O-N 3.12Å
3	E	63.7	Low	67.3	Low	165 Å²	165	136.8 Å²	136.8	77%	0.771	64%	0.638	S	S	*	*	H	α-helix	trans	-59.8	-43.4	-179	-123.4	173.8	171.5	0	0	113.5	F5 I6 Q7	E3-F5 VanDerWaalsContact C-N 3.27Å; E3-F5 PolarHBondContact O-N 3.37Å; E3-I6 PolarHBondContact O-N 3.49Å; E3-Q7 WeakPolarHBondContact O-CB 3.48Å; E3-Q7 PolarHBondContact O-N 2.8Å
4	N	66.4	Low	67.4	Low	119 Å²	119	130.7 Å²	130.7	64%	0.636	62%	0.623	S	S	*	*	H	α-helix	trans	-66.2	-28.4	177.5	-90	-20.5	0	0	0	113.1	L2 K8	L2-N4 PolarHBondContact O-N 3.1Å; N4-K8 WeakPolarHBondContact O-CB 3.27Å; N4-K8 PolarHBondContact O-N 3.27Å
5	F	68.7	Low	67.6	Low	159 Å²	159	125.7 Å²	125.7	70%	0.697	61%	0.611	S	S	*	*	H	α-helix	trans	-76.1	-42.6	177.2	-160.9	-90.6	0	0	0	110.9	L2 E3 K8 S9	L2-F5 PolarHBondContact O-N 3.44Å; L2-F5 VanDerWaalsContact O-N 3.15Å; E3-F5 VanDerWaalsContact C-N 3.27Å; E3-F5 PolarHBondContact O-N 3.37Å; F5-K8 PolarHBondContact O-N 2.91Å; F5-S9 PolarHBondContact O-N 3.34Å
6	I	66.2	Low	67.8	Low	86 Å²	86	124.6 Å²	124.6	44%	0.441	61%	0.61	S	S	.	*	H	α-helix	trans	-61.8	-45.3	175.4	-66.2	170.9	0	0	0	110.4	L2 E3 K8 S9 I10	L2-I6 HydrophobicContact CG-CD1 4.07Å; L2-I6 WeakPolarHBondContact O-CG1 3.4Å; L2-I6 PolarHBondContact O-N 2.94Å; L2-I6 VanDerWaalsContact O-N 3.12Å; E3-I6 PolarHBondContact O-N 3.49Å; I6-K8 PolarHBondContact O-N 3.01Å; I6-S9 PolarHBondContact O-N 2.91Å; I6-I10 HydrophobicContact CG2-CD1 3.59Å; I6-I10 HydrophobicContact CG2-CG1 4.31Å; I6-I10 WeakPolarHBondContact O-CB 3.3Å; I6-I10 VanDerWaalsContact O-CG1 3.28Å; I6-I10 WeakPolarHBondContact O-CG1 3.08Å; I6-I10 PolarHBondContact O-N 2.91Å
7	Q	68.6	Low	67.9	Low	123 Å²	123	123.9 Å²	123.9	58%	0.575	61%	0.608	S	S	*	*	H	α-helix	trans	-67.2	-33.7	-179.1	-154.9	175.2	19.1	0	0	113	E3 R11	E3-Q7 WeakPolarHBondContact O-CB 3.48Å; E3-Q7 PolarHBondContact O-N 2.8Å; Q7-R11 WeakPolarHBondContact O-CB 3.42Å; Q7-R11 PolarHBondContact O-N 3.18Å; Q7-R11 VanDerWaalsContact O-N 3.13Å
8	K	70.6	Confident	68.1	Low	154 Å²	154	124.7 Å²	124.7	67%	0.67	61%	0.61	S	S	*	*	H	α-helix	trans	-71.7	-38.2	172.5	-101.2	-177.7	175.8	177	0	112.8	N4 F5 I6 R12	N4-K8 WeakPolarHBondContact O-CB 3.27Å; N4-K8 PolarHBondContact O-N 3.27Å; F5-K8 PolarHBondContact O-N 2.91Å; I6-K8 PolarHBondContact O-N 3.01Å; K8-R12 PolarHBondContact O-N 2.79Å; K8-R12 VanDerWaalsContact O-N 3.09Å
9	S	69	Low	68.3	Low	52 Å²	52	121.2 Å²	121.2	36%	0.364	60%	0.599	S	S	.	*	H	α-helix	trans	-64	-51.3	175	-164.2	0	0	0	0	110.3	F5 I6 R11 R12 D13	F5-S9 PolarHBondContact O-N 3.34Å; I6-S9 PolarHBondContact O-N 2.91Å; S9-R11 VanDerWaalsContact C-N 3.3Å; S9-R11 PolarHBondContact O-N 3.24Å; S9-R12 CarbonylContact O-C 3.59Å; S9-R12 WeakPolarHBondContact O-CA 3.47Å; S9-R12 WeakPolarHBondContact O-CB 3.35Å; S9-R12 PolarHBondContact O-N 3.17Å; S9-D13 VanDerWaalsContact O-CG 3.26Å; S9-D13 PolarHBondContact O-N 3.33Å; S9-D13 VanDerWaalsContact O-OD2 3.13Å; S9-D13 PolarHBondContact OG-OD2 3.27Å
10	I	69.9	Low	68.6	Low	106 Å²	106	121.8 Å²	121.8	54%	0.544	60%	0.6	S	S	.	*	H	α-helix	trans	-59.5	-39.3	179.9	-66.8	170.7	0	0	0	111.5	I6 D13 A14	I6-I10 HydrophobicContact CG2-CD1 3.59Å; I6-I10 HydrophobicContact CG2-CG1 4.31Å; I6-I10 WeakPolarHBondContact O-CB 3.3Å; I6-I10 VanDerWaalsContact O-CG1 3.28Å; I6-I10 WeakPolarHBondContact O-CG1 3.08Å; I6-I10 PolarHBondContact O-N 2.91Å; I10-D13 PolarHBondContact O-N 2.85Å; I10-A14 WeakPolarHBondContact O-CB 3.5Å; I10-A14 PolarHBondContact O-N 3.02Å
11	R	71	Confident	68.8	Low	197 Å²	197	119.4 Å²	119.4	74%	0.743	59%	0.592	S	S	*	*	H	α-helix	trans	-65.9	-38.5	174.1	-93.5	-173.4	173.5	-178.7	-0.4	113.2	Q7 S9 A15	Q7-R11 WeakPolarHBondContact O-CB 3.42Å; Q7-R11 PolarHBondContact O-N 3.18Å; Q7-R11 VanDerWaalsContact O-N 3.13Å; S9-R11 VanDerWaalsContact C-N 3.3Å; S9-R11 PolarHBondContact O-N 3.24Å; R11-A15 VanDerWaalsContact O-CB 3.26Å; R11-A15 WeakPolarHBondContact O-CB 3.43Å; R11-A15 PolarHBondContact O-N 3.28Å
12	R	71.1	Confident	69.5	Low	179 Å²	179	112 Å²	112	68%	0.675	56%	0.562	S	S	*	*	H	α-helix	trans	-68.6	-42.3	175.1	-82.9	-178.6	178.1	169.2	-2.2	111.5	K8 S9 A15 N16	K8-R12 PolarHBondContact O-N 2.79Å; K8-R12 VanDerWaalsContact O-N 3.09Å; S9-R12 CarbonylContact O-C 3.59Å; S9-R12 WeakPolarHBondContact O-CA 3.47Å; S9-R12 WeakPolarHBondContact O-CB 3.35Å; S9-R12 PolarHBondContact O-N 3.17Å; R12-A15 PolarHBondContact O-N 3.48Å; R12-N16 WeakPolarHBondContact O-CB 3.24Å; R12-N16 VanDerWaalsContact O-CG 3.29Å; R12-N16 PolarHBondContact O-N 3.26Å
13	D	69.2	Low	70.2	Confident	79 Å²	79	110.6 Å²	110.6	42%	0.422	56%	0.555	S	S	.	*	H	α-helix	trans	-66.8	-42	178.3	-63.7	-32.3	0	0	0	110.7	S9 I10 N16 I17	S9-D13 VanDerWaalsContact O-CG 3.26Å; S9-D13 PolarHBondContact O-N 3.33Å; S9-D13 VanDerWaalsContact O-OD2 3.13Å; S9-D13 PolarHBondContact OG-OD2 3.27Å; I10-D13 PolarHBondContact O-N 2.85Å; D13-N16 PolarHBondContact O-N 2.86Å; D13-I17 WeakPolarHBondContact O-CB 3.36Å; D13-I17 WeakPolarHBondContact O-CD1 3.3Å; D13-I17 WeakPolarHBondContact O-CG1 3.5Å; D13-I17 PolarHBondContact O-N 3.33Å
14	A	69.4	Low	70.9	Confident	51 Å²	51	107.2 Å²	107.2	42%	0.421	54%	0.543	S	S	.	.	H	α-helix	trans	-63.6	-41.9	173.1	0	0	0	0	0	112.6	I10 I17 Q18	I10-A14 WeakPolarHBondContact O-CB 3.5Å; I10-A14 PolarHBondContact O-N 3.02Å; A14-I17 PolarHBondContact O-N 3.48Å; A14-Q18 VanDerWaalsContact O-CB 3.28Å; A14-Q18 WeakPolarHBondContact O-CB 3.44Å; A14-Q18 PolarHBondContact O-N 3.34Å
15	A	70.5	Confident	71.5	Confident	55 Å²	55	107.3 Å²	107.3	46%	0.455	54%	0.539	S	S	.	.	H	α-helix	trans	-66.4	-38.3	175.8	0	0	0	0	0	112.3	R11 R12 S19	R11-A15 VanDerWaalsContact O-CB 3.26Å; R11-A15 WeakPolarHBondContact O-CB 3.43Å; R11-A15 PolarHBondContact O-N 3.28Å; R12-A15 PolarHBondContact O-N 3.48Å; A15-S19 VanDerWaalsContact O-CB 3.31Å; A15-S19 WeakPolarHBondContact O-CB 3.35Å; A15-S19 PolarHBondContact O-N 3.48Å
16	N	69.5	Low	72.1	Confident	109 Å²	109	103 Å²	103	58%	0.583	53%	0.526	S	S	*	.	H	α-helix	trans	-68.1	-42.4	175.2	-78.5	-13.9	0	0	0	111.7	R12 D13 S19 H20	R12-N16 WeakPolarHBondContact O-CB 3.24Å; R12-N16 VanDerWaalsContact O-CG 3.29Å; R12-N16 PolarHBondContact O-N 3.26Å; D13-N16 PolarHBondContact O-N 2.86Å; N16-S19 PolarHBondContact O-N 2.88Å; N16-H20 VanDerWaalsContact O-CB 3.25Å; N16-H20 WeakPolarHBondContact O-CB 3.45Å; N16-H20 PolarHBondContact O-N 3.17Å
17	I	70.5	Confident	72.7	Confident	112 Å²	112	101.4 Å²	101.4	57%	0.574	53%	0.526	S	S	*	.	H	α-helix	trans	-62.5	-46.1	174.8	-70.5	164.8	0	0	0	110	D13 A14 H20 V21	D13-I17 WeakPolarHBondContact O-CB 3.36Å; D13-I17 WeakPolarHBondContact O-CD1 3.3Å; D13-I17 WeakPolarHBondContact O-CG1 3.5Å; D13-I17 PolarHBondContact O-N 3.33Å; A14-I17 PolarHBondContact O-N 3.48Å; I17-H20 PolarHBondContact O-N 3.37Å; I17-V21 HydrophobicContact CG2-CG2 4.41Å; I17-V21 WeakPolarHBondContact O-CB 3.48Å; I17-V21 VanDerWaalsContact O-CG2 3.26Å; I17-V21 WeakPolarHBondContact O-CG2 3.11Å; I17-V21 PolarHBondContact O-N 3.1Å
18	Q	71.3	Confident	73.4	Confident	138 Å²	138	98.5 Å²	98.5	65%	0.645	52%	0.516	S	S	*	.	H	α-helix	trans	-65.3	-41.7	179.2	-167.6	158.1	1.8	0	0	111.9	A14 V21 V22	A14-Q18 VanDerWaalsContact O-CB 3.28Å; A14-Q18 WeakPolarHBondContact O-CB 3.44Å; A14-Q18 PolarHBondContact O-N 3.34Å; Q18-V21 PolarHBondContact O-N 2.96Å; Q18-V22 WeakPolarHBondContact O-CB 3.22Å; Q18-V22 VanDerWaalsContact O-CG2 3.22Å; Q18-V22 WeakPolarHBondContact O-CG2 3.25Å; Q18-V22 PolarHBondContact O-N 3.28Å
19	S	72.4	Confident	74	Confident	58 Å²	58	98 Å²	98	41%	0.406	52%	0.518	S	S	.	.	H	α-helix	trans	-63.6	-39.7	173.1	-179.8	0	0	0	0	112.4	A15 N16 V22 N23	A15-S19 VanDerWaalsContact O-CB 3.31Å; A15-S19 WeakPolarHBondContact O-CB 3.35Å; A15-S19 PolarHBondContact O-N 3.48Å; N16-S19 PolarHBondContact O-N 2.88Å; S19-V22 PolarHBondContact O-N 3.45Å; S19-N23 VanDerWaalsContact O-CB 3.3Å; S19-N23 WeakPolarHBondContact O-CB 3.23Å; S19-N23 PolarHBondContact O-N 2.83Å; S19-N23 PolarHBondContact O-ND2 3.36Å
20	H	73.6	Confident	74.7	Confident	134 Å²	134	101 Å²	101	62%	0.62	53%	0.53	S	S	*	.	H	α-helix	trans	-68.9	-39	178.7	-167.8	-76.1	0	0	0	111.8	N16 I17 N24	N16-H20 VanDerWaalsContact O-CB 3.25Å; N16-H20 WeakPolarHBondContact O-CB 3.45Å; N16-H20 PolarHBondContact O-N 3.17Å; I17-H20 PolarHBondContact O-N 3.37Å; H20-N24 VanDerWaalsContact O-CB 3.24Å; H20-N24 WeakPolarHBondContact O-CB 3.3Å; H20-N24 PolarHBondContact O-N 3.45Å
21	V	72.6	Confident	75.5	Confident	72 Å²	72	101.7 Å²	101.7	44%	0.436	53%	0.53	S	S	.	.	H	α-helix	trans	-64.2	-45.8	173.8	171.4	0	0	0	0	110.7	I17 Q18 N24 Q25	I17-V21 HydrophobicContact CG2-CG2 4.41Å; I17-V21 WeakPolarHBondContact O-CB 3.48Å; I17-V21 VanDerWaalsContact O-CG2 3.26Å; I17-V21 WeakPolarHBondContact O-CG2 3.11Å; I17-V21 PolarHBondContact O-N 3.1Å; Q18-V21 PolarHBondContact O-N 2.96Å; V21-N24 PolarHBondContact O-N 3.15Å; V21-Q25 HydrophobicContact CG1-CG 4.49Å; V21-Q25 WeakPolarHBondContact O-CB 3.25Å; V21-Q25 WeakPolarHBondContact O-CG 3.43Å; V21-Q25 PolarHBondContact O-N 3.47Å
22	V	74.5	Confident	76.4	Confident	72 Å²	72	97.8 Å²	97.8	44%	0.436	52%	0.523	S	S	.	.	H	α-helix	trans	-63	-44.7	177	171	0	0	0	0	111.2	Q18 S19 N24 Q25 T26	Q18-V22 WeakPolarHBondContact O-CB 3.22Å; Q18-V22 VanDerWaalsContact O-CG2 3.22Å; Q18-V22 WeakPolarHBondContact O-CG2 3.25Å; Q18-V22 PolarHBondContact O-N 3.28Å; S19-V22 PolarHBondContact O-N 3.45Å; V22-N24 PolarHBondContact O-N 3.37Å; V22-Q25 PolarHBondContact O-N 3.49Å; V22-T26 WeakPolarHBondContact O-CB 3.41Å; V22-T26 PolarHBondContact O-N 3.49Å; V22-T26 PolarHBondContact O-OG1 2.96Å
23	N	75.5	Confident	77.2	Confident	102 Å²	102	90.7 Å²	90.7	55%	0.545	51%	0.505	S	S	.	.	H	α-helix	trans	-63.8	-40.4	178.1	-72	-14.1	0	0	0	111.8	S19 T26 A27	S19-N23 VanDerWaalsContact O-CB 3.3Å; S19-N23 WeakPolarHBondContact O-CB 3.23Å; S19-N23 PolarHBondContact O-N 2.83Å; S19-N23 PolarHBondContact O-ND2 3.36Å; N23-T26 PolarHBondContact O-N 3.48Å; N23-A27 WeakPolarHBondContact O-CB 3.49Å; N23-A27 PolarHBondContact O-N 2.9Å
24	N	78	Confident	78.1	Confident	95 Å²	95	90.7 Å²	90.7	51%	0.508	51%	0.509	S	S	.	.	H	α-helix	trans	-69.6	-40.2	177.9	-166.2	21.8	0	0	0	112.2	H20 V21 V22 T26 A27 T28	H20-N24 VanDerWaalsContact O-CB 3.24Å; H20-N24 WeakPolarHBondContact O-CB 3.3Å; H20-N24 PolarHBondContact O-N 3.45Å; V21-N24 PolarHBondContact O-N 3.15Å; V22-N24 PolarHBondContact O-N 3.37Å; N24-T26 VanDerWaalsContact C-N 3.31Å; N24-T26 PolarHBondContact O-N 3.01Å; N24-A27 PolarHBondContact O-N 3.47Å; N24-T28 WeakPolarHBondContact O-CG2 3.23Å; N24-T28 PolarHBondContact O-N 2.89Å; N24-T28 PolarHBondContact O-OG1 3.25Å
25	Q	79.1	Confident	79.1	Confident	121 Å²	121	92.4 Å²	92.4	57%	0.565	51%	0.511	S	S	*	.	H	α-helix	trans	-64.3	-36.3	172.3	-75.6	179.8	-21.5	0	0	112	V21 V22 T28 M29	V21-Q25 HydrophobicContact CG1-CG 4.49Å; V21-Q25 WeakPolarHBondContact O-CB 3.25Å; V21-Q25 WeakPolarHBondContact O-CG 3.43Å; V21-Q25 PolarHBondContact O-N 3.47Å; V22-Q25 PolarHBondContact O-N 3.49Å; Q25-T28 WeakPolarHBondContact CA-OG1 3.42Å; Q25-T28 PolarHBondContact O-OG1 3.3Å; Q25-M29 WeakPolarHBondContact O-CB 3.38Å; Q25-M29 WeakPolarHBondContact O-CG 3.37Å; Q25-M29 PolarHBondContact O-N 3.01Å
26	T	80.9	Confident	80.2	Confident	68 Å²	68	94.8 Å²	94.8	42%	0.417	52%	0.515	S	S	.	.	H	α-helix	trans	-69.5	-41.7	176.7	-51.4	0	0	0	0	111.2	V22 N23 N24 M29 L30	V22-T26 WeakPolarHBondContact O-CB 3.41Å; V22-T26 PolarHBondContact O-N 3.49Å; V22-T26 PolarHBondContact O-OG1 2.96Å; N23-T26 PolarHBondContact O-N 3.48Å; N24-T26 VanDerWaalsContact C-N 3.31Å; N24-T26 PolarHBondContact O-N 3.01Å; T26-M29 PolarHBondContact O-N 3.19Å; T26-L30 HydrophobicContact CG2-CD1 4.21Å; T26-L30 WeakPolarHBondContact O-CB 3.26Å; T26-L30 VanDerWaalsContact O-CG 3.3Å; T26-L30 WeakPolarHBondContact O-CG 3.21Å; T26-L30 PolarHBondContact O-N 2.93Å
27	A	80.3	Confident	81.2	Confident	53 Å²	53	95.4 Å²	95.4	44%	0.438	52%	0.518	S	S	.	.	H	α-helix	trans	-62.9	-45	176.1	0	0	0	0	0	112.1	N23 N24 L30 E31	N23-A27 WeakPolarHBondContact O-CB 3.49Å; N23-A27 PolarHBondContact O-N 2.9Å; N24-A27 PolarHBondContact O-N 3.47Å; A27-L30 PolarHBondContact O-N 2.77Å; A27-E31 WeakPolarHBondContact O-CB 3.37Å; A27-E31 PolarHBondContact O-N 3.46Å
28	T	81.9	Confident	82.2	Confident	61 Å²	61	93.9 Å²	93.9	37%	0.374	52%	0.517	S	S	.	.	H	α-helix	trans	-65.8	-39.2	176.5	50.3	0	0	0	0	112.2	N24 Q25 E31 I32	N24-T28 WeakPolarHBondContact O-CG2 3.23Å; N24-T28 PolarHBondContact O-N 2.89Å; N24-T28 PolarHBondContact O-OG1 3.25Å; Q25-T28 WeakPolarHBondContact CA-OG1 3.42Å; Q25-T28 PolarHBondContact O-OG1 3.3Å; T28-E31 PolarHBondContact O-N 2.99Å; T28-I32 VanDerWaalsContact O-CG1 3.27Å; T28-I32 WeakPolarHBondContact O-CG1 3.36Å; T28-I32 PolarHBondContact O-N 3.11Å
29	M	83	Confident	83.2	Confident	144 Å²	144	93.3 Å²	93.3	71%	0.709	51%	0.514	S	S	*	.	H	α-helix	trans	-63.7	-39.9	172.8	-81	-128	-69.9	0	0	113.2	Q25 T26 G33	Q25-M29 WeakPolarHBondContact O-CB 3.38Å; Q25-M29 WeakPolarHBondContact O-CG 3.37Å; Q25-M29 PolarHBondContact O-N 3.01Å; T26-M29 PolarHBondContact O-N 3.19Å; M29-G33 PolarHBondContact O-N 2.79Å
30	L	84.7	Confident	84.2	Confident	116 Å²	116	93.6 Å²	93.6	61%	0.607	51%	0.514	S	S	*	.	H	α-helix	trans	-66.1	-41.7	175.5	-74.8	168.5	0	0	0	111.6	T26 A27 G33 T34	T26-L30 HydrophobicContact CG2-CD1 4.21Å; T26-L30 WeakPolarHBondContact O-CB 3.26Å; T26-L30 VanDerWaalsContact O-CG 3.3Å; T26-L30 WeakPolarHBondContact O-CG 3.21Å; T26-L30 PolarHBondContact O-N 2.93Å; A27-L30 PolarHBondContact O-N 2.77Å; L30-G33 PolarHBondContact O-N 3.09Å; L30-T34 WeakPolarHBondContact O-CG2 3.39Å; L30-T34 PolarHBondContact O-N 3Å; L30-T34 PolarHBondContact O-OG1 3.48Å; L30-T34 VanDerWaalsContact O-OG1 3.1Å
31	E	86.9	Confident	85.1	Confident	119 Å²	119	90.1 Å²	90.1	56%	0.556	51%	0.508	S	S	*	.	H	α-helix	trans	-62.4	-45.9	176.3	-170.7	178.1	-179.4	0	0	111.5	A27 T28 G33 T34 N35	A27-E31 WeakPolarHBondContact O-CB 3.37Å; A27-E31 PolarHBondContact O-N 3.46Å; T28-E31 PolarHBondContact O-N 2.99Å; E31-G33 VanDerWaalsContact C-N 3.34Å; E31-G33 PolarHBondContact O-N 2.96Å; E31-T34 WeakPolarHBondContact CA-OG1 3.36Å; E31-T34 PolarHBondContact O-N 2.9Å; E31-T34 PolarHBondContact O-OG1 2.92Å; E31-N35 WeakPolarHBondContact O-CB 3.48Å; E31-N35 PolarHBondContact O-N 3.12Å; E31-N35 PolarHBondContact O-ND2 2.97Å
32	I	88.7	Confident	86.1	Confident	116 Å²	116	90.1 Å²	90.1	60%	0.595	50%	0.503	S	S	*	.	H	α-helix	trans	-60.7	-44.5	174	-67.2	166	0	0	0	110.7	T28 N35 L36	T28-I32 VanDerWaalsContact O-CG1 3.27Å; T28-I32 WeakPolarHBondContact O-CG1 3.36Å; T28-I32 PolarHBondContact O-N 3.11Å; I32-N35 PolarHBondContact O-N 3.26Å; I32-L36 VanDerWaalsContact O-CB 3.3Å; I32-L36 WeakPolarHBondContact O-CB 3.45Å; I32-L36 PolarHBondContact O-N 2.88Å
33	G	88.8	Confident	87.1	Confident	29 Å²	29	93 Å²	93	30%	0.299	51%	0.512	S	S	.	.	H	α-helix	trans	-61.1	-45.2	178.4	0	0	0	0	0	112.9	M29 L30 E31 L36 L37	M29-G33 PolarHBondContact O-N 2.79Å; L30-G33 PolarHBondContact O-N 3.09Å; E31-G33 VanDerWaalsContact C-N 3.34Å; E31-G33 PolarHBondContact O-N 2.96Å; G33-L36 PolarHBondContact O-N 3.44Å; G33-L37 WeakPolarHBondContact O-CB 3.48Å; G33-L37 VanDerWaalsContact O-CG 3.24Å; G33-L37 WeakPolarHBondContact O-CG 3.45Å; G33-L37 PolarHBondContact O-N 3.47Å
34	T	88.1	Confident	87.9	Confident	80 Å²	80	91.9 Å²	91.9	49%	0.491	51%	0.509	S	S	.	.	H	α-helix	trans	-67.4	-40.9	177.5	55.4	0	0	0	0	112.6	L30 E31 L37 S38	L30-T34 WeakPolarHBondContact O-CG2 3.39Å; L30-T34 PolarHBondContact O-N 3Å; L30-T34 PolarHBondContact O-OG1 3.48Å; L30-T34 VanDerWaalsContact O-OG1 3.1Å; E31-T34 WeakPolarHBondContact CA-OG1 3.36Å; E31-T34 PolarHBondContact O-N 2.9Å; E31-T34 PolarHBondContact O-OG1 2.92Å; T34-L37 PolarHBondContact O-N 3.44Å; T34-S38 WeakPolarHBondContact O-CB 3.43Å; T34-S38 PolarHBondContact O-N 3.3Å
35	N	91	Very high	88.7	Confident	86 Å²	86	94.6 Å²	94.6	46%	0.46	51%	0.512	S	S	.	.	H	α-helix	trans	-63.5	-43.2	175	-77.8	-28.9	0	0	0	111.6	E31 I32 S38 Q39	E31-N35 WeakPolarHBondContact O-CB 3.48Å; E31-N35 PolarHBondContact O-N 3.12Å; E31-N35 PolarHBondContact O-ND2 2.97Å; I32-N35 PolarHBondContact O-N 3.26Å; N35-S38 PolarHBondContact O-N 2.96Å; N35-Q39 WeakPolarHBondContact O-CB 3.45Å; N35-Q39 WeakPolarHBondContact O-CG 3.49Å; N35-Q39 PolarHBondContact O-N 3.23Å
36	L	92.9	Very high	89.4	Confident	105 Å²	105	95 Å²	95	55%	0.55	51%	0.512	S	S	.	.	H	α-helix	trans	-63.1	-47.2	176.1	-173.1	67.3	0	0	0	111	I32 G33 S38 Q39 T40	I32-L36 VanDerWaalsContact O-CB 3.3Å; I32-L36 WeakPolarHBondContact O-CB 3.45Å; I32-L36 PolarHBondContact O-N 2.88Å; G33-L36 PolarHBondContact O-N 3.44Å; L36-S38 VanDerWaalsContact C-N 3.34Å; L36-S38 PolarHBondContact O-N 3.15Å; L36-Q39 PolarHBondContact O-N 3.07Å; L36-T40 WeakPolarHBondContact O-CB 3.43Å; L36-T40 PolarHBondContact O-N 2.94Å; L36-T40 PolarHBondContact O-OG1 2.76Å
37	L	90.9	Very high	90.1	Very high	123 Å²	123	96.5 Å²	96.5	64%	0.644	52%	0.517	S	S	*	.	H	α-helix	trans	-59.9	-42	176.9	-75.2	169.2	0	0	0	112.3	G33 T34 T40 A41	G33-L37 WeakPolarHBondContact O-CB 3.48Å; G33-L37 VanDerWaalsContact O-CG 3.24Å; G33-L37 WeakPolarHBondContact O-CG 3.45Å; G33-L37 PolarHBondContact O-N 3.47Å; T34-L37 PolarHBondContact O-N 3.44Å; L37-T40 PolarHBondContact O-N 2.88Å; L37-A41 WeakPolarHBondContact O-CB 3.42Å; L37-A41 PolarHBondContact O-N 2.8Å
38	S	90.9	Very high	90.8	Very high	79 Å²	79	97.2 Å²	97.2	55%	0.552	52%	0.516	S	S	*	.	H	α-helix	trans	-63.9	-44.7	176.4	-176.1	0	0	0	0	111.7	T34 N35 L36 A41 E42	T34-S38 WeakPolarHBondContact O-CB 3.43Å; T34-S38 PolarHBondContact O-N 3.3Å; N35-S38 PolarHBondContact O-N 2.96Å; L36-S38 VanDerWaalsContact C-N 3.34Å; L36-S38 PolarHBondContact O-N 3.15Å; S38-A41 PolarHBondContact O-N 3.21Å; S38-E42 PolarHBondContact O-N 2.86Å
39	Q	93.1	Very high	91.5	Very high	126 Å²	126	97.8 Å²	97.8	59%	0.589	52%	0.519	S	S	*	.	H	α-helix	trans	-63.4	-43.1	174.8	-75.5	-176.9	-0.3	0	0	112.1	N35 L36 E42 Q43	N35-Q39 WeakPolarHBondContact O-CB 3.45Å; N35-Q39 WeakPolarHBondContact O-CG 3.49Å; N35-Q39 PolarHBondContact O-N 3.23Å; L36-Q39 PolarHBondContact O-N 3.07Å; Q39-E42 PolarHBondContact O-N 3.5Å; Q39-Q43 WeakPolarHBondContact O-CB 3.49Å; Q39-Q43 WeakPolarHBondContact O-CG 3.22Å; Q39-Q43 PolarHBondContact O-N 3.36Å
40	T	93.2	Very high	92.1	Very high	65 Å²	65	94.8 Å²	94.8	40%	0.399	51%	0.509	S	S	.	.	H	α-helix	trans	-61.7	-46.3	175.9	-57.1	0	0	0	0	110.7	L36 L37 E42 Q43 T44	L36-T40 WeakPolarHBondContact O-CB 3.43Å; L36-T40 PolarHBondContact O-N 2.94Å; L36-T40 PolarHBondContact O-OG1 2.76Å; L37-T40 PolarHBondContact O-N 2.88Å; T40-E42 PolarHBondContact O-N 2.87Å; T40-Q43 PolarHBondContact O-N 2.92Å; T40-T44 PolarHBondContact O-N 3.28Å; T40-T44 PolarHBondContact O-OG1 2.92Å
41	A	92.4	Very high	92.6	Very high	60 Å²	60	94.4 Å²	94.4	50%	0.496	50%	0.504	S	S	.	.	H	α-helix	trans	-60.2	-42.8	178	0	0	0	0	0	112.4	L37 S38 T44 R45	L37-A41 WeakPolarHBondContact O-CB 3.42Å; L37-A41 PolarHBondContact O-N 2.8Å; S38-A41 PolarHBondContact O-N 3.21Å; A41-T44 PolarHBondContact O-N 3.14Å; A41-R45 WeakPolarHBondContact O-CB 3.4Å; A41-R45 PolarHBondContact O-N 2.63Å
42	E	93.4	Very high	93	Very high	72 Å²	72	91.6 Å²	91.6	34%	0.336	50%	0.501	S	S	.	.	H	α-helix	trans	-69.3	-36.5	177.2	-178.2	58.3	-166.4	0	0	112.1	S38 Q39 T40 R45 K46	S38-E42 PolarHBondContact O-N 2.86Å; Q39-E42 PolarHBondContact O-N 3.5Å; T40-E42 PolarHBondContact O-N 2.87Å; E42-R45 PolarHBondContact O-N 3.42Å; E42-R45 IonicContact OE1-NH2 3.83Å; E42-R45 IonicContact OE2-CZ 3.93Å; E42-R45 IonicContact OE2-NE 3.08Å; E42-R45 PolarHBondContact OE2-NE 2.78Å; E42-R45 VanDerWaalsContact OE2-NE 3.14Å; E42-R45 IonicContact OE2-NH2 4Å; E42-K46 WeakPolarHBondContact O-CG 3.24Å; E42-K46 PolarHBondContact O-N 2.65Å; E42-K46 VanDerWaalsContact OE1-CE 3.27Å; E42-K46 WeakPolarHBondContact OE1-CE 3.42Å
43	Q	94.3	Very high	93.3	Very high	134 Å²	134	92.7 Å²	92.7	63%	0.626	50%	0.502	S	S	*	.	H	α-helix	trans	-63.9	-43.9	172.2	-76.9	-176.3	-13.5	0	0	111.7	Q39 T40 R45 K46 L47	Q39-Q43 WeakPolarHBondContact O-CB 3.49Å; Q39-Q43 WeakPolarHBondContact O-CG 3.22Å; Q39-Q43 PolarHBondContact O-N 3.36Å; T40-Q43 PolarHBondContact O-N 2.92Å; Q43-R45 VanDerWaalsContact C-N 3.31Å; Q43-R45 PolarHBondContact O-N 3.27Å; Q43-K46 PolarHBondContact O-N 3.43Å; Q43-L47 WeakPolarHBondContact O-CB 3.43Å; Q43-L47 PolarHBondContact O-N 3.41Å
44	T	93.4	Very high	93.7	Very high	78 Å²	78	95 Å²	95	48%	0.479	51%	0.51	S	S	.	.	H	α-helix	trans	-60.8	-40.5	174.7	-54.6	0	0	0	0	111.3	T40 A41 L47 T48	T40-T44 PolarHBondContact O-N 3.28Å; T40-T44 PolarHBondContact O-OG1 2.92Å; A41-T44 PolarHBondContact O-N 3.14Å; T44-L47 PolarHBondContact O-N 3.14Å; T44-T48 WeakPolarHBondContact O-CG2 3.37Å; T44-T48 PolarHBondContact O-N 2.69Å; T44-T48 PolarHBondContact O-OG1 2.98Å; T44-T48 VanDerWaalsContact O-OG1 3.05Å
45	R	94.2	Very high	94.1	Very high	151 Å²	151	97 Å²	97	57%	0.57	52%	0.517	S	S	*	.	H	α-helix	trans	-64.7	-41.3	175.8	-161.3	-179.6	81.8	105.5	2.9	112.4	A41 E42 Q43 T48 V49	A41-R45 WeakPolarHBondContact O-CB 3.4Å; A41-R45 PolarHBondContact O-N 2.63Å; E42-R45 PolarHBondContact O-N 3.42Å; E42-R45 IonicContact OE1-NH2 3.83Å; E42-R45 IonicContact OE2-CZ 3.93Å; E42-R45 IonicContact OE2-NE 3.08Å; E42-R45 PolarHBondContact OE2-NE 2.78Å; E42-R45 VanDerWaalsContact OE2-NE 3.14Å; E42-R45 IonicContact OE2-NH2 4Å; Q43-R45 VanDerWaalsContact C-N 3.31Å; Q43-R45 PolarHBondContact O-N 3.27Å; R45-T48 WeakPolarHBondContact CA-OG1 3.25Å; R45-T48 PolarHBondContact O-OG1 3.25Å; R45-V49 WeakPolarHBondContact O-CG2 3.01Å; R45-V49 PolarHBondContact O-N 2.02Å
46	K	95.1	Very high	94.3	Very high	129 Å²	129	96.9 Å²	96.9	56%	0.561	52%	0.516	S	S	*	.	H	α-helix	trans	-64.8	-42	174.7	-74.3	175.1	-178.7	174.4	0	111.7	E42 Q43 V49 V50	E42-K46 WeakPolarHBondContact O-CG 3.24Å; E42-K46 PolarHBondContact O-N 2.65Å; E42-K46 VanDerWaalsContact OE1-CE 3.27Å; E42-K46 WeakPolarHBondContact OE1-CE 3.42Å; Q43-K46 PolarHBondContact O-N 3.43Å; K46-V49 PolarHBondContact O-N 3.29Å; K46-V50 WeakPolarHBondContact O-CG2 3.49Å; K46-V50 PolarHBondContact O-N 2.66Å
47	L	95.4	Very high	94.5	Very high	101 Å²	101	97.9 Å²	97.9	53%	0.529	52%	0.518	S	S	.	.	H	α-helix	trans	-62.5	-48.1	179.1	-172.9	63.7	0	0	0	111.3	Q43 T44 V49 V50 E51	Q43-L47 WeakPolarHBondContact O-CB 3.43Å; Q43-L47 PolarHBondContact O-N 3.41Å; T44-L47 PolarHBondContact O-N 3.14Å; L47-V49 VanDerWaalsContact C-N 3.29Å; L47-V49 PolarHBondContact O-N 3.26Å; L47-V50 CarbonylContact O-C 3.6Å; L47-V50 PolarHBondContact O-N 2.84Å; L47-E51 HydrophobicContact CG-CG 4.47Å; L47-E51 WeakPolarHBondContact O-CG 3.02Å; L47-E51 PolarHBondContact O-N 2.99Å
48	T	94.3	Very high	94.7	Very high	68 Å²	68	95.1 Å²	95.1	42%	0.417	51%	0.506	S	S	.	.	H	α-helix	trans	-60.2	-36.2	177.5	49.7	0	0	0	0	113	T44 R45 A52	T44-T48 WeakPolarHBondContact O-CG2 3.37Å; T44-T48 PolarHBondContact O-N 2.69Å; T44-T48 PolarHBondContact O-OG1 2.98Å; T44-T48 VanDerWaalsContact O-OG1 3.05Å; R45-T48 WeakPolarHBondContact CA-OG1 3.25Å; R45-T48 PolarHBondContact O-OG1 3.25Å; T48-A52 WeakPolarHBondContact O-CB 3.4Å; T48-A52 PolarHBondContact O-N 2.83Å
49	V	95.7	Very high	95	Very high	72 Å²	72	93.7 Å²	93.7	44%	0.436	50%	0.497	S	S	.	.	H	α-helix	trans	-66.4	-40.3	173.4	171.4	0	0	0	0	111.7	R45 K46 L47 K53	R45-V49 WeakPolarHBondContact O-CG2 3.01Å; R45-V49 PolarHBondContact O-N 2.02Å; K46-V49 PolarHBondContact O-N 3.29Å; L47-V49 VanDerWaalsContact C-N 3.29Å; L47-V49 PolarHBondContact O-N 3.26Å; V49-K53 WeakPolarHBondContact O-CG 3.34Å; V49-K53 PolarHBondContact O-N 3.45Å
50	V	96.3	Very high	95.1	Very high	81 Å²	81	95.6 Å²	95.6	49%	0.491	50%	0.498	S	S	.	.	H	α-helix	trans	-67.1	-45.2	176.5	172.8	0	0	0	0	110.5	K46 L47 A52 K53 V54	K46-V50 WeakPolarHBondContact O-CG2 3.49Å; K46-V50 PolarHBondContact O-N 2.66Å; L47-V50 CarbonylContact O-C 3.6Å; L47-V50 PolarHBondContact O-N 2.84Å; V50-A52 VanDerWaalsContact C-N 3.34Å; V50-A52 PolarHBondContact O-N 2.63Å; V50-K53 WeakPolarHBondContact O-CB 3.44Å; V50-K53 PolarHBondContact O-N 2.93Å; V50-K53 VanDerWaalsContact O-N 3.12Å; V50-V54 HydrophobicContact CG1-CG2 4.31Å; V50-V54 WeakPolarHBondContact O-CG2 3.34Å; V50-V54 PolarHBondContact O-N 2.89Å
51	E	95.9	Very high	95.3	Very high	108 Å²	108	98 Å²	98	51%	0.505	51%	0.507	S	S	.	.	H	α-helix	trans	-56.9	-46.1	175.4	-72.9	174.1	162.7	0	0	111.5	L47 K53 V54 L55	L47-E51 HydrophobicContact CG-CG 4.47Å; L47-E51 WeakPolarHBondContact O-CG 3.02Å; L47-E51 PolarHBondContact O-N 2.99Å; E51-K53 VanDerWaalsContact C-N 3.33Å; E51-K53 PolarHBondContact O-N 3.32Å; E51-V54 PolarHBondContact O-N 3.08Å; E51-L55 WeakPolarHBondContact O-CB 3.41Å; E51-L55 PolarHBondContact O-N 2.96Å
52	A	95	Very high	95.5	Very high	61 Å²	61	100.3 Å²	100.3	50%	0.504	51%	0.508	S	S	.	.	H	α-helix	trans	-62.4	-38.3	176.4	0	0	0	0	0	112.7	T48 V50 N56	T48-A52 WeakPolarHBondContact O-CB 3.4Å; T48-A52 PolarHBondContact O-N 2.83Å; V50-A52 VanDerWaalsContact C-N 3.34Å; V50-A52 PolarHBondContact O-N 2.63Å; A52-N56 WeakPolarHBondContact O-CB 3.35Å; A52-N56 PolarHBondContact O-N 3.26Å
53	K	95.5	Very high	95.7	Very high	138 Å²	138	101.4 Å²	101.4	60%	0.6	52%	0.515	S	S	*	.	H	α-helix	trans	-66	-44.6	175	-78.5	179.6	179.5	-178	0	111.9	V49 V50 E51 N56 Q57	V49-K53 WeakPolarHBondContact O-CG 3.34Å; V49-K53 PolarHBondContact O-N 3.45Å; V50-K53 WeakPolarHBondContact O-CB 3.44Å; V50-K53 PolarHBondContact O-N 2.93Å; V50-K53 VanDerWaalsContact O-N 3.12Å; E51-K53 VanDerWaalsContact C-N 3.33Å; E51-K53 PolarHBondContact O-N 3.32Å; K53-N56 PolarHBondContact O-N 3.45Å; K53-Q57 WeakPolarHBondContact O-CG 3.22Å; K53-Q57 PolarHBondContact O-N 2.71Å
54	V	96.8	Very high	95.8	Very high	77 Å²	77	100.6 Å²	100.6	47%	0.467	51%	0.511	S	S	.	.	H	α-helix	trans	-62.2	-47.4	177.5	171.6	0	0	0	0	109.7	V50 E51 N56 Q57 T58	V50-V54 HydrophobicContact CG1-CG2 4.31Å; V50-V54 WeakPolarHBondContact O-CG2 3.34Å; V50-V54 PolarHBondContact O-N 2.89Å; E51-V54 PolarHBondContact O-N 3.08Å; V54-N56 VanDerWaalsContact C-N 3.34Å; V54-N56 PolarHBondContact O-N 3.35Å; V54-Q57 PolarHBondContact O-N 3.44Å; V54-T58 PolarHBondContact O-N 3.23Å; V54-T58 PolarHBondContact O-OG1 2.87Å
55	L	95.6	Very high	96	Very high	123 Å²	123	102.6 Å²	102.6	64%	0.644	52%	0.519	S	S	*	.	H	α-helix	trans	-57.9	-45.8	178.4	-158.1	97.3	0	0	0	111.6	E51 T58 S59	E51-L55 WeakPolarHBondContact O-CB 3.41Å; E51-L55 PolarHBondContact O-N 2.96Å; L55-T58 PolarHBondContact O-N 3.35Å; L55-S59 PolarHBondContact O-N 3.04Å; L55-S59 PolarHBondContact O-OG 3.34Å; L55-S59 VanDerWaalsContact O-OG 3.13Å
56	N	96	Very high	96.1	Very high	84 Å²	84	101.4 Å²	101.4	45%	0.449	52%	0.523	S	S	.	.	H	α-helix	trans	-63.6	-42.7	177.4	-170.8	-19.9	0	0	0	112	A52 K53 V54 S59 R60	A52-N56 WeakPolarHBondContact O-CB 3.35Å; A52-N56 PolarHBondContact O-N 3.26Å; K53-N56 PolarHBondContact O-N 3.45Å; V54-N56 VanDerWaalsContact C-N 3.34Å; V54-N56 PolarHBondContact O-N 3.35Å; N56-S59 PolarHBondContact O-N 2.94Å; N56-R60 WeakPolarHBondContact O-CG 3.49Å; N56-R60 PolarHBondContact O-N 3.35Å; N56-R60 PolarHBondContact OD1-NE 3.47Å; N56-R60 VanDerWaalsContact OD1-NE 3.08Å
57	Q	96.3	Very high	96.2	Very high	126 Å²	126	101 Å²	101	59%	0.589	52%	0.523	S	S	*	.	H	α-helix	trans	-63.2	-44.1	175.3	-78.1	-174	-28.1	0	0	111.9	K53 V54 R60 I61	K53-Q57 WeakPolarHBondContact O-CG 3.22Å; K53-Q57 PolarHBondContact O-N 2.71Å; V54-Q57 PolarHBondContact O-N 3.44Å; Q57-R60 PolarHBondContact O-N 2.87Å; Q57-I61 VanDerWaalsContact O-CG1 3.31Å; Q57-I61 WeakPolarHBondContact O-CG1 3.25Å; Q57-I61 PolarHBondContact O-N 2.99Å
58	T	96.5	Very high	96.2	Very high	64 Å²	64	100.5 Å²	100.5	39%	0.393	52%	0.521	S	S	.	.	H	α-helix	trans	-59.5	-48.8	176.4	-56.2	0	0	0	0	110.8	V54 L55 R60 I61 E62	V54-T58 PolarHBondContact O-N 3.23Å; V54-T58 PolarHBondContact O-OG1 2.87Å; L55-T58 PolarHBondContact O-N 3.35Å; T58-R60 VanDerWaalsContact C-N 3.32Å; T58-R60 PolarHBondContact O-N 3.23Å; T58-I61 PolarHBondContact O-N 3.07Å; T58-I61 VanDerWaalsContact O-N 3.15Å; T58-E62 WeakPolarHBondContact O-CG 3.47Å; T58-E62 PolarHBondContact O-N 2.78Å
59	S	96.2	Very high	96.3	Very high	50 Å²	50	100.2 Å²	100.2	35%	0.35	52%	0.522	S	S	.	.	H	α-helix	trans	-61	-38.1	177.4	-60.5	0	0	0	0	112.8	L55 N56 E62 I63	L55-S59 PolarHBondContact O-N 3.04Å; L55-S59 PolarHBondContact O-OG 3.34Å; L55-S59 VanDerWaalsContact O-OG 3.13Å; N56-S59 PolarHBondContact O-N 2.94Å; S59-E62 PolarHBondContact O-N 3.2Å; S59-I63 VanDerWaalsContact O-CG1 3.27Å; S59-I63 WeakPolarHBondContact O-CG1 3.32Å; S59-I63 PolarHBondContact O-N 3Å
60	R	96.6	Very high	96.4	Very high	166 Å²	166	103 Å²	103	63%	0.626	53%	0.533	S	S	*	.	H	α-helix	trans	-63.8	-43.6	174.7	-75.1	178.4	-173.1	-158.8	-5.4	112	N56 Q57 T58 E62 I63 Q64	N56-R60 WeakPolarHBondContact O-CG 3.49Å; N56-R60 PolarHBondContact O-N 3.35Å; N56-R60 PolarHBondContact OD1-NE 3.47Å; N56-R60 VanDerWaalsContact OD1-NE 3.08Å; Q57-R60 PolarHBondContact O-N 2.87Å; T58-R60 VanDerWaalsContact C-N 3.32Å; T58-R60 PolarHBondContact O-N 3.23Å; R60-E62 VanDerWaalsContact C-N 3.35Å; R60-I63 PolarHBondContact O-N 3.41Å; R60-Q64 WeakPolarHBondContact O-CB 3.49Å; R60-Q64 PolarHBondContact O-N 3Å
61	I	97.1	Very high	96.4	Very high	114 Å²	114	102.1 Å²	102.1	59%	0.585	53%	0.531	S	S	*	.	H	α-helix	trans	-64.7	-42	178.4	-68.3	166.2	0	0	0	110.3	Q57 T58 Q64 L65	Q57-I61 VanDerWaalsContact O-CG1 3.31Å; Q57-I61 WeakPolarHBondContact O-CG1 3.25Å; Q57-I61 PolarHBondContact O-N 2.99Å; T58-I61 PolarHBondContact O-N 3.07Å; T58-I61 VanDerWaalsContact O-N 3.15Å; I61-Q64 PolarHBondContact O-N 3.48Å; I61-L65 WeakPolarHBondContact O-CB 3.39Å; I61-L65 PolarHBondContact O-N 3.31Å
62	E	96.8	Very high	96.5	Very high	110 Å²	110	100.4 Å²	100.4	51%	0.514	53%	0.528	S	S	.	.	H	α-helix	trans	-61	-46.2	176.4	-75.6	176	173.4	0	0	112.2	T58 S59 R60 Q64 L65 L66	T58-E62 WeakPolarHBondContact O-CG 3.47Å; T58-E62 PolarHBondContact O-N 2.78Å; S59-E62 PolarHBondContact O-N 3.2Å; R60-E62 VanDerWaalsContact C-N 3.35Å; E62-Q64 VanDerWaalsContact C-N 3.34Å; E62-Q64 PolarHBondContact O-N 3.43Å; E62-L65 PolarHBondContact O-N 3.44Å; E62-L66 WeakPolarHBondContact O-CG 3.48Å; E62-L66 PolarHBondContact O-N 2.99Å
63	I	96.6	Very high	96.6	Very high	95 Å²	95	101.2 Å²	101.2	49%	0.487	52%	0.524	S	S	.	.	H	α-helix	trans	-59.9	-47.6	176	-69	165.7	0	0	0	110.1	S59 R60 L65 L66 E67	S59-I63 VanDerWaalsContact O-CG1 3.27Å; S59-I63 WeakPolarHBondContact O-CG1 3.32Å; S59-I63 PolarHBondContact O-N 3Å; R60-I63 PolarHBondContact O-N 3.41Å; I63-L65 VanDerWaalsContact C-N 3.29Å; I63-L65 PolarHBondContact O-N 3.47Å; I63-L66 WeakPolarHBondContact O-CB 3.42Å; I63-L66 PolarHBondContact O-N 3.27Å; I63-L66 VanDerWaalsContact O-N 3.16Å; I63-E67 HydrophobicContact CG2-CG 4.43Å; I63-E67 WeakPolarHBondContact O-CG 3.23Å; I63-E67 PolarHBondContact O-N 2.92Å
64	Q	97	Very high	96.6	Very high	116 Å²	116	101 Å²	101	54%	0.542	52%	0.523	S	S	.	.	H	α-helix	trans	-65.5	-33.8	-179	-169.2	158	13.2	0	0	112.5	R60 I61 E62 N68	R60-Q64 WeakPolarHBondContact O-CB 3.49Å; R60-Q64 PolarHBondContact O-N 3Å; I61-Q64 PolarHBondContact O-N 3.48Å; E62-Q64 VanDerWaalsContact C-N 3.34Å; E62-Q64 PolarHBondContact O-N 3.43Å; Q64-N68 WeakPolarHBondContact O-CB 3.28Å; Q64-N68 PolarHBondContact O-N 2.92Å; Q64-N68 PolarHBondContact O-ND2 2.9Å
65	L	97.1	Very high	96.7	Very high	121 Å²	121	102.3 Å²	102.3	63%	0.634	53%	0.527	S	S	*	.	H	α-helix	trans	-65.5	-41.9	173.8	-175	67	0	0	0	111.4	I61 E62 I63 N68 S69	I61-L65 WeakPolarHBondContact O-CB 3.39Å; I61-L65 PolarHBondContact O-N 3.31Å; E62-L65 PolarHBondContact O-N 3.44Å; I63-L65 VanDerWaalsContact C-N 3.29Å; I63-L65 PolarHBondContact O-N 3.47Å; L65-N68 PolarHBondContact O-N 2.85Å; L65-S69 WeakPolarHBondContact O-CB 3.46Å; L65-S69 PolarHBondContact O-N 3.09Å
66	L	97.2	Very high	96.7	Very high	125 Å²	125	101.9 Å²	101.9	65%	0.654	52%	0.521	S	S	*	.	H	α-helix	trans	-65.3	-43.6	176.2	-72.8	168.4	0	0	0	111.8	E62 I63 S69 L70	E62-L66 WeakPolarHBondContact O-CG 3.48Å; E62-L66 PolarHBondContact O-N 2.99Å; I63-L66 WeakPolarHBondContact O-CB 3.42Å; I63-L66 PolarHBondContact O-N 3.27Å; I63-L66 VanDerWaalsContact O-N 3.16Å; L66-S69 PolarHBondContact O-N 3.28Å; L66-L70 WeakPolarHBondContact O-CB 3.38Å; L66-L70 PolarHBondContact O-N 2.8Å
67	E	96.4	Very high	96.8	Very high	122 Å²	122	105 Å²	105	57%	0.57	53%	0.531	S	S	*	.	H	α-helix	trans	-60.6	-45.5	175.8	-73.6	178.5	165.8	0	0	111.7	I63 L70 S71	I63-E67 HydrophobicContact CG2-CG 4.43Å; I63-E67 WeakPolarHBondContact O-CG 3.23Å; I63-E67 PolarHBondContact O-N 2.92Å; E67-L70 PolarHBondContact O-N 2.82Å; E67-S71 WeakPolarHBondContact O-CB 3.05Å; E67-S71 PolarHBondContact O-N 2.8Å
68	N	95.9	Very high	96.8	Very high	90 Å²	90	103.4 Å²	103.4	48%	0.481	52%	0.523	S	S	.	.	H	α-helix	trans	-62.1	-45.8	176	-74.9	-18.9	0	0	0	111.3	Q64 L65 L70 S71 T72	Q64-N68 WeakPolarHBondContact O-CB 3.28Å; Q64-N68 PolarHBondContact O-N 2.92Å; Q64-N68 PolarHBondContact O-ND2 2.9Å; L65-N68 PolarHBondContact O-N 2.85Å; N68-L70 VanDerWaalsContact C-N 3.33Å; N68-L70 PolarHBondContact O-N 2.91Å; N68-S71 WeakPolarHBondContact O-CB 3.31Å; N68-S71 PolarHBondContact O-N 3.44Å; N68-T72 PolarHBondContact O-N 3.02Å; N68-T72 PolarHBondContact O-OG1 2.88Å
69	S	96.8	Very high	96.9	Very high	62 Å²	62	105.5 Å²	105.5	43%	0.434	53%	0.532	S	S	.	.	H	α-helix	trans	-59.7	-42.1	177.2	-178	0	0	0	0	112.2	L65 L66 T72 N73	L65-S69 WeakPolarHBondContact O-CB 3.46Å; L65-S69 PolarHBondContact O-N 3.09Å; L66-S69 PolarHBondContact O-N 3.28Å; S69-T72 PolarHBondContact O-N 2.91Å; S69-N73 WeakPolarHBondContact O-CB 3.4Å; S69-N73 PolarHBondContact O-N 2.97Å; S69-N73 PolarHBondContact O-ND2 2.82Å
70	L	97	Very high	97	Very high	129 Å²	129	108.9 Å²	108.9	68%	0.675	55%	0.545	S	S	*	.	H	α-helix	trans	-64	-42.6	176.5	-173.7	69.3	0	0	0	111.6	L66 E67 N68 N73 K74	L66-L70 WeakPolarHBondContact O-CB 3.38Å; L66-L70 PolarHBondContact O-N 2.8Å; E67-L70 PolarHBondContact O-N 2.82Å; N68-L70 VanDerWaalsContact C-N 3.33Å; N68-L70 PolarHBondContact O-N 2.91Å; L70-N73 PolarHBondContact O-N 2.91Å; L70-K74 PolarHBondContact O-N 2.89Å
71	S	96.9	Very high	97	Very high	64 Å²	64	106.6 Å²	106.6	45%	0.448	55%	0.545	S	S	.	.	H	α-helix	trans	-61.8	-46.2	176.5	-171.3	0	0	0	0	111.8	E67 N68 N73 K74 L75	E67-S71 WeakPolarHBondContact O-CB 3.05Å; E67-S71 PolarHBondContact O-N 2.8Å; N68-S71 WeakPolarHBondContact O-CB 3.31Å; N68-S71 PolarHBondContact O-N 3.44Å; S71-N73 PolarHBondContact O-N 2.83Å; S71-K74 WeakPolarHBondContact O-CB 3.35Å; S71-K74 PolarHBondContact O-N 3.05Å; S71-K74 VanDerWaalsContact O-N 3.17Å; S71-L75 PolarHBondContact O-N 3.11Å
72	T	97.1	Very high	97	Very high	72 Å²	72	106.6 Å²	106.6	44%	0.442	54%	0.542	S	S	.	.	H	α-helix	trans	-59.8	-46.7	176.2	-54.9	0	0	0	0	111.6	N68 S69 K74 L75 E76	N68-T72 PolarHBondContact O-N 3.02Å; N68-T72 PolarHBondContact O-OG1 2.88Å; S69-T72 PolarHBondContact O-N 2.91Å; T72-K74 VanDerWaalsContact C-N 3.25Å; T72-K74 PolarHBondContact O-N 3.05Å; T72-L75 PolarHBondContact O-N 3.25Å; T72-L75 VanDerWaalsContact O-N 3.17Å; T72-E76 WeakPolarHBondContact O-CG 3.47Å; T72-E76 PolarHBondContact O-N 2.85Å
73	N	96.4	Very high	97	Very high	77 Å²	77	104.5 Å²	104.5	41%	0.412	54%	0.537	S	S	.	.	H	α-helix	trans	-59.9	-35.5	176.8	-80.9	-58.5	0	0	0	112.8	S69 L70 S71 K77	S69-N73 WeakPolarHBondContact O-CB 3.4Å; S69-N73 PolarHBondContact O-N 2.97Å; S69-N73 PolarHBondContact O-ND2 2.82Å; L70-N73 PolarHBondContact O-N 2.91Å; S71-N73 PolarHBondContact O-N 2.83Å; N73-K77 WeakPolarHBondContact O-CG 3.47Å; N73-K77 PolarHBondContact O-N 2.89Å
74	K	97	Very high	97	Very high	133 Å²	133	103.2 Å²	103.2	58%	0.578	53%	0.534	S	S	*	.	H	α-helix	trans	-67.8	-46.3	176	-172.5	-178.3	175.4	-172.5	0	111.1	L70 S71 T72 E76 K77 E78	L70-K74 PolarHBondContact O-N 2.89Å; S71-K74 WeakPolarHBondContact O-CB 3.35Å; S71-K74 PolarHBondContact O-N 3.05Å; S71-K74 VanDerWaalsContact O-N 3.17Å; T72-K74 VanDerWaalsContact C-N 3.25Å; T72-K74 PolarHBondContact O-N 3.05Å; K74-E76 VanDerWaalsContact C-N 3.33Å; K74-E76 PolarHBondContact O-N 3.47Å; K74-K77 PolarHBondContact O-N 3.35Å; K74-E78 WeakPolarHBondContact CE-OE1 3.47Å; K74-E78 PolarHBondContact O-N 3.04Å
75	L	97.4	Very high	97	Very high	106 Å²	106	103.2 Å²	103.2	56%	0.555	53%	0.534	S	S	*	.	H	α-helix	trans	-60.8	-40.9	177	-74.9	164	0	0	0	111.9	S71 T72 K77 E78 L79	S71-L75 PolarHBondContact O-N 3.11Å; T72-L75 PolarHBondContact O-N 3.25Å; T72-L75 VanDerWaalsContact O-N 3.17Å; L75-K77 VanDerWaalsContact C-N 3.34Å; L75-K77 PolarHBondContact O-N 3.01Å; L75-E78 PolarHBondContact O-N 3.41Å; L75-L79 WeakPolarHBondContact O-CB 3.39Å; L75-L79 PolarHBondContact O-N 3.3Å
76	E	97.3	Very high	97	Very high	114 Å²	114	102.7 Å²	102.7	53%	0.533	53%	0.53	S	S	.	.	H	α-helix	trans	-61.6	-40.5	176.4	-75.7	179.1	180	0	0	112.4	T72 K74 L79 L80	T72-E76 WeakPolarHBondContact O-CG 3.47Å; T72-E76 PolarHBondContact O-N 2.85Å; K74-E76 VanDerWaalsContact C-N 3.33Å; K74-E76 PolarHBondContact O-N 3.47Å; E76-L79 PolarHBondContact O-N 3.1Å; E76-L80 WeakPolarHBondContact O-CB 3.45Å; E76-L80 PolarHBondContact O-N 2.82Å
77	K	97.3	Very high	97	Very high	150 Å²	150	104.7 Å²	104.7	65%	0.652	53%	0.529	S	S	*	.	H	α-helix	trans	-65.3	-43.1	175.3	-74.9	179.1	-179.9	178.6	0	112.3	N73 K74 L75 L80 L81	N73-K77 WeakPolarHBondContact O-CG 3.47Å; N73-K77 PolarHBondContact O-N 2.89Å; K74-K77 PolarHBondContact O-N 3.35Å; L75-K77 VanDerWaalsContact C-N 3.34Å; L75-K77 PolarHBondContact O-N 3.01Å; K77-L80 PolarHBondContact O-N 3.29Å; K77-L81 PolarHBondContact O-N 3.01Å
78	E	97.1	Very high	97.1	Very high	91 Å²	91	104.4 Å²	104.4	43%	0.425	53%	0.528	S	S	.	.	H	α-helix	trans	-63.6	-42.3	176.4	-75.1	177.4	-169.2	0	0	111.2	K74 L75 L80 L81 Q82	K74-E78 WeakPolarHBondContact CE-OE1 3.47Å; K74-E78 PolarHBondContact O-N 3.04Å; L75-E78 PolarHBondContact O-N 3.41Å; E78-L80 VanDerWaalsContact C-N 3.33Å; E78-L80 PolarHBondContact O-N 2.81Å; E78-L81 PolarHBondContact O-N 2.86Å; E78-Q82 WeakPolarHBondContact O-CG 3.44Å; E78-Q82 PolarHBondContact O-N 3.48Å
79	L	97.7	Very high	97.1	Very high	108 Å²	108	104.9 Å²	104.9	57%	0.565	53%	0.53	S	S	*	.	H	α-helix	trans	-62	-40.7	176.4	-173.1	68.7	0	0	0	111.9	L75 E76 Q82 T83	L75-L79 WeakPolarHBondContact O-CB 3.39Å; L75-L79 PolarHBondContact O-N 3.3Å; E76-L79 PolarHBondContact O-N 3.1Å; L79-Q82 PolarHBondContact O-N 2.68Å; L79-T83 WeakPolarHBondContact O-CB 3.22Å; L79-T83 PolarHBondContact O-N 2.96Å; L79-T83 PolarHBondContact O-OG1 3.3Å
80	L	97.4	Very high	97.1	Very high	121 Å²	121	111.2 Å²	111.2	63%	0.634	54%	0.544	S	S	*	.	H	α-helix	trans	-63.3	-45.8	176.4	-174.5	67.4	0	0	0	111.3	E76 K77 E78 T83 T84	E76-L80 WeakPolarHBondContact O-CB 3.45Å; E76-L80 PolarHBondContact O-N 2.82Å; K77-L80 PolarHBondContact O-N 3.29Å; E78-L80 VanDerWaalsContact C-N 3.33Å; E78-L80 PolarHBondContact O-N 2.81Å; L80-T83 PolarHBondContact O-N 3.29Å; L80-T84 WeakPolarHBondContact O-CG2 3.42Å; L80-T84 PolarHBondContact O-N 3.36Å
81	L	96.9	Very high	97.1	Very high	118 Å²	118	108.8 Å²	108.8	62%	0.618	53%	0.532	S	S	*	.	H	α-helix	trans	-59.3	-50.3	176.5	-79.5	163.3	0	0	0	111.3	K77 E78 T83 T84 E85	K77-L81 PolarHBondContact O-N 3.01Å; E78-L81 PolarHBondContact O-N 2.86Å; L81-T83 VanDerWaalsContact C-N 3.29Å; L81-T83 PolarHBondContact O-N 3.39Å; L81-T84 PolarHBondContact O-N 3.01Å; L81-T84 VanDerWaalsContact O-N 3.12Å; L81-T84 PolarHBondContact O-OG1 3.37Å; L81-E85 PolarHBondContact O-N 3.49Å
82	Q	96.9	Very high	97.1	Very high	114 Å²	114	111.4 Å²	111.4	53%	0.533	54%	0.535	S	S	.	.	H	α-helix	trans	-59.4	-40.4	177.1	-73.2	-177.4	-13.5	0	0	112.1	E78 L79 T84 E85 I86	E78-Q82 WeakPolarHBondContact O-CG 3.44Å; E78-Q82 PolarHBondContact O-N 3.48Å; L79-Q82 PolarHBondContact O-N 2.68Å; Q82-T84 VanDerWaalsContact C-N 3.32Å; Q82-T84 PolarHBondContact O-N 2.97Å; Q82-E85 PolarHBondContact O-N 3.06Å; Q82-I86 VanDerWaalsContact O-CG1 3.29Å; Q82-I86 WeakPolarHBondContact O-CG1 3.3Å; Q82-I86 PolarHBondContact O-N 3.07Å
83	T	97.4	Very high	97	Very high	67 Å²	67	112.1 Å²	112.1	41%	0.411	54%	0.537	S	S	.	.	H	α-helix	trans	-62.1	-40.3	177.1	-59.3	0	0	0	0	111.7	L79 L80 L81 R87	L79-T83 WeakPolarHBondContact O-CB 3.22Å; L79-T83 PolarHBondContact O-N 2.96Å; L79-T83 PolarHBondContact O-OG1 3.3Å; L80-T83 PolarHBondContact O-N 3.29Å; L81-T83 VanDerWaalsContact C-N 3.29Å; L81-T83 PolarHBondContact O-N 3.39Å; T83-R87 PolarHBondContact O-N 2.83Å; T83-R87 VanDerWaalsContact O-N 3.09Å
84	T	97.4	Very high	97	Very high	67 Å²	67	111.6 Å²	111.6	41%	0.411	54%	0.539	S	S	.	.	H	α-helix	trans	-67.1	-39.4	176	58	0	0	0	0	112.5	L80 L81 Q82 R87 Q88	L80-T84 WeakPolarHBondContact O-CG2 3.42Å; L80-T84 PolarHBondContact O-N 3.36Å; L81-T84 PolarHBondContact O-N 3.01Å; L81-T84 VanDerWaalsContact O-N 3.12Å; L81-T84 PolarHBondContact O-OG1 3.37Å; Q82-T84 VanDerWaalsContact C-N 3.32Å; Q82-T84 PolarHBondContact O-N 2.97Å; T84-R87 WeakPolarHBondContact O-CB 3.31Å; T84-R87 PolarHBondContact O-N 3.18Å; T84-Q88 WeakPolarHBondContact O-CG 3.33Å; T84-Q88 PolarHBondContact O-N 2.92Å
85	E	97.2	Very high	97	Very high	117 Å²	117	113.3 Å²	113.3	55%	0.547	54%	0.541	S	S	.	.	H	α-helix	trans	-66.4	-43.6	177.5	-171.1	170.6	-159.7	0	0	111.6	L81 Q82 R87 Q88 L89	L81-E85 PolarHBondContact O-N 3.49Å; Q82-E85 PolarHBondContact O-N 3.06Å; E85-R87 VanDerWaalsContact C-N 3.28Å; E85-R87 PolarHBondContact O-N 3.08Å; E85-Q88 PolarHBondContact O-N 3.25Å; E85-Q88 VanDerWaalsContact O-N 3.15Å; E85-L89 HydrophobicContact CG-CD1 4.37Å; E85-L89 WeakPolarHBondContact O-CG 3.14Å; E85-L89 PolarHBondContact O-N 2.9Å
86	I	97.2	Very high	96.9	Very high	109 Å²	109	113.1 Å²	113.1	56%	0.559	54%	0.541	S	S	*	.	H	α-helix	trans	-58.2	-42.3	174	-70.6	168	0	0	0	110.7	Q82 L89 R90	Q82-I86 VanDerWaalsContact O-CG1 3.29Å; Q82-I86 WeakPolarHBondContact O-CG1 3.3Å; Q82-I86 PolarHBondContact O-N 3.07Å; I86-L89 PolarHBondContact O-N 2.85Å; I86-R90 WeakPolarHBondContact O-CB 3.44Å; I86-R90 PolarHBondContact O-N 2.59Å
87	R	96.9	Very high	96.9	Very high	168 Å²	168	113 Å²	113	63%	0.634	54%	0.54	S	S	*	.	H	α-helix	trans	-61.4	-46.7	176.4	-171.7	-178.2	-67.2	-178.5	-1.6	111.3	T83 T84 E85 L89 R90 D91	T83-R87 PolarHBondContact O-N 2.83Å; T83-R87 VanDerWaalsContact O-N 3.09Å; T84-R87 WeakPolarHBondContact O-CB 3.31Å; T84-R87 PolarHBondContact O-N 3.18Å; E85-R87 VanDerWaalsContact C-N 3.28Å; E85-R87 PolarHBondContact O-N 3.08Å; R87-L89 VanDerWaalsContact C-N 3.34Å; R87-L89 PolarHBondContact O-N 2.91Å; R87-R90 PolarHBondContact O-N 3.02Å; R87-D91 PolarHBondContact O-N 3.45Å
88	Q	96.9	Very high	96.9	Very high	116 Å²	116	109.2 Å²	109.2	54%	0.542	53%	0.532	S	S	.	.	H	α-helix	trans	-62.1	-40.5	177.4	-71	-178.3	3.7	0	0	112.6	T84 E85 D91 K92	T84-Q88 WeakPolarHBondContact O-CG 3.33Å; T84-Q88 PolarHBondContact O-N 2.92Å; E85-Q88 PolarHBondContact O-N 3.25Å; E85-Q88 VanDerWaalsContact O-N 3.15Å; Q88-D91 PolarHBondContact O-N 2.86Å; Q88-K92 WeakPolarHBondContact O-CG 3.28Å; Q88-K92 PolarHBondContact O-N 3.39Å
89	L	96.5	Very high	96.8	Very high	99 Å²	99	111.3 Å²	111.3	52%	0.518	54%	0.54	S	S	.	.	H	α-helix	trans	-63.9	-42.5	176	-73.9	172.6	0	0	0	111.1	E85 I86 R87 D91 K92 N93	E85-L89 HydrophobicContact CG-CD1 4.37Å; E85-L89 WeakPolarHBondContact O-CG 3.14Å; E85-L89 PolarHBondContact O-N 2.9Å; I86-L89 PolarHBondContact O-N 2.85Å; R87-L89 VanDerWaalsContact C-N 3.34Å; R87-L89 PolarHBondContact O-N 2.91Å; L89-D91 PolarHBondContact O-N 2.9Å; L89-K92 PolarHBondContact O-N 2.87Å; L89-N93 WeakPolarHBondContact O-CB 3.46Å; L89-N93 PolarHBondContact O-N 3.16Å
90	R	97.3	Very high	96.7	Very high	195 Å²	195	109.8 Å²	109.8	74%	0.736	54%	0.535	S	S	*	.	H	α-helix	trans	-60.9	-43.2	177.2	-164.1	174.8	-171.1	156	2	112	I86 R87 N93 S94	I86-R90 WeakPolarHBondContact O-CB 3.44Å; I86-R90 PolarHBondContact O-N 2.59Å; R87-R90 PolarHBondContact O-N 3.02Å; R90-N93 PolarHBondContact O-N 3.16Å; R90-S94 PolarHBondContact O-N 2.73Å
91	D	96.9	Very high	96.7	Very high	78 Å²	78	110.3 Å²	110.3	42%	0.417	53%	0.534	S	S	.	.	H	α-helix	trans	-66.2	-38.6	176.9	-65.7	-16.9	0	0	0	112.2	R87 Q88 L89 R95	R87-D91 PolarHBondContact O-N 3.45Å; Q88-D91 PolarHBondContact O-N 2.86Å; L89-D91 PolarHBondContact O-N 2.9Å; D91-R95 PolarHBondContact O-N 3.34Å; D91-R95 VanDerWaalsContact O-N 3.15Å; D91-R95 PolarHBondContact O-NE 3.43Å
92	K	96.2	Very high	96.7	Very high	120 Å²	120	110.1 Å²	110.1	52%	0.522	53%	0.533	S	S	.	.	H	α-helix	trans	-64.1	-42	173.4	-75	175.3	-178.6	173.6	0	111.1	Q88 L89 R95 L96	Q88-K92 WeakPolarHBondContact O-CG 3.28Å; Q88-K92 PolarHBondContact O-N 3.39Å; L89-K92 PolarHBondContact O-N 2.87Å; K92-R95 PolarHBondContact O-N 2.87Å; K92-L96 WeakPolarHBondContact O-CG 3.5Å; K92-L96 PolarHBondContact O-N 3.23Å
93	N	95.3	Very high	96.6	Very high	87 Å²	87	109 Å²	109	47%	0.465	53%	0.531	S	S	.	.	H	α-helix	trans	-64.9	-44.6	179.7	-142.2	53	0	0	0	111.3	L89 R90 R95 L96 E97	L89-N93 WeakPolarHBondContact O-CB 3.46Å; L89-N93 PolarHBondContact O-N 3.16Å; R90-N93 PolarHBondContact O-N 3.16Å; N93-R95 VanDerWaalsContact C-N 3.33Å; N93-R95 PolarHBondContact O-N 3.38Å; N93-L96 WeakPolarHBondContact O-CB 3.45Å; N93-L96 PolarHBondContact O-N 3.32Å; N93-L96 VanDerWaalsContact O-N 3.11Å; N93-E97 PolarHBondContact ND2-OE1 3.29Å; N93-E97 WeakPolarHBondContact O-CG 3.36Å; N93-E97 PolarHBondContact O-N 2.72Å
94	S	97.1	Very high	96.5	Very high	65 Å²	65	111.2 Å²	111.2	46%	0.455	54%	0.536	S	S	.	.	H	α-helix	trans	-58.1	-43.4	175.1	175.8	0	0	0	0	112.2	R90 L96 E97 S98	R90-S94 PolarHBondContact O-N 2.73Å; S94-L96 PolarHBondContact O-N 2.92Å; S94-E97 PolarHBondContact O-N 3.3Å; S94-S98 PolarHBondContact O-N 2.85Å; S94-S98 PolarHBondContact O-OG 3Å
95	R	96.6	Very high	96.4	Very high	169 Å²	169	111.4 Å²	111.4	64%	0.638	54%	0.54	S	S	*	.	H	α-helix	trans	-63.7	-38.7	175.2	-78.8	-175.3	-91.4	-96	1.8	112.9	D91 K92 N93 K99	D91-R95 PolarHBondContact O-N 3.34Å; D91-R95 VanDerWaalsContact O-N 3.15Å; D91-R95 PolarHBondContact O-NE 3.43Å; K92-R95 PolarHBondContact O-N 2.87Å; N93-R95 VanDerWaalsContact C-N 3.33Å; N93-R95 PolarHBondContact O-N 3.38Å; R95-K99 PolarHBondContact O-N 3.49Å; R95-K99 VanDerWaalsContact O-N 3.11Å
96	L	95.7	Very high	96.3	Very high	103 Å²	103	110.7 Å²	110.7	54%	0.539	54%	0.537	S	S	.	.	H	α-helix	trans	-66.6	-44.2	176.4	-74.8	170.5	0	0	0	111.2	K92 N93 S94 S98 K99 V100	K92-L96 WeakPolarHBondContact O-CG 3.5Å; K92-L96 PolarHBondContact O-N 3.23Å; N93-L96 WeakPolarHBondContact O-CB 3.45Å; N93-L96 PolarHBondContact O-N 3.32Å; N93-L96 VanDerWaalsContact O-N 3.11Å; S94-L96 PolarHBondContact O-N 2.92Å; L96-S98 PolarHBondContact O-N 3.42Å; L96-K99 PolarHBondContact O-N 3.36Å; L96-K99 VanDerWaalsContact O-N 3.12Å; L96-V100 WeakPolarHBondContact O-CG2 3.33Å; L96-V100 PolarHBondContact O-N 2.96Å
97	E	96.3	Very high	96.1	Very high	111 Å²	111	112.1 Å²	112.1	52%	0.519	54%	0.541	S	S	.	.	H	α-helix	trans	-57.7	-46.4	176.3	-73.8	165.5	-165.9	0	0	111.4	N93 S94 K99 V100 Q101	N93-E97 PolarHBondContact ND2-OE1 3.29Å; N93-E97 WeakPolarHBondContact O-CG 3.36Å; N93-E97 PolarHBondContact O-N 2.72Å; S94-E97 PolarHBondContact O-N 3.3Å; E97-K99 VanDerWaalsContact C-N 3.32Å; E97-K99 PolarHBondContact O-N 3.47Å; E97-V100 PolarHBondContact O-N 3.13Å; E97-Q101 PolarHBondContact O-N 3.21Å
98	S	97.2	Very high	96	Very high	70 Å²	70	112.7 Å²	112.7	49%	0.49	54%	0.543	S	S	.	.	H	α-helix	trans	-61.7	-39	175.1	-57.7	0	0	0	0	112.7	S94 L96 Q101 L102	S94-S98 PolarHBondContact O-N 2.85Å; S94-S98 PolarHBondContact O-OG 3Å; L96-S98 PolarHBondContact O-N 3.42Å; S98-Q101 PolarHBondContact O-N 3.39Å; S98-L102 PolarHBondContact O-N 3.04Å
99	K	96.6	Very high	95.9	Very high	136 Å²	136	108.8 Å²	108.8	59%	0.591	53%	0.534	S	S	*	.	H	α-helix	trans	-68.3	-37.9	178.2	-171	172.4	-177.8	176.7	0	111.9	R95 L96 E97 L102 L103	R95-K99 PolarHBondContact O-N 3.49Å; R95-K99 VanDerWaalsContact O-N 3.11Å; L96-K99 PolarHBondContact O-N 3.36Å; L96-K99 VanDerWaalsContact O-N 3.12Å; E97-K99 VanDerWaalsContact C-N 3.32Å; E97-K99 PolarHBondContact O-N 3.47Å; K99-L102 PolarHBondContact O-N 3.38Å; K99-L103 HydrophobicContact CG-CD1 4.32Å; K99-L103 WeakPolarHBondContact O-CG 3.46Å; K99-L103 PolarHBondContact O-N 2.99Å
100	V	95.3	Very high	95.8	Very high	75 Å²	75	109 Å²	109	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-63.4	-48.7	175.3	170.1	0	0	0	0	110.1	L96 E97 L102 L103 E104	L96-V100 WeakPolarHBondContact O-CG2 3.33Å; L96-V100 PolarHBondContact O-N 2.96Å; E97-V100 PolarHBondContact O-N 3.13Å; V100-L102 VanDerWaalsContact C-N 3.3Å; V100-L102 PolarHBondContact O-N 2.87Å; V100-L103 PolarHBondContact O-N 3.45Å; V100-E104 HydrophobicContact CG1-CG 4.33Å; V100-E104 WeakPolarHBondContact O-CG 3.46Å; V100-E104 PolarHBondContact O-N 3.01Å
101	Q	96.8	Very high	95.7	Very high	133 Å²	133	103.5 Å²	103.5	62%	0.621	52%	0.517	S	S	*	.	H	α-helix	trans	-58.4	-41.5	177.2	-74.4	-177.6	-17.2	0	0	112.6	E97 S98 E104 S105	E97-Q101 PolarHBondContact O-N 3.21Å; S98-Q101 PolarHBondContact O-N 3.39Å; Q101-E104 PolarHBondContact O-N 3.08Å; Q101-S105 PolarHBondContact O-N 3.09Å
102	L	96.9	Very high	95.7	Very high	113 Å²	113	103.8 Å²	103.8	59%	0.592	52%	0.516	S	S	*	.	H	α-helix	trans	-61.8	-48.5	176.3	-177.5	65	0	0	0	111.5	S98 K99 V100 E104 S105 Q106	S98-L102 PolarHBondContact O-N 3.04Å; K99-L102 PolarHBondContact O-N 3.38Å; V100-L102 VanDerWaalsContact C-N 3.3Å; V100-L102 PolarHBondContact O-N 2.87Å; L102-E104 VanDerWaalsContact C-N 3.35Å; L102-E104 PolarHBondContact O-N 3.3Å; L102-S105 PolarHBondContact O-N 2.93Å; L102-S105 PolarHBondContact O-OG 3.14Å; L102-Q106 PolarHBondContact O-N 3.32Å
103	L	95	Very high	95.6	Very high	92 Å²	92	103.2 Å²	103.2	48%	0.482	52%	0.519	S	S	.	.	H	α-helix	trans	-62.8	-40.3	178.7	-72.9	171.7	0	0	0	112.1	K99 V100 S105 Q106 Q107	K99-L103 HydrophobicContact CG-CD1 4.32Å; K99-L103 WeakPolarHBondContact O-CG 3.46Å; K99-L103 PolarHBondContact O-N 2.99Å; V100-L103 PolarHBondContact O-N 3.45Å; L103-S105 VanDerWaalsContact C-N 3.33Å; L103-S105 PolarHBondContact O-N 3.16Å; L103-Q106 PolarHBondContact O-N 2.87Å; L103-Q107 WeakPolarHBondContact O-CB 3.49Å; L103-Q107 PolarHBondContact O-N 3.09Å
104	E	95.2	Very high	95.5	Very high	112 Å²	112	105.3 Å²	105.3	52%	0.523	53%	0.527	S	S	.	.	H	α-helix	trans	-62.1	-40.6	175.1	-74.7	179.7	170.1	0	0	112	V100 Q101 L102 R108	V100-E104 HydrophobicContact CG1-CG 4.33Å; V100-E104 WeakPolarHBondContact O-CG 3.46Å; V100-E104 PolarHBondContact O-N 3.01Å; Q101-E104 PolarHBondContact O-N 3.08Å; L102-E104 VanDerWaalsContact C-N 3.35Å; L102-E104 PolarHBondContact O-N 3.3Å; E104-R108 WeakPolarHBondContact O-CB 3.29Å; E104-R108 PolarHBondContact O-N 2.85Å
105	S	95.7	Very high	95.5	Very high	71 Å²	71	108.4 Å²	108.4	50%	0.497	53%	0.529	S	S	.	.	H	α-helix	trans	-65.2	-41.9	176.3	77.2	0	0	0	0	111.9	Q101 L102 L103 R108 G109	Q101-S105 PolarHBondContact O-N 3.09Å; L102-S105 PolarHBondContact O-N 2.93Å; L102-S105 PolarHBondContact O-OG 3.14Å; L103-S105 VanDerWaalsContact C-N 3.33Å; L103-S105 PolarHBondContact O-N 3.16Å; S105-R108 PolarHBondContact O-N 3.43Å; S105-G109 PolarHBondContact O-N 3.24Å; S105-G109 VanDerWaalsContact O-N 3.08Å
106	Q	94.9	Very high	95.5	Very high	103 Å²	103	105.8 Å²	105.8	48%	0.481	53%	0.527	S	S	.	.	H	α-helix	trans	-66.4	-46.9	179.5	-175.3	-178.3	-23.5	0	0	110.8	L102 L103 R108 G109 E110	L102-Q106 PolarHBondContact O-N 3.32Å; L103-Q106 PolarHBondContact O-N 2.87Å; Q106-R108 VanDerWaalsContact C-N 3.27Å; Q106-R108 PolarHBondContact O-N 3.38Å; Q106-G109 PolarHBondContact O-N 2.87Å; Q106-G109 VanDerWaalsContact O-N 3.09Å; Q106-E110 PolarHBondContact NE2-OE1 3.09Å; Q106-E110 PolarHBondContact O-N 3.14Å
107	Q	93	Very high	95.4	Very high	139 Å²	139	105.3 Å²	105.3	65%	0.65	52%	0.522	S	S	*	.	H	α-helix	trans	-64	-34.5	179.3	-168.8	172.8	9.3	0	0	112	L103 L111	L103-Q107 WeakPolarHBondContact O-CB 3.49Å; L103-Q107 PolarHBondContact O-N 3.09Å; Q107-L111 WeakPolarHBondContact O-CB 3.3Å; Q107-L111 PolarHBondContact O-N 2.85Å
108	R	94.9	Very high	95.3	Very high	180 Å²	180	105.9 Å²	105.9	68%	0.679	52%	0.523	S	S	*	.	H	α-helix	trans	-64.7	-41.5	173	-169.4	-176.7	-60.7	-116.8	1.2	111.6	E104 S105 Q106 L111 E112	E104-R108 WeakPolarHBondContact O-CB 3.29Å; E104-R108 PolarHBondContact O-N 2.85Å; S105-R108 PolarHBondContact O-N 3.43Å; Q106-R108 VanDerWaalsContact C-N 3.27Å; Q106-R108 PolarHBondContact O-N 3.38Å; R108-L111 PolarHBondContact O-N 3.21Å; R108-E112 PolarHBondContact O-N 2.74Å; R108-E112 VanDerWaalsContact O-N 3.17Å
109	G	95.3	Very high	95.2	Very high	33 Å²	33	107.1 Å²	107.1	34%	0.34	52%	0.524	S	S	.	.	H	α-helix	trans	-60.6	-52.3	174.2	0	0	0	0	0	112.2	S105 Q106 L111 E112 D113	S105-G109 PolarHBondContact O-N 3.24Å; S105-G109 VanDerWaalsContact O-N 3.08Å; Q106-G109 PolarHBondContact O-N 2.87Å; Q106-G109 VanDerWaalsContact O-N 3.09Å; G109-L111 VanDerWaalsContact C-N 3.25Å; G109-L111 PolarHBondContact O-N 3.2Å; G109-E112 PolarHBondContact O-N 3.07Å; G109-E112 VanDerWaalsContact O-N 3.08Å; G109-D113 PolarHBondContact O-N 3.38Å
110	E	94.3	Very high	95.2	Very high	104 Å²	104	108.9 Å²	108.9	49%	0.486	53%	0.527	S	S	.	.	H	α-helix	trans	-58.7	-36.5	178.5	-69.9	175.1	-168.3	0	0	112.4	Q106 D113 M114	Q106-E110 PolarHBondContact NE2-OE1 3.09Å; Q106-E110 PolarHBondContact O-N 3.14Å; E110-D113 PolarHBondContact O-N 2.87Å; E110-M114 WeakPolarHBondContact O-CG 3.45Å; E110-M114 PolarHBondContact O-N 3.45Å
111	L	95.2	Very high	95.1	Very high	79 Å²	79	109.7 Å²	109.7	41%	0.414	53%	0.528	S	S	.	.	H	α-helix	trans	-67.1	-39.4	177.1	-175	65.4	0	0	0	112.3	Q107 R108 G109 M114 R115	Q107-L111 WeakPolarHBondContact O-CB 3.3Å; Q107-L111 PolarHBondContact O-N 2.85Å; R108-L111 PolarHBondContact O-N 3.21Å; G109-L111 VanDerWaalsContact C-N 3.25Å; G109-L111 PolarHBondContact O-N 3.2Å; L111-M114 PolarHBondContact O-N 3.24Å; L111-R115 WeakPolarHBondContact O-CG 3.41Å; L111-R115 PolarHBondContact O-N 2.96Å
112	E	96.3	Very high	95	Very high	85 Å²	85	108.4 Å²	108.4	40%	0.397	52%	0.522	S	S	.	.	H	α-helix	trans	-67.8	-40.6	175.7	-71.2	-54.9	144.9	0	0	111.5	R108 G109 M114 R115 L116	R108-E112 PolarHBondContact O-N 2.74Å; R108-E112 VanDerWaalsContact O-N 3.17Å; G109-E112 PolarHBondContact O-N 3.07Å; G109-E112 VanDerWaalsContact O-N 3.08Å; E112-M114 VanDerWaalsContact C-N 3.35Å; E112-M114 PolarHBondContact O-N 3.34Å; E112-R115 WeakPolarHBondContact O-CB 3.3Å; E112-R115 PolarHBondContact O-N 3.47Å; E112-R115 VanDerWaalsContact O-N 3.14Å; E112-R115 IonicContact OE1-CZ 3.86Å; E112-R115 IonicContact OE1-NH1 3.73Å; E112-R115 PolarHBondContact OE1-NH1 3.36Å; E112-L116 WeakPolarHBondContact O-CG 3.3Å; E112-L116 PolarHBondContact O-N 2.88Å
113	D	95.1	Very high	94.9	Very high	108 Å²	108	106.5 Å²	106.5	58%	0.578	52%	0.518	S	S	*	.	H	α-helix	trans	-60.7	-44.4	174.1	-70.1	-18.9	0	0	0	111.4	G109 E110 R115 L116 E117	G109-D113 PolarHBondContact O-N 3.38Å; E110-D113 PolarHBondContact O-N 2.87Å; D113-R115 VanDerWaalsContact C-N 3.32Å; D113-R115 PolarHBondContact O-N 3.01Å; D113-L116 PolarHBondContact O-N 2.86Å; D113-E117 PolarHBondContact O-N 3.16Å
114	M	92.8	Very high	94.9	Very high	131 Å²	131	105.2 Å²	105.2	65%	0.645	51%	0.514	S	S	*	.	H	α-helix	trans	-64.3	-34.6	175.1	-75.7	-145.1	-63.2	0	0	113	E110 L111 E112 E117 K118	E110-M114 WeakPolarHBondContact O-CG 3.45Å; E110-M114 PolarHBondContact O-N 3.45Å; L111-M114 PolarHBondContact O-N 3.24Å; E112-M114 VanDerWaalsContact C-N 3.35Å; E112-M114 PolarHBondContact O-N 3.34Å; M114-E117 PolarHBondContact O-N 3.12Å; M114-K118 WeakPolarHBondContact O-CB 3.4Å; M114-K118 PolarHBondContact O-N 3.3Å
115	R	96	Very high	94.9	Very high	129 Å²	129	104.3 Å²	104.3	49%	0.487	51%	0.512	S	S	.	.	H	α-helix	trans	-66.1	-42.4	174.8	-80.3	173.9	172.5	172.1	-3	111.5	L111 E112 D113 K118 N119	L111-R115 WeakPolarHBondContact O-CG 3.41Å; L111-R115 PolarHBondContact O-N 2.96Å; E112-R115 WeakPolarHBondContact O-CB 3.3Å; E112-R115 PolarHBondContact O-N 3.47Å; E112-R115 VanDerWaalsContact O-N 3.14Å; E112-R115 IonicContact OE1-CZ 3.86Å; E112-R115 IonicContact OE1-NH1 3.73Å; E112-R115 PolarHBondContact OE1-NH1 3.36Å; D113-R115 VanDerWaalsContact C-N 3.32Å; D113-R115 PolarHBondContact O-N 3.01Å; R115-K118 PolarHBondContact O-N 2.97Å; R115-N119 VanDerWaalsContact O-CG 3.23Å; R115-N119 PolarHBondContact O-N 3.03Å; R115-N119 PolarHBondContact O-ND2 2.83Å
116	L	96.5	Very high	94.8	Very high	114 Å²	114	109.8 Å²	109.8	60%	0.597	52%	0.522	S	S	*	.	H	α-helix	trans	-60.5	-46.4	175.4	-74.1	166.1	0	0	0	110.9	E112 D113 N119 R120	E112-L116 WeakPolarHBondContact O-CG 3.3Å; E112-L116 PolarHBondContact O-N 2.88Å; D113-L116 PolarHBondContact O-N 2.86Å; L116-N119 PolarHBondContact O-N 2.89Å; L116-R120 PolarHBondContact O-N 3.15Å
117	E	94.4	Very high	94.8	Very high	93 Å²	93	109.3 Å²	109.3	44%	0.435	53%	0.526	S	S	.	.	H	α-helix	trans	-67.1	-39.1	179.3	-168.6	57	-156.4	0	0	112.2	D113 M114 N119 R120 L121	D113-E117 PolarHBondContact O-N 3.16Å; M114-E117 PolarHBondContact O-N 3.12Å; E117-N119 VanDerWaalsContact C-N 3.33Å; E117-N119 PolarHBondContact O-N 3.18Å; E117-R120 WeakPolarHBondContact O-CB 3.46Å; E117-R120 PolarHBondContact O-N 3.08Å; E117-L121 HydrophobicContact CG-CD1 4.33Å; E117-L121 WeakPolarHBondContact O-CG 3.41Å; E117-L121 PolarHBondContact O-N 2.91Å
118	K	93.9	Very high	94.8	Very high	124 Å²	124	108.2 Å²	108.2	54%	0.539	52%	0.52	S	S	.	.	H	α-helix	trans	-56.3	-47.1	172.1	177.4	-174.8	173.8	-179.1	0	111.5	M114 R115 R120 L121 Q122	M114-K118 WeakPolarHBondContact O-CB 3.4Å; M114-K118 PolarHBondContact O-N 3.3Å; R115-K118 PolarHBondContact O-N 2.97Å; K118-R120 VanDerWaalsContact C-N 3.32Å; K118-R120 PolarHBondContact O-N 3.37Å; K118-L121 PolarHBondContact O-N 3.28Å; K118-Q122 WeakPolarHBondContact O-CB 3.21Å; K118-Q122 WeakPolarHBondContact O-CG 3.44Å; K118-Q122 PolarHBondContact O-N 3.13Å
119	N	95	Very high	94.8	Very high	95 Å²	95	104.5 Å²	104.5	51%	0.508	51%	0.512	S	S	.	.	H	α-helix	trans	-64.4	-39.3	179.9	-68.7	-19.7	0	0	0	111.2	R115 L116 E117 Q122 S123	R115-N119 VanDerWaalsContact O-CG 3.23Å; R115-N119 PolarHBondContact O-N 3.03Å; R115-N119 PolarHBondContact O-ND2 2.83Å; L116-N119 PolarHBondContact O-N 2.89Å; E117-N119 VanDerWaalsContact C-N 3.33Å; E117-N119 PolarHBondContact O-N 3.18Å; N119-Q122 PolarHBondContact O-N 2.72Å; N119-S123 PolarHBondContact O-N 3.02Å; N119-S123 VanDerWaalsContact O-N 3.1Å
120	R	95.9	Very high	94.8	Very high	174 Å²	174	107.4 Å²	107.4	66%	0.657	52%	0.523	S	S	*	.	H	α-helix	trans	-60.8	-50.1	174.4	-173.7	-176.6	175.3	127.7	0.4	111.3	L116 E117 K118 Q122 S123 V124	L116-R120 PolarHBondContact O-N 3.15Å; E117-R120 WeakPolarHBondContact O-CB 3.46Å; E117-R120 PolarHBondContact O-N 3.08Å; K118-R120 VanDerWaalsContact C-N 3.32Å; K118-R120 PolarHBondContact O-N 3.37Å; R120-Q122 PolarHBondContact O-N 3.19Å; R120-S123 WeakPolarHBondContact O-CB 3.34Å; R120-S123 PolarHBondContact O-N 3.32Å; R120-V124 WeakPolarHBondContact O-CG2 3.27Å; R120-V124 PolarHBondContact O-N 3.03Å
121	L	93.8	Very high	94.8	Very high	91 Å²	91	104.9 Å²	104.9	48%	0.476	52%	0.52	S	S	.	.	H	α-helix	trans	-62.2	-41	178.3	-72.1	172.7	0	0	0	112.3	E117 K118 S123 V124 I125	E117-L121 HydrophobicContact CG-CD1 4.33Å; E117-L121 WeakPolarHBondContact O-CG 3.41Å; E117-L121 PolarHBondContact O-N 2.91Å; K118-L121 PolarHBondContact O-N 3.28Å; L121-S123 VanDerWaalsContact C-N 3.28Å; L121-S123 PolarHBondContact O-N 3.17Å; L121-V124 PolarHBondContact O-N 2.84Å; L121-I125 WeakPolarHBondContact O-CG1 3.49Å; L121-I125 PolarHBondContact O-N 2.88Å
122	Q	94.3	Very high	94.7	Very high	106 Å²	106	105.5 Å²	105.5	50%	0.495	52%	0.523	S	S	.	.	H	α-helix	trans	-59.8	-39.5	175.1	-79.5	-176.5	-33.9	0	0	112.2	K118 N119 R120 I125 R126	K118-Q122 WeakPolarHBondContact O-CB 3.21Å; K118-Q122 WeakPolarHBondContact O-CG 3.44Å; K118-Q122 PolarHBondContact O-N 3.13Å; N119-Q122 PolarHBondContact O-N 2.72Å; R120-Q122 PolarHBondContact O-N 3.19Å; Q122-I125 PolarHBondContact O-N 2.64Å; Q122-R126 WeakPolarHBondContact O-CB 3.26Å; Q122-R126 PolarHBondContact O-N 3.03Å
123	S	95.4	Very high	94.6	Very high	73 Å²	73	106.3 Å²	106.3	51%	0.51	53%	0.526	S	S	.	.	H	α-helix	trans	-64.5	-42.5	175.3	-171.7	0	0	0	0	112.2	N119 R120 L121 R126 T127	N119-S123 PolarHBondContact O-N 3.02Å; N119-S123 VanDerWaalsContact O-N 3.1Å; R120-S123 WeakPolarHBondContact O-CB 3.34Å; R120-S123 PolarHBondContact O-N 3.32Å; L121-S123 VanDerWaalsContact C-N 3.28Å; L121-S123 PolarHBondContact O-N 3.17Å; S123-R126 PolarHBondContact O-N 3Å; S123-T127 PolarHBondContact O-N 2.89Å; S123-T127 PolarHBondContact O-OG1 2.8Å
124	V	95.8	Very high	94.6	Very high	65 Å²	65	104 Å²	104	39%	0.394	52%	0.519	S	S	.	.	H	α-helix	trans	-62.5	-48.4	175.5	174.5	0	0	0	0	111.1	R120 L121 R126 T127 Q128	R120-V124 WeakPolarHBondContact O-CG2 3.27Å; R120-V124 PolarHBondContact O-N 3.03Å; L121-V124 PolarHBondContact O-N 2.84Å; V124-R126 VanDerWaalsContact C-N 3.32Å; V124-R126 PolarHBondContact O-N 2.94Å; V124-T127 WeakPolarHBondContact O-CB 3.18Å; V124-T127 PolarHBondContact O-N 3.11Å; V124-T127 VanDerWaalsContact O-N 3.12Å; V124-Q128 HydrophobicContact CG1-CG 4.39Å; V124-Q128 WeakPolarHBondContact O-CG 3.41Å; V124-Q128 PolarHBondContact O-N 3.28Å
125	I	94.3	Very high	94.6	Very high	94 Å²	94	102.9 Å²	102.9	48%	0.482	52%	0.515	S	S	.	.	H	α-helix	trans	-58.3	-45.6	178.3	-70.6	168.2	0	0	0	110.5	L121 Q122 T127 Q128 M129	L121-I125 WeakPolarHBondContact O-CG1 3.49Å; L121-I125 PolarHBondContact O-N 2.88Å; Q122-I125 PolarHBondContact O-N 2.64Å; I125-T127 VanDerWaalsContact C-N 3.27Å; I125-T127 PolarHBondContact O-N 2.83Å; I125-Q128 PolarHBondContact O-N 3.44Å; I125-M129 HydrophobicContact CG2-CG 4.49Å; I125-M129 HydrophobicContact CG2-SD 4.14Å; I125-M129 WeakPolarHBondContact O-CG 3.15Å; I125-M129 PolarHBondContact O-N 3.43Å
126	R	94.8	Very high	94.4	Very high	186 Å²	186	101.5 Å²	101.5	70%	0.702	51%	0.514	S	S	*	.	H	α-helix	trans	-60.7	-39.9	178.4	-161.4	176.8	99.5	153.3	5.7	111.7	Q122 S123 V124 V130	Q122-R126 WeakPolarHBondContact O-CB 3.26Å; Q122-R126 PolarHBondContact O-N 3.03Å; S123-R126 PolarHBondContact O-N 3Å; V124-R126 VanDerWaalsContact C-N 3.32Å; V124-R126 PolarHBondContact O-N 2.94Å; R126-V130 WeakPolarHBondContact O-CG2 3.4Å; R126-V130 PolarHBondContact O-N 2.98Å
127	T	94.5	Very high	94.2	Very high	93 Å²	93	104.4 Å²	104.4	57%	0.571	52%	0.517	S	S	*	.	H	α-helix	trans	-67.3	-42.8	177.4	-53.4	0	0	0	0	111.3	S123 V124 I125 V130 A131	S123-T127 PolarHBondContact O-N 2.89Å; S123-T127 PolarHBondContact O-OG1 2.8Å; V124-T127 WeakPolarHBondContact O-CB 3.18Å; V124-T127 PolarHBondContact O-N 3.11Å; V124-T127 VanDerWaalsContact O-N 3.12Å; I125-T127 VanDerWaalsContact C-N 3.27Å; I125-T127 PolarHBondContact O-N 2.83Å; T127-V130 PolarHBondContact O-N 3.3Å; T127-A131 PolarHBondContact O-N 3.14Å
128	Q	93.4	Very high	94.1	Very high	115 Å²	115	105.8 Å²	105.8	54%	0.537	52%	0.524	S	S	.	.	H	α-helix	trans	-65.6	-39.5	177.2	-74.8	-177.8	-19	0	0	112.4	V124 I125 V130 A131 I132	V124-Q128 HydrophobicContact CG1-CG 4.39Å; V124-Q128 WeakPolarHBondContact O-CG 3.41Å; V124-Q128 PolarHBondContact O-N 3.28Å; I125-Q128 PolarHBondContact O-N 3.44Å; Q128-V130 VanDerWaalsContact C-N 3.33Å; Q128-V130 PolarHBondContact O-N 2.84Å; Q128-A131 WeakPolarHBondContact O-CB 3.25Å; Q128-A131 PolarHBondContact O-N 3.17Å; Q128-A131 VanDerWaalsContact O-N 3.14Å; Q128-I132 WeakPolarHBondContact O-CG1 3.34Å; Q128-I132 PolarHBondContact O-N 3.27Å
129	M	93.7	Very high	93.9	Very high	102 Å²	102	105.4 Å²	105.4	50%	0.502	53%	0.527	S	S	.	.	H	α-helix	trans	-56.5	-46.7	175	-81.9	171.7	35.2	0	0	111.9	I125 A131 I132 E133	I125-M129 HydrophobicContact CG2-CG 4.49Å; I125-M129 HydrophobicContact CG2-SD 4.14Å; I125-M129 WeakPolarHBondContact O-CG 3.15Å; I125-M129 PolarHBondContact O-N 3.43Å; M129-A131 VanDerWaalsContact C-N 3.29Å; M129-A131 PolarHBondContact O-N 3.14Å; M129-I132 PolarHBondContact O-N 3.42Å; M129-E133 PolarHBondContact O-N 2.87Å
130	V	95.6	Very high	93.7	Very high	95 Å²	95	109.6 Å²	109.6	58%	0.576	54%	0.535	S	S	*	.	H	α-helix	trans	-62.5	-38.8	177.5	175.5	0	0	0	0	111.2	R126 T127 Q128 S134	R126-V130 WeakPolarHBondContact O-CG2 3.4Å; R126-V130 PolarHBondContact O-N 2.98Å; T127-V130 PolarHBondContact O-N 3.3Å; Q128-V130 VanDerWaalsContact C-N 3.33Å; Q128-V130 PolarHBondContact O-N 2.84Å; V130-S134 PolarHBondContact O-N 2.79Å; V130-S134 VanDerWaalsContact O-N 3.14Å
131	A	93.9	Very high	93.4	Very high	50 Å²	50	105.4 Å²	105.4	41%	0.413	53%	0.529	S	S	.	.	H	α-helix	trans	-66.2	-41.1	176.4	0	0	0	0	0	112.3	T127 Q128 M129 S134 L135	T127-A131 PolarHBondContact O-N 3.14Å; Q128-A131 WeakPolarHBondContact O-CB 3.25Å; Q128-A131 PolarHBondContact O-N 3.17Å; Q128-A131 VanDerWaalsContact O-N 3.14Å; M129-A131 VanDerWaalsContact C-N 3.29Å; M129-A131 PolarHBondContact O-N 3.14Å; A131-S134 WeakPolarHBondContact O-CB 3.5Å; A131-S134 PolarHBondContact O-N 2.64Å; A131-L135 WeakPolarHBondContact O-CG 3.25Å; A131-L135 PolarHBondContact O-N 3.06Å
132	I	93.1	Very high	93	Very high	93 Å²	93	103.8 Å²	103.8	48%	0.477	53%	0.528	S	S	.	.	H	α-helix	trans	-63.8	-46.5	177	-69.2	166.5	0	0	0	110.4	Q128 M129 S134 L135 E136	Q128-I132 WeakPolarHBondContact O-CG1 3.34Å; Q128-I132 PolarHBondContact O-N 3.27Å; M129-I132 PolarHBondContact O-N 3.42Å; I132-S134 PolarHBondContact O-N 3.07Å; I132-L135 PolarHBondContact O-N 2.76Å; I132-L135 VanDerWaalsContact O-N 3.11Å; I132-E136 HydrophobicContact CG2-CG 4.36Å; I132-E136 WeakPolarHBondContact O-CG 3.35Å; I132-E136 PolarHBondContact O-N 2.8Å
133	E	94.1	Very high	92.5	Very high	101 Å²	101	102.4 Å²	102.4	47%	0.472	53%	0.527	S	S	.	.	H	α-helix	trans	-57.9	-38.5	176.2	-75.6	-176.4	-173.2	0	0	112.2	M129 R137	M129-E133 PolarHBondContact O-N 2.87Å; E133-R137 WeakPolarHBondContact O-CG 3.5Å; E133-R137 PolarHBondContact O-N 3.02Å
134	S	94.6	Very high	91.9	Very high	60 Å²	60	101.9 Å²	101.9	42%	0.42	52%	0.524	S	S	.	.	H	α-helix	trans	-64.8	-46.2	174.9	-174	0	0	0	0	111.9	V130 A131 I132 R137 Q138	V130-S134 PolarHBondContact O-N 2.79Å; V130-S134 VanDerWaalsContact O-N 3.14Å; A131-S134 WeakPolarHBondContact O-CB 3.5Å; A131-S134 PolarHBondContact O-N 2.64Å; I132-S134 PolarHBondContact O-N 3.07Å; S134-R137 PolarHBondContact O-N 3.23Å; S134-Q138 WeakPolarHBondContact O-CG 3.49Å; S134-Q138 PolarHBondContact O-N 3.04Å; S134-Q138 VanDerWaalsContact O-N 3.07Å
135	L	92.8	Very high	91.4	Very high	107 Å²	107	103.8 Å²	103.8	56%	0.56	53%	0.532	S	S	*	.	H	α-helix	trans	-63.3	-40.7	177.2	-73.5	170	0	0	0	112.3	A131 I132 R137 Q138 L139	A131-L135 WeakPolarHBondContact O-CG 3.25Å; A131-L135 PolarHBondContact O-N 3.06Å; I132-L135 PolarHBondContact O-N 2.76Å; I132-L135 VanDerWaalsContact O-N 3.11Å; L135-R137 VanDerWaalsContact C-N 3.32Å; L135-R137 PolarHBondContact O-N 3.11Å; L135-Q138 PolarHBondContact O-N 2.86Å; L135-L139 WeakPolarHBondContact O-CB 3.37Å; L135-L139 PolarHBondContact O-N 2.77Å
136	E	91.9	Very high	90.7	Very high	101 Å²	101	103.7 Å²	103.7	47%	0.472	53%	0.532	S	S	.	.	H	α-helix	trans	-60.6	-41.5	175.3	-76.1	-172.6	174.5	0	0	111.9	I132 L139 R140	I132-E136 HydrophobicContact CG2-CG 4.36Å; I132-E136 WeakPolarHBondContact O-CG 3.35Å; I132-E136 PolarHBondContact O-N 2.8Å; E136-L139 PolarHBondContact O-N 3.31Å; E136-R140 WeakPolarHBondContact O-CG 3.48Å; E136-R140 PolarHBondContact O-N 3.39Å
137	R	93.1	Very high	90	Very high	175 Å²	175	98.1 Å²	98.1	66%	0.66	52%	0.519	S	S	*	.	H	α-helix	trans	-62.1	-45.4	175.2	-71.9	176.8	-168.4	-176.6	6.2	111.2	E133 S134 L135 L139 R140 V141	E133-R137 WeakPolarHBondContact O-CG 3.5Å; E133-R137 PolarHBondContact O-N 3.02Å; S134-R137 PolarHBondContact O-N 3.23Å; L135-R137 VanDerWaalsContact C-N 3.32Å; L135-R137 PolarHBondContact O-N 3.11Å; R137-L139 PolarHBondContact O-N 3.04Å; R137-R140 PolarHBondContact O-N 3.44Å; R137-V141 WeakPolarHBondContact O-CG2 3.26Å; R137-V141 PolarHBondContact O-N 2.8Å
138	Q	93	Very high	89.4	Confident	122 Å²	122	96.4 Å²	96.4	57%	0.57	51%	0.514	S	S	*	.	H	α-helix	trans	-61.6	-43.4	177.2	-70.3	-178.8	-0.4	0	0	111.9	S134 L135 R140 V141 A142	S134-Q138 WeakPolarHBondContact O-CG 3.49Å; S134-Q138 PolarHBondContact O-N 3.04Å; S134-Q138 VanDerWaalsContact O-N 3.07Å; L135-Q138 PolarHBondContact O-N 2.86Å; Q138-R140 PolarHBondContact O-N 2.85Å; Q138-V141 PolarHBondContact O-N 3.42Å; Q138-A142 PolarHBondContact O-N 3Å
139	L	89.4	Confident	88.8	Confident	116 Å²	116	95.8 Å²	95.8	61%	0.607	51%	0.514	S	S	*	.	H	α-helix	trans	-64.2	-39.5	179.3	-173.4	64.2	0	0	0	112.1	L135 E136 R137 A142 T143	L135-L139 WeakPolarHBondContact O-CB 3.37Å; L135-L139 PolarHBondContact O-N 2.77Å; E136-L139 PolarHBondContact O-N 3.31Å; R137-L139 PolarHBondContact O-N 3.04Å; L139-A142 PolarHBondContact O-N 3.18Å; L139-T143 WeakPolarHBondContact O-CB 3.4Å; L139-T143 PolarHBondContact O-N 2.92Å; L139-T143 PolarHBondContact O-OG1 3.16Å
140	R	90.1	Very high	88.2	Confident	182 Å²	182	96.3 Å²	96.3	69%	0.687	52%	0.515	S	S	*	.	H	α-helix	trans	-60.2	-45.5	175	-75	179.9	-170.7	-172.3	6	111.8	E136 R137 Q138 T143 S144	E136-R140 WeakPolarHBondContact O-CG 3.48Å; E136-R140 PolarHBondContact O-N 3.39Å; R137-R140 PolarHBondContact O-N 3.44Å; Q138-R140 PolarHBondContact O-N 2.85Å; R140-T143 PolarHBondContact O-N 2.97Å; R140-S144 PolarHBondContact O-N 3.31Å; R140-S144 PolarHBondContact O-OG 2.99Å
141	V	89.5	Confident	87.6	Confident	87 Å²	87	99.1 Å²	99.1	53%	0.527	52%	0.52	S	S	.	.	H	α-helix	trans	-64.3	-43.1	177.4	175.3	0	0	0	0	111.4	R137 Q138 T143 S144 N145	R137-V141 WeakPolarHBondContact O-CG2 3.26Å; R137-V141 PolarHBondContact O-N 2.8Å; Q138-V141 PolarHBondContact O-N 3.42Å; V141-T143 VanDerWaalsContact C-N 3.31Å; V141-T143 PolarHBondContact O-N 2.65Å; V141-S144 PolarHBondContact O-N 2.79Å; V141-S144 PolarHBondContact O-OG 3.46Å; V141-N145 VanDerWaalsContact O-CG 3.3Å; V141-N145 PolarHBondContact O-N 3.09Å; V141-N145 VanDerWaalsContact O-N 3.13Å
142	A	85.1	Confident	87.1	Confident	56 Å²	56	102.8 Å²	102.8	46%	0.463	53%	0.528	S	S	.	.	H	α-helix	trans	-62	-39.6	176.3	0	0	0	0	0	112	Q138 L139 N145 N146	Q138-A142 PolarHBondContact O-N 3Å; L139-A142 PolarHBondContact O-N 3.18Å; A142-N145 PolarHBondContact O-N 2.86Å; A142-N146 WeakPolarHBondContact O-CB 3.37Å; A142-N146 PolarHBondContact O-N 3.17Å
143	T	85	Confident	86.5	Confident	77 Å²	77	104.1 Å²	104.1	47%	0.472	53%	0.532	S	S	.	.	H	α-helix	trans	-68.6	-40.2	-179.9	-53.5	0	0	0	0	112.3	L139 R140 V141 N145 N146 T147	L139-T143 WeakPolarHBondContact O-CB 3.4Å; L139-T143 PolarHBondContact O-N 2.92Å; L139-T143 PolarHBondContact O-OG1 3.16Å; R140-T143 PolarHBondContact O-N 2.97Å; V141-T143 VanDerWaalsContact C-N 3.31Å; V141-T143 PolarHBondContact O-N 2.65Å; T143-N145 VanDerWaalsContact C-N 3.34Å; T143-N146 PolarHBondContact O-N 3.34Å; T143-T147 PolarHBondContact O-N 2.93Å; T143-T147 PolarHBondContact O-OG1 2.81Å
144	S	83.1	Confident	85.9	Confident	63 Å²	63	102.1 Å²	102.1	44%	0.441	53%	0.533	S	S	.	.	H	α-helix	trans	-64.9	-38.6	175	57.2	0	0	0	0	112.3	R140 V141 T147 A148	R140-S144 PolarHBondContact O-N 3.31Å; R140-S144 PolarHBondContact O-OG 2.99Å; V141-S144 PolarHBondContact O-N 2.79Å; V141-S144 PolarHBondContact O-OG 3.46Å; S144-T147 WeakPolarHBondContact CA-OG1 3.49Å; S144-T147 PolarHBondContact O-N 3.05Å; S144-T147 PolarHBondContact O-OG1 2.82Å; S144-A148 PolarHBondContact O-N 2.88Å; S144-A148 VanDerWaalsContact O-N 3.1Å
145	N	84	Confident	85.3	Confident	104 Å²	104	105.3 Å²	105.3	56%	0.556	54%	0.542	S	S	*	.	H	α-helix	trans	-65.9	-40.4	175.8	-69.8	-8.8	0	0	0	111.4	V141 A142 T143 A148 L149	V141-N145 VanDerWaalsContact O-CG 3.3Å; V141-N145 PolarHBondContact O-N 3.09Å; V141-N145 VanDerWaalsContact O-N 3.13Å; A142-N145 PolarHBondContact O-N 2.86Å; T143-N145 VanDerWaalsContact C-N 3.34Å; N145-A148 PolarHBondContact O-N 3.26Å; N145-L149 PolarHBondContact O-N 3.34Å
146	N	79.2	Confident	84.8	Confident	92 Å²	92	105.9 Å²	105.9	49%	0.492	55%	0.545	S	S	.	.	H	α-helix	trans	-66.2	-38.5	179	-155.1	1.9	0	0	0	112.2	A142 T143 L149 Q150	A142-N146 WeakPolarHBondContact O-CB 3.37Å; A142-N146 PolarHBondContact O-N 3.17Å; T143-N146 PolarHBondContact O-N 3.34Å; N146-L149 PolarHBondContact O-N 3.23Å; N146-Q150 WeakPolarHBondContact O-CB 3.43Å; N146-Q150 WeakPolarHBondContact O-CG 3.04Å; N146-Q150 PolarHBondContact O-N 2.94Å
147	T	81.5	Confident	84.2	Confident	70 Å²	70	106.3 Å²	106.3	43%	0.429	55%	0.548	S	S	.	.	H	α-helix	trans	-67.6	-35.8	174.2	28.5	0	0	0	0	112.8	T143 S144 K151	T143-T147 PolarHBondContact O-N 2.93Å; T143-T147 PolarHBondContact O-OG1 2.81Å; S144-T147 WeakPolarHBondContact CA-OG1 3.49Å; S144-T147 PolarHBondContact O-N 3.05Å; S144-T147 PolarHBondContact O-OG1 2.82Å; T147-K151 WeakPolarHBondContact O-CG 3.43Å; T147-K151 PolarHBondContact O-N 3.49Å
148	A	81.9	Confident	83.7	Confident	56 Å²	56	104.3 Å²	104.3	46%	0.463	55%	0.546	S	S	.	.	H	α-helix	trans	-64.4	-43.3	172.3	0	0	0	0	0	111.7	S144 N145 K151 Q152	S144-A148 PolarHBondContact O-N 2.88Å; S144-A148 VanDerWaalsContact O-N 3.1Å; N145-A148 PolarHBondContact O-N 3.26Å; A148-K151 WeakPolarHBondContact O-CB 3.5Å; A148-K151 PolarHBondContact O-N 3.38Å; A148-Q152 PolarHBondContact O-N 3.19Å
149	L	79.6	Confident	83.2	Confident	102 Å²	102	101.4 Å²	101.4	53%	0.534	54%	0.539	S	S	.	.	H	α-helix	trans	-63.7	-42.3	176.3	-171.3	67.1	0	0	0	111.9	N145 N146 K151 Q152 Q153	N145-L149 PolarHBondContact O-N 3.34Å; N146-L149 PolarHBondContact O-N 3.23Å; L149-K151 VanDerWaalsContact C-N 3.33Å; L149-K151 PolarHBondContact O-N 3.19Å; L149-Q152 PolarHBondContact O-N 3.11Å; L149-Q153 WeakPolarHBondContact O-CB 3.33Å; L149-Q153 PolarHBondContact O-N 3.42Å
150	Q	81.1	Confident	82.7	Confident	113 Å²	113	99.3 Å²	99.3	53%	0.528	53%	0.531	S	S	.	.	H	α-helix	trans	-60.4	-40	173.6	-78.7	-179.2	-20.6	0	0	112.3	N146 Q153 A154	N146-Q150 WeakPolarHBondContact O-CB 3.43Å; N146-Q150 WeakPolarHBondContact O-CG 3.04Å; N146-Q150 PolarHBondContact O-N 2.94Å; Q150-Q153 PolarHBondContact O-N 2.92Å; Q150-A154 WeakPolarHBondContact O-CB 3.41Å; Q150-A154 PolarHBondContact O-N 3.38Å
151	K	83.1	Confident	82.2	Confident	154 Å²	154	95.7 Å²	95.7	67%	0.67	52%	0.522	S	S	*	.	H	α-helix	trans	-63.4	-43.3	174.3	-78.1	-178.5	178.6	-178	0	112	T147 A148 L149 Q153 A154 Q155	T147-K151 WeakPolarHBondContact O-CG 3.43Å; T147-K151 PolarHBondContact O-N 3.49Å; A148-K151 WeakPolarHBondContact O-CB 3.5Å; A148-K151 PolarHBondContact O-N 3.38Å; L149-K151 VanDerWaalsContact C-N 3.33Å; L149-K151 PolarHBondContact O-N 3.19Å; K151-Q153 VanDerWaalsContact C-N 3.35Å; K151-A154 PolarHBondContact O-N 3.35Å; K151-Q155 WeakPolarHBondContact O-CG 3.3Å; K151-Q155 PolarHBondContact O-N 2.97Å
152	Q	83.9	Confident	81.7	Confident	128 Å²	128	94.9 Å²	94.9	60%	0.598	52%	0.517	S	S	*	.	H	α-helix	trans	-61.4	-42.6	173.4	-91.3	-175.9	-39.2	0	0	111.9	A148 L149 A154 Q155 L156	A148-Q152 PolarHBondContact O-N 3.19Å; L149-Q152 PolarHBondContact O-N 3.11Å; Q152-A154 VanDerWaalsContact C-N 3.33Å; Q152-A154 PolarHBondContact O-N 2.87Å; Q152-Q155 PolarHBondContact O-N 2.87Å; Q152-L156 WeakPolarHBondContact O-CB 3.49Å; Q152-L156 PolarHBondContact O-N 2.86Å
153	Q	80.4	Confident	81.3	Confident	120 Å²	120	97.1 Å²	97.1	56%	0.561	52%	0.521	S	S	*	.	H	α-helix	trans	-63.9	-38	178.3	-165.8	179.9	2.8	0	0	111.9	L149 Q150 K151 L156 M157	L149-Q153 WeakPolarHBondContact O-CB 3.33Å; L149-Q153 PolarHBondContact O-N 3.42Å; Q150-Q153 PolarHBondContact O-N 2.92Å; K151-Q153 VanDerWaalsContact C-N 3.35Å; Q153-L156 PolarHBondContact O-N 3.22Å; Q153-M157 WeakPolarHBondContact O-CB 3.14Å; Q153-M157 PolarHBondContact O-N 3.21Å
154	A	80.7	Confident	80.8	Confident	59 Å²	59	98 Å²	98	49%	0.488	52%	0.521	S	S	.	.	H	α-helix	trans	-66.1	-44.4	175.2	0	0	0	0	0	112.3	Q150 K151 Q152 L156 M157 E158	Q150-A154 WeakPolarHBondContact O-CB 3.41Å; Q150-A154 PolarHBondContact O-N 3.38Å; K151-A154 PolarHBondContact O-N 3.35Å; Q152-A154 VanDerWaalsContact C-N 3.33Å; Q152-A154 PolarHBondContact O-N 2.87Å; A154-L156 VanDerWaalsContact C-N 3.32Å; A154-L156 PolarHBondContact O-N 3.4Å; A154-M157 PolarHBondContact O-N 3.25Å; A154-E158 PolarHBondContact O-N 3.07Å
155	Q	83.7	Confident	80	Confident	127 Å²	127	99.9 Å²	99.9	59%	0.593	53%	0.527	S	S	*	.	H	α-helix	trans	-62.8	-38.7	175.6	-74.8	177.4	-21.5	0	0	112.2	K151 Q152 E158 S159	K151-Q155 WeakPolarHBondContact O-CG 3.3Å; K151-Q155 PolarHBondContact O-N 2.97Å; Q152-Q155 PolarHBondContact O-N 2.87Å; Q155-E158 PolarHBondContact O-N 3.19Å; Q155-S159 WeakPolarHBondContact O-CB 3.41Å; Q155-S159 PolarHBondContact O-N 3.39Å; Q155-S159 PolarHBondContact O-OG 2.99Å
156	L	82.4	Confident	79.2	Confident	120 Å²	120	100.3 Å²	100.3	63%	0.628	53%	0.527	S	S	*	.	H	α-helix	trans	-66.8	-42.8	175.7	-165.4	73.8	0	0	0	111	Q152 Q153 A154 E158 S159 V160	Q152-L156 WeakPolarHBondContact O-CB 3.49Å; Q152-L156 PolarHBondContact O-N 2.86Å; Q153-L156 PolarHBondContact O-N 3.22Å; A154-L156 VanDerWaalsContact C-N 3.32Å; A154-L156 PolarHBondContact O-N 3.4Å; L156-E158 VanDerWaalsContact C-N 3.35Å; L156-E158 PolarHBondContact O-N 3.47Å; L156-S159 WeakPolarHBondContact O-CB 3.39Å; L156-S159 PolarHBondContact O-N 3.41Å; L156-V160 VanDerWaalsContact O-CG2 3.3Å; L156-V160 WeakPolarHBondContact O-CG2 3.29Å; L156-V160 PolarHBondContact O-N 3.49Å
157	M	78.3	Confident	78.4	Confident	110 Å²	110	100.4 Å²	100.4	54%	0.542	53%	0.531	S	S	.	.	H	α-helix	trans	-60.1	-42.4	174	-89.3	-124.3	-138	0	0	112.4	Q153 A154 V160 H161	Q153-M157 WeakPolarHBondContact O-CB 3.14Å; Q153-M157 PolarHBondContact O-N 3.21Å; A154-M157 PolarHBondContact O-N 3.25Å; M157-V160 PolarHBondContact O-N 3.4Å; M157-H161 PolarHBondContact O-N 3.4Å; M157-H161 PolarHBondContact O-ND1 3.04Å
158	E	81.8	Confident	77.2	Confident	133 Å²	133	99.4 Å²	99.4	62%	0.621	53%	0.529	S	S	*	.	H	α-helix	trans	-65.1	-40.7	177.2	-172.3	170.9	-164	0	0	111.4	A154 Q155 L156 V160 H161 T162	A154-E158 PolarHBondContact O-N 3.07Å; Q155-E158 PolarHBondContact O-N 3.19Å; L156-E158 VanDerWaalsContact C-N 3.35Å; L156-E158 PolarHBondContact O-N 3.47Å; E158-V160 VanDerWaalsContact C-N 3.32Å; E158-V160 PolarHBondContact O-N 2.87Å; E158-H161 PolarHBondContact O-N 3.35Å; E158-T162 WeakPolarHBondContact O-CG2 3.48Å; E158-T162 PolarHBondContact O-N 3.12Å; E158-T162 PolarHBondContact O-OG1 3.03Å
159	S	82.5	Confident	75.8	Confident	61 Å²	61	102.3 Å²	102.3	43%	0.427	54%	0.541	S	S	.	.	H	α-helix	trans	-62.4	-38.8	173	-55.4	0	0	0	0	111.9	Q155 L156 T162 L163	Q155-S159 WeakPolarHBondContact O-CB 3.41Å; Q155-S159 PolarHBondContact O-N 3.39Å; Q155-S159 PolarHBondContact O-OG 2.99Å; L156-S159 WeakPolarHBondContact O-CB 3.39Å; L156-S159 PolarHBondContact O-N 3.41Å; S159-T162 WeakPolarHBondContact CA-OG1 3.31Å; S159-T162 PolarHBondContact O-OG1 3.23Å; S159-L163 WeakPolarHBondContact O-CB 3.14Å; S159-L163 WeakPolarHBondContact O-CD1 3.45Å; S159-L163 VanDerWaalsContact O-CG 3.24Å; S159-L163 WeakPolarHBondContact O-CG 3.4Å; S159-L163 PolarHBondContact O-N 2.99Å; S159-L163 VanDerWaalsContact O-N 3.1Å
160	V	80.8	Confident	74.2	Confident	71 Å²	71	102.9 Å²	102.9	43%	0.43	55%	0.549	S	S	.	.	H	α-helix	trans	-68.3	-41.6	174.4	170.3	0	0	0	0	111.4	L156 M157 E158 L163 I164	L156-V160 VanDerWaalsContact O-CG2 3.3Å; L156-V160 WeakPolarHBondContact O-CG2 3.29Å; L156-V160 PolarHBondContact O-N 3.49Å; M157-V160 PolarHBondContact O-N 3.4Å; E158-V160 VanDerWaalsContact C-N 3.32Å; E158-V160 PolarHBondContact O-N 2.87Å; V160-L163 PolarHBondContact O-N 2.83Å; V160-I164 HydrophobicContact CG1-CD1 3.82Å; V160-I164 HydrophobicContact CG1-CG1 4.42Å; V160-I164 VanDerWaalsContact O-CG1 3.27Å; V160-I164 WeakPolarHBondContact O-CG1 3.03Å; V160-I164 PolarHBondContact O-N 3.17Å
161	H	77.8	Confident	72.6	Confident	107 Å²	107	101.6 Å²	101.6	50%	0.495	55%	0.549	S	S	.	.	H	α-helix	trans	-65.1	-41.8	177.4	-79.1	77.5	0	0	0	112	M157 E158 L163 I164 D165	M157-H161 PolarHBondContact O-N 3.4Å; M157-H161 PolarHBondContact O-ND1 3.04Å; E158-H161 PolarHBondContact O-N 3.35Å; H161-L163 VanDerWaalsContact C-N 3.32Å; H161-L163 PolarHBondContact O-N 2.03Å; H161-I164 WeakPolarHBondContact O-CB 3.36Å; H161-I164 PolarHBondContact O-N 2.95Å; H161-I164 VanDerWaalsContact O-N 3.17Å; H161-D165 PolarHBondContact O-N 3.16Å
162	T	79.9	Confident	71	Confident	70 Å²	70	98.1 Å²	98.1	43%	0.429	56%	0.557	S	S	.	*	H	α-helix	trans	-64.3	-36	175.2	49.8	0	0	0	0	112.5	E158 S159 D165 M166	E158-T162 WeakPolarHBondContact O-CG2 3.48Å; E158-T162 PolarHBondContact O-N 3.12Å; E158-T162 PolarHBondContact O-OG1 3.03Å; S159-T162 WeakPolarHBondContact CA-OG1 3.31Å; S159-T162 PolarHBondContact O-OG1 3.23Å; T162-D165 PolarHBondContact O-N 3.49Å; T162-M166 PolarHBondContact O-N 3.43Å
163	L	76.4	Confident	68.7	Low	103 Å²	103	98.2 Å²	98.2	54%	0.539	57%	0.567	S	S	.	*	H	α-helix	trans	-66.2	-41.9	170.8	-72.7	166.5	0	0	0	112	S159 V160 H161 M166 V167	S159-L163 WeakPolarHBondContact O-CB 3.14Å; S159-L163 WeakPolarHBondContact O-CD1 3.45Å; S159-L163 VanDerWaalsContact O-CG 3.24Å; S159-L163 WeakPolarHBondContact O-CG 3.4Å; S159-L163 PolarHBondContact O-N 2.99Å; S159-L163 VanDerWaalsContact O-N 3.1Å; V160-L163 PolarHBondContact O-N 2.83Å; H161-L163 VanDerWaalsContact C-N 3.32Å; H161-L163 PolarHBondContact O-N 2.03Å; L163-M166 HydrophobicContact CD2-CE 3.92Å; L163-M166 HydrophobicContact CG-CE 4.5Å; L163-M166 PolarHBondContact O-N 2.83Å; L163-V167 VanDerWaalsContact O-CG2 3.3Å; L163-V167 WeakPolarHBondContact O-CG2 3.38Å; L163-V167 PolarHBondContact O-N 3.33Å
164	I	73.8	Confident	67.2	Low	94 Å²	94	97.8 Å²	97.8	48%	0.482	58%	0.577	S	S	.	*	H	α-helix	trans	-61.9	-42.2	174.8	-70.7	166.7	0	0	0	110.8	V160 H161 V167 A168	V160-I164 HydrophobicContact CG1-CD1 3.82Å; V160-I164 HydrophobicContact CG1-CG1 4.42Å; V160-I164 VanDerWaalsContact O-CG1 3.27Å; V160-I164 WeakPolarHBondContact O-CG1 3.03Å; V160-I164 PolarHBondContact O-N 3.17Å; H161-I164 WeakPolarHBondContact O-CB 3.36Å; H161-I164 PolarHBondContact O-N 2.95Å; H161-I164 VanDerWaalsContact O-N 3.17Å; I164-V167 CarbonylContact O-C 3.29Å; I164-V167 PolarHBondContact O-N 2.93Å; I164-A168 WeakPolarHBondContact O-CB 3.48Å; I164-A168 PolarHBondContact O-N 3Å
165	D	67.2	Low	65.2	Low	104 Å²	104	104.3 Å²	104.3	56%	0.556	59%	0.594	S	S	*	*	H	α-helix	trans	-68.6	-35.8	178	-80	-13.8	0	0	0	112.3	H161 T162 V167 A168 T169	H161-D165 PolarHBondContact O-N 3.16Å; T162-D165 PolarHBondContact O-N 3.49Å; D165-V167 VanDerWaalsContact C-N 3.3Å; D165-V167 PolarHBondContact O-N 2.64Å; D165-A168 PolarHBondContact O-N 3.26Å; D165-T169 WeakPolarHBondContact O-CB 3.3Å; D165-T169 WeakPolarHBondContact O-CG2 3.41Å; D165-T169 PolarHBondContact O-N 3.32Å; D165-T169 PolarHBondContact O-OG1 3.35Å
166	M	66.4	Low	63.4	Low	113 Å²	113	106 Å²	106	56%	0.557	61%	0.607	S	S	*	*	H	α-helix	trans	-64.9	-33.5	170.3	-83.1	-171	-75.9	0	0	112.4	T162 L163 T169	T162-M166 PolarHBondContact O-N 3.43Å; L163-M166 HydrophobicContact CD2-CE 3.92Å; L163-M166 HydrophobicContact CG-CE 4.5Å; L163-M166 PolarHBondContact O-N 2.83Å; M166-T169 WeakPolarHBondContact CA-OG1 3.05Å; M166-T169 PolarHBondContact O-OG1 2.8Å
167	V	62.9	Low	61.2	Low	94 Å²	94	106.7 Å²	106.7	57%	0.57	62%	0.617	S	S	*	*	H	α-helix	trans	-75.3	-36.7	174	174.1	0	0	0	0	111.2	L163 I164 D165 T170 T171	L163-V167 VanDerWaalsContact O-CG2 3.3Å; L163-V167 WeakPolarHBondContact O-CG2 3.38Å; L163-V167 PolarHBondContact O-N 3.33Å; I164-V167 CarbonylContact O-C 3.29Å; I164-V167 PolarHBondContact O-N 2.93Å; D165-V167 VanDerWaalsContact C-N 3.3Å; D165-V167 PolarHBondContact O-N 2.64Å; V167-T170 PolarHBondContact O-N 2.83Å; V167-T170 PolarHBondContact O-OG1 3.35Å; V167-T171 PolarHBondContact O-OG1 3.35Å; V167-T171 VanDerWaalsContact O-OG1 3.1Å
168	A	56.4	Low	59.2	Low	49 Å²	49	111 Å²	111	41%	0.405	63%	0.632	S	S	.	*	H	α-helix	trans	-70.5	-29.5	176.7	0	0	0	0	0	113	I164 D165 T170 T171	I164-A168 WeakPolarHBondContact O-CB 3.48Å; I164-A168 PolarHBondContact O-N 3Å; D165-A168 PolarHBondContact O-N 3.26Å; A168-T170 VanDerWaalsContact C-N 3.29Å; A168-T170 PolarHBondContact O-N 3.2Å; A168-T171 CarbonylContact O-C 3.57Å; A168-T171 VanDerWaalsContact O-C 3.29Å; A168-T171 PolarHBondContact O-N 2.84Å
169	T	51.7	Low	57	Low	117 Å²	117	116.1 Å²	116.1	72%	0.718	65%	0.646	S	S	*	*	H	α-helix	trans	-74.2	-15.6	176	43.6	0	0	0	0	113.9	D165 M166	D165-T169 WeakPolarHBondContact O-CB 3.3Å; D165-T169 WeakPolarHBondContact O-CG2 3.41Å; D165-T169 PolarHBondContact O-N 3.32Å; D165-T169 PolarHBondContact O-OG1 3.35Å; M166-T169 WeakPolarHBondContact CA-OG1 3.05Å; M166-T169 PolarHBondContact O-OG1 2.8Å
170	T	47.6	Very low	54.8	Low	114 Å²	114	121.5 Å²	121.5	70%	0.699	67%	0.669	S	S	*	*	H	α-helix	trans	-92	-10.3	170.3	56	0	0	0	0	113.4	V167 A168	V167-T170 PolarHBondContact O-N 2.83Å; V167-T170 PolarHBondContact O-OG1 3.35Å; A168-T170 VanDerWaalsContact C-N 3.29Å; A168-T170 PolarHBondContact O-N 3.2Å
171	T	47.2	Very low	52.7	Low	86 Å²	86	123.3 Å²	123.3	53%	0.528	69%	0.685	S	S	.	*	S	Bend	trans	-136.2	87.3	178.5	47.4	0	0	0	0	110.2	V167 A168 T173	V167-T171 PolarHBondContact O-OG1 3.35Å; V167-T171 VanDerWaalsContact O-OG1 3.1Å; A168-T171 CarbonylContact O-C 3.57Å; A168-T171 VanDerWaalsContact O-C 3.29Å; A168-T171 PolarHBondContact O-N 2.84Å; T171-T173 PolarHBondContact O-N 2.68Å; T171-T173 PolarHBondContact O-OG1 3.39Å
172	G	48.5	Very low	50.8	Low	80 Å²	80	121.4 Å²	121.4	83%	0.825	69%	0.694	S	S	*	*			trans	-52.5	108.2	-178.9	0	0	0	0	0	112.4
173	T	36.9	Very low	48.6	Very low	131 Å²	131	130 Å²	130	80%	0.804	72%	0.719	S	S	*	*			trans	-151.7	115.1	159.1	13	0	0	0	0	111.4	T171	T171-T173 PolarHBondContact O-N 2.68Å; T171-T173 PolarHBondContact O-OG1 3.39Å
174	S	48.1	Very low	46.7	Very low	111 Å²	111	129.7 Å²	129.7	78%	0.776	73%	0.725	S	S	*	*			trans	-61.9	129.6	169.1	170.8	0	0	0	0	111.7
175	K	39.9	Very low	45	Very low	195 Å²	195	130.9 Å²	130.9	85%	0.848	74%	0.739	S	S	*	*			trans	-146.4	119.4	151.5	-72.4	-164	179.7	172.6	0	113.3
176	N	44.6	Very low	43.8	Very low	162 Å²	162	131.5 Å²	131.5	87%	0.866	75%	0.749	S	S	*	*			trans	-42.8	131.4	156.3	-83.2	-32.3	0	0	0	112.7
177	T	36.3	Very low	42.8	Very low	136 Å²	136	137.7 Å²	137.7	83%	0.834	77%	0.766	S	S	*	*			trans	-128.6	112.3	157.6	39.9	0	0	0	0	110.8	R179	T177-R179 PolarHBondContact O-N 2.82Å
178	K	36.4	Very low	42.5	Very low	199 Å²	199	136.8 Å²	136.8	87%	0.865	76%	0.764	S	S	*	*			trans	-60	126.7	168.1	-83.4	176.2	171.2	176.7	0	109.4	L180	K178-L180 PolarHBondContact O-N 3.32Å
179	R	35	Very low	42.9	Very low	242 Å²	242	141.4 Å²	141.4	91%	0.913	78%	0.777	S	S	*	*			trans	-60.4	116.7	161.7	-74.3	170.2	73.5	-167	4.8	108.8	T177 S181	T177-R179 PolarHBondContact O-N 2.82Å; R179-S181 PolarHBondContact O-N 3.12Å
180	L	35.9	Very low	44.5	Very low	173 Å²	173	141.1 Å²	141.1	91%	0.906	77%	0.769	S	S	*	*			trans	-74.2	98.9	160.8	-83.5	98.6	0	0	0	108.2	K178	K178-L180 PolarHBondContact O-N 3.32Å
181	S	38.3	Very low	46.7	Very low	109 Å²	109	137.8 Å²	137.8	76%	0.762	74%	0.743	S	S	*	*			trans	-69	128.4	163.9	54.9	0	0	0	0	110.1	R179	R179-S181 PolarHBondContact O-N 3.12Å
182	G	36.6	Very low	48.8	Very low	67 Å²	67	139.6 Å²	139.6	69%	0.691	74%	0.744	S	S	*	*			trans	49.1	86.1	140.7	0	0	0	0	0	116.3	S184	G182-S184 VanDerWaalsContact C-N 3.33Å; G182-S184 PolarHBondContact O-N 3.39Å
183	R	34.3	Very low	51.1	Low	252 Å²	252	135.9 Å²	135.9	95%	0.951	71%	0.705	S	S	*	*			trans	-65.4	100.1	156.2	-161	174.6	-171.3	178.2	1.7	106.8
184	S	36.2	Very low	53.9	Low	96 Å²	96	129.7 Å²	129.7	67%	0.671	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-50.6	140.5	163.3	-24.3	0	0	0	0	107.9	G182	G182-S184 VanDerWaalsContact C-N 3.33Å; G182-S184 PolarHBondContact O-N 3.39Å
185	P	39.4	Very low	56.3	Low	119 Å²	119	124.4 Å²	124.4	77%	0.773	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-56	145.2	168.9	-14.6	27.6	0	0	0	108.6
186	P	40.6	Very low	58.9	Low	117 Å²	117	117.7 Å²	117.7	76%	0.76	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-56.4	145.3	175.7	26.1	-32.1	0	0	0	109.1	S188	P186-S188 PolarHBondContact O-N 2.83Å
187	R	45.1	Very low	61.4	Low	243 Å²	243	110 Å²	110	92%	0.917	56%	0.562	S	S	*	*			trans	-35.4	110.3	175.2	-78.2	177.9	173	-176.5	-3	109.3	Q189	R187-Q189 PolarHBondContact O-N 2.86Å
188	S	57.8	Low	64.3	Low	75 Å²	75	107.1 Å²	107.1	52%	0.524	54%	0.537	S	S	.	.			trans	-46.9	122.9	178.8	46	0	0	0	0	109.2	P186 M190	P186-S188 PolarHBondContact O-N 2.83Å; S188-M190 WeakPolarHBondContact O-CG 3.17Å; S188-M190 PolarHBondContact O-N 3.08Å
189	Q	65.3	Low	67.1	Low	145 Å²	145	103.4 Å²	103.4	68%	0.678	52%	0.521	S	S	*	.			trans	-59.6	108.8	173.1	-161	85.5	15.7	0	0	107.4	R187	R187-Q189 PolarHBondContact O-N 2.86Å
190	M	84.7	Confident	70	Confident	112 Å²	112	94.3 Å²	94.3	55%	0.552	50%	0.497	S	S	*	.			trans	-94.3	107.6	-177.8	-64.3	170.9	80	0	0	108.4	S188 Y211	S188-M190 WeakPolarHBondContact O-CG 3.17Å; S188-M190 PolarHBondContact O-N 3.08Å; M190-Y211 HydrophobicContact CB-CD2 3.51Å; M190-Y211 HydrophobicContact CB-CE2 3.91Å; M190-Y211 HydrophobicContact CB-CG 4Å; M190-Y211 HydrophobicContact CE-CD1 3.17Å; M190-Y211 HydrophobicContact CE-CD2 4.04Å; M190-Y211 HydrophobicContact CE-CE1 3.52Å; M190-Y211 HydrophobicContact CE-CE2 4.34Å; M190-Y211 HydrophobicContact CE-CG 3.43Å; M190-Y211 VanDerWaalsContact CE-CG 3.43Å; M190-Y211 HydrophobicContact CG-CD1 4.44Å; M190-Y211 HydrophobicContact CG-CD2 3.68Å; M190-Y211 HydrophobicContact CG-CE1 4.37Å; M190-Y211 HydrophobicContact CG-CE2 3.61Å; M190-Y211 HydrophobicContact CG-CG 4.08Å
191	W	92.6	Very high	72.8	Confident	43 Å²	43	88.9 Å²	88.9	16%	0.163	48%	0.483	C	S	.	.	B	Isolated β-bridge	trans	-86.1	136.4	171.5	-52.8	-56.7	0	0	0	109.9	D196 A197 H202 Y208 I210 Y211	W191-D196 HydrophobicContact CB-CB 4.01Å; W191-A197 HydrophobicContact CB-CB 4.14Å; W191-A197 HydrophobicContact CD2-CB 3.62Å; W191-A197 HydrophobicContact CE3-CB 3.89Å; W191-A197 HydrophobicContact CG-CB 3.72Å; W191-H202 AromaticContact CE2-CD2 3.99Å; W191-H202 AromaticContact CH2-CD2 3.97Å; W191-H202 AromaticContact CH2-NE2 3.81Å; W191-H202 AromaticContact CZ2-CD2 3.36Å; W191-H202 WeakPolarHBondContact CZ2-CD2 3.29Å; W191-H202 AromaticContact CZ2-CE1 3.9Å; W191-H202 AromaticContact CZ2-NE2 3.23Å; W191-H202 WeakPolarHBondContact CZ2-NE2 3.36Å; W191-Y208 HydrophobicContact CE3-CD1 4.09Å; W191-Y208 HydrophobicContact CH2-CD1 4.33Å; W191-Y208 AromaticContact CZ3-CD1 3.67Å; W191-Y208 HydrophobicContact CZ3-CD1 3.67Å; W191-Y208 HydrophobicContact CZ3-CE1 4.34Å; W191-I210 CarbonylContact O-C 3.54Å; W191-I210 VanDerWaalsContact O-CA 3.25Å; W191-I210 WeakPolarHBondContact O-CA 3.41Å; W191-Y211 PolarHBondContact O-N 3.41Å
192	K	93.1	Very high	75.5	Confident	124 Å²	124	87.4 Å²	87.4	54%	0.539	46%	0.464	S	S	.	.	S	Bend	trans	-77.3	-30.1	179.5	-59.2	171.4	-173.8	170.2	0	112.3	D196 Y211	K192-D196 WeakPolarHBondContact CB-OD2 3.26Å; K192-D196 WeakPolarHBondContact CD-OD2 3.42Å; K192-D196 VanDerWaalsContact CG-OD2 3.25Å; K192-D196 WeakPolarHBondContact CG-OD2 3.32Å; K192-D196 PolarHBondContact N-OD2 3.15Å; K192-D196 VanDerWaalsContact N-OD2 3.15Å; K192-Y211 WeakPolarHBondContact CA-O 3.49Å
193	D	95.3	Very high	78.3	Confident	3 Å²	3	87.9 Å²	87.9	2%	0.016	46%	0.456	C	S	.	.	S	Bend	trans	-156.8	-173.7	177	58.8	32.4	0	0	0	110.8	A195 D196 A197 L273 Y279 P404	D193-A195 VanDerWaalsContact C-N 3.27Å; D193-A195 PolarHBondContact O-N 3.45Å; D193-A195 WeakPolarHBondContact OD1-CA 3.22Å; D193-A195 VanDerWaalsContact OD1-CB 3.3Å; D193-A195 WeakPolarHBondContact OD1-CB 3.41Å; D193-A195 PolarHBondContact OD1-N 3.43Å; D193-D196 PolarHBondContact O-N 2.73Å; D193-D196 PolarHBondContact OD1-N 3.41Å; D193-A197 PolarHBondContact O-N 2.97Å; D193-L273 HydrophobicContact CB-CD2 4.26Å; D193-Y279 WeakPolarHBondContact OD2-CE1 3.38Å; D193-Y279 PolarHBondContact OD2-OH 3.28Å; D193-P404 VanDerWaalsContact OD2-CG 3.25Å; D193-P404 WeakPolarHBondContact OD2-CG 3.28Å
194	C	97.3	Very high	81.3	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	44%	0.436	C	S	.	.	H	α-helix	trans	-68.7	-24.2	179	-65.4	0	0	0	0	113.4	A197 Y198 C223 M225 T233	C194-A197 PolarHBondContact O-N 3.32Å; C194-Y198 WeakPolarHBondContact O-CB 3.36Å; C194-Y198 PolarHBondContact O-N 2.95Å; C194-C223 VanDerWaalsContact CA-SG 3.59Å; C194-C223 HydrophobicContact CB-CB 3.62Å; C194-C223 WeakPolarHBondContact CB-SG 3.25Å; C194-C223 WeakPolarHBondContact SG-CA 3.44Å; C194-C223 WeakPolarHBondContact SG-CB 3.47Å; C194-C223 CovalentContact SG-SG 2.02Å; C194-C223 PolarHBondContact SG-SG 3.41Å; C194-M225 HydrophobicContact CB-CE 4.3Å; C194-T233 VanDerWaalsContact CB-OG1 3.3Å; C194-T233 WeakPolarHBondContact CB-OG1 3.17Å; C194-T233 PolarHBondContact N-OG1 2.93Å; C194-T233 VanDerWaalsContact SG-CA 3.54Å; C194-T233 PolarHBondContact SG-OG1 3.43Å
195	A	97.1	Very high	84.3	Confident	1 Å²	1	75.9 Å²	75.9	1%	0.008	42%	0.415	C	S	.	.	H	α-helix	trans	-71.2	-41.7	176.9	0	0	0	0	0	111.2	D193 A197 Y198 K199 G231 R403 P404 F407	D193-A195 VanDerWaalsContact C-N 3.27Å; D193-A195 PolarHBondContact O-N 3.45Å; D193-A195 WeakPolarHBondContact OD1-CA 3.22Å; D193-A195 VanDerWaalsContact OD1-CB 3.3Å; D193-A195 WeakPolarHBondContact OD1-CB 3.41Å; D193-A195 PolarHBondContact OD1-N 3.43Å; A195-A197 VanDerWaalsContact C-N 3.32Å; A195-A197 PolarHBondContact O-N 3.48Å; A195-Y198 PolarHBondContact O-N 2.87Å; A195-K199 WeakPolarHBondContact O-CG 3.34Å; A195-K199 PolarHBondContact O-N 3.37Å; A195-G231 PolarHBondContact N-O 3.46Å; A195-R403 HydrophobicContact CB-CG 4.15Å; A195-P404 HydrophobicContact CB-CG 3.98Å; A195-F407 HydrophobicContact CB-CD2 3.52Å; A195-F407 HydrophobicContact CB-CE2 3.75Å
196	D	95.5	Very high	87.1	Confident	54 Å²	54	71 Å²	71	29%	0.289	39%	0.386	S	S	.	.	H	α-helix	trans	-60.5	-41.9	172.7	-84.7	-1.4	0	0	0	111.6	W191 K192 D193 K199 A200	W191-D196 HydrophobicContact CB-CB 4.01Å; K192-D196 WeakPolarHBondContact CB-OD2 3.26Å; K192-D196 WeakPolarHBondContact CD-OD2 3.42Å; K192-D196 VanDerWaalsContact CG-OD2 3.25Å; K192-D196 WeakPolarHBondContact CG-OD2 3.32Å; K192-D196 PolarHBondContact N-OD2 3.15Å; K192-D196 VanDerWaalsContact N-OD2 3.15Å; D193-D196 PolarHBondContact O-N 2.73Å; D193-D196 PolarHBondContact OD1-N 3.41Å; D196-K199 PolarHBondContact O-N 2.85Å; D196-A200 WeakPolarHBondContact O-CB 3.38Å; D196-A200 PolarHBondContact O-N 3.16Å
197	A	96	Very high	89.8	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-62.4	-43.3	175.3	0	0	0	0	0	111.8	W191 D193 C194 A195 A200 H202 Y208 M225	W191-A197 HydrophobicContact CB-CB 4.14Å; W191-A197 HydrophobicContact CD2-CB 3.62Å; W191-A197 HydrophobicContact CE3-CB 3.89Å; W191-A197 HydrophobicContact CG-CB 3.72Å; D193-A197 PolarHBondContact O-N 2.97Å; C194-A197 PolarHBondContact O-N 3.32Å; A195-A197 VanDerWaalsContact C-N 3.32Å; A195-A197 PolarHBondContact O-N 3.48Å; A197-A200 WeakPolarHBondContact O-CB 3.38Å; A197-A200 PolarHBondContact O-N 3.35Å; A197-H202 WeakPolarHBondContact O-CB 3.21Å; A197-H202 PolarHBondContact O-N 3.02Å; A197-H202 VanDerWaalsContact O-N 3.12Å; A197-Y208 HydrophobicContact CB-CD1 4.07Å; A197-Y208 HydrophobicContact CB-CE1 4.32Å; A197-M225 HydrophobicContact CB-CE 3.96Å
198	Y	97.4	Very high	92.3	Very high	76 Å²	76	58.5 Å²	58.5	30%	0.298	33%	0.329	S	S	.	.	H	α-helix	trans	-63.3	-46.7	177.2	-168.8	-89.7	0	0	0	112.2	C194 A195 A200 G201 H202 M225 F407	C194-Y198 WeakPolarHBondContact O-CB 3.36Å; C194-Y198 PolarHBondContact O-N 2.95Å; A195-Y198 PolarHBondContact O-N 2.87Å; Y198-A200 PolarHBondContact O-N 3.09Å; Y198-G201 WeakPolarHBondContact O-CA 3.33Å; Y198-G201 PolarHBondContact O-N 3.25Å; Y198-H202 WeakPolarHBondContact CA-O 3.1Å; Y198-M225 HydrophobicContact CD2-CB 3.92Å; Y198-M225 HydrophobicContact CD2-CG 4.23Å; Y198-M225 HydrophobicContact CD2-SD 3.73Å; Y198-M225 HydrophobicContact CE2-CB 4.08Å; Y198-M225 VanDerWaalsContact CE2-O 3.26Å; Y198-M225 WeakPolarHBondContact CE2-O 3.49Å; Y198-M225 HydrophobicContact CG-SD 4.38Å; Y198-F407 HydrophobicContact CD1-CE2 4.13Å; Y198-F407 AromaticContact CD1-CZ 3.58Å; Y198-F407 HydrophobicContact CD1-CZ 3.58Å; Y198-F407 HydrophobicContact CE1-CZ 4.04Å; Y198-F407 HydrophobicContact CG-CZ 4.18Å
199	K	96	Very high	94.1	Very high	121 Å²	121	59 Å²	59	53%	0.526	33%	0.326	S	S	.	.	H	α-helix	trans	-62.8	-27.2	176.1	-72.7	-179.8	179.2	-176.2	0	112.4	A195 D196 G201 F407	A195-K199 WeakPolarHBondContact O-CG 3.34Å; A195-K199 PolarHBondContact O-N 3.37Å; D196-K199 PolarHBondContact O-N 2.85Å; K199-G201 PolarHBondContact O-N 3.01Å; K199-F407 WeakPolarHBondContact CE-OXT 3.47Å; K199-F407 HydrophobicContact CG-CE2 4.36Å; K199-F407 PolarHBondContact NZ-OXT 3.12Å
200	A	95	Very high	95.5	Very high	50 Å²	50	52.1 Å²	52.1	41%	0.413	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	2.4	172.1	0	0	0	0	0	114.1	D196 A197 Y198	D196-A200 WeakPolarHBondContact O-CB 3.38Å; D196-A200 PolarHBondContact O-N 3.16Å; A197-A200 WeakPolarHBondContact O-CB 3.38Å; A197-A200 PolarHBondContact O-N 3.35Å; Y198-A200 PolarHBondContact O-N 3.09Å
201	G	95.1	Very high	95.9	Very high	59 Å²	59	48.8 Å²	48.8	61%	0.608	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	96	6.4	176.2	0	0	0	0	0	114.8	Y198 K199 S203	Y198-G201 WeakPolarHBondContact O-CA 3.33Å; Y198-G201 PolarHBondContact O-N 3.25Å; K199-G201 PolarHBondContact O-N 3.01Å; G201-S203 PolarHBondContact O-N 3.45Å
202	H	95.2	Very high	95.7	Very high	78 Å²	78	46.9 Å²	46.9	36%	0.361	27%	0.268	S	S	.	.			trans	-88.3	94.8	176.4	-63	-88	0	0	0	111	W191 A197 Y198 Y208	W191-H202 AromaticContact CE2-CD2 3.99Å; W191-H202 AromaticContact CH2-CD2 3.97Å; W191-H202 AromaticContact CH2-NE2 3.81Å; W191-H202 AromaticContact CZ2-CD2 3.36Å; W191-H202 WeakPolarHBondContact CZ2-CD2 3.29Å; W191-H202 AromaticContact CZ2-CE1 3.9Å; W191-H202 AromaticContact CZ2-NE2 3.23Å; W191-H202 WeakPolarHBondContact CZ2-NE2 3.36Å; A197-H202 WeakPolarHBondContact O-CB 3.21Å; A197-H202 PolarHBondContact O-N 3.02Å; A197-H202 VanDerWaalsContact O-N 3.12Å; Y198-H202 WeakPolarHBondContact CA-O 3.1Å; H202-Y208 HydrophobicContact CB-CE1 3.7Å
203	S	95.4	Very high	95.1	Very high	77 Å²	77	43 Å²	43	54%	0.538	26%	0.264	S	S	.	.			trans	-103.1	5.7	-172.3	66	0	0	0	0	115.1	G201 M225	G201-S203 PolarHBondContact O-N 3.45Å; S203-M225 VanDerWaalsContact C-CB 3.44Å; S203-M225 WeakPolarHBondContact O-CB 3.45Å
204	A	97.6	Very high	94	Very high	62 Å²	62	51 Å²	51	51%	0.512	31%	0.306	S	S	.	.	S	Bend	trans	-95.3	130.8	179.5	0	0	0	0	0	110.9	Y208 M225	A204-Y208 WeakPolarHBondContact O-CE2 3.37Å; A204-Y208 PolarHBondContact O-OH 2.96Å; A204-M225 WeakPolarHBondContact O-CG 3.36Å
205	S	98.4	Very high	93.1	Very high	34 Å²	34	56.3 Å²	56.3	24%	0.238	33%	0.326	C	S	.	.			trans	-66.3	140.9	176.2	-55.4	0	0	0	0	111.2	C223 M225 E226	S205-C223 VanDerWaalsContact CA-O 3.25Å; S205-C223 WeakPolarHBondContact CA-O 3.33Å; S205-M225 PolarHBondContact OG-N 3.08Å; S205-M225 VanDerWaalsContact OG-N 3.08Å; S205-E226 PolarHBondContact OG-OE1 3.47Å
206	G	97.9	Very high	92.2	Very high	17 Å²	17	62.6 Å²	62.6	18%	0.175	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.9	-165	-176.9	0	0	0	0	0	114	Y208 Y222 C223	G206-Y208 WeakPolarHBondContact O-CD2 3.36Å; G206-Y222 WeakPolarHBondContact O-CA 3.41Å; G206-C223 PolarHBondContact N-O 2.9Å; G206-C223 PolarHBondContact O-N 3.36Å
207	L	97.9	Very high	91.8	Very high	69 Å²	69	66.9 Å²	66.9	36%	0.361	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	130.4	177.5	-62	179.2	0	0	0	111.1	Q220 V221 Y222 L259	L207-Q220 HydrophobicContact CB-CG 4.36Å; L207-V221 WeakPolarHBondContact CA-O 3.4Å; L207-Y222 HydrophobicContact CD2-CD2 4.05Å; L207-L259 HydrophobicContact CD2-CB 3.45Å; L207-L259 VanDerWaalsContact CD2-CB 3.45Å; L207-L259 HydrophobicContact CD2-CD1 4.43Å
208	Y	96.9	Very high	91.6	Very high	29 Å²	29	69.2 Å²	69.2	11%	0.114	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	157.4	177.3	-71.7	-102.2	0	0	0	110.3	W191 A197 H202 A204 G206 Q220 V221 C223 M225	W191-Y208 HydrophobicContact CE3-CD1 4.09Å; W191-Y208 HydrophobicContact CH2-CD1 4.33Å; W191-Y208 AromaticContact CZ3-CD1 3.67Å; W191-Y208 HydrophobicContact CZ3-CD1 3.67Å; W191-Y208 HydrophobicContact CZ3-CE1 4.34Å; A197-Y208 HydrophobicContact CB-CD1 4.07Å; A197-Y208 HydrophobicContact CB-CE1 4.32Å; H202-Y208 HydrophobicContact CB-CE1 3.7Å; A204-Y208 WeakPolarHBondContact O-CE2 3.37Å; A204-Y208 PolarHBondContact O-OH 2.96Å; G206-Y208 WeakPolarHBondContact O-CD2 3.36Å; Y208-Q220 CarbonylContact O-C 3.56Å; Y208-Q220 WeakPolarHBondContact O-CA 3.48Å; Y208-V221 PolarHBondContact N-O 3.48Å; Y208-V221 PolarHBondContact O-N 3.49Å; Y208-C223 VanDerWaalsContact CB-SG 3.56Å; Y208-C223 HydrophobicContact CD2-CB 3.48Å; Y208-C223 VanDerWaalsContact CD2-CB 3.48Å; Y208-C223 WeakPolarHBondContact CD2-SG 3.34Å; Y208-C223 HydrophobicContact CE2-CB 3.83Å; Y208-C223 HydrophobicContact CG-CB 4.25Å; Y208-C223 VanDerWaalsContact CG-SG 3.57Å; Y208-M225 HydrophobicContact CD1-CE 4.47Å; Y208-M225 HydrophobicContact CD2-CE 4.25Å; Y208-M225 HydrophobicContact CE1-CE 4.1Å; Y208-M225 HydrophobicContact CE2-CE 3.85Å
209	L	95.8	Very high	91.5	Very high	86 Å²	86	66.7 Å²	66.7	45%	0.45	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	123.4	171.2	-69.2	174.9	0	0	0	108.7	P218 Q220	L209-P218 HydrophobicContact CB-CB 4.03Å; L209-P218 HydrophobicContact CD1-CG 4.48Å; L209-P218 HydrophobicContact CD2-CB 4.24Å; L209-P218 HydrophobicContact CD2-CG 4.34Å; L209-Q220 HydrophobicContact CD2-CB 3.91Å; L209-Q220 HydrophobicContact CD2-CG 4.26Å
210	I	94.8	Very high	91.5	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	153.8	179.5	64.2	165.3	0	0	0	111.3	W191 I212 P218 V219 V221 L273	W191-I210 CarbonylContact O-C 3.54Å; W191-I210 VanDerWaalsContact O-CA 3.25Å; W191-I210 WeakPolarHBondContact O-CA 3.41Å; I210-I212 HydrophobicContact CD1-CD1 3.97Å; I210-I212 HydrophobicContact CD1-CG1 3.87Å; I210-I212 HydrophobicContact CG1-CD1 4.38Å; I210-I212 HydrophobicContact CG1-CG1 4.15Å; I210-P218 CarbonylContact O-C 3.57Å; I210-P218 VanDerWaalsContact O-CA 3.31Å; I210-P218 WeakPolarHBondContact O-CA 3.46Å; I210-V219 HydrophobicContact CG1-CB 4.43Å; I210-V219 WeakPolarHBondContact CG1-O 3.43Å; I210-V219 PolarHBondContact N-O 3.45Å; I210-V219 PolarHBondContact O-N 2.9Å; I210-V221 HydrophobicContact CB-CG2 4.5Å; I210-V221 HydrophobicContact CD1-CB 4.42Å; I210-V221 HydrophobicContact CD1-CG1 3.61Å; I210-V221 HydrophobicContact CD1-CG2 3.94Å; I210-V221 HydrophobicContact CG1-CG1 3.86Å; I210-V221 HydrophobicContact CG1-CG2 3.93Å; I210-V221 HydrophobicContact CG2-CG2 3.8Å; I210-L273 HydrophobicContact CD1-CD2 3.96Å
211	Y	92.8	Very high	91.7	Very high	42 Å²	42	63.1 Å²	63.1	17%	0.165	37%	0.368	C	S	.	.			trans	-115.6	103.1	-177.8	-69.5	-91.8	0	0	0	110	M190 W191 K192 P218	M190-Y211 HydrophobicContact CB-CD2 3.51Å; M190-Y211 HydrophobicContact CB-CE2 3.91Å; M190-Y211 HydrophobicContact CB-CG 4Å; M190-Y211 HydrophobicContact CE-CD1 3.17Å; M190-Y211 HydrophobicContact CE-CD2 4.04Å; M190-Y211 HydrophobicContact CE-CE1 3.52Å; M190-Y211 HydrophobicContact CE-CE2 4.34Å; M190-Y211 HydrophobicContact CE-CG 3.43Å; M190-Y211 VanDerWaalsContact CE-CG 3.43Å; M190-Y211 HydrophobicContact CG-CD1 4.44Å; M190-Y211 HydrophobicContact CG-CD2 3.68Å; M190-Y211 HydrophobicContact CG-CE1 4.37Å; M190-Y211 HydrophobicContact CG-CE2 3.61Å; M190-Y211 HydrophobicContact CG-CG 4.08Å; W191-Y211 PolarHBondContact O-N 3.41Å; K192-Y211 WeakPolarHBondContact CA-O 3.49Å; Y211-P218 HydrophobicContact CD1-CB 4.17Å; Y211-P218 HydrophobicContact CD2-CB 4.38Å; Y211-P218 HydrophobicContact CE1-CB 3.77Å; Y211-P218 HydrophobicContact CE1-CG 4.13Å; Y211-P218 HydrophobicContact CE2-CB 3.98Å; Y211-P218 HydrophobicContact CG-CB 4.49Å
212	I	89.8	Confident	91.8	Very high	2 Å²	2	62.3 Å²	62.3	1%	0.01	35%	0.346	C	S	.	.			trans	-93.3	117.3	-172.9	-53.4	166.4	0	0	0	109.2	I210 N214 R215 V219 V269 L272 L273	I210-I212 HydrophobicContact CD1-CD1 3.97Å; I210-I212 HydrophobicContact CD1-CG1 3.87Å; I210-I212 HydrophobicContact CG1-CD1 4.38Å; I210-I212 HydrophobicContact CG1-CG1 4.15Å; I212-N214 PolarHBondContact O-N 2.98Å; I212-R215 WeakPolarHBondContact O-CG 3.47Å; I212-R215 PolarHBondContact O-N 3.14Å; I212-V219 HydrophobicContact CD1-CB 4.07Å; I212-V219 HydrophobicContact CD1-CG1 4.48Å; I212-V219 HydrophobicContact CD1-CG2 3.96Å; I212-V269 HydrophobicContact CD1-CG1 3.53Å; I212-L272 HydrophobicContact CG2-CB 3.55Å; I212-L273 HydrophobicContact CD1-CD1 4.29Å; I212-L273 HydrophobicContact CD1-CD2 3.98Å; I212-L273 HydrophobicContact CD1-CG 3.81Å; I212-L273 HydrophobicContact CG1-CD2 3.77Å; I212-L273 HydrophobicContact CG1-CG 4.12Å; I212-L273 HydrophobicContact CG2-CD2 4.21Å; I212-L273 HydrophobicContact CG2-CG 4.22Å
213	G	78.9	Confident	92	Very high	44 Å²	44	58.6 Å²	58.6	45%	0.454	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	-131	-179.5	0	0	0	0	0	112.7
214	N	73.3	Confident	92.2	Very high	171 Å²	171	56 Å²	56	91%	0.914	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	18.2	-177.8	-64	-13.7	0	0	0	113.2	I212 T216	I212-N214 PolarHBondContact O-N 2.98Å; N214-T216 PolarHBondContact O-N 3.5Å
215	R	79	Confident	92.2	Very high	110 Å²	110	53.2 Å²	53.2	42%	0.415	29%	0.286	S	S	.	.			trans	-65.8	134.1	177.4	-66.8	-175.1	87.3	129.6	0.7	109.7	I212	I212-R215 WeakPolarHBondContact O-CG 3.47Å; I212-R215 PolarHBondContact O-N 3.14Å
216	T	77.3	Confident	92.1	Very high	134 Å²	134	58.4 Å²	58.4	82%	0.822	31%	0.306	S	S	*	.	S	Bend	trans	-75.6	-30	176	47.9	0	0	0	0	112.2	N214	N214-T216 PolarHBondContact O-N 3.5Å
217	E	87.3	Confident	92.1	Very high	144 Å²	144	59.5 Å²	59.5	67%	0.673	31%	0.31	S	S	*	.	S	Bend	trans	-100.2	135.5	179.6	-64.9	-176	168.7	0	0	111
218	P	92.6	Very high	91.9	Very high	49 Å²	49	59.6 Å²	59.6	32%	0.318	32%	0.316	S	S	.	.			trans	-69.2	152.8	174.8	28.6	-32.8	0	0	0	111.5	L209 I210 Y211	L209-P218 HydrophobicContact CB-CB 4.03Å; L209-P218 HydrophobicContact CD1-CG 4.48Å; L209-P218 HydrophobicContact CD2-CB 4.24Å; L209-P218 HydrophobicContact CD2-CG 4.34Å; I210-P218 CarbonylContact O-C 3.57Å; I210-P218 VanDerWaalsContact O-CA 3.31Å; I210-P218 WeakPolarHBondContact O-CA 3.46Å; Y211-P218 HydrophobicContact CD1-CB 4.17Å; Y211-P218 HydrophobicContact CD2-CB 4.38Å; Y211-P218 HydrophobicContact CE1-CB 3.77Å; Y211-P218 HydrophobicContact CE1-CG 4.13Å; Y211-P218 HydrophobicContact CE2-CB 3.98Å; Y211-P218 HydrophobicContact CG-CB 4.49Å
219	V	94.5	Very high	91.9	Very high	23 Å²	23	60.2 Å²	60.2	14%	0.139	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	129.8	171.3	-178.7	0	0	0	0	108.5	I210 I212 V221 V269	I210-V219 HydrophobicContact CG1-CB 4.43Å; I210-V219 WeakPolarHBondContact CG1-O 3.43Å; I210-V219 PolarHBondContact N-O 3.45Å; I210-V219 PolarHBondContact O-N 2.9Å; I212-V219 HydrophobicContact CD1-CB 4.07Å; I212-V219 HydrophobicContact CD1-CG1 4.48Å; I212-V219 HydrophobicContact CD1-CG2 3.96Å; V219-V221 HydrophobicContact CG1-CG1 4.26Å; V219-V269 HydrophobicContact CG1-CG1 4.06Å; V219-V269 HydrophobicContact CG1-CG2 4.21Å
220	Q	96.8	Very high	91.9	Very high	96 Å²	96	56.1 Å²	56.1	45%	0.449	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	133.6	172.2	-166	173.9	46.4	0	0	109.8	L207 Y208 L209 L259	L207-Q220 HydrophobicContact CB-CG 4.36Å; Y208-Q220 CarbonylContact O-C 3.56Å; Y208-Q220 WeakPolarHBondContact O-CA 3.48Å; L209-Q220 HydrophobicContact CD2-CB 3.91Å; L209-Q220 HydrophobicContact CD2-CG 4.26Å; Q220-L259 HydrophobicContact CB-CD1 3.85Å; Q220-L259 HydrophobicContact CG-CD1 3.82Å; Q220-L259 WeakPolarHBondContact O-CD1 3.36Å
221	V	98.1	Very high	92.1	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	157.6	179.4	-63.2	0	0	0	0	110.4	L207 Y208 I210 V219 T233 L265	L207-V221 WeakPolarHBondContact CA-O 3.4Å; Y208-V221 PolarHBondContact N-O 3.48Å; Y208-V221 PolarHBondContact O-N 3.49Å; I210-V221 HydrophobicContact CB-CG2 4.5Å; I210-V221 HydrophobicContact CD1-CB 4.42Å; I210-V221 HydrophobicContact CD1-CG1 3.61Å; I210-V221 HydrophobicContact CD1-CG2 3.94Å; I210-V221 HydrophobicContact CG1-CG1 3.86Å; I210-V221 HydrophobicContact CG1-CG2 3.93Å; I210-V221 HydrophobicContact CG2-CG2 3.8Å; V219-V221 HydrophobicContact CG1-CG1 4.26Å; V221-T233 HydrophobicContact CB-CG2 4.01Å; V221-T233 HydrophobicContact CG1-CG2 4.03Å; V221-T233 HydrophobicContact CG2-CG2 4.24Å; V221-L265 HydrophobicContact CG1-CD1 3.87Å; V221-L265 HydrophobicContact CG1-CD2 3.98Å
222	Y	98.6	Very high	92.4	Very high	42 Å²	42	54.1 Å²	54.1	17%	0.165	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	123	166.1	-168.4	-85.3	0	0	0	109.6	G206 L207 V234 L259	G206-Y222 WeakPolarHBondContact O-CA 3.41Å; L207-Y222 HydrophobicContact CD2-CD2 4.05Å; Y222-V234 HydrophobicContact CD1-CB 4.27Å; Y222-V234 HydrophobicContact CD1-CG2 3.91Å; Y222-V234 PolarHBondContact O-N 3.19Å; Y222-L259 WeakPolarHBondContact CB-O 3.45Å; Y222-L259 VanDerWaalsContact CD2-O 3.26Å; Y222-L259 WeakPolarHBondContact CD2-O 3.26Å
223	C	98.6	Very high	92.8	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	124.6	173.8	-60.2	0	0	0	0	110.6	C194 S205 G206 Y208 M225 W232	C194-C223 VanDerWaalsContact CA-SG 3.59Å; C194-C223 HydrophobicContact CB-CB 3.62Å; C194-C223 WeakPolarHBondContact CB-SG 3.25Å; C194-C223 WeakPolarHBondContact SG-CA 3.44Å; C194-C223 WeakPolarHBondContact SG-CB 3.47Å; C194-C223 CovalentContact SG-SG 2.02Å; C194-C223 PolarHBondContact SG-SG 3.41Å; S205-C223 VanDerWaalsContact CA-O 3.25Å; S205-C223 WeakPolarHBondContact CA-O 3.33Å; G206-C223 PolarHBondContact N-O 2.9Å; G206-C223 PolarHBondContact O-N 3.36Å; Y208-C223 VanDerWaalsContact CB-SG 3.56Å; Y208-C223 HydrophobicContact CD2-CB 3.48Å; Y208-C223 VanDerWaalsContact CD2-CB 3.48Å; Y208-C223 WeakPolarHBondContact CD2-SG 3.34Å; Y208-C223 HydrophobicContact CE2-CB 3.83Å; Y208-C223 HydrophobicContact CG-CB 4.25Å; Y208-C223 VanDerWaalsContact CG-SG 3.57Å; C223-M225 HydrophobicContact CB-CE 3.34Å; C223-M225 HydrophobicContact CB-CG 4.24Å; C223-M225 HydrophobicContact CB-SD 3.76Å; C223-W232 CarbonylContact C-O 3.47Å; C223-W232 VanDerWaalsContact CA-O 3.28Å; C223-W232 WeakPolarHBondContact CA-O 3.33Å
224	D	98.6	Very high	93.7	Very high	22 Å²	22	52.1 Å²	52.1	12%	0.118	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	109.4	166.1	-179.9	-19.8	0	0	0	108.2	E226 T227 G230 G231 W232 V234	D224-E226 PolarHBondContact OD1-N 3Å; D224-T227 WeakPolarHBondContact OD1-CB 3.45Å; D224-T227 PolarHBondContact OD1-N 2.99Å; D224-T227 PolarHBondContact OD1-OG1 3.27Å; D224-T227 VanDerWaalsContact OD2-CB 3.22Å; D224-T227 WeakPolarHBondContact OD2-CB 3.45Å; D224-T227 PolarHBondContact OD2-OG1 2.94Å; D224-G230 CarbonylContact O-C 3.54Å; D224-G231 PolarHBondContact O-N 3.1Å; D224-W232 HydrophobicContact CB-CB 4.12Å; D224-W232 PolarHBondContact N-O 3.37Å; D224-W232 PolarHBondContact O-N 3.01Å; D224-V234 HydrophobicContact CB-CG2 3.94Å
225	M	98.2	Very high	94.9	Very high	4 Å²	4	44 Å²	44	2%	0.02	24%	0.237	C	C	.	.			trans	-100.9	5.7	-175.7	-58	-51.1	-160	0	0	112.5	C194 A197 Y198 S203 A204 S205 Y208 C223 G230	C194-M225 HydrophobicContact CB-CE 4.3Å; A197-M225 HydrophobicContact CB-CE 3.96Å; Y198-M225 HydrophobicContact CD2-CB 3.92Å; Y198-M225 HydrophobicContact CD2-CG 4.23Å; Y198-M225 HydrophobicContact CD2-SD 3.73Å; Y198-M225 HydrophobicContact CE2-CB 4.08Å; Y198-M225 VanDerWaalsContact CE2-O 3.26Å; Y198-M225 WeakPolarHBondContact CE2-O 3.49Å; Y198-M225 HydrophobicContact CG-SD 4.38Å; S203-M225 VanDerWaalsContact C-CB 3.44Å; S203-M225 WeakPolarHBondContact O-CB 3.45Å; A204-M225 WeakPolarHBondContact O-CG 3.36Å; S205-M225 PolarHBondContact OG-N 3.08Å; S205-M225 VanDerWaalsContact OG-N 3.08Å; Y208-M225 HydrophobicContact CD1-CE 4.47Å; Y208-M225 HydrophobicContact CD2-CE 4.25Å; Y208-M225 HydrophobicContact CE1-CE 4.1Å; Y208-M225 HydrophobicContact CE2-CE 3.85Å; C223-M225 HydrophobicContact CB-CE 3.34Å; C223-M225 HydrophobicContact CB-CG 4.24Å; C223-M225 HydrophobicContact CB-SD 3.76Å; M225-G230 WeakPolarHBondContact O-CA 3.42Å
226	E	97.4	Very high	95.9	Very high	142 Å²	142	38.8 Å²	38.8	66%	0.664	22%	0.217	S	C	*	.	S	Bend	trans	-118.5	-44.4	-171.3	-71.5	162.5	-136.2	0	0	111.7	S205 D224 S228	S205-E226 PolarHBondContact OG-OE1 3.47Å; D224-E226 PolarHBondContact OD1-N 3Å; E226-S228 PolarHBondContact O-N 2.99Å
227	T	96.6	Very high	96.9	Very high	41 Å²	41	35.9 Å²	35.9	25%	0.252	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-64.2	125.4	-174.6	-61.5	0	0	0	0	111	D224 G229 G230 W232 E284	D224-T227 WeakPolarHBondContact OD1-CB 3.45Å; D224-T227 PolarHBondContact OD1-N 2.99Å; D224-T227 PolarHBondContact OD1-OG1 3.27Å; D224-T227 VanDerWaalsContact OD2-CB 3.22Å; D224-T227 WeakPolarHBondContact OD2-CB 3.45Å; D224-T227 PolarHBondContact OD2-OG1 2.94Å; T227-G229 PolarHBondContact O-N 3.25Å; T227-G229 VanDerWaalsContact O-N 3.11Å; T227-G230 PolarHBondContact O-N 3.02Å; T227-W232 PolarHBondContact O-NE1 2.03Å; T227-E284 HydrophobicContact CG2-CG 4.39Å
228	S	95	Very high	97.5	Very high	70 Å²	70	29.2 Å²	29.2	49%	0.49	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	49	42.8	172.1	-167.2	0	0	0	0	114.2	E226 R403	E226-S228 PolarHBondContact O-N 2.99Å; S228-R403 PolarHBondContact O-NH1 3.38Å; S228-R403 VanDerWaalsContact O-NH1 3.09Å
229	G	95.6	Very high	97.7	Very high	42 Å²	42	30.4 Å²	30.4	43%	0.433	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	90.8	2.8	178.5	0	0	0	0	0	115.5	T227	T227-G229 PolarHBondContact O-N 3.25Å; T227-G229 VanDerWaalsContact O-N 3.11Å
230	G	97.5	Very high	97.8	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.173	C	C	.	.	S	Bend	trans	74.2	-167.6	172.4	0	0	0	0	0	115.2	D224 M225 T227 W232 R403	D224-G230 CarbonylContact O-C 3.54Å; M225-G230 WeakPolarHBondContact O-CA 3.42Å; T227-G230 PolarHBondContact O-N 3.02Å; G230-W232 VanDerWaalsContact C-N 3.31Å; G230-W232 PolarHBondContact O-N 3.35Å; G230-R403 VanDerWaalsContact O-CD 3.23Å; G230-R403 WeakPolarHBondContact O-CD 3.49Å; G230-R403 PolarHBondContact O-NH1 3.13Å
231	G	97.9	Very high	97.9	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.168	C	C	.	.			trans	72.6	19.9	-179.2	0	0	0	0	0	114.5	A195 D224 R403	A195-G231 PolarHBondContact N-O 3.46Å; D224-G231 PolarHBondContact O-N 3.1Å; G231-R403 WeakPolarHBondContact O-CG 3.49Å
232	W	98.6	Very high	97.8	Very high	1 Å²	1	33.8 Å²	33.8	0%	0.004	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	129.7	-176.4	-67	104.4	0	0	0	111.9	C223 D224 T227 G230 R282 M401 R403	C223-W232 CarbonylContact C-O 3.47Å; C223-W232 VanDerWaalsContact CA-O 3.28Å; C223-W232 WeakPolarHBondContact CA-O 3.33Å; D224-W232 HydrophobicContact CB-CB 4.12Å; D224-W232 PolarHBondContact N-O 3.37Å; D224-W232 PolarHBondContact O-N 3.01Å; T227-W232 PolarHBondContact O-NE1 2.03Å; G230-W232 VanDerWaalsContact C-N 3.31Å; G230-W232 PolarHBondContact O-N 3.35Å; W232-R282 HydrophobicContact CE3-CB 4.18Å; W232-R282 HydrophobicContact CH2-CB 3.67Å; W232-R282 HydrophobicContact CZ2-CB 4.17Å; W232-R282 HydrophobicContact CZ3-CB 3.66Å; W232-M401 HydrophobicContact CB-CB 4.02Å; W232-M401 HydrophobicContact CB-CG 3.99Å; W232-M401 HydrophobicContact CB-SD 3.58Å; W232-M401 VanDerWaalsContact CB-SD 3.58Å; W232-M401 HydrophobicContact CD2-CG 3.82Å; W232-M401 HydrophobicContact CD2-SD 3.7Å; W232-M401 HydrophobicContact CE3-CB 4.23Å; W232-M401 HydrophobicContact CE3-CG 3.59Å; W232-M401 HydrophobicContact CE3-SD 4.14Å; W232-M401 HydrophobicContact CG-CG 4Å; W232-M401 HydrophobicContact CG-SD 3.44Å; W232-M401 HydrophobicContact CZ3-CG 4.36Å; W232-R403 HydrophobicContact CD2-CB 3.93Å; W232-R403 HydrophobicContact CE3-CB 3.36Å; W232-R403 HydrophobicContact CE3-CG 4.46Å; W232-R403 HydrophobicContact CH2-CB 4.08Å; W232-R403 VanDerWaalsContact CZ2-CZ 3.44Å; W232-R403 HydrophobicContact CZ3-CB 3.44Å; W232-R403 VanDerWaalsContact CZ3-CB 3.44Å
233	T	98.6	Very high	97.8	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.006	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	110.4	167.9	-56.2	0	0	0	0	109.3	C194 V221 L265 L273 M401 V402	C194-T233 VanDerWaalsContact CB-OG1 3.3Å; C194-T233 WeakPolarHBondContact CB-OG1 3.17Å; C194-T233 PolarHBondContact N-OG1 2.93Å; C194-T233 VanDerWaalsContact SG-CA 3.54Å; C194-T233 PolarHBondContact SG-OG1 3.43Å; V221-T233 HydrophobicContact CB-CG2 4.01Å; V221-T233 HydrophobicContact CG1-CG2 4.03Å; V221-T233 HydrophobicContact CG2-CG2 4.24Å; T233-L265 HydrophobicContact CG2-CD2 4.28Å; T233-L273 HydrophobicContact CG2-CD1 4.19Å; T233-M401 CarbonylContact O-C 3.57Å; T233-M401 VanDerWaalsContact O-CA 3.22Å; T233-M401 WeakPolarHBondContact O-CA 3.28Å; T233-V402 PolarHBondContact N-O 2.96Å; T233-V402 PolarHBondContact O-N 3.25Å
234	V	98.8	Very high	97.8	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.012	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	126.7	179	-177.4	0	0	0	0	109.1	Y222 D224 R237 M401	Y222-V234 HydrophobicContact CD1-CB 4.27Å; Y222-V234 HydrophobicContact CD1-CG2 3.91Å; Y222-V234 PolarHBondContact O-N 3.19Å; D224-V234 HydrophobicContact CB-CG2 3.94Å; V234-R237 HydrophobicContact CG1-CB 4.28Å; V234-M401 HydrophobicContact CG2-CB 4.13Å
235	F	98.7	Very high	97.8	Very high	1 Å²	1	35.9 Å²	35.9	0%	0.004	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	-15.4	179.2	71.6	-94.7	0	0	0	114	W264 L265 L270 L281 M400 V402	F235-W264 HydrophobicContact CD2-CH2 4.18Å; F235-W264 HydrophobicContact CD2-CZ3 4.2Å; F235-W264 AromaticContact CE2-CH2 3.96Å; F235-W264 HydrophobicContact CE2-CH2 3.96Å; F235-W264 HydrophobicContact CE2-CZ3 4.11Å; F235-W264 CarbonylContact O-C 3.52Å; F235-W264 WeakPolarHBondContact O-CA 3.46Å; F235-L265 HydrophobicContact CB-CB 3.82Å; F235-L265 HydrophobicContact CB-CD2 3.98Å; F235-L265 PolarHBondContact O-N 3.46Å; F235-L270 HydrophobicContact CB-CD1 4.23Å; F235-L270 HydrophobicContact CB-CD2 4.3Å; F235-L270 HydrophobicContact CD1-CD1 4.02Å; F235-L270 HydrophobicContact CD1-CD2 4.12Å; F235-L270 HydrophobicContact CD2-CD2 3.47Å; F235-L270 VanDerWaalsContact CD2-CD2 3.47Å; F235-L270 HydrophobicContact CE1-CD2 4.25Å; F235-L270 HydrophobicContact CE2-CD2 3.63Å; F235-L270 HydrophobicContact CG-CD1 4.08Å; F235-L270 HydrophobicContact CG-CD2 3.71Å; F235-L270 HydrophobicContact CZ-CD2 3.99Å; F235-L281 HydrophobicContact CE1-CD1 3.45Å; F235-L281 VanDerWaalsContact CE1-CD1 3.45Å; F235-L281 HydrophobicContact CZ-CD1 3.65Å; F235-M400 HydrophobicContact CD1-CB 4.16Å; F235-M400 VanDerWaalsContact CD1-O 3.26Å; F235-M400 WeakPolarHBondContact CD1-O 3.41Å; F235-M400 HydrophobicContact CD2-CB 4.28Å; F235-M400 VanDerWaalsContact CE1-C 3.49Å; F235-M400 HydrophobicContact CE1-CB 3.51Å; F235-M400 HydrophobicContact CE2-CB 3.66Å; F235-M400 HydrophobicContact CE2-CE 4.16Å; F235-M400 HydrophobicContact CE2-CG 4.39Å; F235-M400 HydrophobicContact CE2-SD 3.85Å; F235-M400 HydrophobicContact CZ-CB 3.25Å; F235-M400 HydrophobicContact CZ-CE 3.75Å; F235-M400 HydrophobicContact CZ-CG 4.19Å; F235-M400 HydrophobicContact CZ-SD 3.94Å; F235-M400 PolarHBondContact N-O 2.99Å; F235-V402 HydrophobicContact CD1-CG1 4.05Å; F235-V402 HydrophobicContact CE1-CG1 3.81Å
236	Q	98.8	Very high	97.8	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	137.3	171	-170.6	-96.6	37.7	0	0	109.3	F245 H263 W264 L366 N367 T398 S399 M400	Q236-F245 HydrophobicContact CG-CE1 4.3Å; Q236-H263 WeakPolarHBondContact CA-O 3.38Å; Q236-W264 HydrophobicContact CB-CE3 3.69Å; Q236-W264 HydrophobicContact CB-CZ3 3.73Å; Q236-W264 HydrophobicContact CG-CE3 3.54Å; Q236-W264 HydrophobicContact CG-CZ3 3.71Å; Q236-L366 PolarHBondContact NE2-O 3.04Å; Q236-N367 PolarHBondContact NE2-OD1 3.43Å; Q236-T398 PolarHBondContact NE2-OG1 2.89Å; Q236-T398 PolarHBondContact OE1-OG1 3.23Å; Q236-S399 CarbonylContact O-C 3.12Å; Q236-S399 WeakPolarHBondContact O-CA 3.38Å; Q236-M400 HydrophobicContact CB-CB 3.96Å; Q236-M400 HydrophobicContact CB-CG 4.05Å; Q236-M400 HydrophobicContact CB-SD 4.19Å; Q236-M400 PolarHBondContact N-O 3.25Å; Q236-M400 PolarHBondContact O-N 3.15Å
237	R	98.7	Very high	97.8	Very high	73 Å²	73	35.7 Å²	35.7	28%	0.275	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	133.4	172.5	-165.9	177.1	-179.8	170.5	2.6	111.3	V234 F239 E262 H263 T398	V234-R237 HydrophobicContact CG1-CB 4.28Å; R237-F239 HydrophobicContact CG-CD1 4.2Å; R237-E262 VanDerWaalsContact O-CA 3.22Å; R237-E262 WeakPolarHBondContact O-CA 3.32Å; R237-E262 WeakPolarHBondContact O-CB 3.5Å; R237-H263 PolarHBondContact N-O 3.14Å; R237-H263 VanDerWaalsContact N-O 3.13Å; R237-H263 PolarHBondContact O-N 3.16Å; R237-T398 WeakPolarHBondContact CA-O 3.32Å
238	R	98.7	Very high	97.9	Very high	5 Å²	5	34.8 Å²	34.8	2%	0.019	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	136.7	174	-50.7	-65.2	-60.9	-79.9	10.7	109.6	F245 E262 L366 G368 I383 S397 T398	R238-F245 HydrophobicContact CG-CZ 4.47Å; R238-E262 WeakPolarHBondContact CA-OE1 3.34Å; R238-E262 IonicContact NE-OE1 2.64Å; R238-E262 IonicContact NE-OE2 3.23Å; R238-L366 PolarHBondContact NH1-O 2.92Å; R238-L366 VanDerWaalsContact NH1-O 3.17Å; R238-G368 PolarHBondContact NH1-O 3.28Å; R238-G368 PolarHBondContact NH2-O 3.43Å; R238-I383 HydrophobicContact CB-CD1 3.99Å; R238-I383 HydrophobicContact CG-CD1 4.23Å; R238-S397 CarbonylContact O-C 3.52Å; R238-S397 WeakPolarHBondContact O-CA 3.49Å; R238-S397 WeakPolarHBondContact O-CB 3.5Å; R238-T398 WeakPolarHBondContact CB-OG1 3.33Å; R238-T398 WeakPolarHBondContact CG-OG1 3.45Å; R238-T398 PolarHBondContact N-O 2.97Å; R238-T398 PolarHBondContact O-N 3.45Å
239	F	98.2	Very high	98.1	Very high	73 Å²	73	32.3 Å²	32.3	32%	0.32	18%	0.181	S	C	.	.	S	Bend	trans	-164.2	-9.7	177.4	65.6	-87	0	0	0	115.8	R237 E262 Y370 R396	R237-F239 HydrophobicContact CG-CD1 4.2Å; F239-E262 HydrophobicContact CD1-CG 3.84Å; F239-E262 HydrophobicContact CE1-CG 3.8Å; F239-E262 PolarHBondContact N-OE1 3.49Å; F239-Y370 VanDerWaalsContact C-OH 3.27Å; F239-Y370 PolarHBondContact O-OH 3.45Å; F239-R396 WeakPolarHBondContact CA-O 3.41Å
240	N	97.1	Very high	98.2	Very high	77 Å²	77	39.6 Å²	39.6	41%	0.412	20%	0.195	S	C	.	.	S	Bend	trans	-145.9	-9.8	-176.3	66.9	5	0	0	0	114.7	S242 E262	N240-S242 VanDerWaalsContact C-N 3.34Å; N240-S242 VanDerWaalsContact OD1-CB 3.31Å; N240-S242 WeakPolarHBondContact OD1-CB 3.44Å; N240-S242 PolarHBondContact OD1-N 2.88Å; N240-S242 PolarHBondContact OD1-OG 3.11Å; N240-E262 PolarHBondContact N-OE1 3.35Å; N240-E262 VanDerWaalsContact OD1-CG 3.3Å; N240-E262 WeakPolarHBondContact OD1-CG 3.33Å; N240-E262 PolarHBondContact OD1-OE1 2.87Å
241	G	97.3	Very high	98.3	Very high	32 Å²	32	42.2 Å²	42.2	33%	0.33	21%	0.208	S	C	.	.			trans	72.9	20.1	-177.9	0	0	0	0	0	114.7	V243 E262 Y370	G241-V243 VanDerWaalsContact C-N 3.26Å; G241-V243 PolarHBondContact O-N 3Å; G241-E262 WeakPolarHBondContact CA-OE2 3.25Å; G241-E262 VanDerWaalsContact N-CD 3.3Å; G241-E262 PolarHBondContact N-OE1 3.31Å; G241-E262 PolarHBondContact N-OE2 3.12Å; G241-Y370 VanDerWaalsContact CA-CG 3.45Å
242	S	97	Very high	98.3	Very high	81 Å²	81	42.2 Å²	42.2	57%	0.566	21%	0.208	S	C	*	.			trans	-71.3	-20.4	-179.2	62.9	0	0	0	0	113.6	N240 E262	N240-S242 VanDerWaalsContact C-N 3.34Å; N240-S242 VanDerWaalsContact OD1-CB 3.31Å; N240-S242 WeakPolarHBondContact OD1-CB 3.44Å; N240-S242 PolarHBondContact OD1-N 2.88Å; N240-S242 PolarHBondContact OD1-OG 3.11Å; S242-E262 PolarHBondContact N-OE2 2.91Å; S242-E262 VanDerWaalsContact N-OE2 3.11Å
243	V	98.1	Very high	98.4	Very high	23 Å²	23	44.7 Å²	44.7	14%	0.139	22%	0.218	C	C	.	.	S	Bend	trans	-114.9	131.4	-179.1	176	0	0	0	0	110.1	G241 F245 F256 E262	G241-V243 VanDerWaalsContact C-N 3.26Å; G241-V243 PolarHBondContact O-N 3Å; V243-F245 HydrophobicContact CB-CD2 4.42Å; V243-F245 HydrophobicContact CB-CE2 4Å; V243-F245 HydrophobicContact CG1-CD2 4.16Å; V243-F245 HydrophobicContact CG1-CE2 3.88Å; V243-F245 WeakPolarHBondContact O-CD2 3.33Å; V243-F256 HydrophobicContact CG1-CD2 3.9Å; V243-F256 HydrophobicContact CG1-CE2 4.17Å; V243-E262 HydrophobicContact CB-CB 3.98Å; V243-E262 HydrophobicContact CG2-CB 3.95Å; V243-E262 WeakPolarHBondContact CG2-O 3.4Å; V243-E262 PolarHBondContact N-OE2 3.24Å
244	D	98	Very high	98.3	Very high	82 Å²	82	50.8 Å²	50.8	44%	0.439	25%	0.248	S	C	.	.			trans	-72	127.2	169.6	178.1	21.6	0	0	0	110.1	Q246 R247	D244-Q246 WeakPolarHBondContact OD1-CB 3.32Å; D244-Q246 PolarHBondContact OD1-N 3.18Å; D244-R247 PolarHBondContact O-NE 3.33Å; D244-R247 PolarHBondContact O-NH2 3.47Å
245	F	98.6	Very high	98.3	Very high	4 Å²	4	51.8 Å²	51.8	2%	0.018	26%	0.259	C	S	.	.			trans	-100.5	0.2	177.9	-86	-111	0	0	0	112.8	Q236 R238 V243 R247 Y252 F256 E262 W264 G354 N367	Q236-F245 HydrophobicContact CG-CE1 4.3Å; R238-F245 HydrophobicContact CG-CZ 4.47Å; V243-F245 HydrophobicContact CB-CD2 4.42Å; V243-F245 HydrophobicContact CB-CE2 4Å; V243-F245 HydrophobicContact CG1-CD2 4.16Å; V243-F245 HydrophobicContact CG1-CE2 3.88Å; V243-F245 WeakPolarHBondContact O-CD2 3.33Å; F245-R247 PolarHBondContact O-N 3.11Å; F245-Y252 WeakPolarHBondContact O-CE2 3.21Å; F245-Y252 PolarHBondContact O-OH 3.47Å; F245-F256 AromaticContact CD1-CE2 3.78Å; F245-F256 HydrophobicContact CD1-CE2 3.78Å; F245-F256 AromaticContact CD1-CZ 3.74Å; F245-F256 HydrophobicContact CD1-CZ 3.74Å; F245-F256 HydrophobicContact CD2-CE2 4.06Å; F245-F256 AromaticContact CE1-CE2 3.82Å; F245-F256 HydrophobicContact CE1-CE2 3.82Å; F245-F256 AromaticContact CE1-CZ 3.98Å; F245-F256 HydrophobicContact CE1-CZ 3.98Å; F245-F256 HydrophobicContact CE2-CE2 4.09Å; F245-F256 AromaticContact CG-CE2 3.9Å; F245-F256 HydrophobicContact CG-CE2 3.9Å; F245-F256 HydrophobicContact CG-CZ 4.15Å; F245-F256 AromaticContact CZ-CE2 3.96Å; F245-F256 HydrophobicContact CZ-CE2 3.96Å; F245-E262 HydrophobicContact CE2-CB 4.35Å; F245-W264 HydrophobicContact CE1-CB 4.27Å; F245-G354 WeakPolarHBondContact O-CA 3.49Å; F245-N367 VanDerWaalsContact CB-O 3.25Å; F245-N367 WeakPolarHBondContact CB-O 3.3Å; F245-N367 HydrophobicContact CD1-CB 3.91Å
246	Q	98	Very high	98.3	Very high	74 Å²	74	53 Å²	53	35%	0.346	26%	0.264	S	S	.	.			trans	-77	56.8	174.6	-61.3	-169.9	10.8	0	0	112.5	D244 R336 T353	D244-Q246 WeakPolarHBondContact OD1-CB 3.32Å; D244-Q246 PolarHBondContact OD1-N 3.18Å; Q246-R336 PolarHBondContact O-NH1 3.14Å; Q246-R336 VanDerWaalsContact O-NH1 3.16Å; Q246-T353 VanDerWaalsContact NE2-CG2 3.32Å
247	R	98.4	Very high	98.3	Very high	68 Å²	68	55.3 Å²	55.3	26%	0.257	29%	0.288	S	S	.	.			trans	-95.6	158.6	-172.2	-55.6	-56	-172.6	158.2	-10.3	112.9	D244 F245 E251 Y252 F256	D244-R247 PolarHBondContact O-NE 3.33Å; D244-R247 PolarHBondContact O-NH2 3.47Å; F245-R247 PolarHBondContact O-N 3.11Å; R247-E251 HydrophobicContact CB-CB 3.76Å; R247-E251 WeakPolarHBondContact CD-OE1 3.45Å; R247-E251 HydrophobicContact CG-CB 4.46Å; R247-E251 IonicContact CZ-OE1 3.14Å; R247-E251 IonicContact NE-OE1 3.71Å; R247-E251 IonicContact NH1-OE1 3.89Å; R247-E251 PolarHBondContact NH1-OE1 3.44Å; R247-E251 VanDerWaalsContact NH1-OE1 3.08Å; R247-Y252 HydrophobicContact CB-CD2 3.85Å; R247-Y252 HydrophobicContact CB-CE2 3.67Å; R247-F256 HydrophobicContact CB-CD1 4.15Å; R247-F256 HydrophobicContact CB-CE1 3.81Å; R247-F256 HydrophobicContact CB-CZ 4.17Å; R247-F256 HydrophobicContact CG-CD1 3.85Å; R247-F256 HydrophobicContact CG-CD2 4Å; R247-F256 HydrophobicContact CG-CE1 3.65Å; R247-F256 HydrophobicContact CG-CE2 3.82Å; R247-F256 HydrophobicContact CG-CG 4.02Å; R247-F256 HydrophobicContact CG-CZ 3.64Å
248	S	98.6	Very high	98.2	Very high	21 Å²	21	56.2 Å²	56.2	15%	0.147	30%	0.298	C	S	.	.			trans	-71.7	166.6	175.4	60.8	0	0	0	0	112.8	R250 E251 Y252 D337	S248-R250 VanDerWaalsContact C-N 3.27Å; S248-R250 PolarHBondContact O-N 3.28Å; S248-E251 WeakPolarHBondContact CB-OE2 3.36Å; S248-E251 PolarHBondContact N-OE2 2.88Å; S248-E251 PolarHBondContact O-N 3.02Å; S248-E251 WeakPolarHBondContact OG-CG 3.41Å; S248-E251 PolarHBondContact OG-N 3.05Å; S248-E251 PolarHBondContact OG-OE2 3.45Å; S248-Y252 PolarHBondContact O-N 3.31Å; S248-D337 WeakPolarHBondContact CA-OD1 3.44Å; S248-D337 WeakPolarHBondContact CB-OD2 3.45Å
249	W	98.8	Very high	98.2	Very high	19 Å²	19	57.4 Å²	57.4	7%	0.072	31%	0.305	C	S	.	.	H	α-helix	trans	-52.6	-46.7	172.4	-179.5	-99	0	0	0	111.9	E251 Y252 K253 E305 Q308 Y309 F333 T335 D337 H338	W249-E251 VanDerWaalsContact C-N 3.34Å; W249-E251 PolarHBondContact O-N 3.4Å; W249-Y252 PolarHBondContact O-N 2.98Å; W249-K253 WeakPolarHBondContact O-CB 3.34Å; W249-K253 PolarHBondContact O-N 3.02Å; W249-E305 HydrophobicContact CZ2-CG 4.06Å; W249-E305 PolarHBondContact NE1-OE1 3.49Å; W249-Q308 HydrophobicContact CH2-CB 4.34Å; W249-Y309 AromaticContact CH2-CD2 3.6Å; W249-Y309 HydrophobicContact CH2-CD2 3.6Å; W249-Y309 HydrophobicContact CH2-CE2 4.16Å; W249-Y309 AromaticContact CZ2-CD2 3.48Å; W249-Y309 HydrophobicContact CZ2-CD2 3.48Å; W249-Y309 VanDerWaalsContact CZ2-CD2 3.48Å; W249-Y309 AromaticContact CZ2-CE2 3.56Å; W249-Y309 HydrophobicContact CZ2-CE2 3.56Å; W249-Y309 HydrophobicContact CZ3-CD2 4.47Å; W249-F333 HydrophobicContact CE3-CD1 4.49Å; W249-F333 HydrophobicContact CH2-CB 4.44Å; W249-F333 HydrophobicContact CZ3-CB 4.16Å; W249-F333 HydrophobicContact CZ3-CD1 4.05Å; W249-F333 VanDerWaalsContact CZ3-O 3.25Å; W249-F333 WeakPolarHBondContact CZ3-O 3.27Å; W249-T335 WeakPolarHBondContact CA-OG1 3.49Å; W249-T335 HydrophobicContact CE3-CG2 4.21Å; W249-T335 PolarHBondContact N-OG1 2.83Å; W249-D337 PolarHBondContact N-OD1 2.96Å; W249-D337 PolarHBondContact N-OD2 2.93Å; W249-H338 HydrophobicContact CB-CB 4.22Å; W249-H338 WeakPolarHBondContact CB-ND1 3.41Å; W249-H338 HydrophobicContact CD2-CB 4.1Å; W249-H338 AromaticContact CD2-CD2 3.88Å; W249-H338 AromaticContact CD2-CG 3.9Å; W249-H338 HydrophobicContact CE3-CB 3.68Å; W249-H338 HydrophobicContact CG-CB 4.36Å; W249-H338 AromaticContact CG-CD2 3.87Å; W249-H338 AromaticContact CG-CG 3.79Å; W249-H338 AromaticContact CG-ND1 3.92Å; W249-H338 HydrophobicContact CZ3-CB 4.34Å
250	R	98.8	Very high	98	Very high	195 Å²	195	57 Å²	57	74%	0.736	31%	0.311	S	S	*	.	H	α-helix	trans	-61.7	-41.6	-179.7	-177	179.5	175.9	-174.9	-1.2	111.9	S248 K253 M254	S248-R250 VanDerWaalsContact C-N 3.27Å; S248-R250 PolarHBondContact O-N 3.28Å; R250-K253 WeakPolarHBondContact O-CB 3.3Å; R250-K253 PolarHBondContact O-N 3.47Å; R250-M254 VanDerWaalsContact O-CG 3.32Å; R250-M254 WeakPolarHBondContact O-CG 3.35Å; R250-M254 PolarHBondContact O-N 2.69Å
251	E	98.8	Very high	98	Very high	55 Å²	55	53.8 Å²	53.8	26%	0.257	30%	0.296	S	S	.	.	H	α-helix	trans	-67.7	-44.1	177.4	-73.6	166.8	112.1	0	0	111.2	R247 S248 W249 K253 M254 G255 F256	R247-E251 HydrophobicContact CB-CB 3.76Å; R247-E251 WeakPolarHBondContact CD-OE1 3.45Å; R247-E251 HydrophobicContact CG-CB 4.46Å; R247-E251 IonicContact CZ-OE1 3.14Å; R247-E251 IonicContact NE-OE1 3.71Å; R247-E251 IonicContact NH1-OE1 3.89Å; R247-E251 PolarHBondContact NH1-OE1 3.44Å; R247-E251 VanDerWaalsContact NH1-OE1 3.08Å; S248-E251 WeakPolarHBondContact CB-OE2 3.36Å; S248-E251 PolarHBondContact N-OE2 2.88Å; S248-E251 PolarHBondContact O-N 3.02Å; S248-E251 WeakPolarHBondContact OG-CG 3.41Å; S248-E251 PolarHBondContact OG-N 3.05Å; S248-E251 PolarHBondContact OG-OE2 3.45Å; W249-E251 VanDerWaalsContact C-N 3.34Å; W249-E251 PolarHBondContact O-N 3.4Å; E251-K253 VanDerWaalsContact C-N 3.29Å; E251-K253 PolarHBondContact O-N 2.88Å; E251-M254 PolarHBondContact O-N 3.41Å; E251-G255 CarbonylContact O-C 3.51Å; E251-G255 WeakPolarHBondContact O-CA 3.47Å; E251-G255 PolarHBondContact O-N 3Å; E251-F256 HydrophobicContact CB-CD1 4.2Å
252	Y	98.8	Very high	98.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-64.2	-32.9	174.5	-89.6	-78	0	0	0	113.2	F245 R247 S248 W249 F256 W264 G266 N267 F333 T335 G355	F245-Y252 WeakPolarHBondContact O-CE2 3.21Å; F245-Y252 PolarHBondContact O-OH 3.47Å; R247-Y252 HydrophobicContact CB-CD2 3.85Å; R247-Y252 HydrophobicContact CB-CE2 3.67Å; S248-Y252 PolarHBondContact O-N 3.31Å; W249-Y252 PolarHBondContact O-N 2.98Å; Y252-F256 AromaticContact CD1-CE1 3.71Å; Y252-F256 HydrophobicContact CD1-CE1 3.71Å; Y252-F256 HydrophobicContact CD1-CZ 4.19Å; Y252-F256 HydrophobicContact CD2-CE1 4.03Å; Y252-F256 AromaticContact CE1-CE1 3.67Å; Y252-F256 HydrophobicContact CE1-CE1 3.67Å; Y252-F256 AromaticContact CE1-CZ 3.65Å; Y252-F256 HydrophobicContact CE1-CZ 3.65Å; Y252-F256 AromaticContact CE2-CE1 4Å; Y252-F256 HydrophobicContact CE2-CE1 4Å; Y252-F256 HydrophobicContact CE2-CZ 4.14Å; Y252-F256 AromaticContact CG-CE1 3.88Å; Y252-F256 HydrophobicContact CG-CE1 3.88Å; Y252-F256 AromaticContact CZ-CE1 3.8Å; Y252-F256 AromaticContact CZ-CZ 3.61Å; Y252-W264 AromaticContact CD1-CD1 3.64Å; Y252-W264 AromaticContact CD1-CD2 3.92Å; Y252-W264 HydrophobicContact CD1-CD2 3.92Å; Y252-W264 AromaticContact CD1-CE2 3.79Å; Y252-W264 AromaticContact CD1-CG 3.85Å; Y252-W264 HydrophobicContact CD1-CG 3.85Å; Y252-W264 HydrophobicContact CD1-CZ2 4.45Å; Y252-W264 AromaticContact CD1-NE1 3.6Å; Y252-W264 AromaticContact CE1-CD2 3.95Å; Y252-W264 HydrophobicContact CE1-CD2 3.95Å; Y252-W264 HydrophobicContact CE1-CE3 4.33Å; Y252-W264 HydrophobicContact CE1-CG 4.02Å; Y252-W264 PolarHBondContact O-NE1 3.03Å; Y252-G266 CarbonylContact O-C 3.5Å; Y252-G266 WeakPolarHBondContact O-CA 2.92Å; Y252-N267 PolarHBondContact O-N 3.37Å; Y252-N267 PolarHBondContact O-OD1 2.93Å; Y252-F333 AromaticContact CD1-CE1 3.67Å; Y252-F333 HydrophobicContact CD1-CE1 3.67Å; Y252-F333 AromaticContact CD1-CZ 3.47Å; Y252-F333 HydrophobicContact CD1-CZ 3.47Å; Y252-F333 VanDerWaalsContact CD1-CZ 3.47Å; Y252-F333 HydrophobicContact CD2-CE1 4.23Å; Y252-F333 HydrophobicContact CE1-CE1 4.34Å; Y252-F333 AromaticContact CE1-CZ 3.84Å; Y252-F333 HydrophobicContact CE1-CZ 3.84Å; Y252-F333 AromaticContact CG-CE1 3.62Å; Y252-F333 HydrophobicContact CG-CE1 3.62Å; Y252-F333 AromaticContact CG-CZ 3.94Å; Y252-F333 HydrophobicContact CG-CZ 3.94Å; Y252-T335 HydrophobicContact CD2-CG2 3.49Å; Y252-T335 VanDerWaalsContact CD2-CG2 3.49Å; Y252-T335 HydrophobicContact CE2-CG2 4.18Å; Y252-T335 HydrophobicContact CG-CG2 4.02Å; Y252-G355 VanDerWaalsContact CE2-N 3.29Å; Y252-G355 PolarHBondContact OH-N 3.22Å
253	K	98.6	Very high	98.2	Very high	52 Å²	52	48.5 Å²	48.5	23%	0.226	25%	0.254	C	S	.	.	H	α-helix	trans	-62.8	-50.4	172.5	168.5	172.5	-173.5	177.4	0	112.1	W249 R250 E251 G266 N267 E268 E305 Y309	W249-K253 WeakPolarHBondContact O-CB 3.34Å; W249-K253 PolarHBondContact O-N 3.02Å; R250-K253 WeakPolarHBondContact O-CB 3.3Å; R250-K253 PolarHBondContact O-N 3.47Å; E251-K253 VanDerWaalsContact C-N 3.29Å; E251-K253 PolarHBondContact O-N 2.88Å; K253-G266 CarbonylContact O-C 3.48Å; K253-G266 WeakPolarHBondContact O-CA 3.27Å; K253-N267 PolarHBondContact O-N 3.34Å; K253-E268 HydrophobicContact CG-CB 4.23Å; K253-E268 PolarHBondContact O-N 3.26Å; K253-E305 WeakPolarHBondContact CD-OE1 3.36Å; K253-E305 VanDerWaalsContact NZ-CD 3.27Å; K253-E305 IonicContact NZ-OE1 3.95Å; K253-E305 PolarHBondContact NZ-OE1 3.44Å; K253-E305 IonicContact NZ-OE2 2.76Å; K253-E305 PolarHBondContact NZ-OE2 2.91Å; K253-Y309 HydrophobicContact CB-CE2 4.4Å; K253-Y309 WeakPolarHBondContact CD-OH 3.35Å; K253-Y309 VanDerWaalsContact CG-OH 3.29Å; K253-Y309 WeakPolarHBondContact CG-OH 3.35Å
254	M	98.3	Very high	98.2	Very high	129 Å²	129	47.5 Å²	47.5	64%	0.635	25%	0.248	S	C	*	.	H	α-helix	trans	-82.4	-23.3	-173.7	-65.1	-57.5	-58.9	0	0	113.7	R250 E251	R250-M254 VanDerWaalsContact O-CG 3.32Å; R250-M254 WeakPolarHBondContact O-CG 3.35Å; R250-M254 PolarHBondContact O-N 2.69Å; E251-M254 PolarHBondContact O-N 3.41Å
255	G	98.6	Very high	98.3	Very high	23 Å²	23	44.1 Å²	44.1	24%	0.237	23%	0.23	C	C	.	.			trans	92.2	158.2	-170.1	0	0	0	0	0	112.7	E251 W264	E251-G255 CarbonylContact O-C 3.51Å; E251-G255 WeakPolarHBondContact O-CA 3.47Å; E251-G255 PolarHBondContact O-N 3Å; G255-W264 CarbonylContact C-O 3.55Å; G255-W264 WeakPolarHBondContact CA-O 3.47Å
256	F	98.8	Very high	98.2	Very high	26 Å²	26	44 Å²	44	11%	0.114	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	165.2	179.4	58.4	-95.4	0	0	0	111.5	V243 F245 R247 E251 Y252 H263 W264	V243-F256 HydrophobicContact CG1-CD2 3.9Å; V243-F256 HydrophobicContact CG1-CE2 4.17Å; F245-F256 AromaticContact CD1-CE2 3.78Å; F245-F256 HydrophobicContact CD1-CE2 3.78Å; F245-F256 AromaticContact CD1-CZ 3.74Å; F245-F256 HydrophobicContact CD1-CZ 3.74Å; F245-F256 HydrophobicContact CD2-CE2 4.06Å; F245-F256 AromaticContact CE1-CE2 3.82Å; F245-F256 HydrophobicContact CE1-CE2 3.82Å; F245-F256 AromaticContact CE1-CZ 3.98Å; F245-F256 HydrophobicContact CE1-CZ 3.98Å; F245-F256 HydrophobicContact CE2-CE2 4.09Å; F245-F256 AromaticContact CG-CE2 3.9Å; F245-F256 HydrophobicContact CG-CE2 3.9Å; F245-F256 HydrophobicContact CG-CZ 4.15Å; F245-F256 AromaticContact CZ-CE2 3.96Å; F245-F256 HydrophobicContact CZ-CE2 3.96Å; R247-F256 HydrophobicContact CB-CD1 4.15Å; R247-F256 HydrophobicContact CB-CE1 3.81Å; R247-F256 HydrophobicContact CB-CZ 4.17Å; R247-F256 HydrophobicContact CG-CD1 3.85Å; R247-F256 HydrophobicContact CG-CD2 4Å; R247-F256 HydrophobicContact CG-CE1 3.65Å; R247-F256 HydrophobicContact CG-CE2 3.82Å; R247-F256 HydrophobicContact CG-CG 4.02Å; R247-F256 HydrophobicContact CG-CZ 3.64Å; E251-F256 HydrophobicContact CB-CD1 4.2Å; Y252-F256 AromaticContact CD1-CE1 3.71Å; Y252-F256 HydrophobicContact CD1-CE1 3.71Å; Y252-F256 HydrophobicContact CD1-CZ 4.19Å; Y252-F256 HydrophobicContact CD2-CE1 4.03Å; Y252-F256 AromaticContact CE1-CE1 3.67Å; Y252-F256 HydrophobicContact CE1-CE1 3.67Å; Y252-F256 AromaticContact CE1-CZ 3.65Å; Y252-F256 HydrophobicContact CE1-CZ 3.65Å; Y252-F256 AromaticContact CE2-CE1 4Å; Y252-F256 HydrophobicContact CE2-CE1 4Å; Y252-F256 HydrophobicContact CE2-CZ 4.14Å; Y252-F256 AromaticContact CG-CE1 3.88Å; Y252-F256 HydrophobicContact CG-CE1 3.88Å; Y252-F256 AromaticContact CZ-CE1 3.8Å; Y252-F256 AromaticContact CZ-CZ 3.61Å; F256-H263 CarbonylContact O-C 3.59Å; F256-H263 VanDerWaalsContact O-CA 3.26Å; F256-H263 WeakPolarHBondContact O-CA 3.47Å; F256-H263 VanDerWaalsContact O-CB 3.32Å; F256-H263 WeakPolarHBondContact O-CB 3.43Å; F256-W264 HydrophobicContact CD1-CB 4.07Å; F256-W264 HydrophobicContact CD2-CB 4.39Å; F256-W264 HydrophobicContact CE1-CB 3.63Å; F256-W264 HydrophobicContact CE1-CG 4.09Å; F256-W264 HydrophobicContact CE2-CB 3.97Å; F256-W264 HydrophobicContact CG-CB 4.44Å; F256-W264 HydrophobicContact CZ-CB 3.57Å; F256-W264 HydrophobicContact CZ-CG 4.29Å; F256-W264 PolarHBondContact N-O 3.44Å; F256-W264 PolarHBondContact O-N 3.36Å
257	G	98.3	Very high	98.3	Very high	49 Å²	49	40.5 Å²	40.5	51%	0.505	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	92.9	-164.2	-178.8	0	0	0	0	0	112.8	E262	G257-E262 WeakPolarHBondContact CA-O 3.43Å
258	D	97.3	Very high	98.2	Very high	92 Å²	92	39.6 Å²	39.6	49%	0.492	21%	0.212	S	C	.	.			trans	-110.7	122.5	177.6	179.7	-2.5	0	0	0	108.9	S260 G261 E262 H263	D258-S260 PolarHBondContact O-N 3.08Å; D258-S260 VanDerWaalsContact O-N 3.16Å; D258-S260 WeakPolarHBondContact OD1-CB 3.06Å; D258-S260 PolarHBondContact OD1-N 3.17Å; D258-G261 CarbonylContact O-C 3.59Å; D258-G261 WeakPolarHBondContact O-CA 3.31Å; D258-G261 PolarHBondContact O-N 3.15Å; D258-E262 PolarHBondContact N-O 3.02Å; D258-H263 WeakPolarHBondContact O-CB 3.48Å; D258-H263 PolarHBondContact O-ND1 3.24Å
259	L	96.9	Very high	98.1	Very high	31 Å²	31	39.3 Å²	39.3	16%	0.162	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-26.1	178.8	-65.5	174.7	0	0	0	112.3	L207 Q220 Y222 G261 H263 L265	L207-L259 HydrophobicContact CD2-CB 3.45Å; L207-L259 VanDerWaalsContact CD2-CB 3.45Å; L207-L259 HydrophobicContact CD2-CD1 4.43Å; Q220-L259 HydrophobicContact CB-CD1 3.85Å; Q220-L259 HydrophobicContact CG-CD1 3.82Å; Q220-L259 WeakPolarHBondContact O-CD1 3.36Å; Y222-L259 WeakPolarHBondContact CB-O 3.45Å; Y222-L259 VanDerWaalsContact CD2-O 3.26Å; Y222-L259 WeakPolarHBondContact CD2-O 3.26Å; L259-G261 VanDerWaalsContact C-N 3.33Å; L259-H263 PolarHBondContact O-CE1 2.83Å; L259-L265 HydrophobicContact CD2-CD1 4Å
260	S	95.8	Very high	98	Very high	63 Å²	63	38.4 Å²	38.4	44%	0.441	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-13.3	172.7	-53.8	0	0	0	0	113.3	D258	D258-S260 PolarHBondContact O-N 3.08Å; D258-S260 VanDerWaalsContact O-N 3.16Å; D258-S260 WeakPolarHBondContact OD1-CB 3.06Å; D258-S260 PolarHBondContact OD1-N 3.17Å
261	G	97.3	Very high	97.9	Very high	10 Å²	10	32.1 Å²	32.1	10%	0.103	18%	0.183	C	C	.	.	S	Bend	trans	-125.8	-139.1	-176.5	0	0	0	0	0	112.6	D258 L259 H263	D258-G261 CarbonylContact O-C 3.59Å; D258-G261 WeakPolarHBondContact O-CA 3.31Å; D258-G261 PolarHBondContact O-N 3.15Å; L259-G261 VanDerWaalsContact C-N 3.33Å; G261-H263 PolarHBondContact O-ND1 3.45Å; G261-H263 VanDerWaalsContact O-ND1 3.15Å
262	E	98.7	Very high	97.7	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	18%	0.182	C	C	.	.	S	Bend	trans	-78.2	129.9	173.6	-63.2	-165.1	149.1	0	0	110.4	R237 R238 F239 N240 G241 S242 V243 F245 G257 D258	R237-E262 VanDerWaalsContact O-CA 3.22Å; R237-E262 WeakPolarHBondContact O-CA 3.32Å; R237-E262 WeakPolarHBondContact O-CB 3.5Å; R238-E262 WeakPolarHBondContact CA-OE1 3.34Å; R238-E262 IonicContact NE-OE1 2.64Å; R238-E262 IonicContact NE-OE2 3.23Å; F239-E262 HydrophobicContact CD1-CG 3.84Å; F239-E262 HydrophobicContact CE1-CG 3.8Å; F239-E262 PolarHBondContact N-OE1 3.49Å; N240-E262 PolarHBondContact N-OE1 3.35Å; N240-E262 VanDerWaalsContact OD1-CG 3.3Å; N240-E262 WeakPolarHBondContact OD1-CG 3.33Å; N240-E262 PolarHBondContact OD1-OE1 2.87Å; G241-E262 WeakPolarHBondContact CA-OE2 3.25Å; G241-E262 VanDerWaalsContact N-CD 3.3Å; G241-E262 PolarHBondContact N-OE1 3.31Å; G241-E262 PolarHBondContact N-OE2 3.12Å; S242-E262 PolarHBondContact N-OE2 2.91Å; S242-E262 VanDerWaalsContact N-OE2 3.11Å; V243-E262 HydrophobicContact CB-CB 3.98Å; V243-E262 HydrophobicContact CG2-CB 3.95Å; V243-E262 WeakPolarHBondContact CG2-O 3.4Å; V243-E262 PolarHBondContact N-OE2 3.24Å; F245-E262 HydrophobicContact CE2-CB 4.35Å; G257-E262 WeakPolarHBondContact CA-O 3.43Å; D258-E262 PolarHBondContact N-O 3.02Å
263	H	98.8	Very high	97.5	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158	166.3	-179	63.4	-85.1	0	0	0	112.8	Q236 R237 F256 D258 L259 G261	Q236-H263 WeakPolarHBondContact CA-O 3.38Å; R237-H263 PolarHBondContact N-O 3.14Å; R237-H263 VanDerWaalsContact N-O 3.13Å; R237-H263 PolarHBondContact O-N 3.16Å; F256-H263 CarbonylContact O-C 3.59Å; F256-H263 VanDerWaalsContact O-CA 3.26Å; F256-H263 WeakPolarHBondContact O-CA 3.47Å; F256-H263 VanDerWaalsContact O-CB 3.32Å; F256-H263 WeakPolarHBondContact O-CB 3.43Å; D258-H263 WeakPolarHBondContact O-CB 3.48Å; D258-H263 PolarHBondContact O-ND1 3.24Å; L259-H263 PolarHBondContact O-CE1 2.83Å; G261-H263 PolarHBondContact O-ND1 3.45Å; G261-H263 VanDerWaalsContact O-ND1 3.15Å
264	W	98.9	Very high	97.3	Very high	3 Å²	3	29.4 Å²	29.4	1%	0.011	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	122.1	160	-175.6	-97.4	0	0	0	107.8	F235 Q236 F245 Y252 G255 F256 G266 N267 F333 W357 N367	F235-W264 HydrophobicContact CD2-CH2 4.18Å; F235-W264 HydrophobicContact CD2-CZ3 4.2Å; F235-W264 AromaticContact CE2-CH2 3.96Å; F235-W264 HydrophobicContact CE2-CH2 3.96Å; F235-W264 HydrophobicContact CE2-CZ3 4.11Å; F235-W264 CarbonylContact O-C 3.52Å; F235-W264 WeakPolarHBondContact O-CA 3.46Å; Q236-W264 HydrophobicContact CB-CE3 3.69Å; Q236-W264 HydrophobicContact CB-CZ3 3.73Å; Q236-W264 HydrophobicContact CG-CE3 3.54Å; Q236-W264 HydrophobicContact CG-CZ3 3.71Å; F245-W264 HydrophobicContact CE1-CB 4.27Å; Y252-W264 AromaticContact CD1-CD1 3.64Å; Y252-W264 AromaticContact CD1-CD2 3.92Å; Y252-W264 HydrophobicContact CD1-CD2 3.92Å; Y252-W264 AromaticContact CD1-CE2 3.79Å; Y252-W264 AromaticContact CD1-CG 3.85Å; Y252-W264 HydrophobicContact CD1-CG 3.85Å; Y252-W264 HydrophobicContact CD1-CZ2 4.45Å; Y252-W264 AromaticContact CD1-NE1 3.6Å; Y252-W264 AromaticContact CE1-CD2 3.95Å; Y252-W264 HydrophobicContact CE1-CD2 3.95Å; Y252-W264 HydrophobicContact CE1-CE3 4.33Å; Y252-W264 HydrophobicContact CE1-CG 4.02Å; Y252-W264 PolarHBondContact O-NE1 3.03Å; G255-W264 CarbonylContact C-O 3.55Å; G255-W264 WeakPolarHBondContact CA-O 3.47Å; F256-W264 HydrophobicContact CD1-CB 4.07Å; F256-W264 HydrophobicContact CD2-CB 4.39Å; F256-W264 HydrophobicContact CE1-CB 3.63Å; F256-W264 HydrophobicContact CE1-CG 4.09Å; F256-W264 HydrophobicContact CE2-CB 3.97Å; F256-W264 HydrophobicContact CG-CB 4.44Å; F256-W264 HydrophobicContact CZ-CB 3.57Å; F256-W264 HydrophobicContact CZ-CG 4.29Å; F256-W264 PolarHBondContact N-O 3.44Å; F256-W264 PolarHBondContact O-N 3.36Å; W264-G266 VanDerWaalsContact C-N 3.29Å; W264-G266 PolarHBondContact O-N 3.04Å; W264-N267 VanDerWaalsContact CE2-OD1 3.26Å; W264-N267 WeakPolarHBondContact CZ2-OD1 3.12Å; W264-N267 PolarHBondContact NE1-OD1 2.86Å; W264-F333 HydrophobicContact CH2-CE2 4.22Å; W264-F333 HydrophobicContact CZ2-CE2 4.04Å; W264-F333 HydrophobicContact CZ2-CZ 4.13Å; W264-W357 AromaticContact CH2-CH2 3.83Å; W264-W357 HydrophobicContact CH2-CH2 3.83Å; W264-W357 HydrophobicContact CH2-CZ3 4.08Å; W264-W357 HydrophobicContact CZ2-CH2 4.27Å; W264-N367 VanDerWaalsContact CZ3-ND2 3.3Å; W264-N367 WeakPolarHBondContact CZ3-ND2 3.37Å
265	L	98.5	Very high	97.1	Very high	11 Å²	11	26.3 Å²	26.3	6%	0.058	16%	0.163	C	C	.	.			trans	-67.9	-29	-173	176	62.7	0	0	0	113.3	V221 T233 F235 L259 V269 L273	V221-L265 HydrophobicContact CG1-CD1 3.87Å; V221-L265 HydrophobicContact CG1-CD2 3.98Å; T233-L265 HydrophobicContact CG2-CD2 4.28Å; F235-L265 HydrophobicContact CB-CB 3.82Å; F235-L265 HydrophobicContact CB-CD2 3.98Å; F235-L265 PolarHBondContact O-N 3.46Å; L259-L265 HydrophobicContact CD2-CD1 4Å; L265-V269 HydrophobicContact CD1-CG1 4.26Å; L265-V269 HydrophobicContact CD2-CG1 3.73Å; L265-V269 HydrophobicContact CG-CB 4.22Å; L265-V269 HydrophobicContact CG-CG1 3.77Å; L265-L273 HydrophobicContact CD2-CD1 4.43Å
266	G	98.4	Very high	96.6	Very high	2 Å²	2	28.7 Å²	28.7	2%	0.021	17%	0.168	C	C	.	.			trans	119.3	132.4	-179.8	0	0	0	0	0	112.9	Y252 K253 W264 E268 V269 L270	Y252-G266 CarbonylContact O-C 3.5Å; Y252-G266 WeakPolarHBondContact O-CA 2.92Å; K253-G266 CarbonylContact O-C 3.48Å; K253-G266 WeakPolarHBondContact O-CA 3.27Å; W264-G266 VanDerWaalsContact C-N 3.29Å; W264-G266 PolarHBondContact O-N 3.04Å; G266-E268 VanDerWaalsContact C-N 3.3Å; G266-E268 PolarHBondContact O-N 3.37Å; G266-V269 PolarHBondContact O-N 3.21Å; G266-L270 PolarHBondContact O-N 3.05Å; G266-L270 VanDerWaalsContact O-N 3.07Å
267	N	98.6	Very high	96.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-63.9	-35.6	-177.9	-64.7	-12.1	0	0	0	112.2	Y252 K253 W264 L270 Y271 M302 Y309 F333	Y252-N267 PolarHBondContact O-N 3.37Å; Y252-N267 PolarHBondContact O-OD1 2.93Å; K253-N267 PolarHBondContact O-N 3.34Å; W264-N267 VanDerWaalsContact CE2-OD1 3.26Å; W264-N267 WeakPolarHBondContact CZ2-OD1 3.12Å; W264-N267 PolarHBondContact NE1-OD1 2.86Å; N267-L270 PolarHBondContact O-N 3.15Å; N267-Y271 VanDerWaalsContact O-CB 3.3Å; N267-Y271 WeakPolarHBondContact O-CB 3.17Å; N267-Y271 PolarHBondContact O-N 3.01Å; N267-M302 HydrophobicContact CB-CE 4.07Å; N267-Y309 HydrophobicContact CB-CD1 3.7Å; N267-Y309 HydrophobicContact CB-CD2 3.67Å; N267-Y309 HydrophobicContact CB-CE1 3.78Å; N267-Y309 HydrophobicContact CB-CE2 3.77Å; N267-Y309 HydrophobicContact CB-CG 3.64Å; N267-F333 WeakPolarHBondContact ND2-CD1 3.01Å
268	E	97.1	Very high	96.2	Very high	49 Å²	49	31.1 Å²	31.1	23%	0.229	18%	0.178	C	C	.	.	H	α-helix	trans	-66.7	-41.5	179	-173.4	62.3	-159.8	0	0	111	K253 G266 L272 Y309	K253-E268 HydrophobicContact CG-CB 4.23Å; K253-E268 PolarHBondContact O-N 3.26Å; G266-E268 VanDerWaalsContact C-N 3.3Å; G266-E268 PolarHBondContact O-N 3.37Å; E268-L272 HydrophobicContact CG-CD1 4.26Å; E268-L272 WeakPolarHBondContact O-CB 3.45Å; E268-L272 WeakPolarHBondContact O-CG 3.31Å; E268-L272 PolarHBondContact O-N 3.37Å; E268-Y309 PolarHBondContact OE2-OH 3.45Å; E268-Y309 VanDerWaalsContact OE2-OH 3.09Å
269	V	96	Very high	96.2	Very high	14 Å²	14	27.2 Å²	27.2	9%	0.085	16%	0.156	C	C	.	.	H	α-helix	trans	-62.2	-45.4	176.3	176.4	0	0	0	0	110.2	I212 V219 L265 G266 L272 L273	I212-V269 HydrophobicContact CD1-CG1 3.53Å; V219-V269 HydrophobicContact CG1-CG1 4.06Å; V219-V269 HydrophobicContact CG1-CG2 4.21Å; L265-V269 HydrophobicContact CD1-CG1 4.26Å; L265-V269 HydrophobicContact CD2-CG1 3.73Å; L265-V269 HydrophobicContact CG-CB 4.22Å; L265-V269 HydrophobicContact CG-CG1 3.77Å; G266-V269 PolarHBondContact O-N 3.21Å; V269-L272 PolarHBondContact O-N 2.97Å; V269-L273 HydrophobicContact CG1-CD1 4.11Å; V269-L273 WeakPolarHBondContact O-CB 3.4Å; V269-L273 WeakPolarHBondContact O-CG 3.46Å; V269-L273 PolarHBondContact O-N 3.43Å
270	L	96.8	Very high	96.2	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-70	-38	-178.5	-166.1	56.2	0	0	0	112.9	F235 G266 N267 L273 T274 F300 M302 V402	F235-L270 HydrophobicContact CB-CD1 4.23Å; F235-L270 HydrophobicContact CB-CD2 4.3Å; F235-L270 HydrophobicContact CD1-CD1 4.02Å; F235-L270 HydrophobicContact CD1-CD2 4.12Å; F235-L270 HydrophobicContact CD2-CD2 3.47Å; F235-L270 VanDerWaalsContact CD2-CD2 3.47Å; F235-L270 HydrophobicContact CE1-CD2 4.25Å; F235-L270 HydrophobicContact CE2-CD2 3.63Å; F235-L270 HydrophobicContact CG-CD1 4.08Å; F235-L270 HydrophobicContact CG-CD2 3.71Å; F235-L270 HydrophobicContact CZ-CD2 3.99Å; G266-L270 PolarHBondContact O-N 3.05Å; G266-L270 VanDerWaalsContact O-N 3.07Å; N267-L270 PolarHBondContact O-N 3.15Å; L270-L273 PolarHBondContact O-N 3.29Å; L270-T274 HydrophobicContact CD1-CG2 4.34Å; L270-T274 WeakPolarHBondContact O-CB 2.97Å; L270-T274 WeakPolarHBondContact O-CG2 3.46Å; L270-T274 PolarHBondContact O-N 2.94Å; L270-T274 PolarHBondContact O-OG1 3.12Å; L270-F300 HydrophobicContact CD1-CE1 3.96Å; L270-F300 HydrophobicContact CD2-CE1 4.01Å; L270-F300 HydrophobicContact CD2-CZ 3.9Å; L270-F300 HydrophobicContact CG-CE1 3.92Å; L270-F300 HydrophobicContact CG-CZ 4.21Å; L270-M302 HydrophobicContact CB-SD 3.78Å; L270-M302 HydrophobicContact CD2-SD 3.34Å; L270-M302 WeakPolarHBondContact CD2-SD 3.37Å; L270-M302 HydrophobicContact CG-SD 3.41Å; L270-M302 WeakPolarHBondContact CG-SD 3.11Å; L270-V402 HydrophobicContact CD1-CG1 4.06Å; L270-V402 HydrophobicContact CD1-CG2 4Å
271	Y	96.9	Very high	96.4	Very high	62 Å²	62	23.2 Å²	23.2	24%	0.243	13%	0.131	C	C	.	.	H	α-helix	trans	-57.6	-51.4	170.2	163.1	-114.2	0	0	0	111.1	N267 L273 T274 S275 M302 A303	N267-Y271 VanDerWaalsContact O-CB 3.3Å; N267-Y271 WeakPolarHBondContact O-CB 3.17Å; N267-Y271 PolarHBondContact O-N 3.01Å; Y271-L273 PolarHBondContact O-N 2.76Å; Y271-T274 PolarHBondContact O-N 3.5Å; Y271-T274 PolarHBondContact O-OG1 3.34Å; Y271-S275 VanDerWaalsContact CE2-OG 3.23Å; Y271-S275 WeakPolarHBondContact CE2-OG 3.41Å; Y271-S275 WeakPolarHBondContact O-CB 3.35Å; Y271-S275 PolarHBondContact O-N 3.02Å; Y271-S275 PolarHBondContact O-OG 3.25Å; Y271-M302 VanDerWaalsContact CD2-O 3.3Å; Y271-M302 WeakPolarHBondContact CD2-O 3.34Å; Y271-A303 VanDerWaalsContact CD2-O 3.3Å; Y271-A303 WeakPolarHBondContact CD2-O 3.5Å
272	L	95.1	Very high	96.4	Very high	48 Å²	48	23.7 Å²	23.7	25%	0.251	13%	0.129	S	C	.	.	H	α-helix	trans	-63.6	-42.2	-179.2	-68.6	171.9	0	0	0	111.6	I212 E268 V269 S275 Q276	I212-L272 HydrophobicContact CG2-CB 3.55Å; E268-L272 HydrophobicContact CG-CD1 4.26Å; E268-L272 WeakPolarHBondContact O-CB 3.45Å; E268-L272 WeakPolarHBondContact O-CG 3.31Å; E268-L272 PolarHBondContact O-N 3.37Å; V269-L272 PolarHBondContact O-N 2.97Å; L272-S275 PolarHBondContact O-N 3.27Å; L272-Q276 WeakPolarHBondContact O-CG 3.36Å
273	L	94.3	Very high	96.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-56.6	-55.9	175.4	-82	169.2	0	0	0	111.3	D193 I210 I212 T233 L265 V269 L270 Y271 S275 Q276 Y279	D193-L273 HydrophobicContact CB-CD2 4.26Å; I210-L273 HydrophobicContact CD1-CD2 3.96Å; I212-L273 HydrophobicContact CD1-CD1 4.29Å; I212-L273 HydrophobicContact CD1-CD2 3.98Å; I212-L273 HydrophobicContact CD1-CG 3.81Å; I212-L273 HydrophobicContact CG1-CD2 3.77Å; I212-L273 HydrophobicContact CG1-CG 4.12Å; I212-L273 HydrophobicContact CG2-CD2 4.21Å; I212-L273 HydrophobicContact CG2-CG 4.22Å; T233-L273 HydrophobicContact CG2-CD1 4.19Å; L265-L273 HydrophobicContact CD2-CD1 4.43Å; V269-L273 HydrophobicContact CG1-CD1 4.11Å; V269-L273 WeakPolarHBondContact O-CB 3.4Å; V269-L273 WeakPolarHBondContact O-CG 3.46Å; V269-L273 PolarHBondContact O-N 3.43Å; L270-L273 PolarHBondContact O-N 3.29Å; Y271-L273 PolarHBondContact O-N 2.76Å; L273-S275 PolarHBondContact O-N 2.91Å; L273-Q276 WeakPolarHBondContact O-CB 3.33Å; L273-Q276 PolarHBondContact O-N 3.42Å; L273-Q276 VanDerWaalsContact O-N 3.15Å; L273-Q276 PolarHBondContact O-NE2 3.06Å; L273-Y279 WeakPolarHBondContact O-CE2 3.47Å
274	T	94.6	Very high	96.4	Very high	3 Å²	3	25.5 Å²	25.5	2%	0.018	14%	0.138	C	C	.	.	H	α-helix	trans	-73.1	-8.1	-175.5	60.3	0	0	0	0	114	L270 Y271 G277 Y279 F300 M302	L270-T274 HydrophobicContact CD1-CG2 4.34Å; L270-T274 WeakPolarHBondContact O-CB 2.97Å; L270-T274 WeakPolarHBondContact O-CG2 3.46Å; L270-T274 PolarHBondContact O-N 2.94Å; L270-T274 PolarHBondContact O-OG1 3.12Å; Y271-T274 PolarHBondContact O-N 3.5Å; Y271-T274 PolarHBondContact O-OG1 3.34Å; T274-G277 VanDerWaalsContact O-O 3.07Å; T274-Y279 HydrophobicContact CG2-CG 4.42Å; T274-F300 HydrophobicContact CG2-CD1 3.55Å; T274-F300 HydrophobicContact CG2-CE1 3.61Å; T274-M302 PolarHBondContact OG1-N 2.67Å
275	S	93.4	Very high	96.4	Very high	64 Å²	64	25.5 Å²	25.5	45%	0.448	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-13.6	172.7	-62.7	0	0	0	0	113.4	Y271 L272 L273 G277	Y271-S275 VanDerWaalsContact CE2-OG 3.23Å; Y271-S275 WeakPolarHBondContact CE2-OG 3.41Å; Y271-S275 WeakPolarHBondContact O-CB 3.35Å; Y271-S275 PolarHBondContact O-N 3.02Å; Y271-S275 PolarHBondContact O-OG 3.25Å; L272-S275 PolarHBondContact O-N 3.27Å; L273-S275 PolarHBondContact O-N 2.91Å; S275-G277 VanDerWaalsContact C-N 3.32Å
276	Q	89	Confident	96.4	Very high	72 Å²	72	26.9 Å²	26.9	34%	0.336	14%	0.144	S	C	.	.	S	Bend	trans	-76.3	-20.3	-179.7	-65.2	177.3	108.2	0	0	113.2	L272 L273 Y279	L272-Q276 WeakPolarHBondContact O-CG 3.36Å; L273-Q276 WeakPolarHBondContact O-CB 3.33Å; L273-Q276 PolarHBondContact O-N 3.42Å; L273-Q276 VanDerWaalsContact O-N 3.15Å; L273-Q276 PolarHBondContact O-NE2 3.06Å; Q276-Y279 HydrophobicContact CB-CE2 4.45Å
277	G	92.1	Very high	96.4	Very high	41 Å²	41	26.8 Å²	26.8	42%	0.423	14%	0.143	S	C	.	.	S	Bend	trans	175.1	-165.8	-174.9	0	0	0	0	0	111.9	T274 S275	T274-G277 VanDerWaalsContact O-O 3.07Å; S275-G277 VanDerWaalsContact C-N 3.32Å
278	Q	95.4	Very high	96.4	Very high	85 Å²	85	28.8 Å²	28.8	40%	0.397	15%	0.151	S	C	.	.			trans	-84.3	118.5	175.6	-172.8	174.4	-35.8	0	0	110.2	D298 R299 Y405	Q278-D298 PolarHBondContact NE2-O 3.01Å; Q278-R299 HydrophobicContact CG-CB 4.48Å; Q278-R299 HydrophobicContact CG-CG 4.21Å; Q278-Y405 HydrophobicContact CG-CG 4.35Å; Q278-Y405 PolarHBondContact O-N 2.91Å
279	Y	97.5	Very high	96.4	Very high	10 Å²	10	31.7 Å²	31.7	4%	0.039	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	143.8	174.8	-78.6	-102.8	0	0	0	110.9	D193 L273 T274 Q276 R299 F300 V402 R403 P404	D193-Y279 WeakPolarHBondContact OD2-CE1 3.38Å; D193-Y279 PolarHBondContact OD2-OH 3.28Å; L273-Y279 WeakPolarHBondContact O-CE2 3.47Å; T274-Y279 HydrophobicContact CG2-CG 4.42Å; Q276-Y279 HydrophobicContact CB-CE2 4.45Å; Y279-R299 CarbonylContact O-C 3.57Å; Y279-R299 WeakPolarHBondContact O-CA 3.08Å; Y279-F300 PolarHBondContact O-N 3.41Å; Y279-V402 HydrophobicContact CD1-CB 4.15Å; Y279-V402 HydrophobicContact CD1-CG2 4.29Å; Y279-R403 CarbonylContact C-O 3.57Å; Y279-R403 WeakPolarHBondContact CA-O 3.26Å; Y279-R403 VanDerWaalsContact CD1-C 3.41Å; Y279-P404 HydrophobicContact CD1-CG 4.39Å; Y279-P404 HydrophobicContact CE1-CG 3.78Å
280	S	98	Very high	96.4	Very high	10 Å²	10	38.5 Å²	38.5	7%	0.07	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	148.8	164.7	-66.3	0	0	0	0	110.4	Y297 V402 R403 Y405	S280-Y297 CarbonylContact C-O 3.57Å; S280-Y297 WeakPolarHBondContact CA-O 3.46Å; S280-Y297 WeakPolarHBondContact CB-O 3.43Å; S280-V402 VanDerWaalsContact O-CA 3.24Å; S280-V402 WeakPolarHBondContact O-CA 3.48Å; S280-R403 PolarHBondContact N-O 3.41Å; S280-R403 PolarHBondContact O-N 3.09Å; S280-R403 VanDerWaalsContact O-N 3.14Å; S280-Y405 WeakPolarHBondContact OG-CD2 3.49Å
281	L	98.2	Very high	96.5	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	131.9	169.9	168.1	68.8	0	0	0	109.7	F235 V283 Q296 Y297 F300 L313 L326 M400 V402	F235-L281 HydrophobicContact CE1-CD1 3.45Å; F235-L281 VanDerWaalsContact CE1-CD1 3.45Å; F235-L281 HydrophobicContact CZ-CD1 3.65Å; L281-V283 HydrophobicContact CD1-CG2 4.24Å; L281-V283 HydrophobicContact CD2-CG2 4.2Å; L281-V283 HydrophobicContact CG-CG2 4.09Å; L281-Q296 CarbonylContact O-C 3.51Å; L281-Q296 WeakPolarHBondContact O-CA 3.47Å; L281-Q296 PolarHBondContact O-NE2 3.35Å; L281-Y297 HydrophobicContact CB-CD2 4.17Å; L281-Y297 HydrophobicContact CD2-CD2 3.8Å; L281-Y297 HydrophobicContact CD2-CE2 4.14Å; L281-Y297 HydrophobicContact CG-CD2 3.98Å; L281-Y297 PolarHBondContact N-O 2.92Å; L281-Y297 PolarHBondContact O-N 2.97Å; L281-F300 HydrophobicContact CB-CB 3.59Å; L281-F300 HydrophobicContact CB-CD1 4.27Å; L281-F300 HydrophobicContact CB-CD2 4.26Å; L281-F300 HydrophobicContact CB-CG 3.79Å; L281-F300 HydrophobicContact CD2-CD2 3.96Å; L281-F300 HydrophobicContact CD2-CE2 4.26Å; L281-F300 HydrophobicContact CD2-CG 4.34Å; L281-L313 HydrophobicContact CD2-CD2 3.82Å; L281-L326 HydrophobicContact CD2-CD1 3.95Å; L281-M400 HydrophobicContact CD1-CB 4.42Å; L281-M400 HydrophobicContact CD1-CE 4.32Å; L281-M400 HydrophobicContact CD2-CE 4.3Å; L281-V402 HydrophobicContact CD1-CG1 4.26Å
282	R	98.5	Very high	96.5	Very high	20 Å²	20	42.9 Å²	42.9	8%	0.075	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	135.9	168.5	-175.1	173.8	-174.1	79.1	4.4	110	W232 E284 H294 S295 M400 M401	W232-R282 HydrophobicContact CE3-CB 4.18Å; W232-R282 HydrophobicContact CH2-CB 3.67Å; W232-R282 HydrophobicContact CZ2-CB 4.17Å; W232-R282 HydrophobicContact CZ3-CB 3.66Å; R282-E284 IonicContact CZ-OE1 3.05Å; R282-E284 IonicContact NE-OE1 2.69Å; R282-E284 PolarHBondContact NE-OE1 3.06Å; R282-E284 IonicContact NH2-OE1 2.65Å; R282-E284 PolarHBondContact NH2-OE1 3.47Å; R282-H294 PolarHBondContact NH1-CD2 3.29Å; R282-H294 PolarHBondContact NH2-CD2 3.43Å; R282-H294 PolarHBondContact NH2-ND1 3Å; R282-S295 CarbonylContact C-O 3.54Å; R282-S295 WeakPolarHBondContact CA-O 3.33Å; R282-M400 WeakPolarHBondContact O-CA 3.47Å; R282-M401 HydrophobicContact CB-CG 3.81Å; R282-M401 HydrophobicContact CB-SD 4.46Å; R282-M401 HydrophobicContact CG-CG 4.43Å; R282-M401 PolarHBondContact N-O 3.05Å; R282-M401 PolarHBondContact O-N 3.17Å
283	V	98.8	Very high	96.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	109.4	176.7	-176.7	0	0	0	0	108.1	L281 L285 H294 S295 Y297 L366 W385 S399 M400	L281-V283 HydrophobicContact CD1-CG2 4.24Å; L281-V283 HydrophobicContact CD2-CG2 4.2Å; L281-V283 HydrophobicContact CG-CG2 4.09Å; V283-L285 HydrophobicContact CG1-CD2 3.65Å; V283-L285 HydrophobicContact CG1-CG 4.11Å; V283-H294 CarbonylContact O-C 3.45Å; V283-H294 WeakPolarHBondContact O-CA 3.48Å; V283-H294 WeakPolarHBondContact O-CB 3.34Å; V283-S295 PolarHBondContact N-O 3.48Å; V283-S295 PolarHBondContact O-N 2.97Å; V283-Y297 HydrophobicContact CG2-CE2 4.36Å; V283-L366 HydrophobicContact CG1-CD1 3.6Å; V283-W385 HydrophobicContact CG1-CH2 4.48Å; V283-W385 HydrophobicContact CG1-CZ3 4.37Å; V283-W385 HydrophobicContact CG2-CH2 4.49Å; V283-S399 CarbonylContact C-O 3.56Å; V283-S399 WeakPolarHBondContact CA-O 3.17Å; V283-M400 HydrophobicContact CG1-CG 4.28Å; V283-M400 HydrophobicContact CG2-CE 3.9Å; V283-M400 HydrophobicContact CG2-CG 4.27Å
284	E	98.8	Very high	96.9	Very high	41 Å²	41	42.9 Å²	42.9	19%	0.192	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	135	172.9	-71.4	-67.5	166.5	0	0	110.1	T227 R282 T398 S399 M401	T227-E284 HydrophobicContact CG2-CG 4.39Å; R282-E284 IonicContact CZ-OE1 3.05Å; R282-E284 IonicContact NE-OE1 2.69Å; R282-E284 PolarHBondContact NE-OE1 3.06Å; R282-E284 IonicContact NH2-OE1 2.65Å; R282-E284 PolarHBondContact NH2-OE1 3.47Å; E284-T398 CarbonylContact O-C 3.59Å; E284-T398 VanDerWaalsContact O-CA 3.25Å; E284-T398 WeakPolarHBondContact O-CA 3.4Å; E284-S399 PolarHBondContact N-O 3.35Å; E284-S399 PolarHBondContact O-N 3Å; E284-M401 HydrophobicContact CB-CE 4.38Å; E284-M401 HydrophobicContact CG-CE 3.73Å
285	L	98.8	Very high	97.1	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.016	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	142.2	-176.2	-52.7	171.6	0	0	0	109.7	V283 S292 A293 A320 L366 W385 F388 L395 T398	V283-L285 HydrophobicContact CG1-CD2 3.65Å; V283-L285 HydrophobicContact CG1-CG 4.11Å; L285-S292 CarbonylContact O-C 3.59Å; L285-S292 VanDerWaalsContact O-CA 3.25Å; L285-S292 WeakPolarHBondContact O-CA 3.18Å; L285-A293 WeakPolarHBondContact CA-O 2.82Å; L285-A293 WeakPolarHBondContact CB-O 3.3Å; L285-A293 PolarHBondContact N-O 2.91Å; L285-A293 PolarHBondContact O-N 3.37Å; L285-A320 HydrophobicContact CD1-CB 3.7Å; L285-L366 HydrophobicContact CD2-CD1 4.06Å; L285-L366 HydrophobicContact CD2-CD2 4.04Å; L285-W385 HydrophobicContact CD1-CB 3.79Å; L285-W385 HydrophobicContact CD1-CD2 3.83Å; L285-W385 HydrophobicContact CD1-CG 3.43Å; L285-W385 VanDerWaalsContact CD1-CG 3.43Å; L285-F388 HydrophobicContact CB-CD1 4.13Å; L285-F388 HydrophobicContact CB-CE1 4.22Å; L285-F388 HydrophobicContact CD1-CB 4.43Å; L285-F388 HydrophobicContact CD1-CD1 4.12Å; L285-L395 HydrophobicContact CB-CD1 4.18Å; L285-L395 HydrophobicContact CD1-CD1 4.46Å; L285-L395 HydrophobicContact CD2-CD1 3.77Å; L285-L395 HydrophobicContact CG-CD1 4.36Å; L285-T398 HydrophobicContact CD2-CG2 3.88Å
286	Q	98.6	Very high	97.3	Very high	39 Å²	39	40.9 Å²	40.9	18%	0.182	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	135.9	170.7	-166.1	173.3	73.3	0	0	110.8	S292 R396 S397	Q286-S292 PolarHBondContact NE2-OG 3Å; Q286-R396 PolarHBondContact O-N 2.84Å; Q286-S397 WeakPolarHBondContact CB-OG 3.35Å; Q286-S397 PolarHBondContact N-O 3.2Å; Q286-S397 PolarHBondContact O-N 3.17Å; Q286-S397 VanDerWaalsContact O-N 3.17Å
287	D	98.3	Very high	97.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.188	C	C	.	.			trans	-85	-177.7	173.6	75.8	-3.9	0	0	0	112.1	E289 R290 I291 F388 R389 Y393 L395 R396	D287-E289 VanDerWaalsContact C-N 3.31Å; D287-E289 VanDerWaalsContact CG-OE2 3.26Å; D287-E289 WeakPolarHBondContact OD1-CA 3.35Å; D287-E289 PolarHBondContact OD1-N 3.06Å; D287-E289 VanDerWaalsContact OD2-OE2 3.07Å; D287-R290 PolarHBondContact O-N 2.9Å; D287-R290 PolarHBondContact OD1-N 3.44Å; D287-I291 PolarHBondContact N-O 2.91Å; D287-I291 VanDerWaalsContact N-O 3.16Å; D287-I291 PolarHBondContact OD1-N 2.87Å; D287-I291 WeakPolarHBondContact OD2-CB 3.44Å; D287-F388 HydrophobicContact CB-CE1 4.38Å; D287-F388 HydrophobicContact CB-CZ 4.45Å; D287-R389 HydrophobicContact CB-CG 4.42Å; D287-R389 IonicContact OD2-CZ 2.73Å; D287-R389 IonicContact OD2-NE 3.32Å; D287-R389 PolarHBondContact OD2-NE 2.97Å; D287-R389 IonicContact OD2-NH1 3.03Å; D287-R389 PolarHBondContact OD2-NH1 3.09Å; D287-R389 IonicContact OD2-NH2 2.59Å; D287-R389 PolarHBondContact OD2-NH2 3.49Å; D287-Y393 HydrophobicContact CB-CE1 3.9Å; D287-L395 HydrophobicContact CB-CD2 4.47Å; D287-R396 VanDerWaalsContact O-CB 3.29Å; D287-R396 WeakPolarHBondContact O-CB 3.38Å
288	W	97.8	Very high	97.9	Very high	42 Å²	42	38.4 Å²	38.4	16%	0.159	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-20	177.6	-68.9	92.1	0	0	0	113	R290 Y370 Y371 T372 V373 N376 Y393 S394 R396	W288-R290 PolarHBondContact O-N 3.44Å; W288-Y370 AromaticContact CH2-CE1 3.83Å; W288-Y370 HydrophobicContact CH2-CE1 3.83Å; W288-Y370 AromaticContact CH2-CZ 3.87Å; W288-Y370 VanDerWaalsContact CH2-OH 3.26Å; W288-Y370 WeakPolarHBondContact CH2-OH 3.49Å; W288-Y370 AromaticContact CZ2-CE1 3.87Å; W288-Y370 HydrophobicContact CZ2-CE1 3.87Å; W288-Y370 AromaticContact CZ2-CZ 3.84Å; W288-Y371 WeakPolarHBondContact CZ2-O 3.46Å; W288-Y371 PolarHBondContact NE1-O 3.45Å; W288-T372 HydrophobicContact CH2-CG2 4.49Å; W288-V373 HydrophobicContact CB-CB 4.46Å; W288-V373 HydrophobicContact CB-CG2 4.32Å; W288-V373 HydrophobicContact CD2-CB 3.88Å; W288-V373 HydrophobicContact CE3-CB 3.59Å; W288-V373 HydrophobicContact CE3-CG1 4.27Å; W288-V373 HydrophobicContact CG-CB 4.26Å; W288-V373 HydrophobicContact CZ3-CB 4.14Å; W288-V373 HydrophobicContact CZ3-CG1 4.43Å; W288-N376 VanDerWaalsContact CD1-CG 3.47Å; W288-Y393 WeakPolarHBondContact CB-OH 3.34Å; W288-Y393 PolarHBondContact N-OH 3.24Å; W288-S394 VanDerWaalsContact CD1-O 3.31Å; W288-S394 PolarHBondContact NE1-O 2.85Å; W288-R396 HydrophobicContact CD2-CB 3.7Å; W288-R396 HydrophobicContact CD2-CG 3.94Å; W288-R396 HydrophobicContact CE3-CB 4.06Å; W288-R396 HydrophobicContact CE3-CG 3.76Å; W288-R396 HydrophobicContact CG-CB 4.02Å; W288-R396 HydrophobicContact CH2-CB 4.47Å; W288-R396 HydrophobicContact CH2-CG 4Å; W288-R396 HydrophobicContact CZ2-CB 4.09Å; W288-R396 HydrophobicContact CZ2-CG 4.12Å; W288-R396 HydrophobicContact CZ3-CB 4.46Å; W288-R396 HydrophobicContact CZ3-CG 3.82Å
289	E	97	Very high	97.9	Very high	110 Å²	110	40.2 Å²	40.2	51%	0.514	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	8.4	172.7	-60.7	76.9	-167	0	0	113.8	D287 I291 Y393	D287-E289 VanDerWaalsContact C-N 3.31Å; D287-E289 VanDerWaalsContact CG-OE2 3.26Å; D287-E289 WeakPolarHBondContact OD1-CA 3.35Å; D287-E289 PolarHBondContact OD1-N 3.06Å; D287-E289 VanDerWaalsContact OD2-OE2 3.07Å; E289-I291 HydrophobicContact CB-CD1 4.38Å; E289-I291 HydrophobicContact CB-CG1 4.49Å; E289-I291 PolarHBondContact O-N 2.73Å; E289-Y393 PolarHBondContact OE2-OH 3.24Å
290	R	96.8	Very high	97.8	Very high	157 Å²	157	39.8 Å²	39.8	59%	0.592	19%	0.185	S	C	*	.			trans	65.3	15.9	-180	-51.2	-61.9	-174.7	127.4	0.3	115	D287 W288 S292 R396	D287-R290 PolarHBondContact O-N 2.9Å; D287-R290 PolarHBondContact OD1-N 3.44Å; W288-R290 PolarHBondContact O-N 3.44Å; R290-S292 PolarHBondContact O-N 3.16Å; R290-R396 VanDerWaalsContact NH1-NH2 3.11Å
291	I	97.9	Very high	97.6	Very high	84 Å²	84	41 Å²	41	43%	0.431	19%	0.192	S	C	.	.			trans	-79.5	118.5	171.4	-59.8	169	0	0	0	107.9	D287 E289 F388 R389	D287-I291 PolarHBondContact N-O 2.91Å; D287-I291 VanDerWaalsContact N-O 3.16Å; D287-I291 PolarHBondContact OD1-N 2.87Å; D287-I291 WeakPolarHBondContact OD2-CB 3.44Å; E289-I291 HydrophobicContact CB-CD1 4.38Å; E289-I291 HydrophobicContact CB-CG1 4.49Å; E289-I291 PolarHBondContact O-N 2.73Å; I291-F388 HydrophobicContact CG2-CE2 4.31Å; I291-F388 HydrophobicContact CG2-CZ 4.23Å; I291-F388 WeakPolarHBondContact O-CZ 3.26Å; I291-R389 VanDerWaalsContact CB-NH2 3.32Å
292	S	97.9	Very high	97.5	Very high	71 Å²	71	41 Å²	41	50%	0.497	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	145.3	176.4	-59.7	0	0	0	0	111.5	L285 Q286 R290	L285-S292 CarbonylContact O-C 3.59Å; L285-S292 VanDerWaalsContact O-CA 3.25Å; L285-S292 WeakPolarHBondContact O-CA 3.18Å; Q286-S292 PolarHBondContact NE2-OG 3Å; R290-S292 PolarHBondContact O-N 3.16Å
293	A	98.4	Very high	97.4	Very high	5 Å²	5	40.4 Å²	40.4	4%	0.041	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	157.8	171.8	0	0	0	0	0	109.8	L285 T319 A320 F388	L285-A293 WeakPolarHBondContact CA-O 2.82Å; L285-A293 WeakPolarHBondContact CB-O 3.3Å; L285-A293 PolarHBondContact N-O 2.91Å; L285-A293 PolarHBondContact O-N 3.37Å; A293-T319 WeakPolarHBondContact CA-OG1 3.4Å; A293-A320 HydrophobicContact CB-CB 3.76Å; A293-F388 HydrophobicContact CB-CD1 4.31Å; A293-F388 HydrophobicContact CB-CD2 3.75Å; A293-F388 HydrophobicContact CB-CE1 4.18Å; A293-F388 HydrophobicContact CB-CE2 3.6Å; A293-F388 HydrophobicContact CB-CG 4.12Å; A293-F388 HydrophobicContact CB-CZ 3.83Å
294	H	98.6	Very high	97.3	Very high	44 Å²	44	41.5 Å²	41.5	20%	0.204	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	153.6	178	70.8	-86.4	0	0	0	112.8	R282 V283 G318 T319 A320	R282-H294 PolarHBondContact NH1-CD2 3.29Å; R282-H294 PolarHBondContact NH2-CD2 3.43Å; R282-H294 PolarHBondContact NH2-ND1 3Å; V283-H294 CarbonylContact O-C 3.45Å; V283-H294 WeakPolarHBondContact O-CA 3.48Å; V283-H294 WeakPolarHBondContact O-CB 3.34Å; H294-G318 CarbonylContact O-C 3.56Å; H294-G318 WeakPolarHBondContact O-CA 3.29Å; H294-T319 PolarHBondContact N-OG1 2.96Å; H294-T319 VanDerWaalsContact N-OG1 3.11Å; H294-T319 PolarHBondContact ND1-OG1 2.83Å; H294-T319 PolarHBondContact O-N 3.35Å; H294-A320 WeakPolarHBondContact O-CB 3.4Å; H294-A320 PolarHBondContact O-N 3.18Å
295	S	98.5	Very high	97.3	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	137.3	164.6	-64.2	0	0	0	0	109.5	R282 V283 A320 W385	R282-S295 CarbonylContact C-O 3.54Å; R282-S295 WeakPolarHBondContact CA-O 3.33Å; V283-S295 PolarHBondContact N-O 3.48Å; V283-S295 PolarHBondContact O-N 2.97Å; S295-A320 WeakPolarHBondContact OG-CB 3.38Å; S295-W385 WeakPolarHBondContact OG-CZ2 3.31Å
296	Q	98.1	Very high	97.2	Very high	24 Å²	24	54.1 Å²	54.1	11%	0.112	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	140.1	179	-178.6	68.5	39.7	0	0	108.7	L281 Y316 S317	L281-Q296 CarbonylContact O-C 3.51Å; L281-Q296 WeakPolarHBondContact O-CA 3.47Å; L281-Q296 PolarHBondContact O-NE2 3.35Å; Q296-Y316 CarbonylContact O-C 3.57Å; Q296-Y316 VanDerWaalsContact O-CA 3.31Å; Q296-Y316 WeakPolarHBondContact O-CA 3.46Å; Q296-S317 WeakPolarHBondContact CB-OG 3.44Å; Q296-S317 PolarHBondContact N-O 3.41Å; Q296-S317 PolarHBondContact O-N 3.37Å
297	Y	97.6	Very high	97.2	Very high	1 Å²	1	57.4 Å²	57.4	0%	0.004	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	123.1	175.2	-53.9	-97.5	0	0	0	108.8	S280 L281 V283 R299 L313 G315 Y316 S324 L326 W385	S280-Y297 CarbonylContact C-O 3.57Å; S280-Y297 WeakPolarHBondContact CA-O 3.46Å; S280-Y297 WeakPolarHBondContact CB-O 3.43Å; L281-Y297 HydrophobicContact CB-CD2 4.17Å; L281-Y297 HydrophobicContact CD2-CD2 3.8Å; L281-Y297 HydrophobicContact CD2-CE2 4.14Å; L281-Y297 HydrophobicContact CG-CD2 3.98Å; L281-Y297 PolarHBondContact N-O 2.92Å; L281-Y297 PolarHBondContact O-N 2.97Å; V283-Y297 HydrophobicContact CG2-CE2 4.36Å; Y297-R299 PolarHBondContact O-N 3.32Å; Y297-L313 HydrophobicContact CD1-CB 3.97Å; Y297-L313 HydrophobicContact CD1-CD1 4.07Å; Y297-L313 HydrophobicContact CD1-CD2 3.83Å; Y297-L313 HydrophobicContact CD1-CG 4.17Å; Y297-L313 HydrophobicContact CD2-CD2 4.18Å; Y297-L313 HydrophobicContact CE1-CB 4.42Å; Y297-L313 HydrophobicContact CE1-CD1 3.88Å; Y297-L313 HydrophobicContact CE1-CD2 4.42Å; Y297-L313 HydrophobicContact CE1-CG 4.48Å; Y297-L313 HydrophobicContact CG-CD2 3.69Å; Y297-G315 WeakPolarHBondContact CA-O 3.35Å; Y297-Y316 HydrophobicContact CD1-CD2 4.12Å; Y297-Y316 AromaticContact CE1-CD2 3.5Å; Y297-Y316 HydrophobicContact CE1-CD2 3.5Å; Y297-Y316 HydrophobicContact CE1-CE2 4.41Å; Y297-Y316 HydrophobicContact CE1-CG 4.25Å; Y297-Y316 HydrophobicContact CE2-CD2 4.41Å; Y297-Y316 AromaticContact CZ-CD2 3.66Å; Y297-S324 WeakPolarHBondContact CE1-OG 3.43Å; Y297-S324 PolarHBondContact OH-OG 3.05Å; Y297-L326 HydrophobicContact CE2-CD1 3.97Å; Y297-W385 WeakPolarHBondContact OH-CH2 3.47Å; Y297-W385 WeakPolarHBondContact OH-CZ2 3.43Å
298	D	96.6	Very high	97.1	Very high	61 Å²	61	60.6 Å²	60.6	33%	0.326	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	-26.4	-178	-64.3	-22.2	0	0	0	113.6	Q278 R314 G315 Y405	Q278-D298 PolarHBondContact NE2-O 3.01Å; D298-R314 PolarHBondContact N-O 3.35Å; D298-G315 PolarHBondContact N-O 3.08Å; D298-Y405 HydrophobicContact CB-CD2 4.08Å; D298-Y405 HydrophobicContact CB-CE2 3.62Å; D298-Y405 WeakPolarHBondContact O-CD2 3.17Å
299	R	95.7	Very high	97.2	Very high	122 Å²	122	58.6 Å²	58.6	46%	0.46	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	121.6	177	-176	169.8	172.7	170.8	-1.6	110.2	Q278 Y279 Y297 L313 R314	Q278-R299 HydrophobicContact CG-CB 4.48Å; Q278-R299 HydrophobicContact CG-CG 4.21Å; Y279-R299 CarbonylContact O-C 3.57Å; Y279-R299 WeakPolarHBondContact O-CA 3.08Å; Y297-R299 PolarHBondContact O-N 3.32Å; R299-L313 CarbonylContact O-C 3.29Å; R299-L313 VanDerWaalsContact O-CA 3.28Å; R299-L313 WeakPolarHBondContact O-CA 3.49Å; R299-R314 HydrophobicContact CB-CB 4.26Å; R299-R314 PolarHBondContact N-O 3.06Å; R299-R314 PolarHBondContact O-N 3.32Å
300	F	95.4	Very high	97.2	Very high	2 Å²	2	57 Å²	57	1%	0.009	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	125	173.2	171.5	-111	0	0	0	109	L270 T274 Y279 L281 M302 Y312 L313 V402	L270-F300 HydrophobicContact CD1-CE1 3.96Å; L270-F300 HydrophobicContact CD2-CE1 4.01Å; L270-F300 HydrophobicContact CD2-CZ 3.9Å; L270-F300 HydrophobicContact CG-CE1 3.92Å; L270-F300 HydrophobicContact CG-CZ 4.21Å; T274-F300 HydrophobicContact CG2-CD1 3.55Å; T274-F300 HydrophobicContact CG2-CE1 3.61Å; Y279-F300 PolarHBondContact O-N 3.41Å; L281-F300 HydrophobicContact CB-CB 3.59Å; L281-F300 HydrophobicContact CB-CD1 4.27Å; L281-F300 HydrophobicContact CB-CD2 4.26Å; L281-F300 HydrophobicContact CB-CG 3.79Å; L281-F300 HydrophobicContact CD2-CD2 3.96Å; L281-F300 HydrophobicContact CD2-CE2 4.26Å; L281-F300 HydrophobicContact CD2-CG 4.34Å; F300-M302 HydrophobicContact CE1-CG 4.28Å; F300-M302 HydrophobicContact CE1-SD 4.4Å; F300-M302 HydrophobicContact CE2-CG 4.09Å; F300-M302 HydrophobicContact CZ-CG 3.63Å; F300-M302 HydrophobicContact CZ-SD 3.76Å; F300-Y312 WeakPolarHBondContact CA-O 3.44Å; F300-L313 HydrophobicContact CB-CD2 4.08Å; F300-L313 HydrophobicContact CD2-CD2 3.6Å; F300-L313 HydrophobicContact CG-CD2 4.3Å; F300-V402 HydrophobicContact CD1-CG1 3.52Å; F300-V402 HydrophobicContact CE1-CG1 3.68Å
301	T	94.3	Very high	97	Very high	34 Å²	34	49.6 Å²	49.6	21%	0.209	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	137.4	176.1	-50.7	0	0	0	0	108.6	L311 Y312	T301-L311 CarbonylContact O-C 3.46Å; T301-Y312 PolarHBondContact N-O 3.48Å; T301-Y312 VanDerWaalsContact N-O 3.07Å; T301-Y312 PolarHBondContact O-N 2.86Å
302	M	95.1	Very high	96.9	Very high	2 Å²	2	50.5 Å²	50.5	1%	0.01	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	146.5	168.8	-73.8	179.7	63.9	0	0	110.4	N267 L270 Y271 T274 F300 Y309 R310 W357	N267-M302 HydrophobicContact CB-CE 4.07Å; L270-M302 HydrophobicContact CB-SD 3.78Å; L270-M302 HydrophobicContact CD2-SD 3.34Å; L270-M302 WeakPolarHBondContact CD2-SD 3.37Å; L270-M302 HydrophobicContact CG-SD 3.41Å; L270-M302 WeakPolarHBondContact CG-SD 3.11Å; Y271-M302 VanDerWaalsContact CD2-O 3.3Å; Y271-M302 WeakPolarHBondContact CD2-O 3.34Å; T274-M302 PolarHBondContact OG1-N 2.67Å; F300-M302 HydrophobicContact CE1-CG 4.28Å; F300-M302 HydrophobicContact CE1-SD 4.4Å; F300-M302 HydrophobicContact CE2-CG 4.09Å; F300-M302 HydrophobicContact CZ-CG 3.63Å; F300-M302 HydrophobicContact CZ-SD 3.76Å; M302-Y309 HydrophobicContact CE-CD1 4.18Å; M302-Y309 HydrophobicContact CE-CG 4.22Å; M302-R310 CarbonylContact C-O 3.55Å; M302-R310 WeakPolarHBondContact CA-O 3.44Å; M302-W357 HydrophobicContact CE-CZ2 3.78Å; M302-W357 HydrophobicContact CG-CZ2 4.34Å; M302-W357 HydrophobicContact SD-CH2 4.44Å; M302-W357 HydrophobicContact SD-CZ2 3.76Å
303	A	96.4	Very high	96.7	Very high	6 Å²	6	47.6 Å²	47.6	5%	0.05	21%	0.209	C	C	.	.			trans	-82.7	168.9	171.2	0	0	0	0	0	111.3	Y271 Q307 Y309 R310 Y312	Y271-A303 VanDerWaalsContact CD2-O 3.3Å; Y271-A303 WeakPolarHBondContact CD2-O 3.5Å; A303-Q307 HydrophobicContact CB-CB 3.6Å; A303-Y309 WeakPolarHBondContact O-CA 3.38Å; A303-R310 HydrophobicContact CB-CB 4.07Å; A303-R310 PolarHBondContact N-O 2.87Å; A303-Y312 HydrophobicContact CB-CE2 4.29Å
304	S	97.3	Very high	96.6	Very high	24 Å²	24	56.1 Å²	56.1	17%	0.168	24%	0.24	C	C	.	.			trans	-66.3	168	175.6	68.2	0	0	0	0	112.6	R306 Q307 Q308 Y309	S304-R306 PolarHBondContact O-N 3Å; S304-Q307 CarbonylContact O-C 3.56Å; S304-Q307 VanDerWaalsContact O-C 3.29Å; S304-Q307 WeakPolarHBondContact O-CA 3.4Å; S304-Q307 PolarHBondContact O-N 2.89Å; S304-Q308 PolarHBondContact O-N 3Å; S304-Y309 PolarHBondContact O-N 2.99Å; S304-Y309 VanDerWaalsContact O-N 3.09Å
305	E	98.1	Very high	96.4	Very high	68 Å²	68	55.7 Å²	55.7	32%	0.318	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-54.7	-37.2	173.1	-172	174.2	-148	0	0	113.1	W249 K253 Q307 Q308 Y309	W249-E305 HydrophobicContact CZ2-CG 4.06Å; W249-E305 PolarHBondContact NE1-OE1 3.49Å; K253-E305 WeakPolarHBondContact CD-OE1 3.36Å; K253-E305 VanDerWaalsContact NZ-CD 3.27Å; K253-E305 IonicContact NZ-OE1 3.95Å; K253-E305 PolarHBondContact NZ-OE1 3.44Å; K253-E305 IonicContact NZ-OE2 2.76Å; K253-E305 PolarHBondContact NZ-OE2 2.91Å; E305-Q307 PolarHBondContact O-N 3.13Å; E305-Q307 VanDerWaalsContact O-N 3.16Å; E305-Q308 WeakPolarHBondContact O-CA 3.33Å; E305-Q308 PolarHBondContact O-N 3.35Å; E305-Y309 HydrophobicContact CB-CE1 4.04Å; E305-Y309 HydrophobicContact CB-CE2 3.97Å; E305-Y309 WeakPolarHBondContact CB-OH 3.41Å; E305-Y309 HydrophobicContact CG-CE2 3.83Å
306	R	97.9	Very high	96.4	Very high	240 Å²	240	58.4 Å²	58.4	91%	0.906	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-61.3	-24.3	177	-66.8	-177	-177.7	167.5	1	112.7	S304	S304-R306 PolarHBondContact O-N 3Å
307	Q	97.2	Very high	96.3	Very high	109 Å²	109	59.9 Å²	59.9	51%	0.509	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-107	27.7	175.1	-65.7	177.2	-49.2	0	0	110.8	A303 S304 E305 Y309 R310	A303-Q307 HydrophobicContact CB-CB 3.6Å; S304-Q307 CarbonylContact O-C 3.56Å; S304-Q307 VanDerWaalsContact O-C 3.29Å; S304-Q307 WeakPolarHBondContact O-CA 3.4Å; S304-Q307 PolarHBondContact O-N 2.89Å; E305-Q307 PolarHBondContact O-N 3.13Å; E305-Q307 VanDerWaalsContact O-N 3.16Å; Q307-Y309 PolarHBondContact O-N 3.26Å; Q307-Y309 VanDerWaalsContact O-N 3.14Å; Q307-R310 VanDerWaalsContact O-CB 3.3Å; Q307-R310 WeakPolarHBondContact O-CB 3.48Å; Q307-R310 PolarHBondContact O-N 2.89Å; Q307-R310 VanDerWaalsContact O-N 3.08Å
308	Q	97.8	Very high	96.3	Very high	67 Å²	67	61.5 Å²	61.5	31%	0.313	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	31.5	172	-55.3	152.6	-44.3	0	0	113.4	W249 S304 E305 R310 F333 N340	W249-Q308 HydrophobicContact CH2-CB 4.34Å; S304-Q308 PolarHBondContact O-N 3Å; E305-Q308 WeakPolarHBondContact O-CA 3.33Å; E305-Q308 PolarHBondContact O-N 3.35Å; Q308-R310 PolarHBondContact O-N 3.15Å; Q308-R310 VanDerWaalsContact O-N 3.09Å; Q308-F333 WeakPolarHBondContact O-CB 3.32Å; Q308-F333 PolarHBondContact O-N 3.01Å; Q308-N340 HydrophobicContact CB-CB 4.31Å; Q308-N340 HydrophobicContact CG-CB 4.26Å; Q308-N340 PolarHBondContact NE2-OD1 3.45Å
309	Y	98.1	Very high	96.4	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	33.6	-176.3	-61.1	-66	0	0	0	113.8	W249 K253 N267 E268 M302 A303 S304 E305 Q307 L311 W357	W249-Y309 AromaticContact CH2-CD2 3.6Å; W249-Y309 HydrophobicContact CH2-CD2 3.6Å; W249-Y309 HydrophobicContact CH2-CE2 4.16Å; W249-Y309 AromaticContact CZ2-CD2 3.48Å; W249-Y309 HydrophobicContact CZ2-CD2 3.48Å; W249-Y309 VanDerWaalsContact CZ2-CD2 3.48Å; W249-Y309 AromaticContact CZ2-CE2 3.56Å; W249-Y309 HydrophobicContact CZ2-CE2 3.56Å; W249-Y309 HydrophobicContact CZ3-CD2 4.47Å; K253-Y309 HydrophobicContact CB-CE2 4.4Å; K253-Y309 WeakPolarHBondContact CD-OH 3.35Å; K253-Y309 VanDerWaalsContact CG-OH 3.29Å; K253-Y309 WeakPolarHBondContact CG-OH 3.35Å; N267-Y309 HydrophobicContact CB-CD1 3.7Å; N267-Y309 HydrophobicContact CB-CD2 3.67Å; N267-Y309 HydrophobicContact CB-CE1 3.78Å; N267-Y309 HydrophobicContact CB-CE2 3.77Å; N267-Y309 HydrophobicContact CB-CG 3.64Å; E268-Y309 PolarHBondContact OE2-OH 3.45Å; E268-Y309 VanDerWaalsContact OE2-OH 3.09Å; M302-Y309 HydrophobicContact CE-CD1 4.18Å; M302-Y309 HydrophobicContact CE-CG 4.22Å; A303-Y309 WeakPolarHBondContact O-CA 3.38Å; S304-Y309 PolarHBondContact O-N 2.99Å; S304-Y309 VanDerWaalsContact O-N 3.09Å; E305-Y309 HydrophobicContact CB-CE1 4.04Å; E305-Y309 HydrophobicContact CB-CE2 3.97Å; E305-Y309 WeakPolarHBondContact CB-OH 3.41Å; E305-Y309 HydrophobicContact CG-CE2 3.83Å; Q307-Y309 PolarHBondContact O-N 3.26Å; Q307-Y309 VanDerWaalsContact O-N 3.14Å; Y309-L311 PolarHBondContact O-N 3.3Å; Y309-W357 PolarHBondContact O-NE1 3.1Å
310	R	96.9	Very high	96.5	Very high	77 Å²	77	57 Å²	57	29%	0.291	28%	0.276	S	S	.	.			trans	-55	132.1	-178.4	179.1	175.8	-70.3	-137.2	7.6	111.2	M302 A303 Q307 Q308 Y312 G330 A331	M302-R310 CarbonylContact C-O 3.55Å; M302-R310 WeakPolarHBondContact CA-O 3.44Å; A303-R310 HydrophobicContact CB-CB 4.07Å; A303-R310 PolarHBondContact N-O 2.87Å; Q307-R310 VanDerWaalsContact O-CB 3.3Å; Q307-R310 WeakPolarHBondContact O-CB 3.48Å; Q307-R310 PolarHBondContact O-N 2.89Å; Q307-R310 VanDerWaalsContact O-N 3.08Å; Q308-R310 PolarHBondContact O-N 3.15Å; Q308-R310 VanDerWaalsContact O-N 3.09Å; R310-Y312 VanDerWaalsContact CD-OH 3.29Å; R310-Y312 WeakPolarHBondContact CD-OH 3.37Å; R310-Y312 HydrophobicContact CG-CE1 4.48Å; R310-Y312 HydrophobicContact CG-CE2 4.16Å; R310-G330 PolarHBondContact NH1-O 2.97Å; R310-A331 WeakPolarHBondContact CA-O 3.41Å; R310-A331 WeakPolarHBondContact CG-O 3.49Å
311	L	94.2	Very high	96.4	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.005	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	151.4	178.9	84.1	99.6	0	0	0	111.5	T301 Y309 L313 I327 G330 A331 W357	T301-L311 CarbonylContact O-C 3.46Å; Y309-L311 PolarHBondContact O-N 3.3Å; L311-L313 HydrophobicContact CD1-CB 4.23Å; L311-L313 HydrophobicContact CD1-CD1 3.27Å; L311-L313 HydrophobicContact CD1-CD2 4.4Å; L311-L313 HydrophobicContact CD1-CG 3.33Å; L311-I327 WeakPolarHBondContact CD1-O 3.49Å; L311-G330 WeakPolarHBondContact O-CA 3.47Å; L311-A331 PolarHBondContact N-O 3.07Å; L311-W357 HydrophobicContact CB-CD2 4.16Å; L311-W357 HydrophobicContact CB-CG 4.17Å; L311-W357 HydrophobicContact CB-CZ2 4.45Å; L311-W357 HydrophobicContact CD2-CB 3.18Å; L311-W357 HydrophobicContact CD2-CD2 3.45Å; L311-W357 VanDerWaalsContact CD2-CD2 3.45Å; L311-W357 HydrophobicContact CD2-CE3 3.99Å; L311-W357 HydrophobicContact CD2-CG 3.11Å; L311-W357 HydrophobicContact CG-CB 4.47Å; L311-W357 HydrophobicContact CG-CD2 4.41Å; L311-W357 HydrophobicContact CG-CG 4.15Å
312	Y	94.3	Very high	96.4	Very high	103 Å²	103	68 Å²	68	40%	0.404	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	129	167.8	-61.7	-82.4	0	0	0	109.7	F300 T301 A303 R310	F300-Y312 WeakPolarHBondContact CA-O 3.44Å; T301-Y312 PolarHBondContact N-O 3.48Å; T301-Y312 VanDerWaalsContact N-O 3.07Å; T301-Y312 PolarHBondContact O-N 2.86Å; A303-Y312 HydrophobicContact CB-CE2 4.29Å; R310-Y312 VanDerWaalsContact CD-OH 3.29Å; R310-Y312 WeakPolarHBondContact CD-OH 3.37Å; R310-Y312 HydrophobicContact CG-CE1 4.48Å; R310-Y312 HydrophobicContact CG-CE2 4.16Å
313	L	94.9	Very high	96.4	Very high	9 Å²	9	74 Å²	74	5%	0.047	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	141.1	-176	-69.5	166.7	0	0	0	111.7	L281 Y297 R299 F300 L311 L326 T328	L281-L313 HydrophobicContact CD2-CD2 3.82Å; Y297-L313 HydrophobicContact CD1-CB 3.97Å; Y297-L313 HydrophobicContact CD1-CD1 4.07Å; Y297-L313 HydrophobicContact CD1-CD2 3.83Å; Y297-L313 HydrophobicContact CD1-CG 4.17Å; Y297-L313 HydrophobicContact CD2-CD2 4.18Å; Y297-L313 HydrophobicContact CE1-CB 4.42Å; Y297-L313 HydrophobicContact CE1-CD1 3.88Å; Y297-L313 HydrophobicContact CE1-CD2 4.42Å; Y297-L313 HydrophobicContact CE1-CG 4.48Å; Y297-L313 HydrophobicContact CG-CD2 3.69Å; R299-L313 CarbonylContact O-C 3.29Å; R299-L313 VanDerWaalsContact O-CA 3.28Å; R299-L313 WeakPolarHBondContact O-CA 3.49Å; F300-L313 HydrophobicContact CB-CD2 4.08Å; F300-L313 HydrophobicContact CD2-CD2 3.6Å; F300-L313 HydrophobicContact CG-CD2 4.3Å; L311-L313 HydrophobicContact CD1-CB 4.23Å; L311-L313 HydrophobicContact CD1-CD1 3.27Å; L311-L313 HydrophobicContact CD1-CD2 4.4Å; L311-L313 HydrophobicContact CD1-CG 3.33Å; L313-L326 HydrophobicContact CD1-CB 3.48Å; L313-L326 VanDerWaalsContact CD1-CB 3.48Å; L313-L326 HydrophobicContact CD1-CD1 3.78Å; L313-L326 HydrophobicContact CD1-CG 4.22Å; L313-T328 HydrophobicContact CB-CG2 4.49Å
314	R	94.9	Very high	96.3	Very high	185 Å²	185	74.6 Å²	74.6	70%	0.698	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.8	162.9	167.4	-64.5	-168.5	174.5	-170.2	-1.3	111.4	D298 R299	D298-R314 PolarHBondContact N-O 3.35Å; R299-R314 HydrophobicContact CB-CB 4.26Å; R299-R314 PolarHBondContact N-O 3.06Å; R299-R314 PolarHBondContact O-N 3.32Å
315	G	95.7	Very high	96.3	Very high	34 Å²	34	73.4 Å²	73.4	35%	0.351	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	68.1	52.2	174.6	0	0	0	0	0	112.9	Y297 D298	Y297-G315 WeakPolarHBondContact CA-O 3.35Å; D298-G315 PolarHBondContact N-O 3.08Å
316	Y	97.3	Very high	96.2	Very high	57 Å²	57	70.5 Å²	70.5	22%	0.224	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	132.5	177.7	172.1	-100.3	0	0	0	111.4	Q296 Y297 A320 G321 Q323	Q296-Y316 CarbonylContact O-C 3.57Å; Q296-Y316 VanDerWaalsContact O-CA 3.31Å; Q296-Y316 WeakPolarHBondContact O-CA 3.46Å; Y297-Y316 HydrophobicContact CD1-CD2 4.12Å; Y297-Y316 AromaticContact CE1-CD2 3.5Å; Y297-Y316 HydrophobicContact CE1-CD2 3.5Å; Y297-Y316 HydrophobicContact CE1-CE2 4.41Å; Y297-Y316 HydrophobicContact CE1-CG 4.25Å; Y297-Y316 HydrophobicContact CE2-CD2 4.41Å; Y297-Y316 AromaticContact CZ-CD2 3.66Å; Y316-A320 PolarHBondContact OH-O 3.29Å; Y316-G321 PolarHBondContact OH-O 2.97Å; Y316-Q323 PolarHBondContact OH-O 2.86Å
317	S	97.4	Very high	95.8	Very high	56 Å²	56	60.4 Å²	60.4	39%	0.392	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	177.4	169.5	61	0	0	0	0	110.7	Q296	Q296-S317 WeakPolarHBondContact CB-OG 3.44Å; Q296-S317 PolarHBondContact N-O 3.41Å; Q296-S317 PolarHBondContact O-N 3.37Å
318	G	97.2	Very high	95.1	Very high	34 Å²	34	57.9 Å²	57.9	35%	0.351	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	123.9	-167.6	175.8	0	0	0	0	0	113.8	H294	H294-G318 CarbonylContact O-C 3.56Å; H294-G318 WeakPolarHBondContact O-CA 3.29Å
319	T	98.2	Very high	94.1	Very high	90 Å²	90	62.8 Å²	62.8	55%	0.552	31%	0.309	S	S	*	.	S	Bend	trans	-108.7	-10.3	-175.5	58.1	0	0	0	0	113.7	A293 H294 G321	A293-T319 WeakPolarHBondContact CA-OG1 3.4Å; H294-T319 PolarHBondContact N-OG1 2.96Å; H294-T319 VanDerWaalsContact N-OG1 3.11Å; H294-T319 PolarHBondContact ND1-OG1 2.83Å; H294-T319 PolarHBondContact O-N 3.35Å; T319-G321 PolarHBondContact O-N 2.93Å
320	A	97.3	Very high	93.2	Very high	0 Å²	0	63 Å²	63	0%	0	31%	0.311	C	S	.	.	S	Bend	trans	-84.9	49.6	-179.1	0	0	0	0	0	112.9	L285 A293 H294 S295 Y316 W385 F388	L285-A320 HydrophobicContact CD1-CB 3.7Å; A293-A320 HydrophobicContact CB-CB 3.76Å; H294-A320 WeakPolarHBondContact O-CB 3.4Å; H294-A320 PolarHBondContact O-N 3.18Å; S295-A320 WeakPolarHBondContact OG-CB 3.38Å; Y316-A320 PolarHBondContact OH-O 3.29Å; A320-W385 PolarHBondContact O-NE1 3.26Å; A320-W385 VanDerWaalsContact O-NE1 3.08Å; A320-F388 HydrophobicContact CB-CB 4.25Å
321	G	94.9	Very high	92.7	Very high	20 Å²	20	59.3 Å²	59.3	21%	0.206	30%	0.297	C	S	.	.			trans	114.9	166.5	-178.7	0	0	0	0	0	114	Y316 T319 H387	Y316-G321 PolarHBondContact OH-O 2.97Å; T319-G321 PolarHBondContact O-N 2.93Å; G321-H387 VanDerWaalsContact CA-O 3.27Å; G321-H387 WeakPolarHBondContact CA-O 3.47Å
322	R	94	Very high	92.8	Very high	245 Å²	245	59.3 Å²	59.3	93%	0.925	30%	0.297	S	S	*	.	S	Bend	trans	-86.8	-13.3	168.6	-69.5	-173.8	175.2	-175.4	-1.4	112.8
323	Q	94.8	Very high	93	Very high	128 Å²	128	54.4 Å²	54.4	60%	0.598	28%	0.278	S	S	*	.	S	Bend	trans	-133.6	151.2	-177	-68.1	178.2	-16.9	0	0	109.6	Y316 H387	Y316-Q323 PolarHBondContact OH-O 2.86Å; Q323-H387 PolarHBondContact O-CD2 2.95Å; Q323-H387 PolarHBondContact OE1-CE1 3.46Å
324	S	95.2	Very high	93.2	Very high	19 Å²	19	54 Å²	54	13%	0.133	28%	0.276	C	S	.	.			trans	-65.1	132.1	176.6	174.6	0	0	0	0	111.4	Y297 L326 H387	Y297-S324 WeakPolarHBondContact CE1-OG 3.43Å; Y297-S324 PolarHBondContact OH-OG 3.05Å; S324-L326 VanDerWaalsContact C-N 3.35Å; S324-L326 PolarHBondContact OG-N 2.95Å; S324-L326 PolarHBondContact OG-O 3.36Å; S324-H387 PolarHBondContact O-CD2 2.85Å
325	S	96.4	Very high	93.3	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.243	C	C	.	.	S	Bend	trans	-85.9	-9.5	167	-52.8	0	0	0	0	112.7	F363 S364 W385 H386 H387	S325-F363 CarbonylContact O-C 3.54Å; S325-S364 VanDerWaalsContact O-CB 3.31Å; S325-S364 WeakPolarHBondContact O-CB 3.46Å; S325-S364 PolarHBondContact O-N 3.06Å; S325-S364 PolarHBondContact O-OG 3.03Å; S325-W385 VanDerWaalsContact CB-CE2 3.43Å; S325-W385 VanDerWaalsContact OG-CD1 3.3Å; S325-W385 PolarHBondContact OG-NE1 2.94Å; S325-H386 PolarHBondContact OG-N 2.88Å; S325-H387 PolarHBondContact OG-CD2 2.88Å; S325-H387 PolarHBondContact OG-N 2.96Å; S325-H387 VanDerWaalsContact OG-N 3.12Å
326	L	94.9	Very high	93.4	Very high	7 Å²	7	50 Å²	50	4%	0.037	25%	0.25	C	S	.	.	S	Bend	trans	-87.4	146.1	168.9	-76.1	167.7	0	0	0	110.1	L281 Y297 L313 S324 T328 W356 W385 M400	L281-L326 HydrophobicContact CD2-CD1 3.95Å; Y297-L326 HydrophobicContact CE2-CD1 3.97Å; L313-L326 HydrophobicContact CD1-CB 3.48Å; L313-L326 VanDerWaalsContact CD1-CB 3.48Å; L313-L326 HydrophobicContact CD1-CD1 3.78Å; L313-L326 HydrophobicContact CD1-CG 4.22Å; S324-L326 VanDerWaalsContact C-N 3.35Å; S324-L326 PolarHBondContact OG-N 2.95Å; S324-L326 PolarHBondContact OG-O 3.36Å; L326-T328 PolarHBondContact O-N 3.3Å; L326-W356 HydrophobicContact CD2-CH2 4.29Å; L326-W356 HydrophobicContact CD2-CZ2 3.48Å; L326-W356 VanDerWaalsContact CD2-CZ2 3.48Å; L326-W385 HydrophobicContact CB-CH2 4.4Å; L326-W385 HydrophobicContact CD1-CH2 3.81Å; L326-W385 HydrophobicContact CD1-CZ3 4.24Å; L326-W385 HydrophobicContact CD2-CZ3 4.43Å; L326-W385 HydrophobicContact CG-CH2 3.59Å; L326-W385 HydrophobicContact CG-CZ3 3.82Å; L326-M400 HydrophobicContact CD1-CE 4.31Å
327	I	90.4	Very high	93.4	Very high	27 Å²	27	50.9 Å²	50.9	14%	0.138	26%	0.259	C	S	.	.			trans	-74.4	114.2	179.6	-63.1	126	0	0	0	109.7	L311 A331 W357 D359	L311-I327 WeakPolarHBondContact CD1-O 3.49Å; I327-A331 HydrophobicContact CB-CB 4.37Å; I327-A331 HydrophobicContact CD1-CB 4.13Å; I327-A331 HydrophobicContact CG2-CB 4.29Å; I327-W357 WeakPolarHBondContact CD1-O 3.44Å; I327-D359 HydrophobicContact CD1-CB 3.46Å; I327-D359 VanDerWaalsContact CD1-CB 3.46Å; I327-D359 HydrophobicContact CG1-CB 3.85Å
328	T	83.1	Confident	93.5	Very high	57 Å²	57	52 Å²	52	35%	0.35	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-24.6	-176.7	50.2	0	0	0	0	113.6	L313 L326 G330	L313-T328 HydrophobicContact CB-CG2 4.49Å; L326-T328 PolarHBondContact O-N 3.3Å; T328-G330 PolarHBondContact O-N 3.21Å
329	H	76.5	Confident	93.5	Very high	170 Å²	170	54 Å²	54	79%	0.787	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	5	-177.5	-60.9	-69.3	0	0	0	114.3
330	G	78.5	Confident	93.4	Very high	4 Å²	4	51.2 Å²	51.2	4%	0.041	24%	0.242	C	C	.	.			trans	79.5	103.1	173.7	0	0	0	0	0	114	R310 L311 T328	R310-G330 PolarHBondContact NH1-O 2.97Å; L311-G330 WeakPolarHBondContact O-CA 3.47Å; T328-G330 PolarHBondContact O-N 3.21Å
331	A	87.4	Confident	93.2	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-103.6	144.4	173.3	0	0	0	0	0	110.5	R310 L311 I327 W357 F358	R310-A331 WeakPolarHBondContact CA-O 3.41Å; R310-A331 WeakPolarHBondContact CG-O 3.49Å; L311-A331 PolarHBondContact N-O 3.07Å; I327-A331 HydrophobicContact CB-CB 4.37Å; I327-A331 HydrophobicContact CD1-CB 4.13Å; I327-A331 HydrophobicContact CG2-CB 4.29Å; A331-W357 HydrophobicContact CB-CB 4.21Å; A331-W357 VanDerWaalsContact O-CD1 3.31Å; A331-F358 WeakPolarHBondContact CB-O 3.35Å
332	G	96	Very high	93.1	Very high	1 Å²	1	55 Å²	55	1%	0.01	26%	0.258	C	S	.	.	P	Polyproline II helix	trans	-63.8	152.4	168.7	0	0	0	0	0	110.4	W357	G332-W357 WeakPolarHBondContact O-CA 3.34Å
333	F	98.3	Very high	93	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-76.9	138.2	170.2	-162.2	-99.4	0	0	0	108.7	W249 Y252 W264 N267 Q308 T335 N340 G355 W357	W249-F333 HydrophobicContact CE3-CD1 4.49Å; W249-F333 HydrophobicContact CH2-CB 4.44Å; W249-F333 HydrophobicContact CZ3-CB 4.16Å; W249-F333 HydrophobicContact CZ3-CD1 4.05Å; W249-F333 VanDerWaalsContact CZ3-O 3.25Å; W249-F333 WeakPolarHBondContact CZ3-O 3.27Å; Y252-F333 AromaticContact CD1-CE1 3.67Å; Y252-F333 HydrophobicContact CD1-CE1 3.67Å; Y252-F333 AromaticContact CD1-CZ 3.47Å; Y252-F333 HydrophobicContact CD1-CZ 3.47Å; Y252-F333 VanDerWaalsContact CD1-CZ 3.47Å; Y252-F333 HydrophobicContact CD2-CE1 4.23Å; Y252-F333 HydrophobicContact CE1-CE1 4.34Å; Y252-F333 AromaticContact CE1-CZ 3.84Å; Y252-F333 HydrophobicContact CE1-CZ 3.84Å; Y252-F333 AromaticContact CG-CE1 3.62Å; Y252-F333 HydrophobicContact CG-CE1 3.62Å; Y252-F333 AromaticContact CG-CZ 3.94Å; Y252-F333 HydrophobicContact CG-CZ 3.94Å; W264-F333 HydrophobicContact CH2-CE2 4.22Å; W264-F333 HydrophobicContact CZ2-CE2 4.04Å; W264-F333 HydrophobicContact CZ2-CZ 4.13Å; N267-F333 WeakPolarHBondContact ND2-CD1 3.01Å; Q308-F333 WeakPolarHBondContact O-CB 3.32Å; Q308-F333 PolarHBondContact O-N 3.01Å; F333-T335 HydrophobicContact CD1-CG2 4.02Å; F333-T335 HydrophobicContact CE1-CG2 3.68Å; F333-N340 WeakPolarHBondContact O-CB 3.38Å; F333-N340 PolarHBondContact O-ND2 3.24Å; F333-G355 WeakPolarHBondContact CZ-O 3.4Å; F333-W357 AromaticContact CD2-CD1 3.8Å; F333-W357 AromaticContact CD2-CD2 3.73Å; F333-W357 HydrophobicContact CD2-CD2 3.73Å; F333-W357 AromaticContact CD2-CE2 3.58Å; F333-W357 HydrophobicContact CD2-CE3 4.35Å; F333-W357 AromaticContact CD2-CG 3.89Å; F333-W357 HydrophobicContact CD2-CG 3.89Å; F333-W357 HydrophobicContact CD2-CZ2 4.1Å; F333-W357 AromaticContact CD2-NE1 3.62Å; F333-W357 HydrophobicContact CE2-CD2 4.2Å; F333-W357 HydrophobicContact CE2-CE3 4.38Å; F333-W357 HydrophobicContact CE2-CZ2 4.38Å
334	S	98.3	Very high	92.8	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-127.5	145	176.5	-53.9	0	0	0	0	110.2	H338 N340 D341 G355 W356	S334-H338 CarbonylContact C-O 3.58Å; S334-H338 VanDerWaalsContact CA-O 3.31Å; S334-H338 WeakPolarHBondContact CA-O 3.38Å; S334-H338 WeakPolarHBondContact CB-O 3.35Å; S334-N340 WeakPolarHBondContact OG-CA 3.36Å; S334-N340 PolarHBondContact OG-N 2.88Å; S334-D341 PolarHBondContact OG-N 2.95Å; S334-G355 CarbonylContact O-C 3.56Å; S334-G355 WeakPolarHBondContact O-CA 3.43Å; S334-W356 PolarHBondContact N-O 3.12Å; S334-W356 PolarHBondContact O-N 3.31Å
335	T	98.6	Very high	92.6	Very high	3 Å²	3	53.6 Å²	53.6	2%	0.018	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-129.7	174.1	175.2	56.8	0	0	0	0	109.4	W249 Y252 F333 D337 H338 A349	W249-T335 WeakPolarHBondContact CA-OG1 3.49Å; W249-T335 HydrophobicContact CE3-CG2 4.21Å; W249-T335 PolarHBondContact N-OG1 2.83Å; Y252-T335 HydrophobicContact CD2-CG2 3.49Å; Y252-T335 VanDerWaalsContact CD2-CG2 3.49Å; Y252-T335 HydrophobicContact CE2-CG2 4.18Å; Y252-T335 HydrophobicContact CG-CG2 4.02Å; F333-T335 HydrophobicContact CD1-CG2 4.02Å; F333-T335 HydrophobicContact CE1-CG2 3.68Å; T335-D337 WeakPolarHBondContact CB-OD1 3.46Å; T335-D337 PolarHBondContact O-N 3.41Å; T335-D337 PolarHBondContact OG1-OD1 2.87Å; T335-H338 PolarHBondContact N-O 3.34Å; T335-H338 CarbonylContact O-C 3.51Å; T335-H338 PolarHBondContact O-N 3.42Å; T335-H338 VanDerWaalsContact O-N 3.16Å; T335-H338 PolarHBondContact OG1-N 3.39Å; T335-A349 WeakPolarHBondContact O-CB 3.4Å
336	R	96.9	Very high	92.4	Very high	132 Å²	132	55 Å²	55	50%	0.498	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-25.6	-178.5	68.3	179.4	-174.6	-178.2	-0	114.3	Q246 L350	Q246-R336 PolarHBondContact O-NH1 3.14Å; Q246-R336 VanDerWaalsContact O-NH1 3.16Å; R336-L350 HydrophobicContact CB-CD2 3.81Å
337	D	98	Very high	92.4	Very high	76 Å²	76	60.1 Å²	60.1	41%	0.406	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-3	-174.8	60.9	-33.9	0	0	0	113.5	S248 W249 T335	S248-D337 WeakPolarHBondContact CA-OD1 3.44Å; S248-D337 WeakPolarHBondContact CB-OD2 3.45Å; W249-D337 PolarHBondContact N-OD1 2.96Å; W249-D337 PolarHBondContact N-OD2 2.93Å; T335-D337 WeakPolarHBondContact CB-OD1 3.46Å; T335-D337 PolarHBondContact O-N 3.41Å; T335-D337 PolarHBondContact OG1-OD1 2.87Å
338	H	97.7	Very high	92.7	Very high	80 Å²	80	58.8 Å²	58.8	37%	0.37	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-139.3	109.1	176.8	-80.9	57	0	0	0	109.8	W249 S334 T335	W249-H338 HydrophobicContact CB-CB 4.22Å; W249-H338 WeakPolarHBondContact CB-ND1 3.41Å; W249-H338 HydrophobicContact CD2-CB 4.1Å; W249-H338 AromaticContact CD2-CD2 3.88Å; W249-H338 AromaticContact CD2-CG 3.9Å; W249-H338 HydrophobicContact CE3-CB 3.68Å; W249-H338 HydrophobicContact CG-CB 4.36Å; W249-H338 AromaticContact CG-CD2 3.87Å; W249-H338 AromaticContact CG-CG 3.79Å; W249-H338 AromaticContact CG-ND1 3.92Å; W249-H338 HydrophobicContact CZ3-CB 4.34Å; S334-H338 CarbonylContact C-O 3.58Å; S334-H338 VanDerWaalsContact CA-O 3.31Å; S334-H338 WeakPolarHBondContact CA-O 3.38Å; S334-H338 WeakPolarHBondContact CB-O 3.35Å; T335-H338 PolarHBondContact N-O 3.34Å; T335-H338 CarbonylContact O-C 3.51Å; T335-H338 PolarHBondContact O-N 3.42Å; T335-H338 VanDerWaalsContact O-N 3.16Å; T335-H338 PolarHBondContact OG1-N 3.39Å
339	D	97.1	Very high	93.4	Very high	75 Å²	75	56.3 Å²	56.3	40%	0.401	28%	0.277	S	S	.	.			trans	-96.5	102.6	-176.5	-171.1	9.5	0	0	0	110.3	K347	D339-K347 WeakPolarHBondContact OD2-CE 3.35Å; D339-K347 WeakPolarHBondContact OD2-CG 3.42Å
340	N	96.6	Very high	94.4	Very high	32 Å²	32	52.9 Å²	52.9	17%	0.171	26%	0.264	C	S	.	.			trans	-126.4	19.2	179.4	-52.5	-59.9	0	0	0	111.4	Q308 F333 S334	Q308-N340 HydrophobicContact CB-CB 4.31Å; Q308-N340 HydrophobicContact CG-CB 4.26Å; Q308-N340 PolarHBondContact NE2-OD1 3.45Å; F333-N340 WeakPolarHBondContact O-CB 3.38Å; F333-N340 PolarHBondContact O-ND2 3.24Å; S334-N340 WeakPolarHBondContact OG-CA 3.36Å; S334-N340 PolarHBondContact OG-N 2.88Å
341	D	93.9	Very high	95.2	Very high	19 Å²	19	58.5 Å²	58.5	10%	0.102	29%	0.29	C	S	.	.	S	Bend	trans	-83.6	166.1	178.7	68	56.2	0	0	0	110.5	S334 C343 C348 F358	S334-D341 PolarHBondContact OG-N 2.95Å; D341-C343 PolarHBondContact O-N 2.89Å; D341-C343 WeakPolarHBondContact OD1-CB 3.31Å; D341-C343 PolarHBondContact OD1-N 3.41Å; D341-C348 HydrophobicContact CB-CB 4.35Å; D341-C348 WeakPolarHBondContact OD2-CB 3.4Å; D341-C348 PolarHBondContact OD2-N 3.43Å; D341-F358 HydrophobicContact CB-CB 3.76Å
342	N	92.1	Very high	95.6	Very high	81 Å²	81	59.3 Å²	59.3	43%	0.433	29%	0.294	S	S	.	.	S	Bend	trans	-92.2	21.7	-176.7	-61.9	-40.3	0	0	0	111.5	D359	N342-D359 WeakPolarHBondContact CB-OD1 3.4Å; N342-D359 PolarHBondContact N-O 3.37Å; N342-D359 PolarHBondContact ND2-OD1 2.86Å
343	C	92.3	Very high	95.7	Very high	25 Å²	25	59.8 Å²	59.8	17%	0.169	30%	0.297	C	S	.	.			trans	-96	100.2	-179.6	-162.9	0	0	0	0	111.6	D341 H345 C346 A360	D341-C343 PolarHBondContact O-N 2.89Å; D341-C343 WeakPolarHBondContact OD1-CB 3.31Å; D341-C343 PolarHBondContact OD1-N 3.41Å; C343-H345 PolarHBondContact O-N 3.4Å; C343-C346 HydrophobicContact CB-CB 4.2Å; C343-C346 WeakPolarHBondContact CB-SG 3.34Å; C343-C346 PolarHBondContact O-N 3.41Å; C343-C346 VanDerWaalsContact O-O 3.05Å; C343-C346 WeakPolarHBondContact SG-CB 3.43Å; C343-C346 PolarHBondContact SG-N 3Å; C343-C346 VanDerWaalsContact SG-N 3.43Å; C343-C346 CovalentContact SG-SG 2.03Å; C343-C346 PolarHBondContact SG-SG 3.41Å; C343-A360 HydrophobicContact CB-CB 4.07Å
344	D	89.8	Confident	95.7	Very high	151 Å²	151	60 Å²	60	81%	0.807	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-22.4	-177.7	-64.7	-32.5	0	0	0	114.6
345	H	91	Very high	95.7	Very high	185 Å²	185	60 Å²	60	86%	0.856	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.5	11.3	-172.8	-59.1	-34.6	0	0	0	113.6	C343	C343-H345 PolarHBondContact O-N 3.4Å
346	C	93.1	Very high	95.7	Very high	31 Å²	31	59.9 Å²	59.9	21%	0.209	30%	0.299	C	S	.	.			trans	-147.7	163.4	179.8	81.2	0	0	0	0	112.1	C343 C348 M351	C343-C346 HydrophobicContact CB-CB 4.2Å; C343-C346 WeakPolarHBondContact CB-SG 3.34Å; C343-C346 PolarHBondContact O-N 3.41Å; C343-C346 VanDerWaalsContact O-O 3.05Å; C343-C346 WeakPolarHBondContact SG-CB 3.43Å; C343-C346 PolarHBondContact SG-N 3Å; C343-C346 VanDerWaalsContact SG-N 3.43Å; C343-C346 CovalentContact SG-SG 2.03Å; C343-C346 PolarHBondContact SG-SG 3.41Å; C346-C348 VanDerWaalsContact SG-SG 3.67Å; C346-M351 HydrophobicContact CB-SD 3.66Å
347	K	95.7	Very high	95.7	Very high	113 Å²	113	53.7 Å²	53.7	49%	0.491	28%	0.275	S	S	.	.			trans	-119.7	96.4	176.2	-63.1	-166.3	169.2	-175.5	0	108.3	D339 A349 L350 M351	D339-K347 WeakPolarHBondContact OD2-CE 3.35Å; D339-K347 WeakPolarHBondContact OD2-CG 3.42Å; K347-A349 VanDerWaalsContact C-N 3.33Å; K347-A349 PolarHBondContact O-N 2.93Å; K347-L350 HydrophobicContact CB-CB 4.1Å; K347-L350 HydrophobicContact CB-CD1 3.88Å; K347-L350 HydrophobicContact CB-CG 4.22Å; K347-L350 HydrophobicContact CD-CD1 3.67Å; K347-L350 HydrophobicContact CG-CD1 4.38Å; K347-L350 PolarHBondContact O-N 3.41Å; K347-M351 PolarHBondContact O-N 2.92Å
348	C	96.9	Very high	95.6	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-63.8	-38.7	-166.6	-68.4	0	0	0	0	112.7	D341 C346 L350 M351 L352 F358 C361	D341-C348 HydrophobicContact CB-CB 4.35Å; D341-C348 WeakPolarHBondContact OD2-CB 3.4Å; D341-C348 PolarHBondContact OD2-N 3.43Å; C346-C348 VanDerWaalsContact SG-SG 3.67Å; C348-L350 VanDerWaalsContact C-N 3.27Å; C348-L350 PolarHBondContact O-N 3.41Å; C348-M351 PolarHBondContact O-N 2.93Å; C348-L352 WeakPolarHBondContact O-CB 3.36Å; C348-L352 PolarHBondContact O-N 3.26Å; C348-F358 HydrophobicContact CB-CB 3.5Å; C348-F358 HydrophobicContact CB-CD1 3.81Å; C348-F358 HydrophobicContact CB-CD2 3.86Å; C348-F358 HydrophobicContact CB-CE1 4.46Å; C348-F358 HydrophobicContact CB-CG 3.46Å; C348-F358 VanDerWaalsContact CB-CG 3.46Å; C348-C361 WeakPolarHBondContact CA-SG 3.24Å; C348-C361 HydrophobicContact CB-CB 3.57Å; C348-C361 WeakPolarHBondContact CB-SG 3.39Å; C348-C361 WeakPolarHBondContact SG-CA 3.4Å; C348-C361 WeakPolarHBondContact SG-CB 3.46Å; C348-C361 CovalentContact SG-SG 2.03Å; C348-C361 PolarHBondContact SG-SG 3.38Å
349	A	97.4	Very high	95.4	Very high	5 Å²	5	49 Å²	49	4%	0.041	25%	0.253	C	S	.	.	H	α-helix	trans	-64.3	-29.7	176.2	0	0	0	0	0	113.2	T335 K347 T353 F358	T335-A349 WeakPolarHBondContact O-CB 3.4Å; K347-A349 VanDerWaalsContact C-N 3.33Å; K347-A349 PolarHBondContact O-N 2.93Å; A349-T353 CarbonylContact O-C 3.56Å; A349-T353 WeakPolarHBondContact O-CA 3.41Å; A349-T353 PolarHBondContact O-N 2.86Å; A349-T353 VanDerWaalsContact O-N 3.14Å; A349-F358 HydrophobicContact CB-CD2 4.26Å; A349-F358 HydrophobicContact CB-CE2 3.77Å
350	L	96.3	Very high	95.1	Very high	98 Å²	98	48.5 Å²	48.5	51%	0.513	26%	0.259	S	S	.	.	H	α-helix	trans	-79.4	-40.7	174.9	-70.6	174.9	0	0	0	111.9	R336 K347 C348	R336-L350 HydrophobicContact CB-CD2 3.81Å; K347-L350 HydrophobicContact CB-CB 4.1Å; K347-L350 HydrophobicContact CB-CD1 3.88Å; K347-L350 HydrophobicContact CB-CG 4.22Å; K347-L350 HydrophobicContact CD-CD1 3.67Å; K347-L350 HydrophobicContact CG-CD1 4.38Å; K347-L350 PolarHBondContact O-N 3.41Å; C348-L350 VanDerWaalsContact C-N 3.27Å; C348-L350 PolarHBondContact O-N 3.41Å
351	M	95.8	Very high	94.9	Very high	122 Å²	122	48 Å²	48	60%	0.601	26%	0.258	S	S	*	.	H	α-helix	trans	-74.3	-44.9	-178.5	-70.1	-179.1	64.3	0	0	113.1	C346 K347 C348	C346-M351 HydrophobicContact CB-SD 3.66Å; K347-M351 PolarHBondContact O-N 2.92Å; C348-M351 PolarHBondContact O-N 2.93Å
352	L	96.6	Very high	94.9	Very high	16 Å²	16	48.2 Å²	48.2	8%	0.084	26%	0.264	C	S	.	.	H	α-helix	trans	-98.1	-8	-175	-57.2	-171.8	0	0	0	113.3	C348 F358 C361 N365 L380 N381	C348-L352 WeakPolarHBondContact O-CB 3.36Å; C348-L352 PolarHBondContact O-N 3.26Å; L352-F358 HydrophobicContact CB-CE1 4.01Å; L352-F358 HydrophobicContact CB-CZ 4.3Å; L352-F358 HydrophobicContact CD1-CD1 4.23Å; L352-F358 HydrophobicContact CD1-CE1 3.92Å; L352-C361 HydrophobicContact CD1-CB 3.47Å; L352-C361 VanDerWaalsContact CD1-CB 3.47Å; L352-C361 HydrophobicContact CG-CB 4.37Å; L352-N365 PolarHBondContact O-ND2 3.31Å; L352-N365 VanDerWaalsContact O-ND2 3.12Å; L352-L380 HydrophobicContact CD2-CB 4.4Å; L352-L380 WeakPolarHBondContact CD2-O 3.47Å; L352-N381 CarbonylContact O-C 3.56Å; L352-N381 VanDerWaalsContact O-CA 3.3Å; L352-N381 WeakPolarHBondContact O-CA 3.37Å; L352-N381 WeakPolarHBondContact O-CB 3.48Å
353	T	97.2	Very high	95.1	Very high	12 Å²	12	49.6 Å²	49.6	7%	0.074	27%	0.267	C	S	.	.			trans	66.4	152.1	179.5	75.2	0	0	0	0	114.4	Q246 A349 N365 I369 N381	Q246-T353 VanDerWaalsContact NE2-CG2 3.32Å; A349-T353 CarbonylContact O-C 3.56Å; A349-T353 WeakPolarHBondContact O-CA 3.41Å; A349-T353 PolarHBondContact O-N 2.86Å; A349-T353 VanDerWaalsContact O-N 3.14Å; T353-N365 PolarHBondContact O-ND2 2.94Å; T353-I369 HydrophobicContact CG2-CD1 4.13Å; T353-I369 HydrophobicContact CG2-CG1 4.13Å; T353-I369 WeakPolarHBondContact OG1-CG1 3.33Å; T353-I369 PolarHBondContact OG1-N 2.82Å; T353-N381 HydrophobicContact CG2-CB 4.23Å; T353-N381 PolarHBondContact OG1-O 3.22Å
354	G	98	Very high	95.4	Very high	4 Å²	4	48.4 Å²	48.4	4%	0.041	26%	0.259	C	S	.	.	S	Bend	trans	78.3	171.1	-179.7	0	0	0	0	0	113.8	F245	F245-G354 WeakPolarHBondContact O-CA 3.49Å
355	G	98.4	Very high	95.8	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.221	C	C	.	.			trans	-93	130.8	175.1	0	0	0	0	0	110.2	Y252 F333 S334 N367	Y252-G355 VanDerWaalsContact CE2-N 3.29Å; Y252-G355 PolarHBondContact OH-N 3.22Å; F333-G355 WeakPolarHBondContact CZ-O 3.4Å; S334-G355 CarbonylContact O-C 3.56Å; S334-G355 WeakPolarHBondContact O-CA 3.43Å; G355-N367 WeakPolarHBondContact O-CB 3.4Å; G355-N367 PolarHBondContact O-ND2 2.92Å
356	W	98.3	Very high	96.1	Very high	1 Å²	1	32.4 Å²	32.4	0%	0.004	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-155.6	167.1	179.5	-160	-118.3	0	0	0	110.9	L326 S334 F358 S364 L366 N367 M400	L326-W356 HydrophobicContact CD2-CH2 4.29Å; L326-W356 HydrophobicContact CD2-CZ2 3.48Å; L326-W356 VanDerWaalsContact CD2-CZ2 3.48Å; S334-W356 PolarHBondContact N-O 3.12Å; S334-W356 PolarHBondContact O-N 3.31Å; W356-F358 VanDerWaalsContact C-N 3.29Å; W356-F358 HydrophobicContact CB-CD1 4.01Å; W356-F358 HydrophobicContact CB-CD2 3.76Å; W356-F358 HydrophobicContact CB-CE1 3.67Å; W356-F358 HydrophobicContact CB-CE2 3.4Å; W356-F358 HydrophobicContact CB-CG 4.07Å; W356-F358 HydrophobicContact CB-CZ 3.36Å; W356-F358 HydrophobicContact CG-CD1 4.45Å; W356-F358 HydrophobicContact CG-CE1 4.23Å; W356-F358 HydrophobicContact CG-CZ 4.35Å; W356-F358 WeakPolarHBondContact O-CD2 3.33Å; W356-F358 PolarHBondContact O-N 3.4Å; W356-F358 VanDerWaalsContact O-N 3.11Å; W356-S364 PolarHBondContact NE1-O 2.93Å; W356-S364 PolarHBondContact NE1-OG 2.91Å; W356-S364 VanDerWaalsContact NE1-OG 3.14Å; W356-L366 HydrophobicContact CH2-CB 3.64Å; W356-L366 HydrophobicContact CH2-CD1 3.94Å; W356-L366 HydrophobicContact CH2-CG 3.61Å; W356-L366 HydrophobicContact CZ2-CB 4.32Å; W356-L366 HydrophobicContact CZ2-CG 3.97Å; W356-L366 HydrophobicContact CZ3-CB 3.91Å; W356-L366 HydrophobicContact CZ3-CG 4.39Å; W356-N367 HydrophobicContact CE3-CB 4.3Å; W356-M400 HydrophobicContact CH2-CE 3.84Å; W356-M400 HydrophobicContact CH2-SD 3.57Å; W356-M400 VanDerWaalsContact CH2-SD 3.57Å; W356-M400 HydrophobicContact CZ3-CE 4.49Å; W356-M400 HydrophobicContact CZ3-SD 3.84Å
357	W	97.6	Very high	96.4	Very high	2 Å²	2	31 Å²	31	1%	0.008	17%	0.17	C	C	.	.			trans	-83.4	80.1	166.3	-57	-85.1	0	0	0	109.9	W264 M302 Y309 L311 I327 A331 G332 F333 M400	W264-W357 AromaticContact CH2-CH2 3.83Å; W264-W357 HydrophobicContact CH2-CH2 3.83Å; W264-W357 HydrophobicContact CH2-CZ3 4.08Å; W264-W357 HydrophobicContact CZ2-CH2 4.27Å; M302-W357 HydrophobicContact CE-CZ2 3.78Å; M302-W357 HydrophobicContact CG-CZ2 4.34Å; M302-W357 HydrophobicContact SD-CH2 4.44Å; M302-W357 HydrophobicContact SD-CZ2 3.76Å; Y309-W357 PolarHBondContact O-NE1 3.1Å; L311-W357 HydrophobicContact CB-CD2 4.16Å; L311-W357 HydrophobicContact CB-CG 4.17Å; L311-W357 HydrophobicContact CB-CZ2 4.45Å; L311-W357 HydrophobicContact CD2-CB 3.18Å; L311-W357 HydrophobicContact CD2-CD2 3.45Å; L311-W357 VanDerWaalsContact CD2-CD2 3.45Å; L311-W357 HydrophobicContact CD2-CE3 3.99Å; L311-W357 HydrophobicContact CD2-CG 3.11Å; L311-W357 HydrophobicContact CG-CB 4.47Å; L311-W357 HydrophobicContact CG-CD2 4.41Å; L311-W357 HydrophobicContact CG-CG 4.15Å; I327-W357 WeakPolarHBondContact CD1-O 3.44Å; A331-W357 HydrophobicContact CB-CB 4.21Å; A331-W357 VanDerWaalsContact O-CD1 3.31Å; G332-W357 WeakPolarHBondContact O-CA 3.34Å; F333-W357 AromaticContact CD2-CD1 3.8Å; F333-W357 AromaticContact CD2-CD2 3.73Å; F333-W357 HydrophobicContact CD2-CD2 3.73Å; F333-W357 AromaticContact CD2-CE2 3.58Å; F333-W357 HydrophobicContact CD2-CE3 4.35Å; F333-W357 AromaticContact CD2-CG 3.89Å; F333-W357 HydrophobicContact CD2-CG 3.89Å; F333-W357 HydrophobicContact CD2-CZ2 4.1Å; F333-W357 AromaticContact CD2-NE1 3.62Å; F333-W357 HydrophobicContact CE2-CD2 4.2Å; F333-W357 HydrophobicContact CE2-CE3 4.38Å; F333-W357 HydrophobicContact CE2-CZ2 4.38Å; W357-M400 HydrophobicContact CZ3-CE 4.47Å
358	F	96.4	Very high	96.5	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	15%	0.147	C	C	.	.			trans	-80.2	149.1	179.8	-62	-72.3	0	0	0	111.3	A331 D341 C348 A349 L352 W356 C361 N365	A331-F358 WeakPolarHBondContact CB-O 3.35Å; D341-F358 HydrophobicContact CB-CB 3.76Å; C348-F358 HydrophobicContact CB-CB 3.5Å; C348-F358 HydrophobicContact CB-CD1 3.81Å; C348-F358 HydrophobicContact CB-CD2 3.86Å; C348-F358 HydrophobicContact CB-CE1 4.46Å; C348-F358 HydrophobicContact CB-CG 3.46Å; C348-F358 VanDerWaalsContact CB-CG 3.46Å; A349-F358 HydrophobicContact CB-CD2 4.26Å; A349-F358 HydrophobicContact CB-CE2 3.77Å; L352-F358 HydrophobicContact CB-CE1 4.01Å; L352-F358 HydrophobicContact CB-CZ 4.3Å; L352-F358 HydrophobicContact CD1-CD1 4.23Å; L352-F358 HydrophobicContact CD1-CE1 3.92Å; W356-F358 VanDerWaalsContact C-N 3.29Å; W356-F358 HydrophobicContact CB-CD1 4.01Å; W356-F358 HydrophobicContact CB-CD2 3.76Å; W356-F358 HydrophobicContact CB-CE1 3.67Å; W356-F358 HydrophobicContact CB-CE2 3.4Å; W356-F358 HydrophobicContact CB-CG 4.07Å; W356-F358 HydrophobicContact CB-CZ 3.36Å; W356-F358 HydrophobicContact CG-CD1 4.45Å; W356-F358 HydrophobicContact CG-CE1 4.23Å; W356-F358 HydrophobicContact CG-CZ 4.35Å; W356-F358 WeakPolarHBondContact O-CD2 3.33Å; W356-F358 PolarHBondContact O-N 3.4Å; W356-F358 VanDerWaalsContact O-N 3.11Å; F358-C361 WeakPolarHBondContact CA-O 3.27Å; F358-C361 HydrophobicContact CD1-CB 4.27Å; F358-N365 HydrophobicContact CE1-CB 4.06Å
359	D	92	Very high	96.6	Very high	58 Å²	58	28.1 Å²	28.1	31%	0.31	16%	0.16	S	C	.	.	S	Bend	trans	-106.1	-111.3	167.5	-176.2	52.6	0	0	0	108.2	I327 N342 C361	I327-D359 HydrophobicContact CD1-CB 3.46Å; I327-D359 VanDerWaalsContact CD1-CB 3.46Å; I327-D359 HydrophobicContact CG1-CB 3.85Å; N342-D359 WeakPolarHBondContact CB-OD1 3.4Å; N342-D359 PolarHBondContact N-O 3.37Å; N342-D359 PolarHBondContact ND2-OD1 2.86Å; D359-C361 PolarHBondContact N-O 2.84Å
360	A	92.1	Very high	96.6	Very high	64 Å²	64	29.6 Å²	29.6	53%	0.529	17%	0.165	S	C	.	.	S	Bend	trans	-123.9	60.7	172	0	0	0	0	0	113.5	C343	C343-A360 HydrophobicContact CB-CB 4.07Å
361	C	93.1	Very high	96.8	Very high	20 Å²	20	27.2 Å²	27.2	14%	0.135	15%	0.149	C	C	.	.	S	Bend	cis	-98.7	-1.8	-6.3	-67.1	0	0	0	0	113.1	C348 L352 F358 D359	C348-C361 WeakPolarHBondContact CA-SG 3.24Å; C348-C361 HydrophobicContact CB-CB 3.57Å; C348-C361 WeakPolarHBondContact CB-SG 3.39Å; C348-C361 WeakPolarHBondContact SG-CA 3.4Å; C348-C361 WeakPolarHBondContact SG-CB 3.46Å; C348-C361 CovalentContact SG-SG 2.03Å; C348-C361 PolarHBondContact SG-SG 3.38Å; L352-C361 HydrophobicContact CD1-CB 3.47Å; L352-C361 VanDerWaalsContact CD1-CB 3.47Å; L352-C361 HydrophobicContact CG-CB 4.37Å; F358-C361 WeakPolarHBondContact CA-O 3.27Å; F358-C361 HydrophobicContact CD1-CB 4.27Å; D359-C361 PolarHBondContact N-O 2.84Å
362	G	93.4	Very high	96.8	Very high	24 Å²	24	25.1 Å²	25.1	25%	0.247	14%	0.143	C	C	.	.			trans	96.1	179.7	-179.6	0	0	0	0	0	115.5
363	F	96	Very high	96.8	Very high	110 Å²	110	28.9 Å²	28.9	48%	0.482	17%	0.167	S	C	.	.	S	Bend	trans	-95.1	-1.7	-167.3	-65.3	-57.6	0	0	0	114.9	S325 H386	S325-F363 CarbonylContact O-C 3.54Å; F363-H386 HydrophobicContact CB-CB 3.76Å; F363-H386 HydrophobicContact CD1-CB 4.2Å; F363-H386 AromaticContact CD1-CE1 3.96Å; F363-H386 AromaticContact CD1-CG 3.85Å; F363-H386 AromaticContact CD1-ND1 3.45Å; F363-H386 WeakPolarHBondContact CD1-ND1 3.45Å; F363-H386 AromaticContact CE1-ND1 4Å; F363-H386 HydrophobicContact CG-CB 4.39Å; F363-H386 WeakPolarHBondContact O-CB 3.25Å; F363-H386 PolarHBondContact O-N 3.47Å
364	S	97.4	Very high	96.7	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.007	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	155.3	179.9	54.6	0	0	0	0	111.6	S325 W356 K384	S325-S364 VanDerWaalsContact O-CB 3.31Å; S325-S364 WeakPolarHBondContact O-CB 3.46Å; S325-S364 PolarHBondContact O-N 3.06Å; S325-S364 PolarHBondContact O-OG 3.03Å; W356-S364 PolarHBondContact NE1-O 2.93Å; W356-S364 PolarHBondContact NE1-OG 2.91Å; W356-S364 VanDerWaalsContact NE1-OG 3.14Å; S364-K384 WeakPolarHBondContact CA-O 3.42Å
365	N	98.3	Very high	96.6	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.7	100.2	162.1	-179.8	6.8	0	0	0	107.1	L352 T353 F358 N367 G368 I383 K384	L352-N365 PolarHBondContact O-ND2 3.31Å; L352-N365 VanDerWaalsContact O-ND2 3.12Å; T353-N365 PolarHBondContact O-ND2 2.94Å; F358-N365 HydrophobicContact CE1-CB 4.06Å; N365-N367 VanDerWaalsContact C-N 3.26Å; N365-N367 WeakPolarHBondContact OD1-CA 3.46Å; N365-N367 PolarHBondContact OD1-N 3.28Å; N365-G368 PolarHBondContact OD1-N 3.4Å; N365-I383 CarbonylContact O-C 3.49Å; N365-I383 WeakPolarHBondContact O-CA 3.38Å; N365-K384 HydrophobicContact CB-CG 4.2Å; N365-K384 PolarHBondContact N-O 2.97Å; N365-K384 PolarHBondContact O-N 3.45Å
366	L	98.8	Very high	96.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-5.1	178.1	-54.8	-173.8	0	0	0	112.6	Q236 R238 V283 L285 W356 I383 K384 W385 L395 T398 M400	Q236-L366 PolarHBondContact NE2-O 3.04Å; R238-L366 PolarHBondContact NH1-O 2.92Å; R238-L366 VanDerWaalsContact NH1-O 3.17Å; V283-L366 HydrophobicContact CG1-CD1 3.6Å; L285-L366 HydrophobicContact CD2-CD1 4.06Å; L285-L366 HydrophobicContact CD2-CD2 4.04Å; W356-L366 HydrophobicContact CH2-CB 3.64Å; W356-L366 HydrophobicContact CH2-CD1 3.94Å; W356-L366 HydrophobicContact CH2-CG 3.61Å; W356-L366 HydrophobicContact CZ2-CB 4.32Å; W356-L366 HydrophobicContact CZ2-CG 3.97Å; W356-L366 HydrophobicContact CZ3-CB 3.91Å; W356-L366 HydrophobicContact CZ3-CG 4.39Å; L366-I383 HydrophobicContact CD2-CG2 4.22Å; L366-K384 WeakPolarHBondContact CD2-O 3.42Å; L366-W385 HydrophobicContact CD1-CE3 4.18Å; L366-W385 HydrophobicContact CD1-CZ3 4.17Å; L366-W385 HydrophobicContact CD2-CB 4.46Å; L366-W385 HydrophobicContact CD2-CE3 3.89Å; L366-W385 HydrophobicContact CG-CE3 4.2Å; L366-W385 HydrophobicContact CG-CZ3 4.45Å; L366-L395 HydrophobicContact CD2-CD1 4.37Å; L366-T398 HydrophobicContact CB-CG2 4.46Å; L366-T398 HydrophobicContact CD1-CG2 4.43Å; L366-T398 HydrophobicContact CD2-CG2 3.98Å; L366-M400 HydrophobicContact CD1-CG 3.99Å; L366-M400 HydrophobicContact CD1-SD 3.98Å
367	N	98.8	Very high	96.5	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.005	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	9.8	-178.7	-68.5	-12.1	0	0	0	112.6	Q236 F245 W264 G355 W356 N365	Q236-N367 PolarHBondContact NE2-OD1 3.43Å; F245-N367 VanDerWaalsContact CB-O 3.25Å; F245-N367 WeakPolarHBondContact CB-O 3.3Å; F245-N367 HydrophobicContact CD1-CB 3.91Å; W264-N367 VanDerWaalsContact CZ3-ND2 3.3Å; W264-N367 WeakPolarHBondContact CZ3-ND2 3.37Å; G355-N367 WeakPolarHBondContact O-CB 3.4Å; G355-N367 PolarHBondContact O-ND2 2.92Å; W356-N367 HydrophobicContact CE3-CB 4.3Å; N365-N367 VanDerWaalsContact C-N 3.26Å; N365-N367 WeakPolarHBondContact OD1-CA 3.46Å; N365-N367 PolarHBondContact OD1-N 3.28Å
368	G	98.3	Very high	96.4	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.01	29%	0.285	C	S	.	.	S	Bend	trans	-67.9	-178	174.7	0	0	0	0	0	113.9	R238 N365 N381	R238-G368 PolarHBondContact NH1-O 3.28Å; R238-G368 PolarHBondContact NH2-O 3.43Å; N365-G368 PolarHBondContact OD1-N 3.4Å; G368-N381 WeakPolarHBondContact CA-O 3.3Å
369	I	98.3	Very high	96.4	Very high	52 Å²	52	55.2 Å²	55.2	27%	0.267	30%	0.298	S	S	.	.	B	Isolated β-bridge	trans	-61.9	135.2	177.5	-61.7	-175	0	0	0	110.2	T353 Y371 N381 G382 I383	T353-I369 HydrophobicContact CG2-CD1 4.13Å; T353-I369 HydrophobicContact CG2-CG1 4.13Å; T353-I369 WeakPolarHBondContact OG1-CG1 3.33Å; T353-I369 PolarHBondContact OG1-N 2.82Å; I369-Y371 HydrophobicContact CB-CD2 4.22Å; I369-Y371 HydrophobicContact CB-CE2 3.67Å; I369-Y371 HydrophobicContact CG2-CD2 4.04Å; I369-Y371 HydrophobicContact CG2-CE1 4.18Å; I369-Y371 HydrophobicContact CG2-CE2 3.66Å; I369-Y371 HydrophobicContact CG2-CG 4.47Å; I369-Y371 PolarHBondContact O-N 3.45Å; I369-N381 PolarHBondContact N-O 2.89Å; I369-G382 WeakPolarHBondContact O-CA 3.41Å; I369-I383 PolarHBondContact O-N 3Å
370	Y	98.6	Very high	96.6	Very high	35 Å²	35	57.5 Å²	57.5	14%	0.137	31%	0.309	C	S	.	.			trans	-79.1	110.8	173.1	-167.7	-82.5	0	0	0	110.1	F239 G241 W288 T372 I383 R396	F239-Y370 VanDerWaalsContact C-OH 3.27Å; F239-Y370 PolarHBondContact O-OH 3.45Å; G241-Y370 VanDerWaalsContact CA-CG 3.45Å; W288-Y370 AromaticContact CH2-CE1 3.83Å; W288-Y370 HydrophobicContact CH2-CE1 3.83Å; W288-Y370 AromaticContact CH2-CZ 3.87Å; W288-Y370 VanDerWaalsContact CH2-OH 3.26Å; W288-Y370 WeakPolarHBondContact CH2-OH 3.49Å; W288-Y370 AromaticContact CZ2-CE1 3.87Å; W288-Y370 HydrophobicContact CZ2-CE1 3.87Å; W288-Y370 AromaticContact CZ2-CZ 3.84Å; Y370-T372 HydrophobicContact CE1-CG2 4.33Å; Y370-I383 HydrophobicContact CD2-CD1 3.49Å; Y370-I383 VanDerWaalsContact CD2-CD1 3.49Å; Y370-I383 HydrophobicContact CE2-CD1 4.25Å; Y370-I383 HydrophobicContact CG-CD1 4.23Å; Y370-R396 WeakPolarHBondContact CE2-O 3.46Å; Y370-R396 PolarHBondContact OH-O 3.35Å
371	Y	98.5	Very high	96.8	Very high	49 Å²	49	56.2 Å²	56.2	19%	0.192	29%	0.294	C	S	.	.			trans	-104.7	127.6	174.8	-72.1	-78.6	0	0	0	110.9	W288 I369 H375 K379 N381	W288-Y371 WeakPolarHBondContact CZ2-O 3.46Å; W288-Y371 PolarHBondContact NE1-O 3.45Å; I369-Y371 HydrophobicContact CB-CD2 4.22Å; I369-Y371 HydrophobicContact CB-CE2 3.67Å; I369-Y371 HydrophobicContact CG2-CD2 4.04Å; I369-Y371 HydrophobicContact CG2-CE1 4.18Å; I369-Y371 HydrophobicContact CG2-CE2 3.66Å; I369-Y371 HydrophobicContact CG2-CG 4.47Å; I369-Y371 PolarHBondContact O-N 3.45Å; Y371-H375 HydrophobicContact CD1-CB 4.38Å; Y371-K379 HydrophobicContact CD1-CD 4.15Å; Y371-K379 HydrophobicContact CD1-CG 4.15Å; Y371-K379 HydrophobicContact CD2-CB 3.71Å; Y371-K379 HydrophobicContact CD2-CD 4.2Å; Y371-K379 HydrophobicContact CD2-CG 3.62Å; Y371-K379 HydrophobicContact CE1-CD 3.91Å; Y371-K379 HydrophobicContact CE1-CG 4.33Å; Y371-K379 HydrophobicContact CE2-CB 3.72Å; Y371-K379 HydrophobicContact CE2-CD 3.92Å; Y371-K379 HydrophobicContact CE2-CG 3.78Å; Y371-K379 HydrophobicContact CG-CB 4.39Å; Y371-K379 HydrophobicContact CG-CD 4.29Å; Y371-K379 HydrophobicContact CG-CG 3.8Å; Y371-N381 WeakPolarHBondContact CE2-OD1 3.3Å; Y371-N381 PolarHBondContact OH-ND2 3.39Å; Y371-N381 PolarHBondContact OH-OD1 3.46Å
372	T	97.3	Very high	97.1	Very high	77 Å²	77	55.3 Å²	55.3	47%	0.472	29%	0.287	S	S	.	.			trans	-70.8	163.2	176.7	53.5	0	0	0	0	112.4	W288 Y370 G374 H375 N376	W288-T372 HydrophobicContact CH2-CG2 4.49Å; Y370-T372 HydrophobicContact CE1-CG2 4.33Å; T372-G374 PolarHBondContact O-N 2.91Å; T372-H375 CarbonylContact O-C 3.56Å; T372-H375 WeakPolarHBondContact O-CA 3.33Å; T372-H375 PolarHBondContact O-N 2.88Å; T372-N376 PolarHBondContact O-N 2.67Å; T372-N376 VanDerWaalsContact O-N 3.15Å
373	V	95.6	Very high	97.3	Very high	96 Å²	96	54.1 Å²	54.1	58%	0.582	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.5	139.1	172.4	64.4	0	0	0	0	111.6	W288 H375	W288-V373 HydrophobicContact CB-CB 4.46Å; W288-V373 HydrophobicContact CB-CG2 4.32Å; W288-V373 HydrophobicContact CD2-CB 3.88Å; W288-V373 HydrophobicContact CE3-CB 3.59Å; W288-V373 HydrophobicContact CE3-CG1 4.27Å; W288-V373 HydrophobicContact CG-CB 4.26Å; W288-V373 HydrophobicContact CZ3-CB 4.14Å; W288-V373 HydrophobicContact CZ3-CG1 4.43Å; V373-H375 PolarHBondContact O-N 3.33Å
374	G	95.1	Very high	97.4	Very high	66 Å²	66	49.6 Å²	49.6	68%	0.68	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.6	-21.4	-174.4	0	0	0	0	0	113.8	T372 N376	T372-G374 PolarHBondContact O-N 2.91Å; G374-N376 PolarHBondContact N-OD1 3.34Å; G374-N376 VanDerWaalsContact N-OD1 3.16Å
375	H	96.4	Very high	97.4	Very high	117 Å²	117	49.6 Å²	49.6	54%	0.542	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	1.8	175.4	-59.9	91.1	0	0	0	112.9	Y371 T372 V373 K379	Y371-H375 HydrophobicContact CD1-CB 4.38Å; T372-H375 CarbonylContact O-C 3.56Å; T372-H375 WeakPolarHBondContact O-CA 3.33Å; T372-H375 PolarHBondContact O-N 2.88Å; V373-H375 PolarHBondContact O-N 3.33Å; H375-K379 WeakPolarHBondContact O-CE 3.36Å; H375-K379 WeakPolarHBondContact O-CG 3.37Å
376	N	96.5	Very high	97.4	Very high	5 Å²	5	52.3 Å²	52.3	3%	0.027	27%	0.268	C	S	.	.			trans	-83.9	-7.6	-172.6	64.2	-64.5	0	0	0	114.7	W288 T372 G374 Y393 S394	W288-N376 VanDerWaalsContact CD1-CG 3.47Å; T372-N376 PolarHBondContact O-N 2.67Å; T372-N376 VanDerWaalsContact O-N 3.15Å; G374-N376 PolarHBondContact N-OD1 3.34Å; G374-N376 VanDerWaalsContact N-OD1 3.16Å; N376-Y393 VanDerWaalsContact ND2-CE2 3.35Å; N376-Y393 WeakPolarHBondContact ND2-CE2 3.39Å; N376-Y393 PolarHBondContact ND2-OH 3.47Å; N376-S394 WeakPolarHBondContact CB-O 3.4Å; N376-S394 PolarHBondContact O-N 3.36Å
377	I	97.2	Very high	97.4	Very high	106 Å²	106	54.7 Å²	54.7	54%	0.544	28%	0.279	S	S	.	.	B	Isolated β-bridge	trans	-97.2	146.4	-177.6	-47.3	179	0	0	0	110	K379 S392	I377-K379 VanDerWaalsContact C-N 3.31Å; I377-K379 PolarHBondContact O-N 2.86Å; I377-S392 CarbonylContact C-O 3.55Å
378	R	96.4	Very high	97.3	Very high	216 Å²	216	56.5 Å²	56.5	82%	0.815	29%	0.287	S	S	*	.	S	Bend	trans	61.1	34	-177.4	-58.1	-176.9	179.6	171.5	-1.5	113.3	S392	R378-S392 WeakPolarHBondContact CA-O 3.45Å; R378-S392 PolarHBondContact N-O 2.84Å
379	K	96.6	Very high	97.3	Very high	61 Å²	61	60.1 Å²	60.1	27%	0.265	30%	0.3	S	S	.	.			trans	-108.3	98.3	179.2	-57.7	-55.1	-177.5	-173.3	0	110.9	Y371 H375 I377 N381 G382 S392	Y371-K379 HydrophobicContact CD1-CD 4.15Å; Y371-K379 HydrophobicContact CD1-CG 4.15Å; Y371-K379 HydrophobicContact CD2-CB 3.71Å; Y371-K379 HydrophobicContact CD2-CD 4.2Å; Y371-K379 HydrophobicContact CD2-CG 3.62Å; Y371-K379 HydrophobicContact CE1-CD 3.91Å; Y371-K379 HydrophobicContact CE1-CG 4.33Å; Y371-K379 HydrophobicContact CE2-CB 3.72Å; Y371-K379 HydrophobicContact CE2-CD 3.92Å; Y371-K379 HydrophobicContact CE2-CG 3.78Å; Y371-K379 HydrophobicContact CG-CB 4.39Å; Y371-K379 HydrophobicContact CG-CD 4.29Å; Y371-K379 HydrophobicContact CG-CG 3.8Å; H375-K379 WeakPolarHBondContact O-CE 3.36Å; H375-K379 WeakPolarHBondContact O-CG 3.37Å; I377-K379 VanDerWaalsContact C-N 3.31Å; I377-K379 PolarHBondContact O-N 2.86Å; K379-N381 VanDerWaalsContact C-N 3.33Å; K379-G382 PolarHBondContact O-N 3.41Å; K379-S392 PolarHBondContact N-O 3.47Å
380	L	95.6	Very high	97.2	Very high	106 Å²	106	58.6 Å²	58.6	56%	0.555	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-30.9	-179.7	-65.2	176.2	0	0	0	112.9	L352 K384	L352-L380 HydrophobicContact CD2-CB 4.4Å; L352-L380 WeakPolarHBondContact CD2-O 3.47Å; L380-K384 PolarHBondContact O-NZ 2.86Å
381	N	97.4	Very high	97.1	Very high	38 Å²	38	60 Å²	60	20%	0.203	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	11.9	178.1	64.5	-18.1	0	0	0	113.4	L352 T353 G368 I369 Y371 K379	L352-N381 CarbonylContact O-C 3.56Å; L352-N381 VanDerWaalsContact O-CA 3.3Å; L352-N381 WeakPolarHBondContact O-CA 3.37Å; L352-N381 WeakPolarHBondContact O-CB 3.48Å; T353-N381 HydrophobicContact CG2-CB 4.23Å; T353-N381 PolarHBondContact OG1-O 3.22Å; G368-N381 WeakPolarHBondContact CA-O 3.3Å; I369-N381 PolarHBondContact N-O 2.89Å; Y371-N381 WeakPolarHBondContact CE2-OD1 3.3Å; Y371-N381 PolarHBondContact OH-ND2 3.39Å; Y371-N381 PolarHBondContact OH-OD1 3.46Å; K379-N381 VanDerWaalsContact C-N 3.33Å
382	G	98	Very high	96.9	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.314	C	S	.	.	B	Isolated β-bridge	trans	-82.3	-174.7	176.7	0	0	0	0	0	113.2	I369 K379 K384	I369-G382 WeakPolarHBondContact O-CA 3.41Å; K379-G382 PolarHBondContact O-N 3.41Å; G382-K384 PolarHBondContact O-N 2.98Å; G382-K384 VanDerWaalsContact O-N 3.16Å
383	I	98.6	Very high	97	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.296	C	S	.	.	S	Bend	trans	-77.1	95.5	174.1	-58.2	176.4	0	0	0	108.9	R238 N365 L366 I369 Y370 S394 L395 T398	R238-I383 HydrophobicContact CB-CD1 3.99Å; R238-I383 HydrophobicContact CG-CD1 4.23Å; N365-I383 CarbonylContact O-C 3.49Å; N365-I383 WeakPolarHBondContact O-CA 3.38Å; L366-I383 HydrophobicContact CD2-CG2 4.22Å; I369-I383 PolarHBondContact O-N 3Å; Y370-I383 HydrophobicContact CD2-CD1 3.49Å; Y370-I383 VanDerWaalsContact CD2-CD1 3.49Å; Y370-I383 HydrophobicContact CE2-CD1 4.25Å; Y370-I383 HydrophobicContact CG-CD1 4.23Å; I383-S394 PolarHBondContact N-OG 2.98Å; I383-S394 VanDerWaalsContact N-OG 3.09Å; I383-S394 CarbonylContact O-C 3.58Å; I383-S394 VanDerWaalsContact O-CA 3.32Å; I383-S394 WeakPolarHBondContact O-CA 3.37Å; I383-L395 HydrophobicContact CB-CB 4.48Å; I383-L395 HydrophobicContact CG2-CB 4.03Å; I383-L395 WeakPolarHBondContact O-CG 3.47Å; I383-L395 PolarHBondContact O-N 3.4Å; I383-T398 HydrophobicContact CG2-CG2 3.46Å; I383-T398 VanDerWaalsContact CG2-CG2 3.46Å
384	K	97.9	Very high	97.1	Very high	15 Å²	15	52.2 Å²	52.2	7%	0.065	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	143.8	-169.5	71.6	-179.8	-179.4	-172.7	0	114.2	S364 N365 L366 L380 G382 P391	S364-K384 WeakPolarHBondContact CA-O 3.42Å; N365-K384 HydrophobicContact CB-CG 4.2Å; N365-K384 PolarHBondContact N-O 2.97Å; N365-K384 PolarHBondContact O-N 3.45Å; L366-K384 WeakPolarHBondContact CD2-O 3.42Å; L380-K384 PolarHBondContact O-NZ 2.86Å; G382-K384 PolarHBondContact O-N 2.98Å; G382-K384 VanDerWaalsContact O-N 3.16Å; K384-P391 VanDerWaalsContact CD-O 3.32Å; K384-P391 WeakPolarHBondContact CD-O 3.27Å
385	W	98.4	Very high	97.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	99.1	167.9	-165.4	-95.1	0	0	0	109.4	V283 L285 S295 Y297 A320 S325 L326 L366 H387 F388 R389 L395	V283-W385 HydrophobicContact CG1-CH2 4.48Å; V283-W385 HydrophobicContact CG1-CZ3 4.37Å; V283-W385 HydrophobicContact CG2-CH2 4.49Å; L285-W385 HydrophobicContact CD1-CB 3.79Å; L285-W385 HydrophobicContact CD1-CD2 3.83Å; L285-W385 HydrophobicContact CD1-CG 3.43Å; L285-W385 VanDerWaalsContact CD1-CG 3.43Å; S295-W385 WeakPolarHBondContact OG-CZ2 3.31Å; Y297-W385 WeakPolarHBondContact OH-CH2 3.47Å; Y297-W385 WeakPolarHBondContact OH-CZ2 3.43Å; A320-W385 PolarHBondContact O-NE1 3.26Å; A320-W385 VanDerWaalsContact O-NE1 3.08Å; S325-W385 VanDerWaalsContact CB-CE2 3.43Å; S325-W385 VanDerWaalsContact OG-CD1 3.3Å; S325-W385 PolarHBondContact OG-NE1 2.94Å; L326-W385 HydrophobicContact CB-CH2 4.4Å; L326-W385 HydrophobicContact CD1-CH2 3.81Å; L326-W385 HydrophobicContact CD1-CZ3 4.24Å; L326-W385 HydrophobicContact CD2-CZ3 4.43Å; L326-W385 HydrophobicContact CG-CH2 3.59Å; L326-W385 HydrophobicContact CG-CZ3 3.82Å; L366-W385 HydrophobicContact CD1-CE3 4.18Å; L366-W385 HydrophobicContact CD1-CZ3 4.17Å; L366-W385 HydrophobicContact CD2-CB 4.46Å; L366-W385 HydrophobicContact CD2-CE3 3.89Å; L366-W385 HydrophobicContact CG-CE3 4.2Å; L366-W385 HydrophobicContact CG-CZ3 4.45Å; W385-H387 PolarHBondContact O-N 3.44Å; W385-F388 HydrophobicContact CB-CB 4.41Å; W385-F388 HydrophobicContact CG-CB 4.4Å; W385-F388 PolarHBondContact O-N 2.87Å; W385-F388 VanDerWaalsContact O-N 3.08Å; W385-R389 PolarHBondContact O-N 3.37Å; W385-R389 VanDerWaalsContact O-N 3.16Å; W385-L395 HydrophobicContact CB-CD1 3.99Å
386	H	97.6	Very high	97.4	Very high	57 Å²	57	46 Å²	46	26%	0.264	22%	0.219	S	C	.	.	H	α-helix	trans	-54.4	-48.2	-167	-179.2	-120.2	0	0	0	113.5	S325 F363 F388 G390	S325-H386 PolarHBondContact OG-N 2.88Å; F363-H386 HydrophobicContact CB-CB 3.76Å; F363-H386 HydrophobicContact CD1-CB 4.2Å; F363-H386 AromaticContact CD1-CE1 3.96Å; F363-H386 AromaticContact CD1-CG 3.85Å; F363-H386 AromaticContact CD1-ND1 3.45Å; F363-H386 WeakPolarHBondContact CD1-ND1 3.45Å; F363-H386 AromaticContact CE1-ND1 4Å; F363-H386 HydrophobicContact CG-CB 4.39Å; F363-H386 WeakPolarHBondContact O-CB 3.25Å; F363-H386 PolarHBondContact O-N 3.47Å; H386-F388 PolarHBondContact O-N 2.89Å; H386-G390 WeakPolarHBondContact O-CA 3.24Å; H386-G390 PolarHBondContact O-N 2.81Å
387	H	97.6	Very high	97.5	Very high	51 Å²	51	47.1 Å²	47.1	24%	0.236	23%	0.227	C	C	.	.	H	α-helix	trans	-76.6	-1.4	-175.3	-65	-70.1	0	0	0	114.4	G321 Q323 S324 S325 W385	G321-H387 VanDerWaalsContact CA-O 3.27Å; G321-H387 WeakPolarHBondContact CA-O 3.47Å; Q323-H387 PolarHBondContact O-CD2 2.95Å; Q323-H387 PolarHBondContact OE1-CE1 3.46Å; S324-H387 PolarHBondContact O-CD2 2.85Å; S325-H387 PolarHBondContact OG-CD2 2.88Å; S325-H387 PolarHBondContact OG-N 2.96Å; S325-H387 VanDerWaalsContact OG-N 3.12Å; W385-H387 PolarHBondContact O-N 3.44Å
388	F	98.1	Very high	97.6	Very high	39 Å²	39	42.3 Å²	42.3	17%	0.171	20%	0.203	C	C	.	.	H	α-helix	trans	-101.7	-55.4	171.2	176.4	-141	0	0	0	112.3	L285 D287 I291 A293 A320 W385 H386 L395	L285-F388 HydrophobicContact CB-CD1 4.13Å; L285-F388 HydrophobicContact CB-CE1 4.22Å; L285-F388 HydrophobicContact CD1-CB 4.43Å; L285-F388 HydrophobicContact CD1-CD1 4.12Å; D287-F388 HydrophobicContact CB-CE1 4.38Å; D287-F388 HydrophobicContact CB-CZ 4.45Å; I291-F388 HydrophobicContact CG2-CE2 4.31Å; I291-F388 HydrophobicContact CG2-CZ 4.23Å; I291-F388 WeakPolarHBondContact O-CZ 3.26Å; A293-F388 HydrophobicContact CB-CD1 4.31Å; A293-F388 HydrophobicContact CB-CD2 3.75Å; A293-F388 HydrophobicContact CB-CE1 4.18Å; A293-F388 HydrophobicContact CB-CE2 3.6Å; A293-F388 HydrophobicContact CB-CG 4.12Å; A293-F388 HydrophobicContact CB-CZ 3.83Å; A320-F388 HydrophobicContact CB-CB 4.25Å; W385-F388 HydrophobicContact CB-CB 4.41Å; W385-F388 HydrophobicContact CG-CB 4.4Å; W385-F388 PolarHBondContact O-N 2.87Å; W385-F388 VanDerWaalsContact O-N 3.08Å; H386-F388 PolarHBondContact O-N 2.89Å; F388-L395 HydrophobicContact CD1-CD2 3.79Å; F388-L395 HydrophobicContact CE1-CD2 3.82Å
389	R	97.7	Very high	97.7	Very high	76 Å²	76	32.9 Å²	32.9	29%	0.287	17%	0.17	S	C	.	.	H	α-helix	trans	-124.8	9.5	-173.7	-67.8	-71.7	163	164.6	-1.8	114.8	D287 I291 W385 Y393 L395	D287-R389 HydrophobicContact CB-CG 4.42Å; D287-R389 IonicContact OD2-CZ 2.73Å; D287-R389 IonicContact OD2-NE 3.32Å; D287-R389 PolarHBondContact OD2-NE 2.97Å; D287-R389 IonicContact OD2-NH1 3.03Å; D287-R389 PolarHBondContact OD2-NH1 3.09Å; D287-R389 IonicContact OD2-NH2 2.59Å; D287-R389 PolarHBondContact OD2-NH2 3.49Å; I291-R389 VanDerWaalsContact CB-NH2 3.32Å; W385-R389 PolarHBondContact O-N 3.37Å; W385-R389 VanDerWaalsContact O-N 3.16Å; R389-Y393 HydrophobicContact CB-CD1 3.73Å; R389-Y393 HydrophobicContact CB-CD2 4.42Å; R389-Y393 HydrophobicContact CB-CG 3.69Å; R389-Y393 HydrophobicContact CG-CD1 4.01Å; R389-Y393 HydrophobicContact CG-CE1 4.33Å; R389-Y393 HydrophobicContact CG-CG 4.31Å; R389-Y393 WeakPolarHBondContact O-CB 3.22Å; R389-L395 HydrophobicContact CB-CD2 4.44Å; R389-L395 HydrophobicContact CG-CD2 3.99Å
390	G	96.6	Very high	97.8	Very high	20 Å²	20	30 Å²	30	21%	0.206	16%	0.157	C	C	.	.			trans	83.6	-178.8	-177.5	0	0	0	0	0	113.5	H386 S392	H386-G390 WeakPolarHBondContact O-CA 3.24Å; H386-G390 PolarHBondContact O-N 2.81Å; G390-S392 VanDerWaalsContact C-N 3.31Å; G390-S392 PolarHBondContact O-N 3Å
391	P	95.1	Very high	97.9	Very high	65 Å²	65	25 Å²	25	42%	0.422	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-11.6	-163.7	28	-33.4	0	0	0	114.2	K384	K384-P391 VanDerWaalsContact CD-O 3.32Å; K384-P391 WeakPolarHBondContact CD-O 3.27Å
392	S	95.8	Very high	98	Very high	36 Å²	36	23.2 Å²	23.2	25%	0.252	12%	0.122	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.2	18.3	-167.7	68.7	0	0	0	0	113.6	I377 R378 K379 G390	I377-S392 CarbonylContact C-O 3.55Å; R378-S392 WeakPolarHBondContact CA-O 3.45Å; R378-S392 PolarHBondContact N-O 2.84Å; K379-S392 PolarHBondContact N-O 3.47Å; G390-S392 VanDerWaalsContact C-N 3.31Å; G390-S392 PolarHBondContact O-N 3Å
393	Y	98.2	Very high	98	Very high	23 Å²	23	25.1 Å²	25.1	9%	0.09	13%	0.129	C	C	.	.	B	Isolated β-bridge	trans	-100.6	122.3	171.9	-173.4	-73.5	0	0	0	108.5	D287 W288 E289 N376 R389 L395	D287-Y393 HydrophobicContact CB-CE1 3.9Å; W288-Y393 WeakPolarHBondContact CB-OH 3.34Å; W288-Y393 PolarHBondContact N-OH 3.24Å; E289-Y393 PolarHBondContact OE2-OH 3.24Å; N376-Y393 VanDerWaalsContact ND2-CE2 3.35Å; N376-Y393 WeakPolarHBondContact ND2-CE2 3.39Å; N376-Y393 PolarHBondContact ND2-OH 3.47Å; R389-Y393 HydrophobicContact CB-CD1 3.73Å; R389-Y393 HydrophobicContact CB-CD2 4.42Å; R389-Y393 HydrophobicContact CB-CG 3.69Å; R389-Y393 HydrophobicContact CG-CD1 4.01Å; R389-Y393 HydrophobicContact CG-CE1 4.33Å; R389-Y393 HydrophobicContact CG-CG 4.31Å; R389-Y393 WeakPolarHBondContact O-CB 3.22Å; Y393-L395 HydrophobicContact CD1-CD2 4.17Å; Y393-L395 HydrophobicContact CE1-CD2 4.27Å
394	S	98.6	Very high	97.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.134	C	C	.	.	P	Polyproline II helix	trans	-87.3	120.1	174.7	-169.1	0	0	0	0	110.3	W288 N376 I383	W288-S394 VanDerWaalsContact CD1-O 3.31Å; W288-S394 PolarHBondContact NE1-O 2.85Å; N376-S394 WeakPolarHBondContact CB-O 3.4Å; N376-S394 PolarHBondContact O-N 3.36Å; I383-S394 PolarHBondContact N-OG 2.98Å; I383-S394 VanDerWaalsContact N-OG 3.09Å; I383-S394 CarbonylContact O-C 3.58Å; I383-S394 VanDerWaalsContact O-CA 3.32Å; I383-S394 WeakPolarHBondContact O-CA 3.37Å
395	L	98.7	Very high	97.7	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.154	C	C	.	.	P	Polyproline II helix	trans	-68.7	158.3	-179.1	-63.7	172.3	0	0	0	112	L285 D287 L366 I383 W385 F388 R389 Y393 T398	L285-L395 HydrophobicContact CB-CD1 4.18Å; L285-L395 HydrophobicContact CD1-CD1 4.46Å; L285-L395 HydrophobicContact CD2-CD1 3.77Å; L285-L395 HydrophobicContact CG-CD1 4.36Å; D287-L395 HydrophobicContact CB-CD2 4.47Å; L366-L395 HydrophobicContact CD2-CD1 4.37Å; I383-L395 HydrophobicContact CB-CB 4.48Å; I383-L395 HydrophobicContact CG2-CB 4.03Å; I383-L395 WeakPolarHBondContact O-CG 3.47Å; I383-L395 PolarHBondContact O-N 3.4Å; W385-L395 HydrophobicContact CB-CD1 3.99Å; F388-L395 HydrophobicContact CD1-CD2 3.79Å; F388-L395 HydrophobicContact CE1-CD2 3.82Å; R389-L395 HydrophobicContact CB-CD2 4.44Å; R389-L395 HydrophobicContact CG-CD2 3.99Å; Y393-L395 HydrophobicContact CD1-CD2 4.17Å; Y393-L395 HydrophobicContact CE1-CD2 4.27Å; L395-T398 HydrophobicContact CB-CG2 4.36Å; L395-T398 HydrophobicContact CD1-CG2 4.08Å
396	R	98.6	Very high	97.4	Very high	52 Å²	52	37.2 Å²	37.2	20%	0.196	19%	0.187	C	C	.	.	S	Bend	trans	-84.8	-42.4	178.3	179.3	173.6	172.8	-96.7	-11.3	111.7	F239 Q286 D287 W288 R290 Y370	F239-R396 WeakPolarHBondContact CA-O 3.41Å; Q286-R396 PolarHBondContact O-N 2.84Å; D287-R396 VanDerWaalsContact O-CB 3.29Å; D287-R396 WeakPolarHBondContact O-CB 3.38Å; W288-R396 HydrophobicContact CD2-CB 3.7Å; W288-R396 HydrophobicContact CD2-CG 3.94Å; W288-R396 HydrophobicContact CE3-CB 4.06Å; W288-R396 HydrophobicContact CE3-CG 3.76Å; W288-R396 HydrophobicContact CG-CB 4.02Å; W288-R396 HydrophobicContact CH2-CB 4.47Å; W288-R396 HydrophobicContact CH2-CG 4Å; W288-R396 HydrophobicContact CZ2-CB 4.09Å; W288-R396 HydrophobicContact CZ2-CG 4.12Å; W288-R396 HydrophobicContact CZ3-CB 4.46Å; W288-R396 HydrophobicContact CZ3-CG 3.82Å; R290-R396 VanDerWaalsContact NH1-NH2 3.11Å; Y370-R396 WeakPolarHBondContact CE2-O 3.46Å; Y370-R396 PolarHBondContact OH-O 3.35Å
397	S	98.7	Very high	97	Very high	29 Å²	29	38 Å²	38	20%	0.203	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	150.3	174.7	63.6	0	0	0	0	112.8	R238 Q286	R238-S397 CarbonylContact O-C 3.52Å; R238-S397 WeakPolarHBondContact O-CA 3.49Å; R238-S397 WeakPolarHBondContact O-CB 3.5Å; Q286-S397 WeakPolarHBondContact CB-OG 3.35Å; Q286-S397 PolarHBondContact N-O 3.2Å; Q286-S397 PolarHBondContact O-N 3.17Å; Q286-S397 VanDerWaalsContact O-N 3.17Å
398	T	98.8	Very high	97	Very high	4 Å²	4	37.4 Å²	37.4	3%	0.025	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	145.2	177	68.1	0	0	0	0	109.8	Q236 R237 R238 E284 L285 L366 I383 L395	Q236-T398 PolarHBondContact NE2-OG1 2.89Å; Q236-T398 PolarHBondContact OE1-OG1 3.23Å; R237-T398 WeakPolarHBondContact CA-O 3.32Å; R238-T398 WeakPolarHBondContact CB-OG1 3.33Å; R238-T398 WeakPolarHBondContact CG-OG1 3.45Å; R238-T398 PolarHBondContact N-O 2.97Å; R238-T398 PolarHBondContact O-N 3.45Å; E284-T398 CarbonylContact O-C 3.59Å; E284-T398 VanDerWaalsContact O-CA 3.25Å; E284-T398 WeakPolarHBondContact O-CA 3.4Å; L285-T398 HydrophobicContact CD2-CG2 3.88Å; L366-T398 HydrophobicContact CB-CG2 4.46Å; L366-T398 HydrophobicContact CD1-CG2 4.43Å; L366-T398 HydrophobicContact CD2-CG2 3.98Å; I383-T398 HydrophobicContact CG2-CG2 3.46Å; I383-T398 VanDerWaalsContact CG2-CG2 3.46Å; L395-T398 HydrophobicContact CB-CG2 4.36Å; L395-T398 HydrophobicContact CD1-CG2 4.08Å
399	S	98.8	Very high	96.9	Very high	18 Å²	18	37.3 Å²	37.3	13%	0.126	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	126.4	168.1	-170	0	0	0	0	108.8	Q236 V283 E284	Q236-S399 CarbonylContact O-C 3.12Å; Q236-S399 WeakPolarHBondContact O-CA 3.38Å; V283-S399 CarbonylContact C-O 3.56Å; V283-S399 WeakPolarHBondContact CA-O 3.17Å; E284-S399 PolarHBondContact N-O 3.35Å; E284-S399 PolarHBondContact O-N 3Å
400	M	98.8	Very high	96.9	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	130.5	172.2	-51.5	-178.9	77.3	0	0	109.3	F235 Q236 L281 R282 V283 L326 W356 W357 L366	F235-M400 HydrophobicContact CD1-CB 4.16Å; F235-M400 VanDerWaalsContact CD1-O 3.26Å; F235-M400 WeakPolarHBondContact CD1-O 3.41Å; F235-M400 HydrophobicContact CD2-CB 4.28Å; F235-M400 VanDerWaalsContact CE1-C 3.49Å; F235-M400 HydrophobicContact CE1-CB 3.51Å; F235-M400 HydrophobicContact CE2-CB 3.66Å; F235-M400 HydrophobicContact CE2-CE 4.16Å; F235-M400 HydrophobicContact CE2-CG 4.39Å; F235-M400 HydrophobicContact CE2-SD 3.85Å; F235-M400 HydrophobicContact CZ-CB 3.25Å; F235-M400 HydrophobicContact CZ-CE 3.75Å; F235-M400 HydrophobicContact CZ-CG 4.19Å; F235-M400 HydrophobicContact CZ-SD 3.94Å; F235-M400 PolarHBondContact N-O 2.99Å; Q236-M400 HydrophobicContact CB-CB 3.96Å; Q236-M400 HydrophobicContact CB-CG 4.05Å; Q236-M400 HydrophobicContact CB-SD 4.19Å; Q236-M400 PolarHBondContact N-O 3.25Å; Q236-M400 PolarHBondContact O-N 3.15Å; L281-M400 HydrophobicContact CD1-CB 4.42Å; L281-M400 HydrophobicContact CD1-CE 4.32Å; L281-M400 HydrophobicContact CD2-CE 4.3Å; R282-M400 WeakPolarHBondContact O-CA 3.47Å; V283-M400 HydrophobicContact CG1-CG 4.28Å; V283-M400 HydrophobicContact CG2-CE 3.9Å; V283-M400 HydrophobicContact CG2-CG 4.27Å; L326-M400 HydrophobicContact CD1-CE 4.31Å; W356-M400 HydrophobicContact CH2-CE 3.84Å; W356-M400 HydrophobicContact CH2-SD 3.57Å; W356-M400 VanDerWaalsContact CH2-SD 3.57Å; W356-M400 HydrophobicContact CZ3-CE 4.49Å; W356-M400 HydrophobicContact CZ3-SD 3.84Å; W357-M400 HydrophobicContact CZ3-CE 4.47Å; L366-M400 HydrophobicContact CD1-CG 3.99Å; L366-M400 HydrophobicContact CD1-SD 3.98Å
401	M	98.8	Very high	96.9	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	147.6	-171.5	64.2	-172.9	86.9	0	0	111.8	W232 T233 V234 R282 E284	W232-M401 HydrophobicContact CB-CB 4.02Å; W232-M401 HydrophobicContact CB-CG 3.99Å; W232-M401 HydrophobicContact CB-SD 3.58Å; W232-M401 VanDerWaalsContact CB-SD 3.58Å; W232-M401 HydrophobicContact CD2-CG 3.82Å; W232-M401 HydrophobicContact CD2-SD 3.7Å; W232-M401 HydrophobicContact CE3-CB 4.23Å; W232-M401 HydrophobicContact CE3-CG 3.59Å; W232-M401 HydrophobicContact CE3-SD 4.14Å; W232-M401 HydrophobicContact CG-CG 4Å; W232-M401 HydrophobicContact CG-SD 3.44Å; W232-M401 HydrophobicContact CZ3-CG 4.36Å; T233-M401 CarbonylContact O-C 3.57Å; T233-M401 VanDerWaalsContact O-CA 3.22Å; T233-M401 WeakPolarHBondContact O-CA 3.28Å; V234-M401 HydrophobicContact CG2-CB 4.13Å; R282-M401 HydrophobicContact CB-CG 3.81Å; R282-M401 HydrophobicContact CB-SD 4.46Å; R282-M401 HydrophobicContact CG-CG 4.43Å; R282-M401 PolarHBondContact N-O 3.05Å; R282-M401 PolarHBondContact O-N 3.17Å; E284-M401 HydrophobicContact CB-CE 4.38Å; E284-M401 HydrophobicContact CG-CE 3.73Å
402	V	98.5	Very high	97	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	151.4	-179.9	-65.1	0	0	0	0	111.7	T233 F235 L270 Y279 S280 L281 F300	T233-V402 PolarHBondContact N-O 2.96Å; T233-V402 PolarHBondContact O-N 3.25Å; F235-V402 HydrophobicContact CD1-CG1 4.05Å; F235-V402 HydrophobicContact CE1-CG1 3.81Å; L270-V402 HydrophobicContact CD1-CG1 4.06Å; L270-V402 HydrophobicContact CD1-CG2 4Å; Y279-V402 HydrophobicContact CD1-CB 4.15Å; Y279-V402 HydrophobicContact CD1-CG2 4.29Å; S280-V402 VanDerWaalsContact O-CA 3.24Å; S280-V402 WeakPolarHBondContact O-CA 3.48Å; L281-V402 HydrophobicContact CD1-CG1 4.26Å; F300-V402 HydrophobicContact CD1-CG1 3.52Å; F300-V402 HydrophobicContact CE1-CG1 3.68Å
403	R	97.6	Very high	97.1	Very high	40 Å²	40	34.1 Å²	34.1	15%	0.151	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	146.1	177.3	-173.6	173	76.5	-175	2.2	109.4	A195 S228 G230 G231 W232 Y279 S280 Y405 F407	A195-R403 HydrophobicContact CB-CG 4.15Å; S228-R403 PolarHBondContact O-NH1 3.38Å; S228-R403 VanDerWaalsContact O-NH1 3.09Å; G230-R403 VanDerWaalsContact O-CD 3.23Å; G230-R403 WeakPolarHBondContact O-CD 3.49Å; G230-R403 PolarHBondContact O-NH1 3.13Å; G231-R403 WeakPolarHBondContact O-CG 3.49Å; W232-R403 HydrophobicContact CD2-CB 3.93Å; W232-R403 HydrophobicContact CE3-CB 3.36Å; W232-R403 HydrophobicContact CE3-CG 4.46Å; W232-R403 HydrophobicContact CH2-CB 4.08Å; W232-R403 VanDerWaalsContact CZ2-CZ 3.44Å; W232-R403 HydrophobicContact CZ3-CB 3.44Å; W232-R403 VanDerWaalsContact CZ3-CB 3.44Å; Y279-R403 CarbonylContact C-O 3.57Å; Y279-R403 WeakPolarHBondContact CA-O 3.26Å; Y279-R403 VanDerWaalsContact CD1-C 3.41Å; S280-R403 PolarHBondContact N-O 3.41Å; S280-R403 PolarHBondContact O-N 3.09Å; S280-R403 VanDerWaalsContact O-N 3.14Å; R403-Y405 PolarHBondContact O-N 3.27Å; R403-F407 VanDerWaalsContact CD-CG 3.43Å; R403-F407 HydrophobicContact CG-CB 3.86Å; R403-F407 HydrophobicContact CG-CD1 4.5Å; R403-F407 HydrophobicContact CG-CD2 4.08Å; R403-F407 HydrophobicContact CG-CG 3.89Å; R403-F407 VanDerWaalsContact NE-CD1 3.31Å
404	P	97.1	Very high	97	Very high	17 Å²	17	34.9 Å²	34.9	11%	0.11	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-50	140.9	172.2	-28	36.6	0	0	0	111.7	D193 A195 Y279 D406 F407	D193-P404 VanDerWaalsContact OD2-CG 3.25Å; D193-P404 WeakPolarHBondContact OD2-CG 3.28Å; A195-P404 HydrophobicContact CB-CG 3.98Å; Y279-P404 HydrophobicContact CD1-CG 4.39Å; Y279-P404 HydrophobicContact CE1-CG 3.78Å; P404-D406 VanDerWaalsContact C-N 3.3Å; P404-D406 WeakPolarHBondContact CB-OD1 3.43Å; P404-D406 PolarHBondContact O-N 3.35Å; P404-F407 WeakPolarHBondContact O-CB 3.47Å; P404-F407 PolarHBondContact O-N 2.96Å
405	Y	94.6	Very high	96.9	Very high	123 Å²	123	37.6 Å²	37.6	48%	0.482	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-33.9	-176.2	175.7	-103.7	0	0	0	112.6	Q278 S280 D298 R403 F407	Q278-Y405 HydrophobicContact CG-CG 4.35Å; Q278-Y405 PolarHBondContact O-N 2.91Å; S280-Y405 WeakPolarHBondContact OG-CD2 3.49Å; D298-Y405 HydrophobicContact CB-CD2 4.08Å; D298-Y405 HydrophobicContact CB-CE2 3.62Å; D298-Y405 WeakPolarHBondContact O-CD2 3.17Å; R403-Y405 PolarHBondContact O-N 3.27Å; Y405-F407 VanDerWaalsContact C-N 3.25Å; Y405-F407 PolarHBondContact O-N 3.43Å
406	D	91.5	Very high	96.7	Very high	130 Å²	130	40.8 Å²	40.8	70%	0.695	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	21.5	179.4	65.3	-25.8	0	0	0	113.5	P404	P404-D406 VanDerWaalsContact C-N 3.3Å; P404-D406 WeakPolarHBondContact CB-OD1 3.43Å; P404-D406 PolarHBondContact O-N 3.35Å
407	F	89.3	Confident	96.6	Very high	74 Å²	74	39.7 Å²	39.7	33%	0.325	19%	0.193	S	C	.	.			trans	-55.3	0	-176.9	175.6	-104.9	0	0	0	113.6	A195 Y198 K199 R403 P404 Y405	A195-F407 HydrophobicContact CB-CD2 3.52Å; A195-F407 HydrophobicContact CB-CE2 3.75Å; Y198-F407 HydrophobicContact CD1-CE2 4.13Å; Y198-F407 AromaticContact CD1-CZ 3.58Å; Y198-F407 HydrophobicContact CD1-CZ 3.58Å; Y198-F407 HydrophobicContact CE1-CZ 4.04Å; Y198-F407 HydrophobicContact CG-CZ 4.18Å; K199-F407 WeakPolarHBondContact CE-OXT 3.47Å; K199-F407 HydrophobicContact CG-CE2 4.36Å; K199-F407 PolarHBondContact NZ-OXT 3.12Å; R403-F407 VanDerWaalsContact CD-CG 3.43Å; R403-F407 HydrophobicContact CG-CB 3.86Å; R403-F407 HydrophobicContact CG-CD1 4.5Å; R403-F407 HydrophobicContact CG-CD2 4.08Å; R403-F407 HydrophobicContact CG-CG 3.89Å; R403-F407 VanDerWaalsContact NE-CD1 3.31Å; P404-F407 WeakPolarHBondContact O-CB 3.47Å; P404-F407 PolarHBondContact O-N 2.96Å; Y405-F407 VanDerWaalsContact C-N 3.25Å; Y405-F407 PolarHBondContact O-N 3.43Å

Retrieved 407 of 407 residues in 84.8 ms (Link to these results)

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