A0A087XJT7_POEFO Loading...

Beta-1,4-galactosyltransferase

Responsible for the synthesis of complex-type N-linked oligosaccharides in many glycoproteins as well as the carbohydrate moieties of glycolipids.

AlphaFold DB , UniProt , Accession A0A087XJT7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 435 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39	Very low	54	Low	247 Å²	247	135.7 Å²	135.7	100%	1.217	77%	0.769	S	S	*	*				0	113.9	0	-84.9	175.9	178.9	0	0	107.6
2	A	40.6	Very low	55.7	Low	88 Å²	88	131.4 Å²	131.4	73%	0.727	75%	0.752	S	S	*	*			trans	-76.1	130.2	-173.3	0	0	0	0	0	111.3	F4	A2-F4 HydrophobicContact CB-CD2 4.35Å; A2-F4 PolarHBondContact O-N 2.76Å
3	C	46.3	Very low	57.3	Low	133 Å²	133	124.5 Å²	124.5	90%	0.899	71%	0.714	S	S	*	*			trans	-70	101.3	167.6	-71.1	0	0	0	0	109.8
4	F	49.2	Very low	58.7	Low	209 Å²	209	123.6 Å²	123.6	92%	0.917	71%	0.705	S	S	*	*			trans	-116.2	89.6	161.6	-93.3	-84.9	0	0	0	108.7	A2	A2-F4 HydrophobicContact CB-CD2 4.35Å; A2-F4 PolarHBondContact O-N 2.76Å
5	G	54	Low	60.2	Low	64 Å²	64	119.7 Å²	119.7	66%	0.66	69%	0.693	S	S	*	*			trans	-160.4	131.4	171.4	0	0	0	0	0	109
6	R	56.7	Low	61.6	Low	225 Å²	225	118.3 Å²	118.3	85%	0.849	68%	0.681	S	S	*	*			trans	97.9	67	179.3	-55	177.8	176.1	-178.6	-0.9	116.1
7	S	55	Low	62.9	Low	100 Å²	100	117.1 Å²	117.1	70%	0.699	67%	0.672	S	S	*	*	S	Bend	trans	-110.6	-6.8	155.5	-169.7	0	0	0	0	113.2	T13	S7-T13 PolarHBondContact O-OG1 3.12Å
8	L	54.9	Low	64.2	Low	132 Å²	132	115.1 Å²	115.1	69%	0.691	66%	0.662	S	S	*	*	S	Bend	trans	-99.4	-6.6	-175.6	-73.4	169.3	0	0	0	114.6
9	D	55.6	Low	65.3	Low	130 Å²	130	111.2 Å²	111.2	70%	0.695	65%	0.649	S	S	*	*			trans	-97.2	5.1	-175.6	-65.3	-33.2	0	0	0	114.1
10	S	70.7	Confident	66.4	Low	58 Å²	58	113.2 Å²	113.2	41%	0.406	65%	0.649	S	S	.	*			trans	-78.7	131.9	175.8	174.6	0	0	0	0	109.8	C12 T13 L14	S10-C12 PolarHBondContact O-N 3.19Å; S10-C12 PolarHBondContact OG-N 3.35Å; S10-T13 WeakPolarHBondContact CB-OG1 3.41Å; S10-T13 PolarHBondContact O-N 3.13Å; S10-T13 PolarHBondContact O-OG1 3.24Å; S10-L14 PolarHBondContact O-N 3.46Å; S10-L14 VanDerWaalsContact O-N 3.16Å
11	P	71.9	Confident	67.3	Low	107 Å²	107	114.1 Å²	114.1	70%	0.695	65%	0.648	S	S	*	*	H	α-helix	trans	-56.7	-23.5	176.9	19.7	-30	0	0	0	112.5	A15	P11-A15 VanDerWaalsContact O-CB 3.31Å; P11-A15 WeakPolarHBondContact O-CB 3.36Å; P11-A15 PolarHBondContact O-N 3.29Å
12	C	74.2	Confident	69.5	Low	84 Å²	84	109.2 Å²	109.2	57%	0.568	62%	0.62	S	S	*	*	H	α-helix	trans	-71.8	-40.5	174.8	-159.1	0	0	0	0	112.7	S10 A15 L16	S10-C12 PolarHBondContact O-N 3.19Å; S10-C12 PolarHBondContact OG-N 3.35Å; C12-A15 PolarHBondContact O-N 3.11Å; C12-L16 WeakPolarHBondContact O-CB 3.35Å; C12-L16 WeakPolarHBondContact O-CG 3.26Å; C12-L16 PolarHBondContact O-N 3.26Å
13	T	76.6	Confident	71.4	Confident	42 Å²	42	107.5 Å²	107.5	26%	0.258	61%	0.606	S	S	.	*	H	α-helix	trans	-69.3	-35.8	175.5	16.4	0	0	0	0	111.9	S7 S10 L16 L17	S7-T13 PolarHBondContact O-OG1 3.12Å; S10-T13 WeakPolarHBondContact CB-OG1 3.41Å; S10-T13 PolarHBondContact O-N 3.13Å; S10-T13 PolarHBondContact O-OG1 3.24Å; T13-L16 PolarHBondContact O-N 3.44Å; T13-L17 WeakPolarHBondContact O-CG 3.15Å; T13-L17 PolarHBondContact O-N 3.1Å
14	L	77.5	Confident	73.2	Confident	112 Å²	112	107.5 Å²	107.5	59%	0.586	59%	0.591	S	S	*	*	H	α-helix	trans	-66.2	-44.2	173.6	-172	67.4	0	0	0	111.7	S10 L16 L17 V18	S10-L14 PolarHBondContact O-N 3.46Å; S10-L14 VanDerWaalsContact O-N 3.16Å; L14-L16 VanDerWaalsContact C-N 3.33Å; L14-L16 PolarHBondContact O-N 3.32Å; L14-L17 PolarHBondContact O-N 2.61Å; L14-V18 WeakPolarHBondContact O-CG2 3.49Å; L14-V18 PolarHBondContact O-N 3.27Å
15	A	81.2	Confident	74.8	Confident	64 Å²	64	101.7 Å²	101.7	53%	0.529	57%	0.573	S	S	.	*	H	α-helix	trans	-61.8	-39.7	176.2	0	0	0	0	0	112.3	P11 C12 G19	P11-A15 VanDerWaalsContact O-CB 3.31Å; P11-A15 WeakPolarHBondContact O-CB 3.36Å; P11-A15 PolarHBondContact O-N 3.29Å; C12-A15 PolarHBondContact O-N 3.11Å; A15-G19 PolarHBondContact O-N 3.19Å
16	L	82.8	Confident	75.9	Confident	97 Å²	97	102.7 Å²	102.7	51%	0.508	56%	0.563	S	S	.	*	H	α-helix	trans	-64.2	-44.5	174.3	-76.6	168	0	0	0	111.9	C12 T13 L14 G19 F20	C12-L16 WeakPolarHBondContact O-CB 3.35Å; C12-L16 WeakPolarHBondContact O-CG 3.26Å; C12-L16 PolarHBondContact O-N 3.26Å; T13-L16 PolarHBondContact O-N 3.44Å; L14-L16 VanDerWaalsContact C-N 3.33Å; L14-L16 PolarHBondContact O-N 3.32Å; L16-G19 PolarHBondContact O-N 3.23Å; L16-F20 VanDerWaalsContact O-CD2 3.22Å; L16-F20 WeakPolarHBondContact O-CD2 3.19Å; L16-F20 PolarHBondContact O-N 2.68Å
17	L	82.8	Confident	76.8	Confident	98 Å²	98	96.1 Å²	96.1	51%	0.513	54%	0.538	S	S	.	.	H	α-helix	trans	-62.2	-44.1	177.5	-83	163	0	0	0	112.2	T13 L14 G19 F20 Q21	T13-L17 WeakPolarHBondContact O-CG 3.15Å; T13-L17 PolarHBondContact O-N 3.1Å; L14-L17 PolarHBondContact O-N 2.61Å; L17-G19 VanDerWaalsContact C-N 3.34Å; L17-F20 PolarHBondContact O-N 3.3Å; L17-Q21 WeakPolarHBondContact O-CB 3.5Å; L17-Q21 PolarHBondContact O-N 2.85Å
18	V	85.8	Confident	77.7	Confident	82 Å²	82	97.1 Å²	97.1	50%	0.497	53%	0.53	S	S	.	.	H	α-helix	trans	-64.3	-41.1	175.3	174	0	0	0	0	110.8	L14 Q21 F22	L14-V18 WeakPolarHBondContact O-CG2 3.49Å; L14-V18 PolarHBondContact O-N 3.27Å; V18-Q21 PolarHBondContact O-N 3Å; V18-F22 WeakPolarHBondContact O-CB 3.16Å; V18-F22 PolarHBondContact O-N 2.89Å
19	G	85.9	Confident	78.6	Confident	40 Å²	40	95 Å²	95	41%	0.412	53%	0.526	S	S	.	.	H	α-helix	trans	-61.1	-45.2	174.8	0	0	0	0	0	112.7	A15 L16 L17 F22 A23	A15-G19 PolarHBondContact O-N 3.19Å; L16-G19 PolarHBondContact O-N 3.23Å; L17-G19 VanDerWaalsContact C-N 3.34Å; G19-F22 PolarHBondContact O-N 3.37Å; G19-A23 WeakPolarHBondContact O-CB 3.4Å; G19-A23 PolarHBondContact O-N 3.49Å
20	F	86.9	Confident	79.1	Confident	151 Å²	151	92.2 Å²	92.2	66%	0.662	51%	0.511	S	S	*	.	H	α-helix	trans	-64.5	-40.8	174.8	-88.1	-68.6	0	0	0	112	L16 L17 A23 F24	L16-F20 VanDerWaalsContact O-CD2 3.22Å; L16-F20 WeakPolarHBondContact O-CD2 3.19Å; L16-F20 PolarHBondContact O-N 2.68Å; L17-F20 PolarHBondContact O-N 3.3Å; F20-A23 PolarHBondContact O-N 3.43Å; F20-F24 WeakPolarHBondContact O-CB 3.31Å; F20-F24 PolarHBondContact O-N 3.45Å
21	Q	85.3	Confident	79	Confident	133 Å²	133	92 Å²	92	62%	0.621	52%	0.518	S	S	*	.	H	α-helix	trans	-65.8	-40.1	177.6	-164.9	174.9	0.9	0	0	111.2	L17 V18 F24 V25	L17-Q21 WeakPolarHBondContact O-CB 3.5Å; L17-Q21 PolarHBondContact O-N 2.85Å; V18-Q21 PolarHBondContact O-N 3Å; Q21-F24 PolarHBondContact O-N 3Å; Q21-V25 WeakPolarHBondContact O-CB 3.47Å; Q21-V25 WeakPolarHBondContact O-CG2 3.47Å; Q21-V25 PolarHBondContact O-N 3.01Å
22	F	85.6	Confident	79.1	Confident	144 Å²	144	87.3 Å²	87.3	63%	0.632	49%	0.489	S	S	*	.	H	α-helix	trans	-67	-43.6	174.9	-157.5	-91.5	0	0	0	111.7	V18 G19 F24 V25 L26	V18-F22 WeakPolarHBondContact O-CB 3.16Å; V18-F22 PolarHBondContact O-N 2.89Å; G19-F22 PolarHBondContact O-N 3.37Å; F22-F24 VanDerWaalsContact C-N 3.31Å; F22-F24 PolarHBondContact O-N 2.82Å; F22-V25 PolarHBondContact O-N 2.99Å; F22-L26 WeakPolarHBondContact O-CB 3.25Å; F22-L26 PolarHBondContact O-N 3.08Å
23	A	81.3	Confident	78.5	Confident	53 Å²	53	90.3 Å²	90.3	44%	0.438	49%	0.493	S	S	.	.	H	α-helix	trans	-62.6	-38.7	175.1	0	0	0	0	0	112	G19 F20 Y27	G19-A23 WeakPolarHBondContact O-CB 3.4Å; G19-A23 PolarHBondContact O-N 3.49Å; F20-A23 PolarHBondContact O-N 3.43Å; A23-Y27 WeakPolarHBondContact O-CB 3.34Å; A23-Y27 PolarHBondContact O-N 2.78Å
24	F	82.8	Confident	77.6	Confident	132 Å²	132	98.9 Å²	98.9	58%	0.579	52%	0.52	S	S	*	.	H	α-helix	trans	-67.7	-48.6	176.3	-162.8	-92.4	0	0	0	110.8	F20 Q21 F22 L26 Y27 F28	F20-F24 WeakPolarHBondContact O-CB 3.31Å; F20-F24 PolarHBondContact O-N 3.45Å; Q21-F24 PolarHBondContact O-N 3Å; F22-F24 VanDerWaalsContact C-N 3.31Å; F22-F24 PolarHBondContact O-N 2.82Å; F24-L26 VanDerWaalsContact C-N 3.33Å; F24-L26 PolarHBondContact O-N 3.28Å; F24-Y27 PolarHBondContact O-N 2.03Å; F24-F28 AromaticContact CD1-CD2 3.56Å; F24-F28 HydrophobicContact CD1-CD2 3.56Å; F24-F28 AromaticContact CD1-CE2 3.73Å; F24-F28 HydrophobicContact CD1-CE2 3.73Å; F24-F28 HydrophobicContact CD2-CD2 4.39Å; F24-F28 AromaticContact CD2-CE2 3.95Å; F24-F28 HydrophobicContact CD2-CE2 3.95Å; F24-F28 AromaticContact CE1-CD2 3.48Å; F24-F28 HydrophobicContact CE1-CD2 3.48Å; F24-F28 VanDerWaalsContact CE1-CD2 3.48Å; F24-F28 AromaticContact CE1-CE2 3.27Å; F24-F28 HydrophobicContact CE1-CE2 3.27Å; F24-F28 HydrophobicContact CE1-CZ 4.19Å; F24-F28 HydrophobicContact CE2-CD2 4.33Å; F24-F28 AromaticContact CE2-CE2 3.54Å; F24-F28 HydrophobicContact CE2-CE2 3.54Å; F24-F28 HydrophobicContact CE2-CZ 4.4Å; F24-F28 HydrophobicContact CG-CD2 4.04Å; F24-F28 HydrophobicContact CG-CE2 4.06Å; F24-F28 AromaticContact CZ-CD2 3.91Å; F24-F28 HydrophobicContact CZ-CD2 3.91Å; F24-F28 AromaticContact CZ-CE2 3.18Å; F24-F28 HydrophobicContact CZ-CE2 3.18Å; F24-F28 AromaticContact CZ-CZ 3.9Å; F24-F28 HydrophobicContact CZ-CZ 3.9Å; F24-F28 VanDerWaalsContact O-CD2 3.25Å; F24-F28 WeakPolarHBondContact O-CD2 3.48Å; F24-F28 PolarHBondContact O-N 3.18Å
25	V	82.8	Confident	76.7	Confident	87 Å²	87	94.4 Å²	94.4	53%	0.527	50%	0.501	S	S	.	.	H	α-helix	trans	-60.1	-43.1	175.8	170.2	0	0	0	0	111.1	Q21 F22 F28 S29	Q21-V25 WeakPolarHBondContact O-CB 3.47Å; Q21-V25 WeakPolarHBondContact O-CG2 3.47Å; Q21-V25 PolarHBondContact O-N 3.01Å; F22-V25 PolarHBondContact O-N 2.99Å; V25-F28 PolarHBondContact O-N 3.25Å; V25-S29 WeakPolarHBondContact O-CB 3.38Å; V25-S29 PolarHBondContact O-N 2.59Å; V25-S29 PolarHBondContact O-OG 3.28Å; V25-S29 VanDerWaalsContact O-OG 3.1Å
26	L	77.6	Confident	75.5	Confident	86 Å²	86	94.6 Å²	94.6	45%	0.45	49%	0.493	S	S	.	.	H	α-helix	trans	-64.5	-43.2	176.3	-168.9	76	0	0	0	111.7	F22 F24 F28 S29 L30	F22-L26 WeakPolarHBondContact O-CB 3.25Å; F22-L26 PolarHBondContact O-N 3.08Å; F24-L26 VanDerWaalsContact C-N 3.33Å; F24-L26 PolarHBondContact O-N 3.28Å; L26-F28 PolarHBondContact O-N 2.81Å; L26-S29 WeakPolarHBondContact CA-OG 3.07Å; L26-S29 PolarHBondContact O-N 2.79Å; L26-S29 PolarHBondContact O-OG 3.04Å; L26-S29 VanDerWaalsContact O-OG 3.05Å; L26-L30 HydrophobicContact CD1-CD1 4.38Å; L26-L30 HydrophobicContact CG-CD1 3.99Å; L26-L30 VanDerWaalsContact O-CB 3.3Å; L26-L30 WeakPolarHBondContact O-CB 3.07Å; L26-L30 VanDerWaalsContact O-CG 3.24Å; L26-L30 WeakPolarHBondContact O-CG 3.12Å; L26-L30 PolarHBondContact O-N 3.38Å
27	Y	76.4	Confident	74.2	Confident	87 Å²	87	92.9 Å²	92.9	34%	0.341	49%	0.487	S	S	.	.	H	α-helix	trans	-60.4	-45.1	176.3	174.8	-97	0	0	0	111.2	A23 F24 G31 G32 F33 L36	A23-Y27 WeakPolarHBondContact O-CB 3.34Å; A23-Y27 PolarHBondContact O-N 2.78Å; F24-Y27 PolarHBondContact O-N 2.03Å; Y27-G31 PolarHBondContact O-N 3.32Å; Y27-G32 VanDerWaalsContact CZ-CA 3.45Å; Y27-G32 WeakPolarHBondContact O-CA 3.48Å; Y27-G32 PolarHBondContact O-N 2.85Å; Y27-F33 HydrophobicContact CE2-CB 4.32Å; Y27-F33 VanDerWaalsContact CZ-N 3.26Å; Y27-F33 PolarHBondContact OH-N 3.45Å; Y27-L36 HydrophobicContact CD2-CD1 3.87Å; Y27-L36 HydrophobicContact CE2-CD1 4.43Å
28	F	73.4	Confident	72.8	Confident	121 Å²	121	92 Å²	92	53%	0.531	49%	0.488	S	S	.	.	H	α-helix	trans	-76.8	-32.4	179.1	-80.2	-81.2	0	0	0	113.6	F24 V25 L26 L30 G31	F24-F28 AromaticContact CD1-CD2 3.56Å; F24-F28 HydrophobicContact CD1-CD2 3.56Å; F24-F28 AromaticContact CD1-CE2 3.73Å; F24-F28 HydrophobicContact CD1-CE2 3.73Å; F24-F28 HydrophobicContact CD2-CD2 4.39Å; F24-F28 AromaticContact CD2-CE2 3.95Å; F24-F28 HydrophobicContact CD2-CE2 3.95Å; F24-F28 AromaticContact CE1-CD2 3.48Å; F24-F28 HydrophobicContact CE1-CD2 3.48Å; F24-F28 VanDerWaalsContact CE1-CD2 3.48Å; F24-F28 AromaticContact CE1-CE2 3.27Å; F24-F28 HydrophobicContact CE1-CE2 3.27Å; F24-F28 HydrophobicContact CE1-CZ 4.19Å; F24-F28 HydrophobicContact CE2-CD2 4.33Å; F24-F28 AromaticContact CE2-CE2 3.54Å; F24-F28 HydrophobicContact CE2-CE2 3.54Å; F24-F28 HydrophobicContact CE2-CZ 4.4Å; F24-F28 HydrophobicContact CG-CD2 4.04Å; F24-F28 HydrophobicContact CG-CE2 4.06Å; F24-F28 AromaticContact CZ-CD2 3.91Å; F24-F28 HydrophobicContact CZ-CD2 3.91Å; F24-F28 AromaticContact CZ-CE2 3.18Å; F24-F28 HydrophobicContact CZ-CE2 3.18Å; F24-F28 AromaticContact CZ-CZ 3.9Å; F24-F28 HydrophobicContact CZ-CZ 3.9Å; F24-F28 VanDerWaalsContact O-CD2 3.25Å; F24-F28 WeakPolarHBondContact O-CD2 3.48Å; F24-F28 PolarHBondContact O-N 3.18Å; V25-F28 PolarHBondContact O-N 3.25Å; L26-F28 PolarHBondContact O-N 2.81Å; F28-L30 VanDerWaalsContact C-N 3.3Å; F28-G31 PolarHBondContact O-N 3.29Å
29	S	73.2	Confident	71.3	Confident	86 Å²	86	93 Å²	93	60%	0.601	49%	0.494	S	S	*	.	H	α-helix	trans	-69.1	-31.1	175	69.2	0	0	0	0	112	V25 L26 G31	V25-S29 WeakPolarHBondContact O-CB 3.38Å; V25-S29 PolarHBondContact O-N 2.59Å; V25-S29 PolarHBondContact O-OG 3.28Å; V25-S29 VanDerWaalsContact O-OG 3.1Å; L26-S29 WeakPolarHBondContact CA-OG 3.07Å; L26-S29 PolarHBondContact O-N 2.79Å; L26-S29 PolarHBondContact O-OG 3.04Å; L26-S29 VanDerWaalsContact O-OG 3.05Å; S29-G31 PolarHBondContact O-N 3.26Å
30	L	65.7	Low	69.8	Low	73 Å²	73	97.7 Å²	97.7	38%	0.382	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	15.1	169.5	-63.8	173.6	0	0	0	113	L26 F28 G32 G35	L26-L30 HydrophobicContact CD1-CD1 4.38Å; L26-L30 HydrophobicContact CG-CD1 3.99Å; L26-L30 VanDerWaalsContact O-CB 3.3Å; L26-L30 WeakPolarHBondContact O-CB 3.07Å; L26-L30 VanDerWaalsContact O-CG 3.24Å; L26-L30 WeakPolarHBondContact O-CG 3.12Å; L26-L30 PolarHBondContact O-N 3.38Å; F28-L30 VanDerWaalsContact C-N 3.3Å; L30-G32 VanDerWaalsContact C-N 3.34Å; L30-G32 PolarHBondContact O-N 3.3Å; L30-G35 CarbonylContact O-C 3.24Å; L30-G35 WeakPolarHBondContact O-CA 3.4Å
31	G	69.6	Low	68	Low	54 Å²	54	93.9 Å²	93.9	56%	0.557	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.7	23.3	174.6	0	0	0	0	0	115.2	Y27 F28 S29	Y27-G31 PolarHBondContact O-N 3.32Å; F28-G31 PolarHBondContact O-N 3.29Å; S29-G31 PolarHBondContact O-N 3.26Å
32	G	73.2	Confident	66	Low	7 Å²	7	96 Å²	96	7%	0.072	51%	0.508	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.1	-158	178.9	0	0	0	0	0	113.5	Y27 L30 R34 G35 L36	Y27-G32 VanDerWaalsContact CZ-CA 3.45Å; Y27-G32 WeakPolarHBondContact O-CA 3.48Å; Y27-G32 PolarHBondContact O-N 2.85Å; L30-G32 VanDerWaalsContact C-N 3.34Å; L30-G32 PolarHBondContact O-N 3.3Å; G32-R34 PolarHBondContact O-N 2.77Å; G32-G35 PolarHBondContact O-N 3.13Å; G32-L36 PolarHBondContact O-N 3.41Å
33	F	62.8	Low	64.2	Low	148 Å²	148	93.5 Å²	93.5	65%	0.649	50%	0.504	S	S	*	.	H	α-helix	trans	-52.2	-30.8	-179.8	-167.4	-97.7	0	0	0	112.7	Y27 V37	Y27-F33 HydrophobicContact CE2-CB 4.32Å; Y27-F33 VanDerWaalsContact CZ-N 3.26Å; Y27-F33 PolarHBondContact OH-N 3.45Å; F33-V37 HydrophobicContact CD1-CG2 3.94Å; F33-V37 HydrophobicContact CE1-CG2 3.72Å; F33-V37 HydrophobicContact CZ-CG2 4.16Å; F33-V37 WeakPolarHBondContact O-CB 3.25Å; F33-V37 WeakPolarHBondContact O-CG2 3.4Å; F33-V37 PolarHBondContact O-N 3.09Å
34	R	57.2	Low	62.8	Low	221 Å²	221	97.5 Å²	97.5	83%	0.834	52%	0.524	S	S	*	.	H	α-helix	trans	-68.8	-43.7	178.1	-77.7	-175.7	161.3	-176.5	-5.1	113.8	G32 S38	G32-R34 PolarHBondContact O-N 2.77Å; R34-S38 PolarHBondContact O-N 2.9Å
35	G	58.1	Low	61.7	Low	18 Å²	18	96.1 Å²	96.1	19%	0.186	52%	0.519	C	S	.	.	H	α-helix	trans	-82.3	-23.2	177.6	0	0	0	0	0	112.9	L30 G32 S38 V39	L30-G35 CarbonylContact O-C 3.24Å; L30-G35 WeakPolarHBondContact O-CA 3.4Å; G32-G35 PolarHBondContact O-N 3.13Å; G35-S38 WeakPolarHBondContact O-CB 3.34Å; G35-S38 PolarHBondContact O-N 2.95Å; G35-V39 WeakPolarHBondContact O-CG2 3.41Å; G35-V39 PolarHBondContact O-N 2.84Å
36	L	57.1	Low	60.9	Low	68 Å²	68	94.9 Å²	94.9	36%	0.356	51%	0.513	S	S	.	.	H	α-helix	trans	-65.2	-41.8	167.1	-124.1	149.9	0	0	0	111.7	Y27 G32 S38 V39 L40	Y27-L36 HydrophobicContact CD2-CD1 3.87Å; Y27-L36 HydrophobicContact CE2-CD1 4.43Å; G32-L36 PolarHBondContact O-N 3.41Å; L36-S38 VanDerWaalsContact C-N 3.33Å; L36-V39 PolarHBondContact O-N 3.05Å; L36-L40 HydrophobicContact CD2-CD1 3.88Å; L36-L40 PolarHBondContact O-N 2.89Å; L36-L40 VanDerWaalsContact O-N 3.08Å
37	V	55.5	Low	61	Low	62 Å²	62	100 Å²	100	38%	0.376	54%	0.535	S	S	.	.	H	α-helix	trans	-64.8	-36	170.1	170.8	0	0	0	0	111.2	F33 V39 L40 V41	F33-V37 HydrophobicContact CD1-CG2 3.94Å; F33-V37 HydrophobicContact CE1-CG2 3.72Å; F33-V37 HydrophobicContact CZ-CG2 4.16Å; F33-V37 WeakPolarHBondContact O-CB 3.25Å; F33-V37 WeakPolarHBondContact O-CG2 3.4Å; F33-V37 PolarHBondContact O-N 3.09Å; V37-V39 VanDerWaalsContact C-N 3.3Å; V37-V39 PolarHBondContact O-N 3.39Å; V37-L40 PolarHBondContact O-N 3.3Å; V37-V41 HydrophobicContact CG1-CG2 3.85Å; V37-V41 WeakPolarHBondContact O-CA 3.36Å; V37-V41 WeakPolarHBondContact O-CB 3.39Å; V37-V41 VanDerWaalsContact O-CG2 3.3Å; V37-V41 WeakPolarHBondContact O-CG2 3.41Å; V37-V41 PolarHBondContact O-N 3.41Å
38	S	53.1	Low	61.5	Low	79 Å²	79	98.3 Å²	98.3	55%	0.552	53%	0.529	S	S	*	.	H	α-helix	trans	-67.5	-25.8	175.2	-170.2	0	0	0	0	114.1	R34 G35 L36	R34-S38 PolarHBondContact O-N 2.9Å; G35-S38 WeakPolarHBondContact O-CB 3.34Å; G35-S38 PolarHBondContact O-N 2.95Å; L36-S38 VanDerWaalsContact C-N 3.33Å
39	V	54.5	Low	62.2	Low	103 Å²	103	97.1 Å²	97.1	62%	0.624	53%	0.528	S	S	*	.	H	α-helix	trans	-82.8	-34.2	175.2	171.4	0	0	0	0	111.3	G35 L36 V37	G35-V39 WeakPolarHBondContact O-CG2 3.41Å; G35-V39 PolarHBondContact O-N 2.84Å; L36-V39 PolarHBondContact O-N 3.05Å; V37-V39 VanDerWaalsContact C-N 3.3Å; V37-V39 PolarHBondContact O-N 3.39Å
40	L	53.5	Low	63	Low	138 Å²	138	96 Å²	96	72%	0.723	51%	0.511	S	S	*	.	H	α-helix	trans	-84.5	-24.6	178.5	-87.6	150	0	0	0	113.8	L36 V37	L36-L40 HydrophobicContact CD2-CD1 3.88Å; L36-L40 PolarHBondContact O-N 2.89Å; L36-L40 VanDerWaalsContact O-N 3.08Å; V37-L40 PolarHBondContact O-N 3.3Å
41	V	49.3	Very low	64.2	Low	72 Å²	72	96.8 Å²	96.8	44%	0.436	52%	0.522	S	S	.	.			trans	-108.5	92.9	176.4	-174.1	0	0	0	0	107.1	V37 T43	V37-V41 HydrophobicContact CG1-CG2 3.85Å; V37-V41 WeakPolarHBondContact O-CA 3.36Å; V37-V41 WeakPolarHBondContact O-CB 3.39Å; V37-V41 VanDerWaalsContact O-CG2 3.3Å; V37-V41 WeakPolarHBondContact O-CG2 3.41Å; V37-V41 PolarHBondContact O-N 3.41Å; V41-T43 HydrophobicContact CG1-CG2 3.75Å; V41-T43 PolarHBondContact O-N 2.64Å
42	H	43.6	Very low	65.2	Low	176 Å²	176	104 Å²	104	82%	0.815	53%	0.533	S	S	*	.			trans	-61.4	88.7	155.2	-89.7	-30.6	0	0	0	107.3	T44	H42-T44 PolarHBondContact O-N 3.36Å
43	T	47.1	Very low	66.3	Low	92 Å²	92	106.3 Å²	106.3	56%	0.564	55%	0.547	S	S	*	.			trans	-64.9	105.8	161.7	47.6	0	0	0	0	105.8	V41 E45	V41-T43 HydrophobicContact CG1-CG2 3.75Å; V41-T43 PolarHBondContact O-N 2.64Å; T43-E45 PolarHBondContact O-N 2.98Å
44	T	52	Low	67.8	Low	137 Å²	137	103.3 Å²	103.3	84%	0.84	54%	0.535	S	S	*	.			trans	-68.7	66.9	169	53.5	0	0	0	0	108.3	H42	H42-T44 PolarHBondContact O-N 3.36Å
45	E	60.6	Low	69.6	Low	103 Å²	103	96 Å²	96	48%	0.481	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-66.8	131.3	167.3	-70.3	-66.4	167.8	0	0	106.9	T43 E47 P297	T43-E45 PolarHBondContact O-N 2.98Å; E45-E47 PolarHBondContact O-N 3.29Å; E45-E47 VanDerWaalsContact O-N 3.13Å; E45-P297 VanDerWaalsContact OE2-CB 3.28Å; E45-P297 WeakPolarHBondContact OE2-CB 3.42Å
46	P	65.8	Low	71.3	Confident	61 Å²	61	95.2 Å²	95.2	40%	0.396	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-61.1	120.2	-179.6	24	-32	0	0	0	109.4	F48 A299	P46-F48 HydrophobicContact CB-CD2 4.29Å; P46-F48 HydrophobicContact CB-CE2 3.66Å; P46-F48 HydrophobicContact CB-CZ 4.28Å; P46-F48 HydrophobicContact CG-CE2 3.85Å; P46-F48 WeakPolarHBondContact O-CD2 3.4Å; P46-A299 WeakPolarHBondContact O-CB 3.21Å
47	E	79.9	Confident	73.1	Confident	195 Å²	195	93.5 Å²	93.5	91%	0.911	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-85.4	117	178.6	-164.8	171.2	-168.3	0	0	108.8	E45	E45-E47 PolarHBondContact O-N 3.29Å; E45-E47 VanDerWaalsContact O-N 3.13Å
48	F	86.4	Confident	74.9	Confident	50 Å²	50	92.3 Å²	92.3	22%	0.219	49%	0.486	C	S	.	.			trans	-108	133.5	177.9	-72.5	-83.4	0	0	0	110.3	P46 Y50 P97 H218 A299 I300	P46-F48 HydrophobicContact CB-CD2 4.29Å; P46-F48 HydrophobicContact CB-CE2 3.66Å; P46-F48 HydrophobicContact CB-CZ 4.28Å; P46-F48 HydrophobicContact CG-CE2 3.85Å; P46-F48 WeakPolarHBondContact O-CD2 3.4Å; F48-Y50 HydrophobicContact CB-CD2 4.23Å; F48-Y50 HydrophobicContact CB-CE2 3.81Å; F48-Y50 WeakPolarHBondContact O-CD2 3.4Å; F48-Y50 PolarHBondContact O-N 2.97Å; F48-P97 HydrophobicContact CB-CG 3.89Å; F48-P97 HydrophobicContact CD1-CG 4.26Å; F48-P97 HydrophobicContact CG-CG 4.44Å; F48-H218 HydrophobicContact CZ-CB 4.45Å; F48-H218 AromaticContact CZ-CD2 3.95Å; F48-A299 HydrophobicContact CD2-CB 4.26Å; F48-A299 WeakPolarHBondContact CD2-O 3.44Å; F48-I300 HydrophobicContact CD2-CG2 3.91Å; F48-I300 HydrophobicContact CE2-CG2 3.3Å; F48-I300 HydrophobicContact CZ-CG2 4.01Å
49	D	88.3	Confident	76.6	Confident	96 Å²	96	91.5 Å²	91.5	51%	0.513	48%	0.475	S	S	.	.			trans	-82.2	101.4	174.1	-178.2	12	0	0	0	110.9	S51	D49-S51 VanDerWaalsContact C-N 3.28Å; D49-S51 VanDerWaalsContact CG-OG 3.23Å; D49-S51 PolarHBondContact O-N 3.42Å; D49-S51 WeakPolarHBondContact OD1-CA 3.37Å; D49-S51 WeakPolarHBondContact OD1-CB 3.26Å; D49-S51 PolarHBondContact OD1-N 2.97Å; D49-S51 PolarHBondContact OD1-OG 3.31Å; D49-S51 PolarHBondContact OD2-OG 2.8Å; D49-S51 VanDerWaalsContact OD2-OG 3.1Å
50	Y	90.6	Very high	78.1	Confident	64 Å²	64	87.7 Å²	87.7	25%	0.251	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-0.6	175.3	-76.1	-89.6	0	0	0	113.8	F48 R52 P97 E215 N216 A299 H302	F48-Y50 HydrophobicContact CB-CD2 4.23Å; F48-Y50 HydrophobicContact CB-CE2 3.81Å; F48-Y50 WeakPolarHBondContact O-CD2 3.4Å; F48-Y50 PolarHBondContact O-N 2.97Å; Y50-R52 VanDerWaalsContact C-N 3.34Å; Y50-P97 HydrophobicContact CD1-CB 3.86Å; Y50-P97 HydrophobicContact CD1-CG 4.18Å; Y50-P97 HydrophobicContact CD2-CG 4.5Å; Y50-P97 HydrophobicContact CE1-CB 4.01Å; Y50-P97 HydrophobicContact CE1-CG 4.15Å; Y50-P97 HydrophobicContact CE2-CG 4.47Å; Y50-P97 HydrophobicContact CG-CB 4.37Å; Y50-P97 HydrophobicContact CG-CG 4.36Å; Y50-E215 HydrophobicContact CE1-CB 4.24Å; Y50-N216 HydrophobicContact CE1-CB 4.33Å; Y50-N216 WeakPolarHBondContact OH-CB 3.48Å; Y50-N216 PolarHBondContact OH-ND2 2.83Å; Y50-A299 PolarHBondContact OH-O 3.07Å; Y50-H302 AromaticContact CD1-ND1 3.97Å; Y50-H302 HydrophobicContact CE1-CB 4.06Å; Y50-H302 AromaticContact CE1-CG 3.97Å; Y50-H302 AromaticContact CE1-ND1 3.51Å; Y50-H302 AromaticContact CE2-CE1 3.73Å; Y50-H302 AromaticContact CE2-ND1 3.71Å; Y50-H302 AromaticContact CZ-CE1 3.85Å; Y50-H302 AromaticContact CZ-CG 3.69Å; Y50-H302 AromaticContact CZ-ND1 3.36Å
51	S	90.3	Very high	79.7	Confident	88 Å²	88	86.3 Å²	86.3	62%	0.615	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-22.1	179.4	76.8	0	0	0	0	113.2	D49	D49-S51 VanDerWaalsContact C-N 3.28Å; D49-S51 VanDerWaalsContact CG-OG 3.23Å; D49-S51 PolarHBondContact O-N 3.42Å; D49-S51 WeakPolarHBondContact OD1-CA 3.37Å; D49-S51 WeakPolarHBondContact OD1-CB 3.26Å; D49-S51 PolarHBondContact OD1-N 2.97Å; D49-S51 PolarHBondContact OD1-OG 3.31Å; D49-S51 PolarHBondContact OD2-OG 2.8Å; D49-S51 VanDerWaalsContact OD2-OG 3.1Å
52	R	91.4	Very high	81.3	Confident	206 Å²	206	87 Å²	87	78%	0.777	45%	0.454	S	S	*	.	S	Bend	trans	-130.8	65.9	-179.7	-63	-178.5	-175.1	-169.9	1.8	111.4	Y50	Y50-R52 VanDerWaalsContact C-N 3.34Å
53	P	94.8	Very high	83.2	Confident	56 Å²	56	79.4 Å²	79.4	36%	0.364	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-70.2	148.7	-179.3	31.4	-35.4	0	0	0	111.5	P97	P53-P97 HydrophobicContact CB-CB 4.32Å
54	H	95.4	Very high	84.3	Confident	85 Å²	85	76.9 Å²	76.9	39%	0.394	41%	0.411	S	S	.	.	B	Isolated β-bridge	trans	-76.9	158	174.9	-65.1	89.2	0	0	0	111.5	V95 P97 V98 S99	H54-V95 HydrophobicContact CB-CB 4.29Å; H54-V95 HydrophobicContact CB-CG2 3.79Å; H54-V95 PolarHBondContact CE1-O 3.39Å; H54-V95 PolarHBondContact ND1-O 2.81Å; H54-P97 PolarHBondContact N-O 3.44Å; H54-V98 CarbonylContact O-C 3.52Å; H54-V98 VanDerWaalsContact O-CA 3.26Å; H54-V98 WeakPolarHBondContact O-CA 3.39Å; H54-S99 PolarHBondContact O-N 2.81Å; H54-S99 PolarHBondContact O-OG 2.75Å
55	D	94.7	Very high	84.9	Confident	66 Å²	66	74.7 Å²	74.7	35%	0.353	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-67.4	143.9	168.9	-177	-90.1	0	0	0	110.3	Y57 T58	D55-Y57 PolarHBondContact O-N 2.79Å; D55-Y57 WeakPolarHBondContact OD1-CB 3.27Å; D55-Y57 PolarHBondContact OD1-N 3.07Å; D55-T58 PolarHBondContact N-OG1 2.95Å; D55-T58 VanDerWaalsContact O-CB 3.26Å; D55-T58 WeakPolarHBondContact O-CB 3.37Å; D55-T58 PolarHBondContact O-N 2.96Å; D55-T58 PolarHBondContact O-OG1 3.16Å
56	V	94.3	Very high	84.7	Confident	2 Å²	2	74.4 Å²	74.4	1%	0.012	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-7.8	-177.4	79.2	0	0	0	0	113.6	Y153 H154 P157 F158 R161	V56-Y153 HydrophobicContact CG1-CE1 3.95Å; V56-H154 WeakPolarHBondContact CG2-O 3.31Å; V56-P157 HydrophobicContact CG1-CG 4.07Å; V56-P157 HydrophobicContact CG2-CG 4.11Å; V56-P157 VanDerWaalsContact O-CB 3.24Å; V56-P157 WeakPolarHBondContact O-CB 3.32Å; V56-P157 WeakPolarHBondContact O-CG 3.34Å; V56-F158 HydrophobicContact CG2-CB 4.29Å; V56-R161 PolarHBondContact O-NH1 3.15Å; V56-R161 PolarHBondContact O-NH2 2.96Å
57	Y	94.1	Very high	84.3	Confident	32 Å²	32	76.5 Å²	76.5	13%	0.125	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.5	5.1	171.7	-72.5	-99.9	0	0	0	113.5	D55 L60 R114 N115 Y153 P157	D55-Y57 PolarHBondContact O-N 2.79Å; D55-Y57 WeakPolarHBondContact OD1-CB 3.27Å; D55-Y57 PolarHBondContact OD1-N 3.07Å; Y57-L60 HydrophobicContact CD1-CD2 3.74Å; Y57-L60 HydrophobicContact CE1-CD2 4.21Å; Y57-L60 WeakPolarHBondContact O-CB 3.24Å; Y57-L60 PolarHBondContact O-N 3.44Å; Y57-R114 HydrophobicContact CD1-CB 4.45Å; Y57-R114 HydrophobicContact CE1-CB 3.67Å; Y57-N115 PolarHBondContact OH-ND2 3.38Å; Y57-Y153 HydrophobicContact CD2-CE2 4.13Å; Y57-Y153 AromaticContact CE2-CD2 3.73Å; Y57-Y153 HydrophobicContact CE2-CD2 3.73Å; Y57-Y153 HydrophobicContact CE2-CE1 4.29Å; Y57-Y153 AromaticContact CE2-CE2 3.27Å; Y57-Y153 HydrophobicContact CE2-CE2 3.27Å; Y57-Y153 HydrophobicContact CE2-CG 4.43Å; Y57-Y153 AromaticContact CE2-CZ 3.59Å; Y57-Y153 WeakPolarHBondContact CE2-O 3.36Å; Y57-Y153 AromaticContact CZ-CE2 3.93Å; Y57-Y153 PolarHBondContact OH-O 3Å; Y57-P157 HydrophobicContact CD1-CB 3.91Å; Y57-P157 HydrophobicContact CD1-CG 4.22Å; Y57-P157 HydrophobicContact CD2-CB 4.47Å; Y57-P157 HydrophobicContact CD2-CG 4.08Å; Y57-P157 HydrophobicContact CE1-CB 3.9Å; Y57-P157 HydrophobicContact CE1-CG 3.89Å; Y57-P157 HydrophobicContact CE2-CB 4.43Å; Y57-P157 HydrophobicContact CE2-CG 3.7Å; Y57-P157 HydrophobicContact CG-CB 4.19Å; Y57-P157 HydrophobicContact CG-CG 4.29Å
58	T	93.1	Very high	83.1	Confident	38 Å²	38	72.8 Å²	72.8	23%	0.233	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	142.1	176.1	-54.4	0	0	0	0	110.8	D55 L60 V95 R161	D55-T58 PolarHBondContact N-OG1 2.95Å; D55-T58 VanDerWaalsContact O-CB 3.26Å; D55-T58 WeakPolarHBondContact O-CB 3.37Å; D55-T58 PolarHBondContact O-N 2.96Å; D55-T58 PolarHBondContact O-OG1 3.16Å; T58-L60 PolarHBondContact O-N 3.48Å; T58-V95 HydrophobicContact CG2-CG1 3.94Å; T58-R161 WeakPolarHBondContact O-CD 3.37Å; T58-R161 PolarHBondContact O-NH1 3.32Å
59	N	88.6	Confident	81.5	Confident	61 Å²	61	75.5 Å²	75.5	33%	0.326	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	2.5	-179.9	-68	-9.8	0	0	0	116.7	S61 L62 V95	N59-S61 PolarHBondContact O-N 3.27Å; N59-L62 HydrophobicContact CB-CD1 4.02Å; N59-L62 WeakPolarHBondContact O-CB 3.37Å; N59-L62 PolarHBondContact O-N 3.01Å; N59-L62 VanDerWaalsContact O-N 3.11Å; N59-V95 HydrophobicContact CB-CG1 4.42Å; N59-V95 WeakPolarHBondContact ND2-CG1 3.31Å
60	L	87.3	Confident	80.1	Confident	23 Å²	23	75.6 Å²	75.6	12%	0.12	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-67.3	-26.9	-178.2	-154.8	75.5	0	0	0	112.6	Y57 T58 L62 L63 P157 Q160 R161	Y57-L60 HydrophobicContact CD1-CD2 3.74Å; Y57-L60 HydrophobicContact CE1-CD2 4.21Å; Y57-L60 WeakPolarHBondContact O-CB 3.24Å; Y57-L60 PolarHBondContact O-N 3.44Å; T58-L60 PolarHBondContact O-N 3.48Å; L60-L62 PolarHBondContact O-N 2.96Å; L60-L63 HydrophobicContact CD1-CD1 3.42Å; L60-L63 VanDerWaalsContact CD1-CD1 3.42Å; L60-L63 HydrophobicContact CG-CD1 3.85Å; L60-L63 WeakPolarHBondContact O-CB 3.35Å; L60-L63 PolarHBondContact O-N 3.27Å; L60-P157 HydrophobicContact CD1-CB 3.94Å; L60-P157 HydrophobicContact CD2-CB 3.8Å; L60-P157 HydrophobicContact CG-CB 4.49Å; L60-Q160 HydrophobicContact CD1-CB 3.78Å; L60-R161 HydrophobicContact CD1-CG 4.36Å
61	S	85.3	Confident	78.5	Confident	109 Å²	109	84.5 Å²	84.5	76%	0.762	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-67.9	-11.4	175	57.3	0	0	0	0	114.2	N59 L63	N59-S61 PolarHBondContact O-N 3.27Å; S61-L63 VanDerWaalsContact C-N 3.34Å
62	L	84.9	Confident	76.9	Confident	88 Å²	88	87.8 Å²	87.8	46%	0.461	48%	0.483	S	S	.	.	G	3₁₀ helix	trans	-82.3	-14.9	175.1	-56.7	177.4	0	0	0	112.3	N59 L60 G64 V65 L93	N59-L62 HydrophobicContact CB-CD1 4.02Å; N59-L62 WeakPolarHBondContact O-CB 3.37Å; N59-L62 PolarHBondContact O-N 3.01Å; N59-L62 VanDerWaalsContact O-N 3.11Å; L60-L62 PolarHBondContact O-N 2.96Å; L62-G64 PolarHBondContact O-N 2.83Å; L62-V65 PolarHBondContact O-N 3.37Å; L62-L93 HydrophobicContact CB-CD2 3.79Å; L62-L93 HydrophobicContact CD1-CD2 4.09Å
63	L	83.6	Confident	74.9	Confident	16 Å²	16	82.3 Å²	82.3	8%	0.084	48%	0.477	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	130	177.9	-74.3	168.1	0	0	0	111.1	L60 S61 V65 L93 L117 Y124 Q160	L60-L63 HydrophobicContact CD1-CD1 3.42Å; L60-L63 VanDerWaalsContact CD1-CD1 3.42Å; L60-L63 HydrophobicContact CG-CD1 3.85Å; L60-L63 WeakPolarHBondContact O-CB 3.35Å; L60-L63 PolarHBondContact O-N 3.27Å; S61-L63 VanDerWaalsContact C-N 3.34Å; L63-V65 VanDerWaalsContact C-N 3.32Å; L63-L93 HydrophobicContact CD2-CD1 3.3Å; L63-L93 HydrophobicContact CG-CD1 3.82Å; L63-L117 HydrophobicContact CB-CD1 3.92Å; L63-L117 HydrophobicContact CD1-CD1 4.37Å; L63-Y124 WeakPolarHBondContact CD2-OH 3.36Å; L63-Q160 HydrophobicContact CD1-CB 3.77Å
64	G	69.4	Low	72.7	Confident	38 Å²	38	83.3 Å²	83.3	39%	0.392	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	81	5.8	-179.7	0	0	0	0	0	115	L62 P66	L62-G64 PolarHBondContact O-N 2.83Å; G64-P66 WeakPolarHBondContact O-CD 3.5Å
65	V	64.3	Low	70.8	Confident	92 Å²	92	86.7 Å²	86.7	56%	0.558	52%	0.524	S	S	*	.			trans	-89.4	112.1	165.1	-177	0	0	0	0	107.8	L62 L63	L62-V65 PolarHBondContact O-N 3.37Å; L63-V65 VanDerWaalsContact C-N 3.32Å
66	P	57	Low	68.3	Low	97 Å²	97	87 Å²	87	63%	0.63	54%	0.543	S	S	*	.	P	Polyproline II helix	trans	-57.5	141.5	176	-19.7	30.4	0	0	0	110	G64	G64-P66 WeakPolarHBondContact O-CD 3.5Å
67	P	56.4	Low	65.9	Low	104 Å²	104	94.9 Å²	94.9	68%	0.675	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-56.7	141	172.7	22.2	-30.8	0	0	0	109.6
68	P	54.1	Low	63.9	Low	117 Å²	117	99.4 Å²	99.4	76%	0.76	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-56.6	136.4	-179.9	21.5	-31.1	0	0	0	109.6
69	P	54.7	Low	61.7	Low	107 Å²	107	101.1 Å²	101.1	70%	0.695	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-59.1	145.6	-179.1	22.4	-31.4	0	0	0	110.2	R71	P69-R71 PolarHBondContact O-N 3.41Å
70	P	58.8	Low	59.9	Low	98 Å²	98	103.6 Å²	103.6	64%	0.636	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-56.8	135.6	173.8	22.3	-30.3	0	0	0	109.1	N72	P70-N72 PolarHBondContact O-N 2.96Å
71	R	56.4	Low	58.4	Low	252 Å²	252	106.2 Å²	106.2	95%	0.951	69%	0.69	S	S	*	*	S	Bend	trans	-56.3	-3.7	-171.5	-109.3	178.5	179.3	178.4	-0.6	116.1	P69	P69-R71 PolarHBondContact O-N 3.41Å
72	N	55.7	Low	57.3	Low	157 Å²	157	109 Å²	109	84%	0.84	69%	0.691	S	S	*	*			trans	-130.6	82.7	177.8	-67.1	-12.8	0	0	0	110.7	P70	P70-N72 PolarHBondContact O-N 2.96Å
73	S	50.3	Low	57	Low	91 Å²	91	110.7 Å²	110.7	64%	0.636	71%	0.707	S	S	*	*			trans	-145.1	112.1	160.9	-44.2	0	0	0	0	108.9
74	G	49.4	Very low	57.1	Low	77 Å²	77	113.7 Å²	113.7	79%	0.794	72%	0.723	S	S	*	*			trans	-66	159.2	177.9	0	0	0	0	0	113.3
75	T	54.7	Low	58.2	Low	155 Å²	155	120.4 Å²	120.4	95%	0.951	74%	0.741	S	S	*	*			trans	-47.8	128.4	178.4	41.4	0	0	0	0	115.2
76	G	43	Very low	59.7	Low	73 Å²	73	121.1 Å²	121.1	75%	0.753	74%	0.742	S	S	*	*			trans	-159.1	139.3	165.8	0	0	0	0	0	112
77	L	43.4	Very low	61.5	Low	168 Å²	168	116.8 Å²	116.8	88%	0.88	71%	0.713	S	S	*	*			trans	-61.1	161	-172.9	-89.3	108.5	0	0	0	115.4	A79	L77-A79 PolarHBondContact O-N 3.29Å
78	P	51.9	Low	63.3	Low	126 Å²	126	115 Å²	115	82%	0.818	70%	0.702	S	S	*	*			trans	-76.1	108.9	-164.8	30.6	-32.1	0	0	0	111.7
79	A	46.1	Very low	65.2	Low	74 Å²	74	115.1 Å²	115.1	61%	0.612	70%	0.695	S	S	*	*			trans	-81.7	145.1	169.3	0	0	0	0	0	110.1	L77 G81	L77-A79 PolarHBondContact O-N 3.29Å; A79-G81 PolarHBondContact O-N 3.17Å
80	S	51.4	Low	67	Low	113 Å²	113	114.9 Å²	114.9	79%	0.79	69%	0.693	S	S	*	*	S	Bend	trans	-26.2	122.1	161.1	51.3	0	0	0	0	111.5	Q82	S80-Q82 PolarHBondContact O-N 3.22Å
81	G	56.3	Low	68.8	Low	78 Å²	78	110.8 Å²	110.8	80%	0.804	67%	0.667	S	S	*	*			trans	-38.7	118.6	-164	0	0	0	0	0	112.9	A79	A79-G81 PolarHBondContact O-N 3.17Å
82	Q	62.5	Low	70.5	Confident	169 Å²	169	103.3 Å²	103.3	79%	0.79	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-54.8	140.4	176.7	-71.7	-156.3	-27.7	0	0	109.5	S80 L84	S80-Q82 PolarHBondContact O-N 3.22Å; Q82-L84 PolarHBondContact O-N 2.87Å
83	P	78.3	Confident	72.4	Confident	123 Å²	123	96.4 Å²	96.4	80%	0.799	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-54.5	131.7	174.6	21.3	-30.2	0	0	0	109.2
84	L	85.3	Confident	74.6	Confident	79 Å²	79	93.4 Å²	93.4	41%	0.414	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-57.6	142.4	178	-72.2	175.3	0	0	0	109.1	Q82 E130	Q82-L84 PolarHBondContact O-N 2.87Å; L84-E130 HydrophobicContact CB-CG 3.86Å
85	K	92.9	Very high	76.8	Confident	178 Å²	178	90.8 Å²	90.8	77%	0.774	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-73.1	153.2	174	-67.1	-178.3	-179.6	178	0	109.5	C129 E130	K85-C129 CarbonylContact O-C 3.47Å; K85-C129 WeakPolarHBondContact O-CA 3.22Å; K85-C129 VanDerWaalsContact O-CB 3.25Å; K85-C129 WeakPolarHBondContact O-CB 3.32Å; K85-E130 PolarHBondContact O-N 3.38Å
86	D	95.4	Very high	78.7	Confident	108 Å²	108	83.5 Å²	83.5	58%	0.578	52%	0.515	S	S	*	.	B	Isolated β-bridge	trans	-58.8	143.8	171.5	-69.2	-27.3	0	0	0	111.8	E130 H132	D86-E130 WeakPolarHBondContact CA-O 3.15Å; D86-H132 IonicContact OD2-CE1 2.9Å
87	C	95.1	Very high	81.3	Confident	5 Å²	5	80.5 Å²	80.5	3%	0.034	48%	0.482	C	S	.	.	P	Polyproline II helix	trans	-65.5	137.1	177	-61.7	0	0	0	0	111	C129 E130 H132 Q163	C87-C129 WeakPolarHBondContact CA-SG 3.43Å; C87-C129 HydrophobicContact CB-CB 3.89Å; C87-C129 WeakPolarHBondContact CB-SG 3.28Å; C87-C129 VanDerWaalsContact SG-C 3.52Å; C87-C129 WeakPolarHBondContact SG-CB 3.21Å; C87-C129 CovalentContact SG-SG 2.03Å; C87-C129 PolarHBondContact SG-SG 3.48Å; C87-E130 PolarHBondContact N-O 2.85Å; C87-E130 PolarHBondContact SG-O 3.1Å; C87-E130 VanDerWaalsContact SG-O 3.35Å; C87-H132 PolarHBondContact O-CD2 3.03Å; C87-H132 PolarHBondContact O-NE2 2.84Å; C87-Q163 HydrophobicContact CB-CB 4.2Å
88	P	94.5	Very high	83.8	Confident	67 Å²	67	72.6 Å²	72.6	44%	0.435	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-61.8	142.4	178.1	26.9	-36.4	0	0	0	112.4	P90 S91 P92	P88-P90 CarbonylContact C-O 3.52Å; P88-P90 CarbonylContact O-C 3.56Å; P88-P90 VanDerWaalsContact O-C 3.32Å; P88-S91 PolarHBondContact O-N 2.86Å; P88-P92 HydrophobicContact CG-CG 3.99Å
89	I	92.6	Very high	85.8	Confident	120 Å²	120	67.5 Å²	67.5	62%	0.615	41%	0.408	S	S	*	.	S	Bend	trans	-119.6	120.3	173.2	-59	175.4	0	0	0	108.8	H132	I89-H132 HydrophobicContact CD1-CB 4.16Å; I89-H132 WeakPolarHBondContact CD1-CD2 3.49Å
90	P	93.4	Very high	87.9	Confident	101 Å²	101	64.4 Å²	64.4	66%	0.656	38%	0.382	S	S	*	.	S	Bend	cis	-69.3	161.6	-6.8	32	-35.8	0	0	0	112	P88 L94	P88-P90 CarbonylContact C-O 3.52Å; P88-P90 CarbonylContact O-C 3.56Å; P88-P90 VanDerWaalsContact O-C 3.32Å; P90-L94 HydrophobicContact CB-CD1 4.28Å
91	S	95.3	Very high	89.3	Confident	12 Å²	12	64.3 Å²	64.3	8%	0.084	37%	0.368	C	S	.	.			trans	-60.7	134.7	174.2	163.7	0	0	0	0	110.6	P88 L93 L94 R161 Q163	P88-S91 PolarHBondContact O-N 2.86Å; S91-L93 PolarHBondContact O-N 3.41Å; S91-L93 PolarHBondContact OG-N 3.31Å; S91-L93 VanDerWaalsContact OG-N 3.12Å; S91-L94 WeakPolarHBondContact O-CG 3.36Å; S91-R161 VanDerWaalsContact CB-O 3.25Å; S91-R161 WeakPolarHBondContact CB-O 3.42Å; S91-R161 PolarHBondContact OG-O 2.78Å; S91-Q163 PolarHBondContact OG-OE1 2.87Å
92	P	94.1	Very high	90.3	Very high	95 Å²	95	63.2 Å²	63.2	62%	0.617	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-7.6	175.8	31.7	-38.2	0	0	0	112.9	P88	P88-P92 HydrophobicContact CG-CG 3.99Å
93	L	95.1	Very high	90.7	Very high	13 Å²	13	59.8 Å²	59.8	7%	0.068	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-14.4	-177.2	-56.7	176.4	0	0	0	113	L62 L63 S91 R161 Q163	L62-L93 HydrophobicContact CB-CD2 3.79Å; L62-L93 HydrophobicContact CD1-CD2 4.09Å; L63-L93 HydrophobicContact CD2-CD1 3.3Å; L63-L93 HydrophobicContact CG-CD1 3.82Å; S91-L93 PolarHBondContact O-N 3.41Å; S91-L93 PolarHBondContact OG-N 3.31Å; S91-L93 VanDerWaalsContact OG-N 3.12Å; L93-R161 HydrophobicContact CB-CB 4.22Å; L93-R161 HydrophobicContact CB-CG 4.11Å; L93-R161 WeakPolarHBondContact O-CD 3.3Å; L93-Q163 HydrophobicContact CD1-CG 4.02Å
94	L	95.6	Very high	90.5	Very high	27 Å²	27	59.2 Å²	59.2	14%	0.141	34%	0.337	C	S	.	.			trans	-60.1	139	-178.3	-57.4	-177.8	0	0	0	111.3	P90 S91 Q162 D217	P90-L94 HydrophobicContact CB-CD1 4.28Å; S91-L94 WeakPolarHBondContact O-CG 3.36Å; L94-Q162 HydrophobicContact CD2-CG 3.82Å; L94-D217 HydrophobicContact CD2-CB 4.22Å
95	V	95.8	Very high	90.4	Very high	23 Å²	23	57.7 Å²	57.7	14%	0.139	33%	0.333	C	S	.	.			trans	-118.7	-5.6	-176.5	-59.8	0	0	0	0	113.8	H54 T58 N59 V98 D217	H54-V95 HydrophobicContact CB-CB 4.29Å; H54-V95 HydrophobicContact CB-CG2 3.79Å; H54-V95 PolarHBondContact CE1-O 3.39Å; H54-V95 PolarHBondContact ND1-O 2.81Å; T58-V95 HydrophobicContact CG2-CG1 3.94Å; N59-V95 HydrophobicContact CB-CG1 4.42Å; N59-V95 WeakPolarHBondContact ND2-CG1 3.31Å; V95-V98 HydrophobicContact CG2-CG1 3.76Å; V95-D217 WeakPolarHBondContact CG2-OD2 3.42Å; V95-D217 PolarHBondContact N-OD1 3.09Å; V95-D217 VanDerWaalsContact N-OD1 3.13Å; V95-D217 PolarHBondContact N-OD2 2.77Å
96	G	95.7	Very high	90.2	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.01	31%	0.309	C	S	.	.	S	Bend	trans	84.2	-133.8	-177	0	0	0	0	0	112.1	V98 N216 D217 H218	G96-V98 PolarHBondContact O-N 2.87Å; G96-N216 WeakPolarHBondContact CA-OD1 3.46Å; G96-N216 WeakPolarHBondContact O-CA 3.33Å; G96-N216 PolarHBondContact O-OD1 2.95Å; G96-D217 WeakPolarHBondContact CA-OD1 3.41Å; G96-D217 PolarHBondContact N-OD1 2.79Å; G96-D217 PolarHBondContact O-N 3.39Å; G96-D217 VanDerWaalsContact O-N 3.09Å; G96-H218 VanDerWaalsContact CA-ND1 3.34Å; G96-H218 WeakPolarHBondContact CA-ND1 3.43Å; G96-H218 PolarHBondContact N-CE1 3.12Å
97	P	96.9	Very high	90.2	Very high	10 Å²	10	48.7 Å²	48.7	7%	0.065	30%	0.296	C	S	.	.	B	Isolated β-bridge	trans	-56.5	130.2	179.8	-28	36.9	0	0	0	113	F48 Y50 P53 H54 E215	F48-P97 HydrophobicContact CB-CG 3.89Å; F48-P97 HydrophobicContact CD1-CG 4.26Å; F48-P97 HydrophobicContact CG-CG 4.44Å; Y50-P97 HydrophobicContact CD1-CB 3.86Å; Y50-P97 HydrophobicContact CD1-CG 4.18Å; Y50-P97 HydrophobicContact CD2-CG 4.5Å; Y50-P97 HydrophobicContact CE1-CB 4.01Å; Y50-P97 HydrophobicContact CE1-CG 4.15Å; Y50-P97 HydrophobicContact CE2-CG 4.47Å; Y50-P97 HydrophobicContact CG-CB 4.37Å; Y50-P97 HydrophobicContact CG-CG 4.36Å; P53-P97 HydrophobicContact CB-CB 4.32Å; H54-P97 PolarHBondContact N-O 3.44Å; P97-E215 CarbonylContact C-O 3.55Å; P97-E215 VanDerWaalsContact CA-O 3.27Å; P97-E215 WeakPolarHBondContact CA-O 3.22Å
98	V	96.5	Very high	90.3	Very high	3 Å²	3	50.8 Å²	50.8	2%	0.018	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-122.8	144	178.2	-67.5	0	0	0	0	111.4	H54 V95 G96 F158 E215	H54-V98 CarbonylContact O-C 3.52Å; H54-V98 VanDerWaalsContact O-CA 3.26Å; H54-V98 WeakPolarHBondContact O-CA 3.39Å; V95-V98 HydrophobicContact CG2-CG1 3.76Å; G96-V98 PolarHBondContact O-N 2.87Å; V98-F158 HydrophobicContact CG2-CD2 4.14Å; V98-F158 HydrophobicContact CG2-CE2 4.14Å; V98-E215 PolarHBondContact N-O 2.83Å
99	S	93.5	Very high	90.4	Very high	19 Å²	19	51.8 Å²	51.8	13%	0.133	31%	0.305	C	S	.	.			trans	-77.3	138.8	-177.4	65.9	0	0	0	0	110.5	H54 H101	H54-S99 PolarHBondContact O-N 2.81Å; H54-S99 PolarHBondContact O-OG 2.75Å; S99-H101 PolarHBondContact OG-CD2 3.49Å; S99-H101 VanDerWaalsContact OG-CD2 3.31Å; S99-H101 PolarHBondContact OG-NE2 3.24Å
100	V	89.2	Confident	90.6	Very high	9 Å²	9	49.7 Å²	49.7	6%	0.055	30%	0.296	C	S	.	.			trans	-111.5	107.1	173.1	178.3	0	0	0	0	109.4	L102 L213 E215 K304	V100-L102 HydrophobicContact CG1-CD2 3.71Å; V100-L102 HydrophobicContact CG1-CG 4.14Å; V100-L213 HydrophobicContact CG1-CB 3.9Å; V100-L213 HydrophobicContact CG1-CD1 3.41Å; V100-L213 VanDerWaalsContact CG1-CD1 3.41Å; V100-L213 HydrophobicContact CG1-CG 4.25Å; V100-L213 HydrophobicContact CG2-CB 4.05Å; V100-E215 HydrophobicContact CG2-CG 3.69Å; V100-K304 HydrophobicContact CB-CB 4.23Å; V100-K304 HydrophobicContact CB-CD 3.6Å; V100-K304 HydrophobicContact CG1-CB 4.11Å; V100-K304 HydrophobicContact CG1-CD 3.65Å; V100-K304 HydrophobicContact CG1-CG 4.37Å; V100-K304 HydrophobicContact CG2-CB 4.26Å; V100-K304 HydrophobicContact CG2-CD 4.42Å; V100-K304 PolarHBondContact O-NZ 2.95Å
101	H	80.6	Confident	90.7	Very high	110 Å²	110	44.9 Å²	44.9	51%	0.509	26%	0.264	S	S	.	.			trans	-94.5	112.1	177.3	-65.9	-81.7	0	0	0	110.5	S99	S99-H101 PolarHBondContact OG-CD2 3.49Å; S99-H101 VanDerWaalsContact OG-CD2 3.31Å; S99-H101 PolarHBondContact OG-NE2 3.24Å
102	L	77.9	Confident	90.8	Very high	56 Å²	56	49 Å²	49	29%	0.293	28%	0.278	S	S	.	.			trans	-97.3	-3.6	-176.6	-61.8	-178.8	0	0	0	113.7	V100 L213 K304 I306	V100-L102 HydrophobicContact CG1-CD2 3.71Å; V100-L102 HydrophobicContact CG1-CG 4.14Å; L102-L213 HydrophobicContact CD2-CD1 3.8Å; L102-K304 HydrophobicContact CD1-CD 4.11Å; L102-K304 HydrophobicContact CD1-CG 4.31Å; L102-K304 HydrophobicContact CG-CD 4.45Å; L102-I306 HydrophobicContact CD2-CB 4.43Å; L102-I306 HydrophobicContact CD2-CD1 4.48Å; L102-I306 HydrophobicContact CD2-CG1 3.77Å; L102-I306 HydrophobicContact CD2-CG2 4.49Å
103	S	71	Confident	90.9	Very high	96 Å²	96	50 Å²	50	67%	0.671	28%	0.275	S	S	*	.	S	Bend	trans	-85.9	118.3	-177.6	35.4	0	0	0	0	110.6
104	S	74.4	Confident	90.9	Very high	111 Å²	111	55.6 Å²	55.6	78%	0.776	29%	0.294	S	S	*	.	S	Bend	trans	51.3	84.4	173.3	-61.6	0	0	0	0	114.5	L106	S104-L106 PolarHBondContact O-N 3.47Å
105	P	82.1	Confident	90.9	Very high	48 Å²	48	54.3 Å²	54.3	31%	0.312	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-61.5	138	-179.7	25.7	-33.3	0	0	0	111.4	S146 R149 S150	P105-S146 WeakPolarHBondContact CG-O 3.48Å; P105-R149 HydrophobicContact CB-CB 3.79Å; P105-R149 HydrophobicContact CG-CB 4.42Å; P105-S150 WeakPolarHBondContact CB-OG 3.38Å
106	L	90.5	Very high	90.9	Very high	53 Å²	53	58.4 Å²	58.4	28%	0.277	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-56	158.5	175.2	-68.1	-177.8	0	0	0	112	S104 D110 I111 R149 Y153	S104-L106 PolarHBondContact O-N 3.47Å; L106-D110 HydrophobicContact CB-CB 4.2Å; L106-D110 HydrophobicContact CD1-CB 4.44Å; L106-I111 HydrophobicContact CB-CD1 4.31Å; L106-I111 HydrophobicContact CB-CG1 3.87Å; L106-R149 WeakPolarHBondContact O-CD 3.2Å; L106-Y153 HydrophobicContact CD1-CD2 3.71Å; L106-Y153 HydrophobicContact CD1-CE2 3.61Å; L106-Y153 HydrophobicContact CG-CD2 4.43Å
107	S	95.1	Very high	90.9	Very high	43 Å²	43	61.5 Å²	61.5	30%	0.301	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-66.4	156.2	171.4	80	0	0	0	0	110.5	E109 D110 I111	S107-E109 PolarHBondContact O-N 2.97Å; S107-D110 WeakPolarHBondContact CB-OD2 3.15Å; S107-D110 PolarHBondContact N-OD2 3.06Å; S107-D110 PolarHBondContact O-N 3.03Å; S107-D110 PolarHBondContact OG-N 3.21Å; S107-D110 VanDerWaalsContact OG-N 3.13Å; S107-D110 PolarHBondContact OG-OD2 3.35Å; S107-I111 VanDerWaalsContact O-CG1 3.28Å; S107-I111 WeakPolarHBondContact O-CG1 3.19Å; S107-I111 PolarHBondContact O-N 2.64Å
108	L	95.9	Very high	91	Very high	50 Å²	50	61.8 Å²	61.8	26%	0.262	33%	0.332	S	S	.	.	H	α-helix	trans	-60.4	-33.5	176.5	-71.4	172.8	0	0	0	111.7	I111 R112 R149 L152 L351	L108-I111 PolarHBondContact O-N 3.41Å; L108-R112 WeakPolarHBondContact O-CB 3.18Å; L108-R112 PolarHBondContact O-N 2.79Å; L108-R149 HydrophobicContact CD2-CG 3.87Å; L108-R149 HydrophobicContact CG-CG 4.07Å; L108-L152 HydrophobicContact CD2-CD1 3.73Å; L108-L351 HydrophobicContact CD2-CD1 4.16Å; L108-L351 WeakPolarHBondContact O-CD1 3.23Å
109	E	96.6	Very high	91	Very high	88 Å²	88	66.8 Å²	66.8	41%	0.411	36%	0.358	S	S	.	.	H	α-helix	trans	-67.3	-44.5	177.4	-178	55	-157	0	0	111.4	S107 I111 R112 Q113	S107-E109 PolarHBondContact O-N 2.97Å; E109-I111 VanDerWaalsContact C-N 3.3Å; E109-I111 PolarHBondContact O-N 3.1Å; E109-R112 WeakPolarHBondContact O-CB 3.24Å; E109-R112 PolarHBondContact O-N 3.4Å; E109-R112 IonicContact OE1-CZ 3.13Å; E109-R112 IonicContact OE1-NE 3.83Å; E109-R112 PolarHBondContact OE1-NE 3.07Å; E109-R112 IonicContact OE1-NH2 3.85Å; E109-R112 PolarHBondContact OE1-NH2 3.05Å; E109-R112 IonicContact OE2-CZ 3.02Å; E109-R112 IonicContact OE2-NE 3.79Å; E109-R112 PolarHBondContact OE2-NE 3.23Å; E109-R112 IonicContact OE2-NH2 3.24Å; E109-R112 PolarHBondContact OE2-NH2 3.46Å; E109-Q113 WeakPolarHBondContact O-CG 3.3Å; E109-Q113 PolarHBondContact O-N 3.02Å; E109-Q113 PolarHBondContact OE1-NE2 3.1Å
110	D	96.8	Very high	91.2	Very high	76 Å²	76	69.8 Å²	69.8	41%	0.406	38%	0.378	S	S	.	.	H	α-helix	trans	-63.1	-38.2	176.1	-60.3	-46.5	0	0	0	111.9	L106 S107 Q113 R114	L106-D110 HydrophobicContact CB-CB 4.2Å; L106-D110 HydrophobicContact CD1-CB 4.44Å; S107-D110 WeakPolarHBondContact CB-OD2 3.15Å; S107-D110 PolarHBondContact N-OD2 3.06Å; S107-D110 PolarHBondContact O-N 3.03Å; S107-D110 PolarHBondContact OG-N 3.21Å; S107-D110 VanDerWaalsContact OG-N 3.13Å; S107-D110 PolarHBondContact OG-OD2 3.35Å; D110-Q113 PolarHBondContact O-N 3.01Å; D110-R114 WeakPolarHBondContact O-CG 3.43Å; D110-R114 PolarHBondContact O-N 3.03Å; D110-R114 VanDerWaalsContact O-N 3.16Å
111	I	96.7	Very high	91.6	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-65.3	-42	176	-62.7	163.5	0	0	0	110.1	L106 S107 L108 E109 R114 N115 R149 L152 Y153 L351	L106-I111 HydrophobicContact CB-CD1 4.31Å; L106-I111 HydrophobicContact CB-CG1 3.87Å; S107-I111 VanDerWaalsContact O-CG1 3.28Å; S107-I111 WeakPolarHBondContact O-CG1 3.19Å; S107-I111 PolarHBondContact O-N 2.64Å; L108-I111 PolarHBondContact O-N 3.41Å; E109-I111 VanDerWaalsContact C-N 3.3Å; E109-I111 PolarHBondContact O-N 3.1Å; I111-R114 PolarHBondContact O-N 3.07Å; I111-N115 PolarHBondContact O-N 3.25Å; I111-N115 PolarHBondContact O-ND2 2.91Å; I111-R149 HydrophobicContact CD1-CB 4.17Å; I111-R149 VanDerWaalsContact CD1-O 3.29Å; I111-R149 WeakPolarHBondContact CD1-O 3.5Å; I111-L152 HydrophobicContact CG2-CB 4.48Å; I111-Y153 HydrophobicContact CG1-CD2 4.32Å; I111-L351 HydrophobicContact CB-CD1 3.8Å; I111-L351 HydrophobicContact CG2-CD1 3.58Å; I111-L351 HydrophobicContact CG2-CD2 4.33Å
112	R	96.7	Very high	92.5	Very high	99 Å²	99	64.1 Å²	64.1	37%	0.374	35%	0.351	S	S	.	.	H	α-helix	trans	-58.8	-48.4	175.6	-174.4	-174.1	76.8	93.8	-8.7	111.4	L108 E109 R114 N115 P350 L351	L108-R112 WeakPolarHBondContact O-CB 3.18Å; L108-R112 PolarHBondContact O-N 2.79Å; E109-R112 WeakPolarHBondContact O-CB 3.24Å; E109-R112 PolarHBondContact O-N 3.4Å; E109-R112 IonicContact OE1-CZ 3.13Å; E109-R112 IonicContact OE1-NE 3.83Å; E109-R112 PolarHBondContact OE1-NE 3.07Å; E109-R112 IonicContact OE1-NH2 3.85Å; E109-R112 PolarHBondContact OE1-NH2 3.05Å; E109-R112 IonicContact OE2-CZ 3.02Å; E109-R112 IonicContact OE2-NE 3.79Å; E109-R112 PolarHBondContact OE2-NE 3.23Å; E109-R112 IonicContact OE2-NH2 3.24Å; E109-R112 PolarHBondContact OE2-NH2 3.46Å; R112-R114 PolarHBondContact O-N 3.39Å; R112-N115 CarbonylContact O-C 3.51Å; R112-N115 PolarHBondContact O-N 3.01Å; R112-P350 HydrophobicContact CG-CB 4.11Å; R112-L351 HydrophobicContact CB-CD1 4.38Å; R112-L351 HydrophobicContact CB-CD2 4.38Å; R112-L351 HydrophobicContact CB-CG 4.37Å
113	Q	96.1	Very high	93.4	Very high	116 Å²	116	65 Å²	65	54%	0.542	35%	0.35	S	S	.	.	H	α-helix	trans	-61.8	-32	179.2	-66	-60.4	-18.1	0	0	112.9	E109 D110 N115	E109-Q113 WeakPolarHBondContact O-CG 3.3Å; E109-Q113 PolarHBondContact O-N 3.02Å; E109-Q113 PolarHBondContact OE1-NE2 3.1Å; D110-Q113 PolarHBondContact O-N 3.01Å; Q113-N115 VanDerWaalsContact C-N 3.3Å
114	R	95.2	Very high	94.7	Very high	129 Å²	129	60.6 Å²	60.6	49%	0.487	32%	0.319	S	S	.	.	H	α-helix	trans	-77	-14.1	176	-70.7	173.6	177.4	-94.6	-1.2	114.1	Y57 D110 I111 R112 P116	Y57-R114 HydrophobicContact CD1-CB 4.45Å; Y57-R114 HydrophobicContact CE1-CB 3.67Å; D110-R114 WeakPolarHBondContact O-CG 3.43Å; D110-R114 PolarHBondContact O-N 3.03Å; D110-R114 VanDerWaalsContact O-N 3.16Å; I111-R114 PolarHBondContact O-N 3.07Å; R112-R114 PolarHBondContact O-N 3.39Å; R114-P116 VanDerWaalsContact C-CD 3.41Å; R114-P116 WeakPolarHBondContact O-CD 3.37Å
115	N	96.5	Very high	95.8	Very high	1 Å²	1	60.1 Å²	60.1	1%	0.005	30%	0.3	C	S	.	.			trans	-125	64.1	-177.7	-66.4	-82.6	0	0	0	110.7	Y57 I111 R112 Q113 L117 V118 H156 Q160	Y57-N115 PolarHBondContact OH-ND2 3.38Å; I111-N115 PolarHBondContact O-N 3.25Å; I111-N115 PolarHBondContact O-ND2 2.91Å; R112-N115 CarbonylContact O-C 3.51Å; R112-N115 PolarHBondContact O-N 3.01Å; Q113-N115 VanDerWaalsContact C-N 3.3Å; N115-L117 PolarHBondContact O-N 3.46Å; N115-L117 VanDerWaalsContact O-N 3.17Å; N115-V118 HydrophobicContact CB-CB 4.28Å; N115-V118 HydrophobicContact CB-CG2 3.81Å; N115-V118 PolarHBondContact O-N 3.18Å; N115-V118 VanDerWaalsContact O-N 3.09Å; N115-H156 HydrophobicContact CB-CB 4.48Å; N115-H156 WeakPolarHBondContact OD1-CB 3.05Å; N115-Q160 PolarHBondContact OD1-NE2 2.94Å
116	P	95.3	Very high	96.4	Very high	108 Å²	108	58 Å²	58	70%	0.701	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-19.2	-173.1	28.4	-36.7	0	0	0	114.1	R114 V118	R114-P116 VanDerWaalsContact C-CD 3.41Å; R114-P116 WeakPolarHBondContact O-CD 3.37Å; P116-V118 VanDerWaalsContact C-N 3.35Å
117	L	95.8	Very high	96.5	Very high	66 Å²	66	58.4 Å²	58.4	35%	0.346	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-9.1	177.6	-59.1	179.2	0	0	0	113.2	L63 N115 Y124 P127	L63-L117 HydrophobicContact CB-CD1 3.92Å; L63-L117 HydrophobicContact CD1-CD1 4.37Å; N115-L117 PolarHBondContact O-N 3.46Å; N115-L117 VanDerWaalsContact O-N 3.17Å; L117-Y124 HydrophobicContact CB-CD2 4Å; L117-Y124 HydrophobicContact CB-CE2 3.85Å; L117-Y124 HydrophobicContact CD1-CE2 4.17Å; L117-P127 HydrophobicContact CD1-CG 4.45Å
118	V	97.8	Very high	96.2	Very high	16 Å²	16	58.4 Å²	58.4	10%	0.097	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-81.6	122.7	176.6	177.5	0	0	0	0	109	N115 P116 H156 L351	N115-V118 HydrophobicContact CB-CB 4.28Å; N115-V118 HydrophobicContact CB-CG2 3.81Å; N115-V118 PolarHBondContact O-N 3.18Å; N115-V118 VanDerWaalsContact O-N 3.09Å; P116-V118 VanDerWaalsContact C-N 3.35Å; V118-H156 HydrophobicContact CG2-CB 4.36Å; V118-L351 HydrophobicContact CG1-CD2 4.25Å
119	L	97.6	Very high	96.1	Very high	108 Å²	108	56.3 Å²	56.3	57%	0.565	28%	0.278	S	S	*	.	B	Isolated β-bridge	trans	-88.6	159.1	178.4	-58.5	178.8	0	0	0	111	G122 R123	L119-G122 PolarHBondContact O-N 2.8Å; L119-G122 VanDerWaalsContact O-N 3.07Å; L119-R123 HydrophobicContact CB-CB 4.3Å; L119-R123 PolarHBondContact N-O 2.95Å; L119-R123 PolarHBondContact O-N 3.32Å
120	P	98.2	Very high	96	Very high	83 Å²	83	55 Å²	55	54%	0.539	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	143.5	173.2	-27.5	35.4	0	0	0	113.1	G122 L348	P120-G122 VanDerWaalsContact C-N 3.33Å; P120-L348 HydrophobicContact CB-CB 4.47Å
121	G	97.8	Very high	96	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.8	1.5	-166.6	0	0	0	0	0	113.6	R123 S167 E349 Y352 T353	G121-R123 VanDerWaalsContact C-N 3.31Å; G121-S167 PolarHBondContact O-OG 2.8Å; G121-E349 PolarHBondContact N-O 3.02Å; G121-Y352 CarbonylContact C-O 3.57Å; G121-Y352 WeakPolarHBondContact CA-O 3.46Å; G121-Y352 CarbonylContact O-C 3.36Å; G121-Y352 VanDerWaalsContact O-C 3.24Å; G121-Y352 WeakPolarHBondContact O-CA 3.4Å; G121-T353 VanDerWaalsContact CA-OG1 3.27Å; G121-T353 WeakPolarHBondContact CA-OG1 3.49Å; G121-T353 PolarHBondContact O-N 3.05Å; G121-T353 VanDerWaalsContact O-N 3.12Å; G121-T353 PolarHBondContact O-OG1 2.88Å
122	G	98.2	Very high	95.9	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.2	35.1	-175.3	0	0	0	0	0	112.3	L119 P120 S167 I168 L351	L119-G122 PolarHBondContact O-N 2.8Å; L119-G122 VanDerWaalsContact O-N 3.07Å; P120-G122 VanDerWaalsContact C-N 3.33Å; G122-S167 WeakPolarHBondContact O-CA 3.49Å; G122-I168 PolarHBondContact O-N 3.25Å; G122-L351 WeakPolarHBondContact CA-O 3.33Å
123	R	98.3	Very high	95.9	Very high	75 Å²	75	54 Å²	54	28%	0.283	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	140.2	-174	-73	178	162.8	-160.5	-10.6	110.3	L119 G121 Y166 S167	L119-R123 HydrophobicContact CB-CB 4.3Å; L119-R123 PolarHBondContact N-O 2.95Å; L119-R123 PolarHBondContact O-N 3.32Å; G121-R123 VanDerWaalsContact C-N 3.31Å; R123-Y166 WeakPolarHBondContact CA-O 3.32Å; R123-S167 WeakPolarHBondContact CG-OG 3.46Å
124	Y	98.1	Very high	96	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.008	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	138.8	176.1	167.7	-93.6	0	0	0	110.8	L63 L117 P126 Q160 I164 H165 Y166	L63-Y124 WeakPolarHBondContact CD2-OH 3.36Å; L117-Y124 HydrophobicContact CB-CD2 4Å; L117-Y124 HydrophobicContact CB-CE2 3.85Å; L117-Y124 HydrophobicContact CD1-CE2 4.17Å; Y124-P126 HydrophobicContact CE1-CG 3.99Å; Y124-Q160 HydrophobicContact CD1-CG 3.88Å; Y124-Q160 HydrophobicContact CD2-CG 3.67Å; Y124-Q160 HydrophobicContact CE1-CB 4.11Å; Y124-Q160 HydrophobicContact CE1-CG 3.81Å; Y124-Q160 HydrophobicContact CE2-CB 4.33Å; Y124-Q160 HydrophobicContact CE2-CG 3.61Å; Y124-Q160 HydrophobicContact CG-CG 3.79Å; Y124-I164 WeakPolarHBondContact CD1-O 3.32Å; Y124-H165 WeakPolarHBondContact O-CA 3.33Å; Y124-H165 PolarHBondContact O-CD2 3.02Å; Y124-Y166 VanDerWaalsContact CB-CE1 3.45Å; Y124-Y166 AromaticContact CD1-CD1 3.74Å; Y124-Y166 HydrophobicContact CD1-CD1 3.74Å; Y124-Y166 AromaticContact CD1-CE1 3.39Å; Y124-Y166 HydrophobicContact CD1-CE1 3.39Å; Y124-Y166 HydrophobicContact CE1-CE1 4.38Å; Y124-Y166 HydrophobicContact CG-CD1 4.3Å; Y124-Y166 AromaticContact CG-CE1 3.69Å; Y124-Y166 HydrophobicContact CG-CE1 3.69Å; Y124-Y166 PolarHBondContact N-O 3.09Å; Y124-Y166 PolarHBondContact O-N 3.09Å
125	R	96.3	Very high	96.1	Very high	101 Å²	101	44.5 Å²	44.5	38%	0.381	23%	0.231	S	C	.	.			trans	-130.6	138	167.9	-164.7	-175.2	-170.6	86.2	-1.2	108	E130 P131	R125-E130 IonicContact CZ-OE2 2.94Å; R125-E130 IonicContact NE-OE2 2.87Å; R125-E130 PolarHBondContact NE-OE2 3.47Å; R125-E130 IonicContact NH2-OE2 2.67Å; R125-E130 PolarHBondContact NH2-OE2 3.08Å; R125-P131 HydrophobicContact CG-CG 3.89Å
126	P	95.1	Very high	96.2	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.019	23%	0.231	C	C	.	.			trans	-55	131.2	171.2	-24.5	34.9	0	0	0	110.8	Y124 D128 P131 Q163	Y124-P126 HydrophobicContact CE1-CG 3.99Å; P126-D128 VanDerWaalsContact C-N 3.32Å; P126-P131 HydrophobicContact CG-CB 4.28Å; P126-Q163 HydrophobicContact CG-CB 3.99Å; P126-Q163 WeakPolarHBondContact CG-O 3.29Å
127	P	91.9	Very high	96.4	Very high	62 Å²	62	39.3 Å²	39.3	40%	0.403	20%	0.197	S	C	.	.	S	Bend	trans	-79.2	-16.2	-177.6	31.1	-35.8	0	0	0	113.5	L117	L117-P127 HydrophobicContact CD1-CG 4.45Å
128	D	89.5	Confident	96.5	Very high	43 Å²	43	36.2 Å²	36.2	23%	0.23	18%	0.181	C	C	.	.	S	Bend	trans	-111.7	-6.6	-167.3	59	-39.9	0	0	0	114.1	P126	P126-D128 VanDerWaalsContact C-N 3.32Å
129	C	93.3	Very high	96.6	Very high	7 Å²	7	35.4 Å²	35.4	5%	0.047	18%	0.176	C	C	.	.	S	Bend	trans	-155.8	161.7	179.4	60.6	0	0	0	0	112.3	K85 C87 P131 Q163	K85-C129 CarbonylContact O-C 3.47Å; K85-C129 WeakPolarHBondContact O-CA 3.22Å; K85-C129 VanDerWaalsContact O-CB 3.25Å; K85-C129 WeakPolarHBondContact O-CB 3.32Å; C87-C129 WeakPolarHBondContact CA-SG 3.43Å; C87-C129 HydrophobicContact CB-CB 3.89Å; C87-C129 WeakPolarHBondContact CB-SG 3.28Å; C87-C129 VanDerWaalsContact SG-C 3.52Å; C87-C129 WeakPolarHBondContact SG-CB 3.21Å; C87-C129 CovalentContact SG-SG 2.03Å; C87-C129 PolarHBondContact SG-SG 3.48Å; C129-P131 WeakPolarHBondContact O-CD 3.47Å; C129-Q163 PolarHBondContact SG-NE2 3.29Å
130	E	95.4	Very high	96.6	Very high	61 Å²	61	30.6 Å²	30.6	29%	0.285	15%	0.151	S	C	.	.	B	Isolated β-bridge	trans	-85.1	117.8	173.6	-67.2	-57.8	154	0	0	111	L84 K85 D86 C87 R125	L84-E130 HydrophobicContact CB-CG 3.86Å; K85-E130 PolarHBondContact O-N 3.38Å; D86-E130 WeakPolarHBondContact CA-O 3.15Å; C87-E130 PolarHBondContact N-O 2.85Å; C87-E130 PolarHBondContact SG-O 3.1Å; C87-E130 VanDerWaalsContact SG-O 3.35Å; R125-E130 IonicContact CZ-OE2 2.94Å; R125-E130 IonicContact NE-OE2 2.87Å; R125-E130 PolarHBondContact NE-OE2 3.47Å; R125-E130 IonicContact NH2-OE2 2.67Å; R125-E130 PolarHBondContact NH2-OE2 3.08Å
131	P	96	Very high	96.5	Very high	8 Å²	8	27.2 Å²	27.2	5%	0.052	13%	0.128	C	C	.	.			trans	-73.7	135.9	-178	28.1	-33.4	0	0	0	111.9	R125 P126 C129 H133 H165	R125-P131 HydrophobicContact CG-CG 3.89Å; P126-P131 HydrophobicContact CG-CB 4.28Å; C129-P131 WeakPolarHBondContact O-CD 3.47Å; P131-H133 VanDerWaalsContact C-N 3.32Å; P131-H165 HydrophobicContact CB-CB 4.12Å; P131-H165 HydrophobicContact CG-CB 3.64Å
132	H	95.3	Very high	96.3	Very high	82 Å²	82	28.2 Å²	28.2	38%	0.38	13%	0.132	S	C	.	.	S	Bend	trans	-75.6	-19.5	174.8	-68.4	-70.5	0	0	0	114.2	D86 C87 I89	D86-H132 IonicContact OD2-CE1 2.9Å; C87-H132 PolarHBondContact O-CD2 3.03Å; C87-H132 PolarHBondContact O-NE2 2.84Å; I89-H132 HydrophobicContact CD1-CB 4.16Å; I89-H132 WeakPolarHBondContact CD1-CD2 3.49Å
133	H	95.9	Very high	95.8	Very high	64 Å²	64	33.9 Å²	33.9	30%	0.296	16%	0.162	S	C	.	.			trans	-124.6	130.5	-169.2	-58.7	-52.7	0	0	0	110.6	P131 I164 H165 T222	P131-H133 VanDerWaalsContact C-N 3.32Å; H133-I164 HydrophobicContact CB-CB 4.35Å; H133-I164 HydrophobicContact CB-CG2 3.96Å; H133-H165 WeakPolarHBondContact O-CB 3.34Å; H133-H165 PolarHBondContact O-N 3.48Å; H133-T222 HydrophobicContact CB-CG2 4.01Å; H133-T222 WeakPolarHBondContact CD2-CG2 3.47Å
134	H	97.9	Very high	95.4	Very high	45 Å²	45	31.5 Å²	31.5	21%	0.208	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	106.3	179	-63.2	-121.7	0	0	0	108.1	H165 E200 W202 S203 C204	H134-H165 CarbonylContact C-O 3.55Å; H134-H165 WeakPolarHBondContact CA-O 3.19Å; H134-H165 AromaticContact CE1-ND1 3.97Å; H134-H165 AromaticContact CG-ND1 3.73Å; H134-H165 AromaticContact ND1-CG 3.82Å; H134-H165 AromaticContact ND1-ND1 3.12Å; H134-H165 PolarHBondContact ND1-ND1 3.19Å; H134-H165 VanDerWaalsContact ND1-ND1 3.12Å; H134-E200 IonicContact ND1-OE1 3.67Å; H134-W202 HydrophobicContact CB-CE3 4Å; H134-W202 HydrophobicContact CB-CZ3 4.34Å; H134-S203 PolarHBondContact N-OG 3.03Å; H134-S203 VanDerWaalsContact N-OG 3.13Å; H134-S203 PolarHBondContact O-N 3.12Å; H134-S203 PolarHBondContact O-OG 3.07Å; H134-S203 VanDerWaalsContact O-OG 3.12Å; H134-C204 PolarHBondContact O-N 2.78Å
135	T	98.6	Very high	95.2	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	119.2	-169.6	-61.3	0	0	0	0	112.4	I137 H165 Y166 S167 W202 C204 F206 Y221	T135-I137 HydrophobicContact CG2-CD1 4.28Å; T135-I137 HydrophobicContact CG2-CG1 4.26Å; T135-H165 PolarHBondContact N-O 3.21Å; T135-Y166 WeakPolarHBondContact O-CA 3.16Å; T135-Y166 WeakPolarHBondContact O-CB 3.38Å; T135-S167 PolarHBondContact O-N 2.88Å; T135-W202 VanDerWaalsContact C-CE3 3.43Å; T135-C204 WeakPolarHBondContact CA-O 3.41Å; T135-C204 HydrophobicContact CG2-CB 4.43Å; T135-F206 HydrophobicContact CG2-CB 4.38Å; T135-F206 HydrophobicContact CG2-CD2 3.39Å; T135-F206 HydrophobicContact CG2-CE2 4.02Å; T135-F206 HydrophobicContact CG2-CG 4.12Å; T135-Y221 PolarHBondContact OG1-O 2.78Å
136	A	98.8	Very high	95.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	126.2	164.9	0	0	0	0	0	110	Y169 A196 W202 C204 I205 F206	A136-Y169 HydrophobicContact CB-CD2 4.23Å; A136-Y169 HydrophobicContact CB-CE2 4.03Å; A136-A196 HydrophobicContact CB-CB 4.08Å; A136-W202 HydrophobicContact CB-CB 4.29Å; A136-W202 HydrophobicContact CB-CD2 3.71Å; A136-W202 HydrophobicContact CB-CE3 4.29Å; A136-W202 HydrophobicContact CB-CG 3.67Å; A136-C204 PolarHBondContact N-O 2.73Å; A136-I205 CarbonylContact O-C 3.48Å; A136-I205 WeakPolarHBondContact O-CA 3.33Å; A136-F206 PolarHBondContact O-N 2.81Å
137	I	98.9	Very high	95.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	113.2	172.7	-57.1	98.8	0	0	0	109	T135 V139 L159 Y166 S167 I168 Y169 F206 H208 Y221	T135-I137 HydrophobicContact CG2-CD1 4.28Å; T135-I137 HydrophobicContact CG2-CG1 4.26Å; I137-V139 HydrophobicContact CG2-CG2 4.06Å; I137-L159 HydrophobicContact CD1-CD1 3.7Å; I137-L159 HydrophobicContact CG1-CD1 4.41Å; I137-Y166 HydrophobicContact CD1-CD2 3.85Å; I137-Y166 HydrophobicContact CD1-CG 4.14Å; I137-S167 PolarHBondContact N-O 2.9Å; I137-I168 HydrophobicContact CB-CG1 4.42Å; I137-I168 HydrophobicContact CD1-CG1 4.2Å; I137-Y169 PolarHBondContact O-N 3.45Å; I137-F206 HydrophobicContact CB-CB 4.38Å; I137-F206 HydrophobicContact CG1-CB 4.07Å; I137-F206 HydrophobicContact CG2-CB 4.32Å; I137-H208 HydrophobicContact CG2-CB 3.97Å; I137-Y221 HydrophobicContact CG1-CD1 4.36Å
138	V	98.8	Very high	95.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	120.7	-179.3	-179.9	0	0	0	0	110	V171 L189 V193 I205 F206 H208	V138-V171 HydrophobicContact CG1-CG2 3.84Å; V138-L189 HydrophobicContact CG1-CD2 4.11Å; V138-V193 HydrophobicContact CG2-CG2 4.25Å; V138-I205 HydrophobicContact CG2-CG2 4.34Å; V138-F206 PolarHBondContact N-O 3.26Å; V138-H208 PolarHBondContact O-N 2.89Å
139	V	98.7	Very high	95.6	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	111.9	-175.9	-173.5	0	0	0	0	109.8	I137 L151 I168 Y169 I170 V171 H208 V210	I137-V139 HydrophobicContact CG2-CG2 4.06Å; V139-L151 HydrophobicContact CG1-CD2 4.12Å; V139-L151 HydrophobicContact CG2-CD2 4.03Å; V139-I168 HydrophobicContact CG2-CG2 4.45Å; V139-Y169 PolarHBondContact N-O 3.45Å; V139-I170 HydrophobicContact CB-CD1 3.63Å; V139-I170 HydrophobicContact CG1-CD1 4.12Å; V139-I170 HydrophobicContact CG2-CD1 3.88Å; V139-V171 PolarHBondContact O-N 3.17Å; V139-H208 WeakPolarHBondContact CA-O 3.16Å; V139-H208 HydrophobicContact CG2-CB 4.32Å; V139-V210 HydrophobicContact CG1-CB 3.76Å; V139-V210 HydrophobicContact CG1-CG2 4.16Å
140	P	97.7	Very high	95.8	Very high	6 Å²	6	32.9 Å²	32.9	4%	0.039	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	132.2	174.7	31	-29	0	0	0	109.4	F183 R185 L188 L189 H208	P140-F183 HydrophobicContact CB-CZ 4.18Å; P140-R185 HydrophobicContact CB-CG 4.28Å; P140-R185 HydrophobicContact CG-CG 3.71Å; P140-L188 HydrophobicContact CB-CB 3.69Å; P140-L188 HydrophobicContact CB-CD1 4.02Å; P140-L189 HydrophobicContact CB-CD2 4.48Å; P140-L189 HydrophobicContact CG-CD2 3.88Å; P140-L189 HydrophobicContact CG-CG 4.16Å; P140-H208 VanDerWaalsContact CD-O 3.25Å; P140-H208 WeakPolarHBondContact CD-O 3.37Å
141	F	96.4	Very high	95.9	Very high	12 Å²	12	30 Å²	30	5%	0.053	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	139.6	-166.1	-175	-102.6	0	0	0	113.8	R144 L148 I170 V171 Q172 Q173 V210	F141-R144 HydrophobicContact CD2-CB 4.28Å; F141-R144 VanDerWaalsContact CE2-C 3.44Å; F141-R144 HydrophobicContact CE2-CB 3.63Å; F141-R144 WeakPolarHBondContact CE2-O 3.19Å; F141-R144 HydrophobicContact CZ-CB 4.29Å; F141-L148 HydrophobicContact CD2-CB 4.49Å; F141-L148 HydrophobicContact CE1-CD2 4.45Å; F141-L148 HydrophobicContact CE2-CB 3.74Å; F141-L148 HydrophobicContact CE2-CD2 4.21Å; F141-L148 HydrophobicContact CZ-CB 4.16Å; F141-L148 HydrophobicContact CZ-CD2 4.08Å; F141-I170 HydrophobicContact CB-CG2 3.5Å; F141-I170 HydrophobicContact CD1-CG2 3.8Å; F141-I170 HydrophobicContact CD2-CG2 4.43Å; F141-I170 HydrophobicContact CG-CG2 3.67Å; F141-V171 PolarHBondContact N-O 3.24Å; F141-Q172 WeakPolarHBondContact O-CA 3.23Å; F141-Q173 PolarHBondContact O-N 2.91Å; F141-V210 HydrophobicContact CD2-CB 4.44Å; F141-V210 HydrophobicContact CD2-CG2 3.94Å; F141-V210 HydrophobicContact CE2-CG2 4.17Å
142	R	92.8	Very high	96	Very high	22 Å²	22	29.6 Å²	29.6	8%	0.083	15%	0.145	C	C	.	.	S	Bend	trans	-157.6	118.2	166.5	-169.3	170.9	69.6	177.7	10.3	111	R144 N180 G181 F183 G313	R142-R144 VanDerWaalsContact C-N 3.35Å; R142-R144 PolarHBondContact O-N 3.17Å; R142-N180 PolarHBondContact NH1-O 2.83Å; R142-G181 PolarHBondContact NH1-O 3.43Å; R142-G181 PolarHBondContact NH2-O 2.9Å; R142-F183 HydrophobicContact CB-CD2 3.88Å; R142-F183 HydrophobicContact CB-CE2 3.75Å; R142-G313 VanDerWaalsContact NH2-C 3.3Å; R142-G313 PolarHBondContact NH2-O 3.16Å
143	N	88.1	Confident	96.1	Very high	118 Å²	118	27.6 Å²	27.6	63%	0.631	14%	0.135	S	C	*	.	S	Bend	trans	58.4	36.7	166.8	-155.6	57.2	0	0	0	115.1
144	R	90.8	Very high	96.2	Very high	25 Å²	25	24.7 Å²	24.7	9%	0.094	12%	0.121	C	C	.	.			trans	-127.2	44.9	-178.8	-74.2	-174.3	167.6	-134.7	-12.2	113.4	F141 R142 S146 H147 L148 V210 D211 H308 D311	F141-R144 HydrophobicContact CD2-CB 4.28Å; F141-R144 VanDerWaalsContact CE2-C 3.44Å; F141-R144 HydrophobicContact CE2-CB 3.63Å; F141-R144 WeakPolarHBondContact CE2-O 3.19Å; F141-R144 HydrophobicContact CZ-CB 4.29Å; R142-R144 VanDerWaalsContact C-N 3.35Å; R142-R144 PolarHBondContact O-N 3.17Å; R144-S146 VanDerWaalsContact C-N 3.26Å; R144-S146 PolarHBondContact O-N 3.09Å; R144-S146 VanDerWaalsContact O-N 3.17Å; R144-H147 HydrophobicContact CB-CB 4.21Å; R144-H147 PolarHBondContact NH1-CE1 2.85Å; R144-H147 PolarHBondContact NH1-ND1 2.97Å; R144-H147 WeakPolarHBondContact O-CB 3.41Å; R144-H147 PolarHBondContact O-N 3.45Å; R144-L148 PolarHBondContact O-N 3.22Å; R144-V210 HydrophobicContact CB-CG1 4.35Å; R144-D211 IonicContact NH1-OD2 2.96Å; R144-D211 PolarHBondContact NH1-OD2 3.11Å; R144-H308 PolarHBondContact NH1-CD2 3.24Å; R144-H308 PolarHBondContact NH1-NE2 2.92Å; R144-H308 VanDerWaalsContact NH1-NE2 3.16Å; R144-H308 PolarHBondContact NH2-CD2 3.28Å; R144-H308 PolarHBondContact NH2-CE1 3.1Å; R144-H308 PolarHBondContact NH2-ND1 3.49Å; R144-H308 PolarHBondContact NH2-NE2 3.14Å; R144-D311 IonicContact CZ-OD1 3.41Å; R144-D311 IonicContact CZ-OD2 2.64Å; R144-D311 IonicContact NE-OD1 3.93Å; R144-D311 IonicContact NE-OD2 3.82Å; R144-D311 PolarHBondContact NE-OD2 2.83Å; R144-D311 IonicContact NH2-OD1 2.63Å; R144-D311 PolarHBondContact NH2-OD1 3.09Å; R144-D311 IonicContact NH2-OD2 3.17Å; R144-D311 PolarHBondContact NH2-OD2 3.25Å
145	I	93.1	Very high	96.2	Very high	76 Å²	76	22.5 Å²	22.5	39%	0.39	11%	0.111	S	C	.	.	H	α-helix	trans	-58.7	-33.6	-170.4	-167.2	59.2	0	0	0	113.9	L148 R149	I145-L148 HydrophobicContact CD1-CD2 4.1Å; I145-L148 PolarHBondContact O-N 3.02Å; I145-R149 WeakPolarHBondContact O-CG 3.28Å; I145-R149 PolarHBondContact O-N 3.16Å
146	S	93.6	Very high	96.1	Very high	55 Å²	55	22.5 Å²	22.5	39%	0.385	11%	0.111	S	C	.	.	H	α-helix	trans	-65.5	-39.3	175.1	52.9	0	0	0	0	112.5	P105 R144 S150	P105-S146 WeakPolarHBondContact CG-O 3.48Å; R144-S146 VanDerWaalsContact C-N 3.26Å; R144-S146 PolarHBondContact O-N 3.09Å; R144-S146 VanDerWaalsContact O-N 3.17Å; S146-S150 PolarHBondContact O-N 3.27Å; S146-S150 VanDerWaalsContact O-N 3.11Å; S146-S150 PolarHBondContact O-OG 2.95Å
147	H	95.1	Very high	96.1	Very high	20 Å²	20	22.5 Å²	22.5	9%	0.093	11%	0.111	C	C	.	.	H	α-helix	trans	-69.4	-42.7	176	-61.5	-170	0	0	0	110.2	R144 R149 S150 L151 V210 I306 H308	R144-H147 HydrophobicContact CB-CB 4.21Å; R144-H147 PolarHBondContact NH1-CE1 2.85Å; R144-H147 PolarHBondContact NH1-ND1 2.97Å; R144-H147 WeakPolarHBondContact O-CB 3.41Å; R144-H147 PolarHBondContact O-N 3.45Å; H147-R149 VanDerWaalsContact C-N 3.32Å; H147-R149 PolarHBondContact O-N 2.92Å; H147-S150 WeakPolarHBondContact O-CB 3.44Å; H147-S150 PolarHBondContact O-N 3.02Å; H147-S150 VanDerWaalsContact O-N 3.1Å; H147-L151 WeakPolarHBondContact O-CB 3.48Å; H147-L151 PolarHBondContact O-N 2.82Å; H147-V210 HydrophobicContact CB-CG1 4.27Å; H147-V210 HydrophobicContact CB-CG2 4.09Å; H147-I306 HydrophobicContact CB-CD1 3.97Å; H147-H308 AromaticContact CE1-CD2 3.97Å
148	L	96.6	Very high	96	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.005	11%	0.111	C	C	.	.	H	α-helix	trans	-58.2	-44	176	178.6	58.9	0	0	0	111.5	F141 R144 I145 S150 L151 L152 I170 V210 Y352	F141-L148 HydrophobicContact CD2-CB 4.49Å; F141-L148 HydrophobicContact CE1-CD2 4.45Å; F141-L148 HydrophobicContact CE2-CB 3.74Å; F141-L148 HydrophobicContact CE2-CD2 4.21Å; F141-L148 HydrophobicContact CZ-CB 4.16Å; F141-L148 HydrophobicContact CZ-CD2 4.08Å; R144-L148 PolarHBondContact O-N 3.22Å; I145-L148 HydrophobicContact CD1-CD2 4.1Å; I145-L148 PolarHBondContact O-N 3.02Å; L148-S150 VanDerWaalsContact C-N 3.34Å; L148-S150 PolarHBondContact O-N 3.26Å; L148-L151 HydrophobicContact CD1-CD2 4.43Å; L148-L151 WeakPolarHBondContact O-CB 3.47Å; L148-L151 PolarHBondContact O-N 3.04Å; L148-L152 HydrophobicContact CD1-CD1 3.95Å; L148-L152 HydrophobicContact CD1-CD2 4.35Å; L148-L152 HydrophobicContact CD1-CG 3.93Å; L148-L152 HydrophobicContact CG-CD1 3.93Å; L148-L152 HydrophobicContact CG-CG 4.35Å; L148-L152 VanDerWaalsContact O-CG 3.28Å; L148-L152 WeakPolarHBondContact O-CG 3.42Å; L148-L152 PolarHBondContact O-N 2.91Å; L148-I170 HydrophobicContact CD1-CD1 3.46Å; L148-I170 VanDerWaalsContact CD1-CD1 3.46Å; L148-I170 HydrophobicContact CD1-CG1 3.86Å; L148-I170 HydrophobicContact CD2-CG1 4.37Å; L148-I170 HydrophobicContact CD2-CG2 4.34Å; L148-V210 HydrophobicContact CB-CG2 4.16Å; L148-Y352 HydrophobicContact CD2-CE1 4.36Å; L148-Y352 HydrophobicContact CD2-CE2 4.46Å
149	R	96.6	Very high	96	Very high	85 Å²	85	22.5 Å²	22.5	32%	0.321	11%	0.111	S	C	.	.	H	α-helix	trans	-60.5	-42.8	174.5	-71.6	169.6	-176.3	-179.2	2.4	112.3	P105 L106 L108 I111 I145 H147 L151 Y153	P105-R149 HydrophobicContact CB-CB 3.79Å; P105-R149 HydrophobicContact CG-CB 4.42Å; L106-R149 WeakPolarHBondContact O-CD 3.2Å; L108-R149 HydrophobicContact CD2-CG 3.87Å; L108-R149 HydrophobicContact CG-CG 4.07Å; I111-R149 HydrophobicContact CD1-CB 4.17Å; I111-R149 VanDerWaalsContact CD1-O 3.29Å; I111-R149 WeakPolarHBondContact CD1-O 3.5Å; I145-R149 WeakPolarHBondContact O-CG 3.28Å; I145-R149 PolarHBondContact O-N 3.16Å; H147-R149 VanDerWaalsContact C-N 3.32Å; H147-R149 PolarHBondContact O-N 2.92Å; R149-L151 VanDerWaalsContact C-N 3.34Å; R149-Y153 VanDerWaalsContact O-CB 3.25Å; R149-Y153 WeakPolarHBondContact O-CB 3.33Å; R149-Y153 PolarHBondContact O-N 3.42Å
150	S	96.7	Very high	96	Very high	11 Å²	11	22.6 Å²	22.6	8%	0.077	11%	0.111	C	C	.	.	H	α-helix	trans	-63	-42.4	176.3	-51.3	0	0	0	0	111.5	P105 S146 H147 L148 H154	P105-S150 WeakPolarHBondContact CB-OG 3.38Å; S146-S150 PolarHBondContact O-N 3.27Å; S146-S150 VanDerWaalsContact O-N 3.11Å; S146-S150 PolarHBondContact O-OG 2.95Å; H147-S150 WeakPolarHBondContact O-CB 3.44Å; H147-S150 PolarHBondContact O-N 3.02Å; H147-S150 VanDerWaalsContact O-N 3.1Å; L148-S150 VanDerWaalsContact C-N 3.34Å; L148-S150 PolarHBondContact O-N 3.26Å; S150-H154 WeakPolarHBondContact O-CB 3.25Å; S150-H154 PolarHBondContact O-N 3.46Å; S150-H154 VanDerWaalsContact O-N 3.12Å
151	L	97.6	Very high	95.9	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-61.3	-51.5	176.9	-176	75.2	0	0	0	111.5	V139 H147 L148 R149 H154 L155 V210 L213	V139-L151 HydrophobicContact CG1-CD2 4.12Å; V139-L151 HydrophobicContact CG2-CD2 4.03Å; H147-L151 WeakPolarHBondContact O-CB 3.48Å; H147-L151 PolarHBondContact O-N 2.82Å; L148-L151 HydrophobicContact CD1-CD2 4.43Å; L148-L151 WeakPolarHBondContact O-CB 3.47Å; L148-L151 PolarHBondContact O-N 3.04Å; R149-L151 VanDerWaalsContact C-N 3.34Å; L151-H154 PolarHBondContact O-N 3.41Å; L151-L155 HydrophobicContact CD1-CD1 3.52Å; L151-L155 HydrophobicContact CD1-CG 3.83Å; L151-L155 HydrophobicContact CD2-CD1 4.32Å; L151-L155 HydrophobicContact CG-CD1 3.76Å; L151-L155 HydrophobicContact CG-CG 4.16Å; L151-L155 VanDerWaalsContact O-CB 3.32Å; L151-L155 WeakPolarHBondContact O-CB 3.14Å; L151-L155 PolarHBondContact O-N 2.9Å; L151-V210 HydrophobicContact CD2-CG2 4.18Å; L151-L213 HydrophobicContact CB-CD2 4.32Å; L151-L213 HydrophobicContact CD1-CD2 3.78Å
152	L	97.9	Very high	96	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-65.3	-43	-178.8	-64.8	171.4	0	0	0	111.4	L108 I111 L148 H154 H156 I168 L351 Y352	L108-L152 HydrophobicContact CD2-CD1 3.73Å; I111-L152 HydrophobicContact CG2-CB 4.48Å; L148-L152 HydrophobicContact CD1-CD1 3.95Å; L148-L152 HydrophobicContact CD1-CD2 4.35Å; L148-L152 HydrophobicContact CD1-CG 3.93Å; L148-L152 HydrophobicContact CG-CD1 3.93Å; L148-L152 HydrophobicContact CG-CG 4.35Å; L148-L152 VanDerWaalsContact O-CG 3.28Å; L148-L152 WeakPolarHBondContact O-CG 3.42Å; L148-L152 PolarHBondContact O-N 2.91Å; L152-H154 PolarHBondContact O-N 3.39Å; L152-H156 PolarHBondContact O-CD2 2.98Å; L152-H156 PolarHBondContact O-N 2.88Å; L152-I168 HydrophobicContact CD2-CD1 3.88Å; L152-I168 HydrophobicContact CD2-CG2 4.28Å; L152-L351 HydrophobicContact CD1-CB 4.12Å; L152-L351 HydrophobicContact CD1-CD1 4.47Å; L152-Y352 HydrophobicContact CD1-CD1 3.64Å; L152-Y352 HydrophobicContact CD1-CE1 4.02Å; L152-Y352 HydrophobicContact CD2-CD1 4.43Å
153	Y	97	Very high	96.2	Very high	39 Å²	39	21.9 Å²	21.9	15%	0.153	11%	0.109	C	C	.	.	H	α-helix	trans	-54.8	-40.1	175.1	170.7	-100.1	0	0	0	112.2	V56 Y57 L106 I111 R149 P157	V56-Y153 HydrophobicContact CG1-CE1 3.95Å; Y57-Y153 HydrophobicContact CD2-CE2 4.13Å; Y57-Y153 AromaticContact CE2-CD2 3.73Å; Y57-Y153 HydrophobicContact CE2-CD2 3.73Å; Y57-Y153 HydrophobicContact CE2-CE1 4.29Å; Y57-Y153 AromaticContact CE2-CE2 3.27Å; Y57-Y153 HydrophobicContact CE2-CE2 3.27Å; Y57-Y153 HydrophobicContact CE2-CG 4.43Å; Y57-Y153 AromaticContact CE2-CZ 3.59Å; Y57-Y153 WeakPolarHBondContact CE2-O 3.36Å; Y57-Y153 AromaticContact CZ-CE2 3.93Å; Y57-Y153 PolarHBondContact OH-O 3Å; L106-Y153 HydrophobicContact CD1-CD2 3.71Å; L106-Y153 HydrophobicContact CD1-CE2 3.61Å; L106-Y153 HydrophobicContact CG-CD2 4.43Å; I111-Y153 HydrophobicContact CG1-CD2 4.32Å; R149-Y153 VanDerWaalsContact O-CB 3.25Å; R149-Y153 WeakPolarHBondContact O-CB 3.33Å; R149-Y153 PolarHBondContact O-N 3.42Å; Y153-P157 VanDerWaalsContact O-CD 3.28Å; Y153-P157 WeakPolarHBondContact O-CD 3.48Å; Y153-P157 WeakPolarHBondContact O-CG 3.26Å
154	H	97.7	Very high	96.6	Very high	3 Å²	3	16.4 Å²	16.4	1%	0.014	8%	0.079	C	C	.	.	H	α-helix	trans	-85.3	-47.8	-175.8	-165.6	82.8	0	0	0	112.8	V56 S150 L151 L152 P157 F158 L213 P214	V56-H154 WeakPolarHBondContact CG2-O 3.31Å; S150-H154 WeakPolarHBondContact O-CB 3.25Å; S150-H154 PolarHBondContact O-N 3.46Å; S150-H154 VanDerWaalsContact O-N 3.12Å; L151-H154 PolarHBondContact O-N 3.41Å; L152-H154 PolarHBondContact O-N 3.39Å; H154-P157 WeakPolarHBondContact O-CD 3.49Å; H154-F158 WeakPolarHBondContact O-CB 3.37Å; H154-F158 PolarHBondContact O-N 3Å; H154-L213 HydrophobicContact CB-CD2 4.09Å; H154-P214 PolarHBondContact NE2-O 2.98Å
155	L	98.2	Very high	97	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-71.6	-39.9	-173.3	-76.1	-170.8	0	0	0	113.1	L151 F158 L159 P214 Y221	L151-L155 HydrophobicContact CD1-CD1 3.52Å; L151-L155 HydrophobicContact CD1-CG 3.83Å; L151-L155 HydrophobicContact CD2-CD1 4.32Å; L151-L155 HydrophobicContact CG-CD1 3.76Å; L151-L155 HydrophobicContact CG-CG 4.16Å; L151-L155 VanDerWaalsContact O-CB 3.32Å; L151-L155 WeakPolarHBondContact O-CB 3.14Å; L151-L155 PolarHBondContact O-N 2.9Å; L155-F158 WeakPolarHBondContact O-CB 3.39Å; L155-F158 PolarHBondContact O-N 3.06Å; L155-L159 HydrophobicContact CB-CD1 4.22Å; L155-L159 WeakPolarHBondContact O-CB 3.46Å; L155-L159 WeakPolarHBondContact O-CG 3.4Å; L155-L159 PolarHBondContact O-N 3.09Å; L155-P214 HydrophobicContact CD2-CG 3.92Å; L155-Y221 HydrophobicContact CD2-CE1 4.16Å
156	H	98.2	Very high	97.2	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-56	-56.2	-176.6	-77.6	-58.6	0	0	0	113.5	N115 V118 L152 F158 L159 Q160 Y166 L351	N115-H156 HydrophobicContact CB-CB 4.48Å; N115-H156 WeakPolarHBondContact OD1-CB 3.05Å; V118-H156 HydrophobicContact CG2-CB 4.36Å; L152-H156 PolarHBondContact O-CD2 2.98Å; L152-H156 PolarHBondContact O-N 2.88Å; H156-F158 VanDerWaalsContact C-N 3.3Å; H156-F158 PolarHBondContact O-N 3.46Å; H156-L159 PolarHBondContact O-N 3.38Å; H156-Q160 WeakPolarHBondContact O-CB 3.2Å; H156-Q160 WeakPolarHBondContact O-CG 3.19Å; H156-Q160 PolarHBondContact O-N 2.93Å; H156-Q160 PolarHBondContact O-NE2 2.84Å; H156-Y166 AromaticContact ND1-CE2 3.78Å; H156-Y166 AromaticContact ND1-CZ 3.8Å; H156-Y166 PolarHBondContact ND1-OH 3.17Å; H156-Y166 PolarHBondContact O-OH 2.9Å; H156-L351 PolarHBondContact CE1-O 3.1Å; H156-L351 PolarHBondContact NE2-O 2.82Å
157	P	97.6	Very high	97.5	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-69.3	-30.8	179.9	31.8	-40.6	0	0	0	112.2	V56 Y57 L60 Y153 H154 R161	V56-P157 HydrophobicContact CG1-CG 4.07Å; V56-P157 HydrophobicContact CG2-CG 4.11Å; V56-P157 VanDerWaalsContact O-CB 3.24Å; V56-P157 WeakPolarHBondContact O-CB 3.32Å; V56-P157 WeakPolarHBondContact O-CG 3.34Å; Y57-P157 HydrophobicContact CD1-CB 3.91Å; Y57-P157 HydrophobicContact CD1-CG 4.22Å; Y57-P157 HydrophobicContact CD2-CB 4.47Å; Y57-P157 HydrophobicContact CD2-CG 4.08Å; Y57-P157 HydrophobicContact CE1-CB 3.9Å; Y57-P157 HydrophobicContact CE1-CG 3.89Å; Y57-P157 HydrophobicContact CE2-CB 4.43Å; Y57-P157 HydrophobicContact CE2-CG 3.7Å; Y57-P157 HydrophobicContact CG-CB 4.19Å; Y57-P157 HydrophobicContact CG-CG 4.29Å; L60-P157 HydrophobicContact CD1-CB 3.94Å; L60-P157 HydrophobicContact CD2-CB 3.8Å; L60-P157 HydrophobicContact CG-CB 4.49Å; Y153-P157 VanDerWaalsContact O-CD 3.28Å; Y153-P157 WeakPolarHBondContact O-CD 3.48Å; Y153-P157 WeakPolarHBondContact O-CG 3.26Å; H154-P157 WeakPolarHBondContact O-CD 3.49Å; P157-R161 PolarHBondContact O-N 3.37Å; P157-R161 VanDerWaalsContact O-N 3.08Å; P157-R161 PolarHBondContact O-NH1 2.88Å
158	F	97.9	Very high	97.7	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-60.7	-47.6	175.1	-175.1	-82.5	0	0	0	112.2	V56 V98 H154 L155 H156 Q162 P214 N216 D217 Y221	V56-F158 HydrophobicContact CG2-CB 4.29Å; V98-F158 HydrophobicContact CG2-CD2 4.14Å; V98-F158 HydrophobicContact CG2-CE2 4.14Å; H154-F158 WeakPolarHBondContact O-CB 3.37Å; H154-F158 PolarHBondContact O-N 3Å; L155-F158 WeakPolarHBondContact O-CB 3.39Å; L155-F158 PolarHBondContact O-N 3.06Å; H156-F158 VanDerWaalsContact C-N 3.3Å; H156-F158 PolarHBondContact O-N 3.46Å; F158-Q162 PolarHBondContact O-N 2.9Å; F158-P214 HydrophobicContact CD1-CG 4.09Å; F158-P214 HydrophobicContact CD2-CG 4.02Å; F158-P214 HydrophobicContact CE1-CB 4.14Å; F158-P214 HydrophobicContact CE1-CG 3.73Å; F158-P214 HydrophobicContact CE2-CB 3.8Å; F158-P214 HydrophobicContact CE2-CG 3.66Å; F158-P214 HydrophobicContact CG-CG 4.22Å; F158-P214 HydrophobicContact CZ-CB 3.51Å; F158-P214 HydrophobicContact CZ-CG 3.49Å; F158-P214 VanDerWaalsContact CZ-CG 3.49Å; F158-N216 WeakPolarHBondContact CZ-O 3.37Å; F158-D217 HydrophobicContact CD2-CB 3.92Å; F158-D217 HydrophobicContact CE2-CB 3.59Å; F158-D217 VanDerWaalsContact CZ-CA 3.45Å; F158-D217 HydrophobicContact CZ-CB 3.98Å; F158-Y221 HydrophobicContact CD1-CD2 4.45Å; F158-Y221 HydrophobicContact CD1-CE2 4.31Å; F158-Y221 AromaticContact CE1-CD2 3.76Å; F158-Y221 HydrophobicContact CE1-CD2 3.76Å; F158-Y221 AromaticContact CE1-CE2 3.58Å; F158-Y221 HydrophobicContact CE1-CE2 3.58Å; F158-Y221 HydrophobicContact CZ-CE2 4.34Å
159	L	98.3	Very high	97.8	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-74	-35.6	179.6	-61	172.6	0	0	0	112.2	I137 L155 H156 R161 Q162 I164 Y166 Y221	I137-L159 HydrophobicContact CD1-CD1 3.7Å; I137-L159 HydrophobicContact CG1-CD1 4.41Å; L155-L159 HydrophobicContact CB-CD1 4.22Å; L155-L159 WeakPolarHBondContact O-CB 3.46Å; L155-L159 WeakPolarHBondContact O-CG 3.4Å; L155-L159 PolarHBondContact O-N 3.09Å; H156-L159 PolarHBondContact O-N 3.38Å; L159-R161 VanDerWaalsContact C-N 3.34Å; L159-R161 PolarHBondContact O-N 2.97Å; L159-Q162 WeakPolarHBondContact O-CB 3.47Å; L159-Q162 PolarHBondContact O-N 3.27Å; L159-Q162 VanDerWaalsContact O-N 3.1Å; L159-I164 HydrophobicContact CB-CD1 4.46Å; L159-I164 HydrophobicContact CD2-CD1 4.02Å; L159-Y166 HydrophobicContact CB-CD1 3.67Å; L159-Y166 HydrophobicContact CB-CE1 3.42Å; L159-Y166 VanDerWaalsContact CB-CE1 3.42Å; L159-Y166 HydrophobicContact CB-CE2 4.47Å; L159-Y166 HydrophobicContact CB-CG 4.28Å; L159-Y166 HydrophobicContact CD1-CD1 4.26Å; L159-Y166 HydrophobicContact CD1-CD2 3.8Å; L159-Y166 HydrophobicContact CD1-CE1 4.26Å; L159-Y166 HydrophobicContact CD1-CE2 3.84Å; L159-Y166 HydrophobicContact CD1-CG 4.03Å; L159-Y166 HydrophobicContact CG-CE1 4.49Å; L159-Y221 VanDerWaalsContact CD2-CB 3.46Å; L159-Y221 HydrophobicContact CD2-CD1 3.45Å; L159-Y221 VanDerWaalsContact CD2-CD1 3.45Å; L159-Y221 HydrophobicContact CD2-CD2 3.92Å; L159-Y221 HydrophobicContact CD2-CE1 4.12Å; L159-Y221 HydrophobicContact CD2-CG 3.32Å
160	Q	97.8	Very high	97.9	Very high	1 Å²	1	4.7 Å²	4.7	1%	0.005	2%	0.022	C	C	.	.	H	α-helix	trans	-60.7	-42	174.8	-75.8	173.3	92.1	0	0	111.7	L60 L63 N115 Y124 H156 Q162 Q163 Y166	L60-Q160 HydrophobicContact CD1-CB 3.78Å; L63-Q160 HydrophobicContact CD1-CB 3.77Å; N115-Q160 PolarHBondContact OD1-NE2 2.94Å; Y124-Q160 HydrophobicContact CD1-CG 3.88Å; Y124-Q160 HydrophobicContact CD2-CG 3.67Å; Y124-Q160 HydrophobicContact CE1-CB 4.11Å; Y124-Q160 HydrophobicContact CE1-CG 3.81Å; Y124-Q160 HydrophobicContact CE2-CB 4.33Å; Y124-Q160 HydrophobicContact CE2-CG 3.61Å; Y124-Q160 HydrophobicContact CG-CG 3.79Å; H156-Q160 WeakPolarHBondContact O-CB 3.2Å; H156-Q160 WeakPolarHBondContact O-CG 3.19Å; H156-Q160 PolarHBondContact O-N 2.93Å; H156-Q160 PolarHBondContact O-NE2 2.84Å; Q160-Q162 PolarHBondContact O-N 3.33Å; Q160-Q163 PolarHBondContact O-N 3Å; Q160-Y166 HydrophobicContact CG-CE1 4.23Å
161	R	96.9	Very high	98	Very high	0 Å²	0	4.1 Å²	4.1	0%	0	2%	0.018	C	C	.	.	H	α-helix	trans	-61.5	-29.3	173.4	-83.5	-162.1	-62.2	-68	-3.4	113.6	V56 T58 L60 S91 L93 P157 L159 Q163 D217	V56-R161 PolarHBondContact O-NH1 3.15Å; V56-R161 PolarHBondContact O-NH2 2.96Å; T58-R161 WeakPolarHBondContact O-CD 3.37Å; T58-R161 PolarHBondContact O-NH1 3.32Å; L60-R161 HydrophobicContact CD1-CG 4.36Å; S91-R161 VanDerWaalsContact CB-O 3.25Å; S91-R161 WeakPolarHBondContact CB-O 3.42Å; S91-R161 PolarHBondContact OG-O 2.78Å; L93-R161 HydrophobicContact CB-CB 4.22Å; L93-R161 HydrophobicContact CB-CG 4.11Å; L93-R161 WeakPolarHBondContact O-CD 3.3Å; P157-R161 PolarHBondContact O-N 3.37Å; P157-R161 VanDerWaalsContact O-N 3.08Å; P157-R161 PolarHBondContact O-NH1 2.88Å; L159-R161 VanDerWaalsContact C-N 3.34Å; L159-R161 PolarHBondContact O-N 2.97Å; R161-Q163 PolarHBondContact O-N 3.23Å; R161-D217 IonicContact CZ-OD2 3.9Å; R161-D217 IonicContact NE-OD2 3.32Å; R161-D217 PolarHBondContact NE-OD2 2.93Å; R161-D217 IonicContact NH2-OD2 3.23Å
162	Q	97.3	Very high	97.9	Very high	15 Å²	15	6.2 Å²	6.2	7%	0.07	3%	0.028	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	-4.3	176.5	-66.3	179.7	-2.8	0	0	112.9	L94 F158 L159 Q160 I164 D217 N219	L94-Q162 HydrophobicContact CD2-CG 3.82Å; F158-Q162 PolarHBondContact O-N 2.9Å; L159-Q162 WeakPolarHBondContact O-CB 3.47Å; L159-Q162 PolarHBondContact O-N 3.27Å; L159-Q162 VanDerWaalsContact O-N 3.1Å; Q160-Q162 PolarHBondContact O-N 3.33Å; Q162-I164 HydrophobicContact CB-CG2 4.15Å; Q162-I164 PolarHBondContact O-N 2.77Å; Q162-D217 PolarHBondContact NE2-O 2.92Å; Q162-N219 PolarHBondContact NE2-O 2.89Å; Q162-N219 VanDerWaalsContact NE2-O 3.09Å
163	Q	96.7	Very high	97.8	Very high	11 Å²	11	6.4 Å²	6.4	5%	0.051	3%	0.029	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	40.6	-179.6	-61.8	-173.9	-76.9	0	0	113	C87 S91 L93 P126 C129 Q160 R161	C87-Q163 HydrophobicContact CB-CB 4.2Å; S91-Q163 PolarHBondContact OG-OE1 2.87Å; L93-Q163 HydrophobicContact CD1-CG 4.02Å; P126-Q163 HydrophobicContact CG-CB 3.99Å; P126-Q163 WeakPolarHBondContact CG-O 3.29Å; C129-Q163 PolarHBondContact SG-NE2 3.29Å; Q160-Q163 PolarHBondContact O-N 3Å; R161-Q163 PolarHBondContact O-N 3.23Å
164	I	97.3	Very high	97.5	Very high	2 Å²	2	6.1 Å²	6.1	1%	0.01	3%	0.031	C	C	.	.			trans	-100.6	152.2	176	65.8	174.9	0	0	0	110.9	Y124 H133 L159 Q162 Y166 T222	Y124-I164 WeakPolarHBondContact CD1-O 3.32Å; H133-I164 HydrophobicContact CB-CB 4.35Å; H133-I164 HydrophobicContact CB-CG2 3.96Å; L159-I164 HydrophobicContact CB-CD1 4.46Å; L159-I164 HydrophobicContact CD2-CD1 4.02Å; Q162-I164 HydrophobicContact CB-CG2 4.15Å; Q162-I164 PolarHBondContact O-N 2.77Å; I164-Y166 HydrophobicContact CG1-CD1 4.09Å; I164-T222 HydrophobicContact CG2-CG2 4.27Å
165	H	98.3	Very high	96.5	Very high	15 Å²	15	11 Å²	11	7%	0.069	5%	0.052	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	125.8	164.6	178.9	-117.4	0	0	0	109.1	Y124 P131 H133 H134 T135 E200 W202	Y124-H165 WeakPolarHBondContact O-CA 3.33Å; Y124-H165 PolarHBondContact O-CD2 3.02Å; P131-H165 HydrophobicContact CB-CB 4.12Å; P131-H165 HydrophobicContact CG-CB 3.64Å; H133-H165 WeakPolarHBondContact O-CB 3.34Å; H133-H165 PolarHBondContact O-N 3.48Å; H134-H165 CarbonylContact C-O 3.55Å; H134-H165 WeakPolarHBondContact CA-O 3.19Å; H134-H165 AromaticContact CE1-ND1 3.97Å; H134-H165 AromaticContact CG-ND1 3.73Å; H134-H165 AromaticContact ND1-CG 3.82Å; H134-H165 AromaticContact ND1-ND1 3.12Å; H134-H165 PolarHBondContact ND1-ND1 3.19Å; H134-H165 VanDerWaalsContact ND1-ND1 3.12Å; T135-H165 PolarHBondContact N-O 3.21Å; H165-E200 VanDerWaalsContact CE1-CD 3.44Å; H165-E200 IonicContact CE1-OE1 3.47Å; H165-E200 PolarHBondContact CE1-OE1 3.11Å; H165-E200 IonicContact CE1-OE2 3.43Å; H165-E200 PolarHBondContact CE1-OE2 3.13Å; H165-E200 VanDerWaalsContact CE1-OE2 3.32Å; H165-E200 IonicContact ND1-OE1 3.62Å; H165-E200 PolarHBondContact ND1-OE1 3.06Å; H165-E200 IonicContact NE2-OE1 2.55Å; H165-W202 AromaticContact CE1-CH2 3.58Å; H165-W202 AromaticContact CE1-CZ3 3.63Å; H165-W202 AromaticContact ND1-CZ3 3.57Å
166	Y	98.8	Very high	95.1	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	161	-178.2	76.1	-94.8	0	0	0	114.8	R123 Y124 T135 I137 H156 L159 Q160 I164 I168	R123-Y166 WeakPolarHBondContact CA-O 3.32Å; Y124-Y166 VanDerWaalsContact CB-CE1 3.45Å; Y124-Y166 AromaticContact CD1-CD1 3.74Å; Y124-Y166 HydrophobicContact CD1-CD1 3.74Å; Y124-Y166 AromaticContact CD1-CE1 3.39Å; Y124-Y166 HydrophobicContact CD1-CE1 3.39Å; Y124-Y166 HydrophobicContact CE1-CE1 4.38Å; Y124-Y166 HydrophobicContact CG-CD1 4.3Å; Y124-Y166 AromaticContact CG-CE1 3.69Å; Y124-Y166 HydrophobicContact CG-CE1 3.69Å; Y124-Y166 PolarHBondContact N-O 3.09Å; Y124-Y166 PolarHBondContact O-N 3.09Å; T135-Y166 WeakPolarHBondContact O-CA 3.16Å; T135-Y166 WeakPolarHBondContact O-CB 3.38Å; I137-Y166 HydrophobicContact CD1-CD2 3.85Å; I137-Y166 HydrophobicContact CD1-CG 4.14Å; H156-Y166 AromaticContact ND1-CE2 3.78Å; H156-Y166 AromaticContact ND1-CZ 3.8Å; H156-Y166 PolarHBondContact ND1-OH 3.17Å; H156-Y166 PolarHBondContact O-OH 2.9Å; L159-Y166 HydrophobicContact CB-CD1 3.67Å; L159-Y166 HydrophobicContact CB-CE1 3.42Å; L159-Y166 VanDerWaalsContact CB-CE1 3.42Å; L159-Y166 HydrophobicContact CB-CE2 4.47Å; L159-Y166 HydrophobicContact CB-CG 4.28Å; L159-Y166 HydrophobicContact CD1-CD1 4.26Å; L159-Y166 HydrophobicContact CD1-CD2 3.8Å; L159-Y166 HydrophobicContact CD1-CE1 4.26Å; L159-Y166 HydrophobicContact CD1-CE2 3.84Å; L159-Y166 HydrophobicContact CD1-CG 4.03Å; L159-Y166 HydrophobicContact CG-CE1 4.49Å; Q160-Y166 HydrophobicContact CG-CE1 4.23Å; I164-Y166 HydrophobicContact CG1-CD1 4.09Å; Y166-I168 HydrophobicContact CD2-CG1 4.12Å; Y166-I168 HydrophobicContact CE2-CD1 4.2Å; Y166-I168 HydrophobicContact CE2-CG1 4.07Å
167	S	98.7	Very high	92.8	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	140.7	168.7	-170.8	0	0	0	0	110.8	G121 G122 R123 T135 I137 W202	G121-S167 PolarHBondContact O-OG 2.8Å; G122-S167 WeakPolarHBondContact O-CA 3.49Å; R123-S167 WeakPolarHBondContact CG-OG 3.46Å; T135-S167 PolarHBondContact O-N 2.88Å; I137-S167 PolarHBondContact N-O 2.9Å; S167-W202 VanDerWaalsContact CB-CH2 3.43Å; S167-W202 VanDerWaalsContact CB-CZ2 3.45Å
168	I	98.9	Very high	90.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	123.6	178.5	-56.6	-179.4	0	0	0	110	G122 I137 V139 L152 Y166 I170 Y352 T353	G122-I168 PolarHBondContact O-N 3.25Å; I137-I168 HydrophobicContact CB-CG1 4.42Å; I137-I168 HydrophobicContact CD1-CG1 4.2Å; V139-I168 HydrophobicContact CG2-CG2 4.45Å; L152-I168 HydrophobicContact CD2-CD1 3.88Å; L152-I168 HydrophobicContact CD2-CG2 4.28Å; Y166-I168 HydrophobicContact CD2-CG1 4.12Å; Y166-I168 HydrophobicContact CE2-CD1 4.2Å; Y166-I168 HydrophobicContact CE2-CG1 4.07Å; I168-I170 HydrophobicContact CG2-CD1 3.82Å; I168-I170 HydrophobicContact CG2-CG1 4.48Å; I168-Y352 CarbonylContact O-C 3.47Å; I168-Y352 WeakPolarHBondContact O-CA 3.42Å; I168-T353 PolarHBondContact O-N 2.9Å
169	Y	98.9	Very high	88.9	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	114	179.2	-67.4	-88.6	0	0	0	110.5	A136 I137 V139 A196 D199 W202 T353 L355	A136-Y169 HydrophobicContact CB-CD2 4.23Å; A136-Y169 HydrophobicContact CB-CE2 4.03Å; I137-Y169 PolarHBondContact O-N 3.45Å; V139-Y169 PolarHBondContact N-O 3.45Å; Y169-A196 HydrophobicContact CD1-CB 4.41Å; Y169-A196 HydrophobicContact CD2-CB 3.9Å; Y169-A196 HydrophobicContact CE1-CB 4.2Å; Y169-A196 HydrophobicContact CE2-CB 3.66Å; Y169-A196 HydrophobicContact CG-CB 4.25Å; Y169-D199 WeakPolarHBondContact CE1-OD2 3.37Å; Y169-D199 WeakPolarHBondContact OH-CB 3.26Å; Y169-D199 PolarHBondContact OH-OD2 3.12Å; Y169-W202 HydrophobicContact CE2-CZ2 4.23Å; Y169-T353 HydrophobicContact CD1-CG2 3.85Å; Y169-T353 HydrophobicContact CE1-CG2 3.95Å; Y169-L355 HydrophobicContact CD1-CD1 4.05Å
170	I	98.8	Very high	87.3	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	113	174.9	-54.9	-51.8	0	0	0	108.5	V139 F141 L148 I168 Q172 Y352 T353 L355	V139-I170 HydrophobicContact CB-CD1 3.63Å; V139-I170 HydrophobicContact CG1-CD1 4.12Å; V139-I170 HydrophobicContact CG2-CD1 3.88Å; F141-I170 HydrophobicContact CB-CG2 3.5Å; F141-I170 HydrophobicContact CD1-CG2 3.8Å; F141-I170 HydrophobicContact CD2-CG2 4.43Å; F141-I170 HydrophobicContact CG-CG2 3.67Å; L148-I170 HydrophobicContact CD1-CD1 3.46Å; L148-I170 VanDerWaalsContact CD1-CD1 3.46Å; L148-I170 HydrophobicContact CD1-CG1 3.86Å; L148-I170 HydrophobicContact CD2-CG1 4.37Å; L148-I170 HydrophobicContact CD2-CG2 4.34Å; I168-I170 HydrophobicContact CG2-CD1 3.82Å; I168-I170 HydrophobicContact CG2-CG1 4.48Å; I170-Q172 PolarHBondContact O-N 2.96Å; I170-Y352 HydrophobicContact CB-CD2 3.67Å; I170-Y352 HydrophobicContact CB-CE2 4Å; I170-Y352 HydrophobicContact CG1-CD2 3.22Å; I170-Y352 HydrophobicContact CG1-CE2 3.83Å; I170-Y352 HydrophobicContact CG1-CG 3.65Å; I170-T353 PolarHBondContact N-O 3.26Å; I170-L355 PolarHBondContact O-N 2.92Å
171	V	98.6	Very high	86.3	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	92.4	-179.2	-165.4	0	0	0	0	109	V138 V139 F141 Q173 L188 V191 G192 L355 V357	V138-V171 HydrophobicContact CG1-CG2 3.84Å; V139-V171 PolarHBondContact O-N 3.17Å; F141-V171 PolarHBondContact N-O 3.24Å; V171-Q173 PolarHBondContact O-N 2.89Å; V171-L188 HydrophobicContact CB-CB 4.37Å; V171-L188 HydrophobicContact CG1-CB 4.09Å; V171-L188 HydrophobicContact CG1-CD2 3.78Å; V171-V191 HydrophobicContact CG1-CB 4.2Å; V171-V191 HydrophobicContact CG1-CG1 4.21Å; V171-G192 VanDerWaalsContact CG2-CA 3.47Å; V171-L355 CarbonylContact C-O 3.54Å; V171-L355 HydrophobicContact CG2-CD1 4.42Å; V171-V357 HydrophobicContact CG1-CG1 4.46Å; V171-V357 HydrophobicContact CG1-CG2 3.72Å
172	Q	97.1	Very high	85.9	Confident	44 Å²	44	36.9 Å²	36.9	21%	0.206	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	109.9	-176.8	172.8	64	67.6	0	0	110.7	F141 I170 V174 L355 V357	F141-Q172 WeakPolarHBondContact O-CA 3.23Å; I170-Q172 PolarHBondContact O-N 2.96Å; Q172-V174 PolarHBondContact O-N 3.05Å; Q172-L355 PolarHBondContact N-O 2.77Å; Q172-V357 PolarHBondContact O-N 3.43Å
173	Q	94.9	Very high	85.7	Confident	4 Å²	4	37.3 Å²	37.3	2%	0.019	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	125.8	170.7	-171.8	179.1	-20.3	0	0	110.3	F141 V171 T182 F183 L188 I359	F141-Q173 PolarHBondContact O-N 2.91Å; V171-Q173 PolarHBondContact O-N 2.89Å; Q173-T182 PolarHBondContact NE2-O 2.67Å; Q173-F183 VanDerWaalsContact OE1-CD2 3.26Å; Q173-L188 HydrophobicContact CB-CD1 3.9Å; Q173-L188 HydrophobicContact CB-CD2 3.81Å; Q173-L188 HydrophobicContact CB-CG 4.44Å; Q173-L188 HydrophobicContact CG-CD2 4.35Å; Q173-I359 HydrophobicContact CG-CD1 4.04Å; Q173-I359 HydrophobicContact CG-CG1 4.09Å
174	V	90.8	Very high	85.6	Confident	32 Å²	32	36.8 Å²	36.8	19%	0.194	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-68.2	151.6	174.2	-63.1	0	0	0	0	112.6	Q172 L344 T356 V357 N358	Q172-V174 PolarHBondContact O-N 3.05Å; V174-L344 HydrophobicContact CB-CD1 4.39Å; V174-L344 HydrophobicContact CG1-CD1 3.5Å; V174-L344 VanDerWaalsContact CG1-CD1 3.5Å; V174-L344 HydrophobicContact CG2-CD1 4.13Å; V174-T356 HydrophobicContact CG1-CG2 3.37Å; V174-V357 PolarHBondContact N-O 3.38Å; V174-V357 VanDerWaalsContact N-O 3.1Å; V174-N358 HydrophobicContact CG2-CB 3.92Å
175	K	76.9	Confident	85.5	Confident	106 Å²	106	37.7 Å²	37.7	46%	0.461	18%	0.184	S	C	.	.	P	Polyproline II helix	trans	-79.4	142.6	165.4	-69.4	177.2	178.3	173.2	0	108.6	N180	K175-N180 WeakPolarHBondContact CD-OD1 3.33Å; K175-N180 WeakPolarHBondContact CE-OD1 3.25Å
176	L	68.2	Low	85.3	Confident	41 Å²	41	37 Å²	37	22%	0.215	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-83.1	154.8	176.6	-65.2	162.4	0	0	0	109.8	W178 G179 E361	L176-W178 PolarHBondContact O-N 3.13Å; L176-W178 VanDerWaalsContact O-N 3.15Å; L176-G179 CarbonylContact C-O 3.49Å; L176-G179 PolarHBondContact N-O 3.25Å; L176-G179 VanDerWaalsContact N-O 3.12Å; L176-G179 PolarHBondContact O-N 3.29Å; L176-E361 HydrophobicContact CD1-CB 4.3Å; L176-E361 HydrophobicContact CD1-CG 3.62Å; L176-E361 HydrophobicContact CD2-CG 4.36Å
177	Q	50.6	Low	85.2	Confident	172 Å²	172	37.7 Å²	37.7	80%	0.804	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-26.6	-176.9	-71.7	-179.9	-12.5	0	0	113.1
178	W	54.6	Low	85.2	Confident	211 Å²	211	37.7 Å²	37.7	80%	0.799	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.3	34.4	178.4	-58.1	-86.7	0	0	0	114.3	L176	L176-W178 PolarHBondContact O-N 3.13Å; L176-W178 VanDerWaalsContact O-N 3.15Å
179	G	58.6	Low	85.2	Confident	39 Å²	39	37.7 Å²	37.7	40%	0.402	18%	0.184	S	C	.	.	B	Isolated β-bridge	trans	138.3	178.4	172.2	0	0	0	0	0	113.2	L176 G181	L176-G179 CarbonylContact C-O 3.49Å; L176-G179 PolarHBondContact N-O 3.25Å; L176-G179 VanDerWaalsContact N-O 3.12Å; L176-G179 PolarHBondContact O-N 3.29Å; G179-G181 PolarHBondContact O-N 3.31Å
180	N	64.7	Low	85.1	Confident	57 Å²	57	37.7 Å²	37.7	31%	0.305	18%	0.184	S	C	.	.			trans	-70.6	-5	-173.3	-77.1	-12.1	0	0	0	115	R142 K175	R142-N180 PolarHBondContact NH1-O 2.83Å; K175-N180 WeakPolarHBondContact CD-OD1 3.33Å; K175-N180 WeakPolarHBondContact CE-OD1 3.25Å
181	G	77.3	Confident	85.1	Confident	13 Å²	13	37.6 Å²	37.6	13%	0.134	18%	0.184	C	C	.	.			trans	59.6	155.6	-170.1	0	0	0	0	0	112.8	R142 G179	R142-G181 PolarHBondContact NH1-O 3.43Å; R142-G181 PolarHBondContact NH2-O 2.9Å; G179-G181 PolarHBondContact O-N 3.31Å
182	T	89.1	Confident	85.1	Confident	12 Å²	12	37.6 Å²	37.6	7%	0.074	18%	0.184	C	C	.	.			trans	-76.2	134.6	172.9	-45.6	0	0	0	0	109.4	Q173 W270 G271 G313 D362	Q173-T182 PolarHBondContact NE2-O 2.67Å; T182-W270 HydrophobicContact CG2-CB 3.92Å; T182-W270 WeakPolarHBondContact O-CZ3 3.37Å; T182-G271 VanDerWaalsContact CG2-N 3.27Å; T182-G313 CarbonylContact C-O 3.54Å; T182-G313 WeakPolarHBondContact CA-O 3.43Å; T182-D362 WeakPolarHBondContact OG1-CB 3.39Å; T182-D362 PolarHBondContact OG1-OD2 3.44Å
183	F	92.3	Very high	85.2	Confident	23 Å²	23	35.5 Å²	35.5	10%	0.101	17%	0.174	C	C	.	.			trans	-68.7	142.8	175.9	-168.3	-117.6	0	0	0	109.6	P140 R142 Q173 R185 L188 G271 G313 N314	P140-F183 HydrophobicContact CB-CZ 4.18Å; R142-F183 HydrophobicContact CB-CD2 3.88Å; R142-F183 HydrophobicContact CB-CE2 3.75Å; Q173-F183 VanDerWaalsContact OE1-CD2 3.26Å; F183-R185 HydrophobicContact CD1-CB 4.31Å; F183-R185 HydrophobicContact CE1-CB 3.82Å; F183-R185 HydrophobicContact CE1-CG 4.43Å; F183-L188 HydrophobicContact CD2-CD1 4Å; F183-L188 HydrophobicContact CE2-CD1 3.29Å; F183-L188 HydrophobicContact CZ-CD1 3.65Å; F183-G271 PolarHBondContact O-N 3.44Å; F183-G313 PolarHBondContact N-O 2.61Å; F183-N314 HydrophobicContact CB-CB 4.1Å
184	N	94.5	Very high	85.4	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.19	C	C	.	.			trans	-137.1	91	175.7	-171.5	-29	0	0	0	109.9	K187 L188 N267 Y269 W270 I359	N184-K187 HydrophobicContact CB-CB 4.09Å; N184-K187 PolarHBondContact O-N 3.21Å; N184-K187 WeakPolarHBondContact OD1-CB 3.49Å; N184-K187 PolarHBondContact OD1-N 3.24Å; N184-L188 WeakPolarHBondContact O-CD1 3.38Å; N184-L188 VanDerWaalsContact O-CG 3.23Å; N184-L188 WeakPolarHBondContact O-CG 3.43Å; N184-L188 PolarHBondContact O-N 2.88Å; N184-L188 VanDerWaalsContact O-N 3.1Å; N184-N267 PolarHBondContact ND2-O 2.84Å; N184-Y269 VanDerWaalsContact CG-O 3.28Å; N184-Y269 PolarHBondContact OD1-O 2.95Å; N184-W270 HydrophobicContact CB-CD2 4.18Å; N184-W270 HydrophobicContact CB-CE3 3.69Å; N184-W270 HydrophobicContact CB-CH2 4.49Å; N184-W270 HydrophobicContact CB-CZ3 3.87Å; N184-I359 HydrophobicContact CB-CD1 3.73Å
185	R	95.2	Very high	85.7	Confident	22 Å²	22	38.7 Å²	38.7	8%	0.083	18%	0.182	C	C	.	.	H	α-helix	trans	-57.9	-53.4	-176.2	-177.4	176.2	162.7	-79.7	-2.3	112	P140 F183 K187 L188 L189 D209 E275 D276	P140-R185 HydrophobicContact CB-CG 4.28Å; P140-R185 HydrophobicContact CG-CG 3.71Å; F183-R185 HydrophobicContact CD1-CB 4.31Å; F183-R185 HydrophobicContact CE1-CB 3.82Å; F183-R185 HydrophobicContact CE1-CG 4.43Å; R185-K187 PolarHBondContact O-N 3.22Å; R185-L188 PolarHBondContact O-N 3.47Å; R185-L189 HydrophobicContact CG-CD1 4.49Å; R185-L189 WeakPolarHBondContact O-CG 3.4Å; R185-L189 PolarHBondContact O-N 2.03Å; R185-D209 IonicContact CZ-OD1 2.73Å; R185-D209 VanDerWaalsContact CZ-OD1 3.23Å; R185-D209 IonicContact NE-OD1 3.76Å; R185-D209 PolarHBondContact NE-OD1 3.38Å; R185-D209 IonicContact NE-OD2 2.67Å; R185-D209 IonicContact NH2-OD1 3.64Å; R185-D209 PolarHBondContact NH2-OD1 3.42Å; R185-E275 WeakPolarHBondContact CD-OE1 3.49Å; R185-E275 IonicContact CZ-OE1 3.57Å; R185-E275 IonicContact NE-OE1 2.72Å; R185-E275 IonicContact NH1-OE1 2.87Å; R185-E275 PolarHBondContact NH1-OE1 3.37Å; R185-D276 IonicContact CZ-OD1 2.98Å; R185-D276 IonicContact NH1-OD1 3.03Å; R185-D276 PolarHBondContact NH1-OD1 2.69Å; R185-D276 IonicContact NH1-OD2 3.78Å; R185-D276 IonicContact NH2-OD1 3.85Å
186	A	95	Very high	86.7	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.8	-43.9	-178.3	0	0	0	0	0	113	L189 N190 F265 P266 E275	A186-L189 WeakPolarHBondContact O-CB 3.3Å; A186-L189 PolarHBondContact O-N 3.2Å; A186-N190 PolarHBondContact O-N 3.13Å; A186-N190 VanDerWaalsContact O-N 3.13Å; A186-F265 HydrophobicContact CB-CB 3.9Å; A186-F265 HydrophobicContact CB-CD1 4.05Å; A186-F265 HydrophobicContact CB-CG 4.43Å; A186-P266 HydrophobicContact CB-CG 4.45Å; A186-P266 WeakPolarHBondContact CB-O 3.41Å; A186-E275 HydrophobicContact CB-CB 3.91Å; A186-E275 HydrophobicContact CB-CG 3.84Å
187	K	96.6	Very high	88.2	Confident	14 Å²	14	34 Å²	34	6%	0.061	16%	0.163	C	C	.	.	H	α-helix	trans	-65.7	-39.8	177	-168.6	168.1	-173.6	-174.2	0	111.8	N184 R185 N190 V191 N267 W270 L339 T340 I359	N184-K187 HydrophobicContact CB-CB 4.09Å; N184-K187 PolarHBondContact O-N 3.21Å; N184-K187 WeakPolarHBondContact OD1-CB 3.49Å; N184-K187 PolarHBondContact OD1-N 3.24Å; R185-K187 PolarHBondContact O-N 3.22Å; K187-N190 WeakPolarHBondContact O-CB 3.44Å; K187-N190 PolarHBondContact O-N 3.03Å; K187-V191 WeakPolarHBondContact O-CG2 3.29Å; K187-V191 PolarHBondContact O-N 3.31Å; K187-N267 HydrophobicContact CD-CB 4.11Å; K187-N267 HydrophobicContact CG-CB 4.27Å; K187-W270 HydrophobicContact CD-CZ2 4.49Å; K187-L339 HydrophobicContact CG-CD1 3.88Å; K187-T340 WeakPolarHBondContact CE-O 3.28Å; K187-T340 PolarHBondContact NZ-O 2.92Å; K187-T340 PolarHBondContact NZ-OG1 2.78Å; K187-I359 HydrophobicContact CD-CB 4.05Å; K187-I359 HydrophobicContact CD-CD1 4.44Å; K187-I359 HydrophobicContact CG-CB 4.41Å; K187-I359 PolarHBondContact NZ-O 2.63Å
188	L	97.9	Very high	90.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.1	-38.3	176	-67.6	166.5	0	0	0	112.4	P140 V171 Q173 F183 N184 R185 N190 V191 G192 V357 I359	P140-L188 HydrophobicContact CB-CB 3.69Å; P140-L188 HydrophobicContact CB-CD1 4.02Å; V171-L188 HydrophobicContact CB-CB 4.37Å; V171-L188 HydrophobicContact CG1-CB 4.09Å; V171-L188 HydrophobicContact CG1-CD2 3.78Å; Q173-L188 HydrophobicContact CB-CD1 3.9Å; Q173-L188 HydrophobicContact CB-CD2 3.81Å; Q173-L188 HydrophobicContact CB-CG 4.44Å; Q173-L188 HydrophobicContact CG-CD2 4.35Å; F183-L188 HydrophobicContact CD2-CD1 4Å; F183-L188 HydrophobicContact CE2-CD1 3.29Å; F183-L188 HydrophobicContact CZ-CD1 3.65Å; N184-L188 WeakPolarHBondContact O-CD1 3.38Å; N184-L188 VanDerWaalsContact O-CG 3.23Å; N184-L188 WeakPolarHBondContact O-CG 3.43Å; N184-L188 PolarHBondContact O-N 2.88Å; N184-L188 VanDerWaalsContact O-N 3.1Å; R185-L188 PolarHBondContact O-N 3.47Å; L188-N190 VanDerWaalsContact C-N 3.35Å; L188-N190 PolarHBondContact O-N 3.42Å; L188-V191 PolarHBondContact O-N 2.88Å; L188-G192 PolarHBondContact O-N 2.89Å; L188-V357 HydrophobicContact CD2-CG2 3.62Å; L188-I359 HydrophobicContact CD2-CD1 4.19Å; L188-I359 HydrophobicContact CD2-CG2 3.92Å; L188-I359 HydrophobicContact CG-CD1 4.24Å
189	L	98.1	Very high	92.3	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-58.2	-47.6	172.7	-70.8	175.4	0	0	0	111.1	V138 P140 R185 A186 V191 G192 V193 L207 F265	V138-L189 HydrophobicContact CG1-CD2 4.11Å; P140-L189 HydrophobicContact CB-CD2 4.48Å; P140-L189 HydrophobicContact CG-CD2 3.88Å; P140-L189 HydrophobicContact CG-CG 4.16Å; R185-L189 HydrophobicContact CG-CD1 4.49Å; R185-L189 WeakPolarHBondContact O-CG 3.4Å; R185-L189 PolarHBondContact O-N 2.03Å; A186-L189 WeakPolarHBondContact O-CB 3.3Å; A186-L189 PolarHBondContact O-N 3.2Å; L189-V191 VanDerWaalsContact C-N 3.31Å; L189-V191 PolarHBondContact O-N 3.19Å; L189-G192 PolarHBondContact O-N 2.98Å; L189-V193 WeakPolarHBondContact O-CG2 3.37Å; L189-V193 PolarHBondContact O-N 3.12Å; L189-L207 HydrophobicContact CB-CD2 4.14Å; L189-L207 HydrophobicContact CD1-CB 4.31Å; L189-L207 HydrophobicContact CD1-CD2 4.43Å; L189-L207 HydrophobicContact CD2-CB 4.09Å; L189-L207 HydrophobicContact CD2-CD2 3.93Å; L189-L207 HydrophobicContact CG-CD2 4.39Å; L189-F265 HydrophobicContact CD1-CD1 4.13Å; L189-F265 HydrophobicContact CD1-CE1 3.93Å; L189-F265 HydrophobicContact CD1-CZ 4.18Å
190	N	98.2	Very high	94.1	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-55.7	-43.7	174.2	-83.3	-21.2	0	0	0	112.9	A186 K187 L188 R194 Y259 F265 N267 L336 L339	A186-N190 PolarHBondContact O-N 3.13Å; A186-N190 VanDerWaalsContact O-N 3.13Å; K187-N190 WeakPolarHBondContact O-CB 3.44Å; K187-N190 PolarHBondContact O-N 3.03Å; L188-N190 VanDerWaalsContact C-N 3.35Å; L188-N190 PolarHBondContact O-N 3.42Å; N190-R194 WeakPolarHBondContact O-CB 3.08Å; N190-R194 PolarHBondContact O-N 2.82Å; N190-Y259 WeakPolarHBondContact CA-OH 3Å; N190-Y259 PolarHBondContact OD1-OH 3.46Å; N190-F265 PolarHBondContact ND2-O 3.12Å; N190-F265 PolarHBondContact OD1-N 3.38Å; N190-N267 PolarHBondContact ND2-OD1 2.92Å; N190-L336 HydrophobicContact CB-CD1 4.37Å; N190-L339 HydrophobicContact CB-CD1 3.76Å; N190-L339 HydrophobicContact CB-CD2 3.86Å; N190-L339 HydrophobicContact CB-CG 4.34Å
191	V	98.6	Very high	95.6	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-62.1	-49.9	176.8	178.2	0	0	0	0	111.1	V171 K187 L188 L189 V193 R194 E195 L339 Y341 V357 I359	V171-V191 HydrophobicContact CG1-CB 4.2Å; V171-V191 HydrophobicContact CG1-CG1 4.21Å; K187-V191 WeakPolarHBondContact O-CG2 3.29Å; K187-V191 PolarHBondContact O-N 3.31Å; L188-V191 PolarHBondContact O-N 2.88Å; L189-V191 VanDerWaalsContact C-N 3.31Å; L189-V191 PolarHBondContact O-N 3.19Å; V191-V193 VanDerWaalsContact C-N 3.34Å; V191-V193 PolarHBondContact O-N 3.47Å; V191-R194 PolarHBondContact O-N 2.91Å; V191-R194 VanDerWaalsContact O-N 3.16Å; V191-E195 HydrophobicContact CG1-CG 4.36Å; V191-E195 WeakPolarHBondContact O-CG 3.03Å; V191-E195 PolarHBondContact O-N 3.42Å; V191-L339 HydrophobicContact CG2-CD1 4.01Å; V191-L339 HydrophobicContact CG2-CD2 4.33Å; V191-Y341 HydrophobicContact CB-CD1 4.37Å; V191-Y341 HydrophobicContact CB-CE1 4.23Å; V191-Y341 HydrophobicContact CG1-CD1 4.25Å; V191-Y341 HydrophobicContact CG1-CD2 3.75Å; V191-Y341 HydrophobicContact CG1-CE1 3.96Å; V191-Y341 HydrophobicContact CG1-CE2 3.54Å; V191-Y341 HydrophobicContact CG1-CG 4.11Å; V191-Y341 HydrophobicContact CG2-CD1 3.47Å; V191-Y341 VanDerWaalsContact CG2-CD1 3.47Å; V191-Y341 HydrophobicContact CG2-CD2 4.15Å; V191-Y341 HydrophobicContact CG2-CE1 3.77Å; V191-Y341 HydrophobicContact CG2-CG 3.64Å; V191-V357 HydrophobicContact CG1-CB 4.33Å; V191-V357 HydrophobicContact CG1-CG1 3.7Å; V191-V357 HydrophobicContact CG1-CG2 4.42Å; V191-I359 HydrophobicContact CG2-CG2 4.19Å
192	G	98.6	Very high	96.6	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-61.6	-41.1	-179.1	0	0	0	0	0	112.8	V171 L188 L189 E195 A196	V171-G192 VanDerWaalsContact CG2-CA 3.47Å; L188-G192 PolarHBondContact O-N 2.89Å; L189-G192 PolarHBondContact O-N 2.98Å; G192-E195 PolarHBondContact O-N 3.17Å; G192-A196 WeakPolarHBondContact O-CB 3.34Å; G192-A196 PolarHBondContact O-N 3.48Å
193	V	98.4	Very high	97	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.6	-46.9	173.4	172.1	0	0	0	0	111.1	V138 L189 V191 E195 A196 L197 I205 L207 Y259	V138-V193 HydrophobicContact CG2-CG2 4.25Å; L189-V193 WeakPolarHBondContact O-CG2 3.37Å; L189-V193 PolarHBondContact O-N 3.12Å; V191-V193 VanDerWaalsContact C-N 3.34Å; V191-V193 PolarHBondContact O-N 3.47Å; V193-E195 VanDerWaalsContact C-N 3.28Å; V193-E195 PolarHBondContact O-N 3.17Å; V193-A196 PolarHBondContact O-N 3.31Å; V193-L197 HydrophobicContact CG1-CD1 3.85Å; V193-L197 HydrophobicContact CG1-CG 4.3Å; V193-L197 VanDerWaalsContact O-CG 3.3Å; V193-L197 WeakPolarHBondContact O-CG 3.48Å; V193-L197 PolarHBondContact O-N 2.91Å; V193-L197 VanDerWaalsContact O-N 3.08Å; V193-I205 HydrophobicContact CG1-CD1 3.73Å; V193-I205 HydrophobicContact CG2-CD1 4.44Å; V193-I205 HydrophobicContact CG2-CG2 3.63Å; V193-L207 HydrophobicContact CG2-CD2 3.84Å; V193-Y259 HydrophobicContact CB-CD1 4.41Å; V193-Y259 HydrophobicContact CB-CE1 3.9Å; V193-Y259 HydrophobicContact CG1-CD1 3.65Å; V193-Y259 HydrophobicContact CG1-CE1 3.63Å; V193-Y259 HydrophobicContact CG1-CG 4.25Å; V193-Y259 HydrophobicContact CG2-CE1 4.1Å; V193-Y259 HydrophobicContact CG2-CE2 4.06Å
194	R	98.3	Very high	97.2	Very high	94 Å²	94	30.6 Å²	30.6	36%	0.355	15%	0.15	S	C	.	.	H	α-helix	trans	-62.4	-35.8	-179.8	-167.2	167.4	84.3	169.8	8.8	112.6	N190 V191 K198 L336 L339 Y341	N190-R194 WeakPolarHBondContact O-CB 3.08Å; N190-R194 PolarHBondContact O-N 2.82Å; V191-R194 PolarHBondContact O-N 2.91Å; V191-R194 VanDerWaalsContact O-N 3.16Å; R194-K198 WeakPolarHBondContact O-CG 3.29Å; R194-L336 HydrophobicContact CB-CD1 4.41Å; R194-L339 HydrophobicContact CB-CD2 4.31Å; R194-L339 PolarHBondContact NH1-O 3.32Å; R194-Y341 VanDerWaalsContact CZ-OH 3.31Å; R194-Y341 PolarHBondContact NE-OH 3.19Å; R194-Y341 PolarHBondContact NH2-OH 3.33Å
195	E	98.6	Very high	97.4	Very high	8 Å²	8	30.7 Å²	30.7	4%	0.037	15%	0.151	C	C	.	.	H	α-helix	trans	-79.5	-38.1	177.1	-66.2	-54.9	145	0	0	112.9	V191 G192 V193 L197 K198 Y341 L355	V191-E195 HydrophobicContact CG1-CG 4.36Å; V191-E195 WeakPolarHBondContact O-CG 3.03Å; V191-E195 PolarHBondContact O-N 3.42Å; G192-E195 PolarHBondContact O-N 3.17Å; V193-E195 VanDerWaalsContact C-N 3.28Å; V193-E195 PolarHBondContact O-N 3.17Å; E195-L197 VanDerWaalsContact C-N 3.34Å; E195-L197 PolarHBondContact O-N 3.41Å; E195-K198 WeakPolarHBondContact O-CB 3.49Å; E195-K198 PolarHBondContact O-N 2.98Å; E195-K198 IonicContact OE1-NZ 3.43Å; E195-K198 PolarHBondContact OE1-NZ 3.06Å; E195-K198 WeakPolarHBondContact OE2-CD 3.44Å; E195-K198 IonicContact OE2-NZ 3.56Å; E195-K198 PolarHBondContact OE2-NZ 2.87Å; E195-Y341 PolarHBondContact OE1-OH 3.47Å; E195-L355 HydrophobicContact CB-CD1 3.63Å; E195-L355 HydrophobicContact CB-CD2 4.34Å; E195-L355 HydrophobicContact CG-CD1 4.09Å
196	A	98.3	Very high	97.6	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.008	15%	0.147	C	C	.	.	H	α-helix	trans	-63	-40.6	178.4	0	0	0	0	0	111.8	A136 Y169 G192 V193 K198 D199 W202	A136-A196 HydrophobicContact CB-CB 4.08Å; Y169-A196 HydrophobicContact CD1-CB 4.41Å; Y169-A196 HydrophobicContact CD2-CB 3.9Å; Y169-A196 HydrophobicContact CE1-CB 4.2Å; Y169-A196 HydrophobicContact CE2-CB 3.66Å; Y169-A196 HydrophobicContact CG-CB 4.25Å; G192-A196 WeakPolarHBondContact O-CB 3.34Å; G192-A196 PolarHBondContact O-N 3.48Å; V193-A196 PolarHBondContact O-N 3.31Å; A196-K198 PolarHBondContact O-N 2.88Å; A196-D199 PolarHBondContact O-N 3.47Å; A196-D199 VanDerWaalsContact O-N 3.09Å; A196-W202 VanDerWaalsContact O-CD1 3.22Å; A196-W202 PolarHBondContact O-NE1 2.99Å; A196-W202 VanDerWaalsContact O-NE1 3.12Å
197	L	97.8	Very high	97.7	Very high	48 Å²	48	29.7 Å²	29.7	25%	0.251	15%	0.147	S	C	.	.	H	α-helix	trans	-69	-8.5	177.6	-66.6	178.9	0	0	0	114.3	V193 E195 W202 I205 P256 M260	V193-L197 HydrophobicContact CG1-CD1 3.85Å; V193-L197 HydrophobicContact CG1-CG 4.3Å; V193-L197 VanDerWaalsContact O-CG 3.3Å; V193-L197 WeakPolarHBondContact O-CG 3.48Å; V193-L197 PolarHBondContact O-N 2.91Å; V193-L197 VanDerWaalsContact O-N 3.08Å; E195-L197 VanDerWaalsContact C-N 3.34Å; E195-L197 PolarHBondContact O-N 3.41Å; L197-W202 HydrophobicContact CD2-CB 4.45Å; L197-I205 HydrophobicContact CD1-CD1 4.49Å; L197-I205 HydrophobicContact CD2-CD1 4.28Å; L197-P256 HydrophobicContact CD1-CB 4.42Å; L197-P256 HydrophobicContact CD2-CB 4.08Å; L197-P256 HydrophobicContact CD2-CG 3.92Å; L197-M260 HydrophobicContact CD1-CE 3.61Å
198	K	97.6	Very high	97.8	Very high	126 Å²	126	29 Å²	29	55%	0.548	14%	0.144	S	C	.	.	H	α-helix	trans	-86.8	-21.6	170.8	-63.7	174.5	-166.1	169	0	112.8	R194 E195 A196	R194-K198 WeakPolarHBondContact O-CG 3.29Å; E195-K198 WeakPolarHBondContact O-CB 3.49Å; E195-K198 PolarHBondContact O-N 2.98Å; E195-K198 IonicContact OE1-NZ 3.43Å; E195-K198 PolarHBondContact OE1-NZ 3.06Å; E195-K198 WeakPolarHBondContact OE2-CD 3.44Å; E195-K198 IonicContact OE2-NZ 3.56Å; E195-K198 PolarHBondContact OE2-NZ 2.87Å; A196-K198 PolarHBondContact O-N 2.88Å
199	D	95.3	Very high	97.7	Very high	54 Å²	54	30.5 Å²	30.5	29%	0.289	15%	0.152	S	C	.	.	H	α-helix	trans	-86.8	-34.3	-173.7	-74.1	-18.9	0	0	0	113	Y169 A196 K346	Y169-D199 WeakPolarHBondContact CE1-OD2 3.37Å; Y169-D199 WeakPolarHBondContact OH-CB 3.26Å; Y169-D199 PolarHBondContact OH-OD2 3.12Å; A196-D199 PolarHBondContact O-N 3.47Å; A196-D199 VanDerWaalsContact O-N 3.09Å; D199-K346 IonicContact OD1-NZ 2.78Å; D199-K346 PolarHBondContact OD1-NZ 3.36Å; D199-K346 WeakPolarHBondContact OD2-CE 3.18Å; D199-K346 IonicContact OD2-NZ 2.83Å; D199-K346 PolarHBondContact OD2-NZ 2.88Å
200	E	95.6	Very high	97.7	Very high	54 Å²	54	30.9 Å²	30.9	25%	0.252	15%	0.154	S	C	.	.	S	Bend	trans	-162.9	157.4	-174.1	-156.7	167.7	158.4	0	0	111.6	H134 H165 W202	H134-E200 IonicContact ND1-OE1 3.67Å; H165-E200 VanDerWaalsContact CE1-CD 3.44Å; H165-E200 IonicContact CE1-OE1 3.47Å; H165-E200 PolarHBondContact CE1-OE1 3.11Å; H165-E200 IonicContact CE1-OE2 3.43Å; H165-E200 PolarHBondContact CE1-OE2 3.13Å; H165-E200 VanDerWaalsContact CE1-OE2 3.32Å; H165-E200 IonicContact ND1-OE1 3.62Å; H165-E200 PolarHBondContact ND1-OE1 3.06Å; H165-E200 IonicContact NE2-OE1 2.55Å; E200-W202 HydrophobicContact CB-CD2 4.33Å; E200-W202 HydrophobicContact CB-CZ2 4.02Å; E200-W202 PolarHBondContact O-N 3.45Å
201	D	96.1	Very high	97.5	Very high	156 Å²	156	31.4 Å²	31.4	83%	0.834	16%	0.157	S	C	*	.			trans	-77.5	69.8	174.1	-65.8	-33.2	0	0	0	110.9	S203	D201-S203 PolarHBondContact O-N 2.76Å
202	W	98	Very high	97.4	Very high	8 Å²	8	31.5 Å²	31.5	3%	0.03	16%	0.158	C	C	.	.			trans	-63	130.1	176.7	-62.2	107.5	0	0	0	111.1	H134 T135 A136 H165 S167 Y169 A196 L197 E200 P256	H134-W202 HydrophobicContact CB-CE3 4Å; H134-W202 HydrophobicContact CB-CZ3 4.34Å; T135-W202 VanDerWaalsContact C-CE3 3.43Å; A136-W202 HydrophobicContact CB-CB 4.29Å; A136-W202 HydrophobicContact CB-CD2 3.71Å; A136-W202 HydrophobicContact CB-CE3 4.29Å; A136-W202 HydrophobicContact CB-CG 3.67Å; H165-W202 AromaticContact CE1-CH2 3.58Å; H165-W202 AromaticContact CE1-CZ3 3.63Å; H165-W202 AromaticContact ND1-CZ3 3.57Å; S167-W202 VanDerWaalsContact CB-CH2 3.43Å; S167-W202 VanDerWaalsContact CB-CZ2 3.45Å; Y169-W202 HydrophobicContact CE2-CZ2 4.23Å; A196-W202 VanDerWaalsContact O-CD1 3.22Å; A196-W202 PolarHBondContact O-NE1 2.99Å; A196-W202 VanDerWaalsContact O-NE1 3.12Å; L197-W202 HydrophobicContact CD2-CB 4.45Å; E200-W202 HydrophobicContact CB-CD2 4.33Å; E200-W202 HydrophobicContact CB-CZ2 4.02Å; E200-W202 PolarHBondContact O-N 3.45Å; W202-P256 WeakPolarHBondContact O-CG 3.08Å
203	S	97.1	Very high	97.4	Very high	54 Å²	54	31.6 Å²	31.6	38%	0.378	16%	0.158	S	C	.	.	S	Bend	trans	-85.3	-18	174.1	52.2	0	0	0	0	112.5	H134 D201	H134-S203 PolarHBondContact N-OG 3.03Å; H134-S203 VanDerWaalsContact N-OG 3.13Å; H134-S203 PolarHBondContact O-N 3.12Å; H134-S203 PolarHBondContact O-OG 3.07Å; H134-S203 VanDerWaalsContact O-OG 3.12Å; D201-S203 PolarHBondContact O-N 2.76Å
204	C	98.1	Very high	97.4	Very high	4 Å²	4	31.6 Å²	31.6	3%	0.027	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	143.6	-177.8	-174	0	0	0	0	112.1	H134 T135 A136 F206 C223	H134-C204 PolarHBondContact O-N 2.78Å; T135-C204 WeakPolarHBondContact CA-O 3.41Å; T135-C204 HydrophobicContact CG2-CB 4.43Å; A136-C204 PolarHBondContact N-O 2.73Å; C204-F206 WeakPolarHBondContact SG-CE2 3.46Å; C204-C223 WeakPolarHBondContact CA-SG 3.49Å; C204-C223 HydrophobicContact CB-CB 3.7Å; C204-C223 WeakPolarHBondContact CB-SG 3.11Å; C204-C223 VanDerWaalsContact SG-CA 3.56Å; C204-C223 WeakPolarHBondContact SG-CB 3.49Å; C204-C223 PolarHBondContact SG-N 3.3Å; C204-C223 CovalentContact SG-SG 2.03Å; C204-C223 PolarHBondContact SG-SG 3.22Å
205	I	98.4	Very high	97.3	Very high	2 Å²	2	28 Å²	28	1%	0.01	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	123.9	177.3	-58.1	164.5	0	0	0	108	A136 V138 V193 L197 L207 A253 V254 P256	A136-I205 CarbonylContact O-C 3.48Å; A136-I205 WeakPolarHBondContact O-CA 3.33Å; V138-I205 HydrophobicContact CG2-CG2 4.34Å; V193-I205 HydrophobicContact CG1-CD1 3.73Å; V193-I205 HydrophobicContact CG2-CD1 4.44Å; V193-I205 HydrophobicContact CG2-CG2 3.63Å; L197-I205 HydrophobicContact CD1-CD1 4.49Å; L197-I205 HydrophobicContact CD2-CD1 4.28Å; I205-L207 HydrophobicContact CG2-CD2 4.08Å; I205-L207 HydrophobicContact CG2-CG 4.38Å; I205-A253 VanDerWaalsContact O-CA 3.31Å; I205-A253 WeakPolarHBondContact O-CA 3.08Å; I205-V254 HydrophobicContact CB-CG2 4.09Å; I205-V254 WeakPolarHBondContact CB-O 3.38Å; I205-V254 HydrophobicContact CG2-CG2 4.42Å; I205-V254 PolarHBondContact N-O 3.13Å; I205-V254 PolarHBondContact O-N 3.26Å; I205-P256 HydrophobicContact CD1-CB 4.32Å; I205-P256 HydrophobicContact CD1-CG 4.15Å; I205-P256 HydrophobicContact CG1-CG 4.48Å
206	F	98.4	Very high	97.2	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	129.3	170.3	-91.4	-113.1	0	0	0	110	T135 A136 I137 V138 C204 Y221 L231 V251 S252 A253	T135-F206 HydrophobicContact CG2-CB 4.38Å; T135-F206 HydrophobicContact CG2-CD2 3.39Å; T135-F206 HydrophobicContact CG2-CE2 4.02Å; T135-F206 HydrophobicContact CG2-CG 4.12Å; A136-F206 PolarHBondContact O-N 2.81Å; I137-F206 HydrophobicContact CB-CB 4.38Å; I137-F206 HydrophobicContact CG1-CB 4.07Å; I137-F206 HydrophobicContact CG2-CB 4.32Å; V138-F206 PolarHBondContact N-O 3.26Å; C204-F206 WeakPolarHBondContact SG-CE2 3.46Å; F206-Y221 AromaticContact CD1-CD1 3.29Å; F206-Y221 HydrophobicContact CD1-CD1 3.29Å; F206-Y221 AromaticContact CD1-CE1 3.58Å; F206-Y221 HydrophobicContact CD1-CE1 3.58Å; F206-Y221 AromaticContact CD1-CG 3.89Å; F206-Y221 HydrophobicContact CD1-CG 3.89Å; F206-Y221 HydrophobicContact CD2-CD1 4.49Å; F206-Y221 AromaticContact CE1-CD1 3.43Å; F206-Y221 HydrophobicContact CE1-CD1 3.43Å; F206-Y221 VanDerWaalsContact CE1-CD1 3.43Å; F206-Y221 AromaticContact CE1-CD2 3.99Å; F206-Y221 HydrophobicContact CE1-CD2 3.99Å; F206-Y221 AromaticContact CE1-CE1 3.87Å; F206-Y221 HydrophobicContact CE1-CE1 3.87Å; F206-Y221 HydrophobicContact CE1-CE2 4.35Å; F206-Y221 AromaticContact CE1-CG 3.5Å; F206-Y221 HydrophobicContact CE1-CG 3.5Å; F206-Y221 VanDerWaalsContact CE1-CG 3.5Å; F206-Y221 WeakPolarHBondContact CE2-O 3.34Å; F206-Y221 AromaticContact CG-CD1 3.88Å; F206-Y221 HydrophobicContact CG-CD1 3.88Å; F206-Y221 HydrophobicContact CG-CE1 4.44Å; F206-Y221 HydrophobicContact CZ-CD1 4.16Å; F206-Y221 HydrophobicContact CZ-CD2 4.49Å; F206-Y221 AromaticContact CZ-CG 3.9Å; F206-Y221 HydrophobicContact CZ-CG 3.9Å; F206-L231 HydrophobicContact CE1-CD2 4.07Å; F206-L231 HydrophobicContact CE1-CG 3.87Å; F206-L231 HydrophobicContact CZ-CD2 4.23Å; F206-L231 HydrophobicContact CZ-CG 4.25Å; F206-V251 HydrophobicContact CD1-CG1 4Å; F206-V251 HydrophobicContact CE1-CG1 4.36Å; F206-S252 WeakPolarHBondContact CA-O 3.36Å; F206-A253 HydrophobicContact CD1-CB 4.38Å; F206-A253 HydrophobicContact CD2-CB 3.76Å; F206-A253 HydrophobicContact CE1-CB 4.03Å; F206-A253 HydrophobicContact CE2-CB 3.35Å; F206-A253 HydrophobicContact CG-CB 4.25Å; F206-A253 HydrophobicContact CZ-CB 3.45Å; F206-A253 VanDerWaalsContact CZ-CB 3.45Å
207	L	97.9	Very high	97.2	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	109.2	178.8	-55.5	160.5	0	0	0	106.5	L189 V193 I205 V251 S252 V254 Y259 F265	L189-L207 HydrophobicContact CB-CD2 4.14Å; L189-L207 HydrophobicContact CD1-CB 4.31Å; L189-L207 HydrophobicContact CD1-CD2 4.43Å; L189-L207 HydrophobicContact CD2-CB 4.09Å; L189-L207 HydrophobicContact CD2-CD2 3.93Å; L189-L207 HydrophobicContact CG-CD2 4.39Å; V193-L207 HydrophobicContact CG2-CD2 3.84Å; I205-L207 HydrophobicContact CG2-CD2 4.08Å; I205-L207 HydrophobicContact CG2-CG 4.38Å; L207-V251 WeakPolarHBondContact O-CA 3.34Å; L207-S252 PolarHBondContact N-O 2.99Å; L207-S252 PolarHBondContact O-N 3.01Å; L207-V254 HydrophobicContact CD1-CG2 3.95Å; L207-V254 HydrophobicContact CG-CG2 4.48Å; L207-Y259 HydrophobicContact CD1-CE2 4.12Å; L207-Y259 HydrophobicContact CD2-CE2 4.08Å; L207-F265 HydrophobicContact CD1-CD2 4.41Å; L207-F265 HydrophobicContact CD1-CE2 3.32Å; L207-F265 HydrophobicContact CD1-CZ 3.63Å; L207-F265 HydrophobicContact CD2-CE2 4.49Å; L207-F265 HydrophobicContact CG-CE2 4.46Å
208	H	98.3	Very high	97.1	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	126.6	-155.9	-164.2	-63.6	0	0	0	112.6	I137 V138 V139 P140 L212 Y221 V251	I137-H208 HydrophobicContact CG2-CB 3.97Å; V138-H208 PolarHBondContact O-N 2.89Å; V139-H208 WeakPolarHBondContact CA-O 3.16Å; V139-H208 HydrophobicContact CG2-CB 4.32Å; P140-H208 VanDerWaalsContact CD-O 3.25Å; P140-H208 WeakPolarHBondContact CD-O 3.37Å; H208-L212 PolarHBondContact CE1-O 3.38Å; H208-Y221 AromaticContact CD2-CE1 3.72Å; H208-Y221 AromaticContact NE2-CE1 3.91Å; H208-Y221 AromaticContact NE2-CZ 3.86Å; H208-Y221 PolarHBondContact NE2-OH 2.76Å; H208-V251 VanDerWaalsContact CD2-CG1 3.46Å; H208-V251 WeakPolarHBondContact CD2-CG1 3.48Å
209	D	96.8	Very high	97.1	Very high	31 Å²	31	22.8 Å²	22.8	17%	0.166	12%	0.121	C	C	.	.			trans	-72.2	140.5	172.9	-71.8	0	0	0	0	111.6	R185 D211 L212 G250	R185-D209 IonicContact CZ-OD1 2.73Å; R185-D209 VanDerWaalsContact CZ-OD1 3.23Å; R185-D209 IonicContact NE-OD1 3.76Å; R185-D209 PolarHBondContact NE-OD1 3.38Å; R185-D209 IonicContact NE-OD2 2.67Å; R185-D209 IonicContact NH2-OD1 3.64Å; R185-D209 PolarHBondContact NH2-OD1 3.42Å; D209-D211 PolarHBondContact O-N 3.45Å; D209-D211 VanDerWaalsContact O-N 3.12Å; D209-L212 HydrophobicContact CB-CD1 4.03Å; D209-L212 HydrophobicContact CB-CG 4.15Å; D209-L212 PolarHBondContact O-N 3.18Å; D209-G250 PolarHBondContact N-O 2.84Å; D209-G250 WeakPolarHBondContact OD2-CA 3.31Å
210	V	96.6	Very high	97.1	Very high	9 Å²	9	22.9 Å²	22.9	6%	0.055	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-16.6	-177.2	70.9	0	0	0	0	113.7	V139 F141 R144 H147 L148 L151	V139-V210 HydrophobicContact CG1-CB 3.76Å; V139-V210 HydrophobicContact CG1-CG2 4.16Å; F141-V210 HydrophobicContact CD2-CB 4.44Å; F141-V210 HydrophobicContact CD2-CG2 3.94Å; F141-V210 HydrophobicContact CE2-CG2 4.17Å; R144-V210 HydrophobicContact CB-CG1 4.35Å; H147-V210 HydrophobicContact CB-CG1 4.27Å; H147-V210 HydrophobicContact CB-CG2 4.09Å; L148-V210 HydrophobicContact CB-CG2 4.16Å; L151-V210 HydrophobicContact CD2-CG2 4.18Å
211	D	95	Very high	97.2	Very high	10 Å²	10	20.3 Å²	20.3	5%	0.053	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.7	11.6	-174.1	57.7	11.7	0	0	0	114.3	R144 D209 M305 I306 H308	R144-D211 IonicContact NH1-OD2 2.96Å; R144-D211 PolarHBondContact NH1-OD2 3.11Å; D209-D211 PolarHBondContact O-N 3.45Å; D209-D211 VanDerWaalsContact O-N 3.12Å; D211-M305 CarbonylContact O-C 3.59Å; D211-M305 VanDerWaalsContact O-CA 3.25Å; D211-M305 WeakPolarHBondContact O-CA 3.32Å; D211-M305 WeakPolarHBondContact OD2-CE 3.16Å; D211-I306 HydrophobicContact CB-CB 3.94Å; D211-I306 HydrophobicContact CB-CG1 4.25Å; D211-I306 PolarHBondContact O-N 3.1Å; D211-H308 IonicContact OD2-CD2 2.69Å; D211-H308 PolarHBondContact OD2-CD2 2.99Å; D211-H308 VanDerWaalsContact OD2-CD2 3.24Å; D211-H308 IonicContact OD2-NE2 3.88Å; D211-H308 PolarHBondContact OD2-NE2 3.42Å
212	L	97.3	Very high	97.2	Very high	3 Å²	3	14.2 Å²	14.2	2%	0.016	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	125.2	175.9	-70	178.4	0	0	0	110.8	H208 D209 M235 V251 Y303 M305	H208-L212 PolarHBondContact CE1-O 3.38Å; D209-L212 HydrophobicContact CB-CD1 4.03Å; D209-L212 HydrophobicContact CB-CG 4.15Å; D209-L212 PolarHBondContact O-N 3.18Å; L212-M235 HydrophobicContact CD1-SD 4.19Å; L212-M235 HydrophobicContact CD2-CG 4.2Å; L212-M235 HydrophobicContact CD2-SD 3.91Å; L212-V251 HydrophobicContact CB-CG2 3.99Å; L212-V251 HydrophobicContact CD1-CG2 3.95Å; L212-Y303 HydrophobicContact CB-CD1 3.92Å; L212-M305 HydrophobicContact CD2-CB 3.91Å; L212-M305 HydrophobicContact CD2-CG 4.03Å
213	L	97.5	Very high	97.2	Very high	2 Å²	2	15 Å²	15	1%	0.01	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	122.5	-178.7	-55.5	179.5	0	0	0	109.5	V100 L102 L151 H154 Y303 K304 I306	V100-L213 HydrophobicContact CG1-CB 3.9Å; V100-L213 HydrophobicContact CG1-CD1 3.41Å; V100-L213 VanDerWaalsContact CG1-CD1 3.41Å; V100-L213 HydrophobicContact CG1-CG 4.25Å; V100-L213 HydrophobicContact CG2-CB 4.05Å; L102-L213 HydrophobicContact CD2-CD1 3.8Å; L151-L213 HydrophobicContact CB-CD2 4.32Å; L151-L213 HydrophobicContact CD1-CD2 3.78Å; H154-L213 HydrophobicContact CB-CD2 4.09Å; L213-Y303 CarbonylContact O-C 3.47Å; L213-Y303 WeakPolarHBondContact O-CA 3.45Å; L213-K304 PolarHBondContact N-O 2.8Å; L213-K304 PolarHBondContact O-N 2.99Å; L213-I306 HydrophobicContact CD1-CD1 4.16Å; L213-I306 HydrophobicContact CD1-CG1 4.13Å; L213-I306 HydrophobicContact CG-CD1 4.48Å; L213-I306 HydrophobicContact CG-CG1 4.39Å
214	P	97.5	Very high	97.1	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	138.8	-179.3	28.3	-36	0	0	0	111.6	H154 L155 F158 Y221 Y303	H154-P214 PolarHBondContact NE2-O 2.98Å; L155-P214 HydrophobicContact CD2-CG 3.92Å; F158-P214 HydrophobicContact CD1-CG 4.09Å; F158-P214 HydrophobicContact CD2-CG 4.02Å; F158-P214 HydrophobicContact CE1-CB 4.14Å; F158-P214 HydrophobicContact CE1-CG 3.73Å; F158-P214 HydrophobicContact CE2-CB 3.8Å; F158-P214 HydrophobicContact CE2-CG 3.66Å; F158-P214 HydrophobicContact CG-CG 4.22Å; F158-P214 HydrophobicContact CZ-CB 3.51Å; F158-P214 HydrophobicContact CZ-CG 3.49Å; F158-P214 VanDerWaalsContact CZ-CG 3.49Å; P214-Y221 HydrophobicContact CB-CE2 4.4Å; P214-Y221 HydrophobicContact CG-CE2 4.16Å; P214-Y303 HydrophobicContact CB-CD1 4.18Å; P214-Y303 HydrophobicContact CB-CE1 3.69Å; P214-Y303 HydrophobicContact CB-CE2 4.4Å; P214-Y303 HydrophobicContact CG-CE1 4.24Å
215	E	97.3	Very high	96.8	Very high	19 Å²	19	24.8 Å²	24.8	9%	0.089	12%	0.123	C	C	.	.	S	Bend	trans	-104.2	0.3	-175.5	-70.6	179.8	118.4	0	0	113.9	Y50 P97 V98 V100 Y240 H302 K304	Y50-E215 HydrophobicContact CE1-CB 4.24Å; P97-E215 CarbonylContact C-O 3.55Å; P97-E215 VanDerWaalsContact CA-O 3.27Å; P97-E215 WeakPolarHBondContact CA-O 3.22Å; V98-E215 PolarHBondContact N-O 2.83Å; V100-E215 HydrophobicContact CG2-CG 3.69Å; E215-Y240 PolarHBondContact OE1-OH 2.88Å; E215-Y240 VanDerWaalsContact OE2-CE1 3.23Å; E215-Y240 WeakPolarHBondContact OE2-CE1 3.45Å; E215-Y240 PolarHBondContact OE2-OH 3.16Å; E215-H302 HydrophobicContact CB-CB 3.89Å; E215-H302 PolarHBondContact N-O 3.09Å; E215-K304 HydrophobicContact CG-CB 4.12Å
216	N	97.1	Very high	96.4	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.152	C	C	.	.	B	Isolated β-bridge	trans	-146.8	122.8	176.7	-174.6	-24.5	0	0	0	110.3	Y50 G96 F158 H218 N219	Y50-N216 HydrophobicContact CE1-CB 4.33Å; Y50-N216 WeakPolarHBondContact OH-CB 3.48Å; Y50-N216 PolarHBondContact OH-ND2 2.83Å; G96-N216 WeakPolarHBondContact CA-OD1 3.46Å; G96-N216 WeakPolarHBondContact O-CA 3.33Å; G96-N216 PolarHBondContact O-OD1 2.95Å; F158-N216 WeakPolarHBondContact CZ-O 3.37Å; N216-H218 PolarHBondContact O-N 2.83Å; N216-H218 WeakPolarHBondContact OD1-CB 3.35Å; N216-H218 PolarHBondContact OD1-N 2.85Å; N216-H218 PolarHBondContact OD1-ND1 2.77Å; N216-N219 WeakPolarHBondContact O-CB 3.41Å; N216-N219 PolarHBondContact O-N 2.97Å
217	D	96.8	Very high	96.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-4.4	-174.2	68.1	4.6	0	0	0	115.2	L94 V95 G96 F158 R161 Q162 N219	L94-D217 HydrophobicContact CD2-CB 4.22Å; V95-D217 WeakPolarHBondContact CG2-OD2 3.42Å; V95-D217 PolarHBondContact N-OD1 3.09Å; V95-D217 VanDerWaalsContact N-OD1 3.13Å; V95-D217 PolarHBondContact N-OD2 2.77Å; G96-D217 WeakPolarHBondContact CA-OD1 3.41Å; G96-D217 PolarHBondContact N-OD1 2.79Å; G96-D217 PolarHBondContact O-N 3.39Å; G96-D217 VanDerWaalsContact O-N 3.09Å; F158-D217 HydrophobicContact CD2-CB 3.92Å; F158-D217 HydrophobicContact CE2-CB 3.59Å; F158-D217 VanDerWaalsContact CZ-CA 3.45Å; F158-D217 HydrophobicContact CZ-CB 3.98Å; R161-D217 IonicContact CZ-OD2 3.9Å; R161-D217 IonicContact NE-OD2 3.32Å; R161-D217 PolarHBondContact NE-OD2 2.93Å; R161-D217 IonicContact NH2-OD2 3.23Å; Q162-D217 PolarHBondContact NE2-O 2.92Å; D217-N219 PolarHBondContact O-N 3.43Å
218	H	96.4	Very high	95.9	Very high	71 Å²	71	32.8 Å²	32.8	33%	0.329	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-13	164	-67.4	60.5	0	0	0	112.3	F48 G96 N216 T220 I300	F48-H218 HydrophobicContact CZ-CB 4.45Å; F48-H218 AromaticContact CZ-CD2 3.95Å; G96-H218 VanDerWaalsContact CA-ND1 3.34Å; G96-H218 WeakPolarHBondContact CA-ND1 3.43Å; G96-H218 PolarHBondContact N-CE1 3.12Å; N216-H218 PolarHBondContact O-N 2.83Å; N216-H218 WeakPolarHBondContact OD1-CB 3.35Å; N216-H218 PolarHBondContact OD1-N 2.85Å; N216-H218 PolarHBondContact OD1-ND1 2.77Å; H218-T220 VanDerWaalsContact C-N 3.29Å; H218-T220 PolarHBondContact O-N 3.03Å; H218-I300 HydrophobicContact CB-CB 4.47Å; H218-I300 HydrophobicContact CB-CG2 4.12Å
219	N	96.8	Very high	95.7	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.011	16%	0.163	C	C	.	.	S	Bend	trans	-77.4	81.5	167.5	-164.2	24.6	0	0	0	109.8	Q162 N216 D217 L231 Y303	Q162-N219 PolarHBondContact NE2-O 2.89Å; Q162-N219 VanDerWaalsContact NE2-O 3.09Å; N216-N219 WeakPolarHBondContact O-CB 3.41Å; N216-N219 PolarHBondContact O-N 2.97Å; D217-N219 PolarHBondContact O-N 3.43Å; N219-L231 VanDerWaalsContact OD1-CD1 3.26Å; N219-L231 WeakPolarHBondContact OD1-CD1 3.32Å; N219-Y303 WeakPolarHBondContact ND2-CE2 3.37Å; N219-Y303 PolarHBondContact ND2-OH 2.84Å
220	T	96.8	Very high	95.7	Very high	55 Å²	55	31.8 Å²	31.8	34%	0.337	16%	0.155	S	C	.	.			trans	-70.6	137.1	-170.2	57.7	0	0	0	0	113	H218 T222	H218-T220 VanDerWaalsContact C-N 3.29Å; H218-T220 PolarHBondContact O-N 3.03Å; T220-T222 PolarHBondContact O-N 2.99Å; T220-T222 PolarHBondContact OG1-OG1 2.85Å
221	Y	97.8	Very high	95.6	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.154	C	C	.	.	S	Bend	trans	-82.2	59.1	179.9	-84.7	-128.7	0	0	0	111.6	T135 I137 L155 F158 L159 F206 H208 P214 Y303	T135-Y221 PolarHBondContact OG1-O 2.78Å; I137-Y221 HydrophobicContact CG1-CD1 4.36Å; L155-Y221 HydrophobicContact CD2-CE1 4.16Å; F158-Y221 HydrophobicContact CD1-CD2 4.45Å; F158-Y221 HydrophobicContact CD1-CE2 4.31Å; F158-Y221 AromaticContact CE1-CD2 3.76Å; F158-Y221 HydrophobicContact CE1-CD2 3.76Å; F158-Y221 AromaticContact CE1-CE2 3.58Å; F158-Y221 HydrophobicContact CE1-CE2 3.58Å; F158-Y221 HydrophobicContact CZ-CE2 4.34Å; L159-Y221 VanDerWaalsContact CD2-CB 3.46Å; L159-Y221 HydrophobicContact CD2-CD1 3.45Å; L159-Y221 VanDerWaalsContact CD2-CD1 3.45Å; L159-Y221 HydrophobicContact CD2-CD2 3.92Å; L159-Y221 HydrophobicContact CD2-CE1 4.12Å; L159-Y221 HydrophobicContact CD2-CG 3.32Å; F206-Y221 AromaticContact CD1-CD1 3.29Å; F206-Y221 HydrophobicContact CD1-CD1 3.29Å; F206-Y221 AromaticContact CD1-CE1 3.58Å; F206-Y221 HydrophobicContact CD1-CE1 3.58Å; F206-Y221 AromaticContact CD1-CG 3.89Å; F206-Y221 HydrophobicContact CD1-CG 3.89Å; F206-Y221 HydrophobicContact CD2-CD1 4.49Å; F206-Y221 AromaticContact CE1-CD1 3.43Å; F206-Y221 HydrophobicContact CE1-CD1 3.43Å; F206-Y221 VanDerWaalsContact CE1-CD1 3.43Å; F206-Y221 AromaticContact CE1-CD2 3.99Å; F206-Y221 HydrophobicContact CE1-CD2 3.99Å; F206-Y221 AromaticContact CE1-CE1 3.87Å; F206-Y221 HydrophobicContact CE1-CE1 3.87Å; F206-Y221 HydrophobicContact CE1-CE2 4.35Å; F206-Y221 AromaticContact CE1-CG 3.5Å; F206-Y221 HydrophobicContact CE1-CG 3.5Å; F206-Y221 VanDerWaalsContact CE1-CG 3.5Å; F206-Y221 WeakPolarHBondContact CE2-O 3.34Å; F206-Y221 AromaticContact CG-CD1 3.88Å; F206-Y221 HydrophobicContact CG-CD1 3.88Å; F206-Y221 HydrophobicContact CG-CE1 4.44Å; F206-Y221 HydrophobicContact CZ-CD1 4.16Å; F206-Y221 HydrophobicContact CZ-CD2 4.49Å; F206-Y221 AromaticContact CZ-CG 3.9Å; F206-Y221 HydrophobicContact CZ-CG 3.9Å; H208-Y221 AromaticContact CD2-CE1 3.72Å; H208-Y221 AromaticContact NE2-CE1 3.91Å; H208-Y221 AromaticContact NE2-CZ 3.86Å; H208-Y221 PolarHBondContact NE2-OH 2.76Å; P214-Y221 HydrophobicContact CB-CE2 4.4Å; P214-Y221 HydrophobicContact CG-CE2 4.16Å; Y221-Y303 PolarHBondContact OH-OH 3.3Å; Y221-Y303 VanDerWaalsContact OH-OH 3.09Å
222	T	96.5	Very high	95.6	Very high	28 Å²	28	31.1 Å²	31.1	17%	0.172	15%	0.151	C	C	.	.			trans	-130.4	153.2	-174.3	59.2	0	0	0	0	110.5	H133 I164 T220	H133-T222 HydrophobicContact CB-CG2 4.01Å; H133-T222 WeakPolarHBondContact CD2-CG2 3.47Å; I164-T222 HydrophobicContact CG2-CG2 4.27Å; T220-T222 PolarHBondContact O-N 2.99Å; T220-T222 PolarHBondContact OG1-OG1 2.85Å
223	C	96.1	Very high	95.4	Very high	24 Å²	24	31.3 Å²	31.3	16%	0.162	15%	0.152	C	C	.	.			trans	-93.8	139.8	-178.8	-76	0	0	0	0	112.4	C204 V254 T255	C204-C223 WeakPolarHBondContact CA-SG 3.49Å; C204-C223 HydrophobicContact CB-CB 3.7Å; C204-C223 WeakPolarHBondContact CB-SG 3.11Å; C204-C223 VanDerWaalsContact SG-CA 3.56Å; C204-C223 WeakPolarHBondContact SG-CB 3.49Å; C204-C223 PolarHBondContact SG-N 3.3Å; C204-C223 CovalentContact SG-SG 2.03Å; C204-C223 PolarHBondContact SG-SG 3.22Å; C223-V254 PolarHBondContact SG-O 2.94Å; C223-T255 HydrophobicContact CB-CG2 3.82Å
224	H	95.1	Very high	95.3	Very high	72 Å²	72	31.2 Å²	31.2	33%	0.333	15%	0.151	S	C	.	.			trans	-71.5	130.2	165.2	-176.2	-79.9	0	0	0	109.9	Q226 F227 T229 Q258	H224-Q226 VanDerWaalsContact C-N 3.32Å; H224-Q226 PolarHBondContact ND1-N 2.84Å; H224-Q226 PolarHBondContact O-N 3.44Å; H224-F227 WeakPolarHBondContact CB-O 3.25Å; H224-F227 AromaticContact CE1-CD2 3.58Å; H224-F227 AromaticContact ND1-CD2 3.89Å; H224-F227 PolarHBondContact ND1-N 3.12Å; H224-T229 WeakPolarHBondContact CB-OG1 3.49Å; H224-Q258 PolarHBondContact O-NE2 2.67Å
225	K	91.9	Very high	95.1	Very high	193 Å²	193	31.4 Å²	31.4	84%	0.839	15%	0.153	S	C	*	.	S	Bend	trans	-57.1	-40.6	-171.2	-66	-175.3	178.4	-177.8	0	113.7	Q258	K225-Q258 PolarHBondContact O-NE2 3.19Å; K225-Q258 VanDerWaalsContact O-NE2 3.09Å
226	Q	89.8	Confident	94.9	Very high	132 Å²	132	32.2 Å²	32.2	62%	0.617	16%	0.157	S	C	*	.	S	Bend	trans	-98.5	-20.8	-171.7	-63	178.1	-16.7	0	0	114.8	H224	H224-Q226 VanDerWaalsContact C-N 3.32Å; H224-Q226 PolarHBondContact ND1-N 2.84Å; H224-Q226 PolarHBondContact O-N 3.44Å
227	F	92.9	Very high	94.5	Very high	37 Å²	37	38 Å²	38	16%	0.162	18%	0.182	C	C	.	.	S	Bend	trans	-146	141.6	-161.1	-64.5	-50	0	0	0	111.9	H224 Q258 M291 K292 V294	H224-F227 WeakPolarHBondContact CB-O 3.25Å; H224-F227 AromaticContact CE1-CD2 3.58Å; H224-F227 AromaticContact ND1-CD2 3.89Å; H224-F227 PolarHBondContact ND1-N 3.12Å; F227-Q258 VanDerWaalsContact N-NE2 3.14Å; F227-M291 HydrophobicContact CD1-CB 4.23Å; F227-K292 HydrophobicContact CB-CG 4.42Å; F227-K292 WeakPolarHBondContact CB-O 3.36Å; F227-K292 HydrophobicContact CD1-CG 3.62Å; F227-K292 HydrophobicContact CD2-CD 4.29Å; F227-K292 VanDerWaalsContact CD2-CE 3.42Å; F227-K292 HydrophobicContact CD2-CG 3.85Å; F227-K292 HydrophobicContact CE1-CG 3.8Å; F227-K292 HydrophobicContact CE2-CD 4.19Å; F227-K292 HydrophobicContact CE2-CG 4.06Å; F227-K292 HydrophobicContact CG-CG 3.66Å; F227-K292 HydrophobicContact CZ-CD 4.3Å; F227-K292 HydrophobicContact CZ-CG 4.02Å; F227-V294 HydrophobicContact CB-CG2 3.58Å; F227-V294 HydrophobicContact CD2-CG2 3.95Å; F227-V294 HydrophobicContact CG-CG2 4.15Å
228	P	93.9	Very high	94.2	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.197	C	C	.	.			trans	-56.2	140.2	169.8	-28.3	37.5	0	0	0	112	F248 V254 M262 V286 M291 I293 V294	P228-F248 HydrophobicContact CB-CE2 4.27Å; P228-F248 HydrophobicContact CB-CZ 3.92Å; P228-V254 HydrophobicContact CB-CG1 3.82Å; P228-V254 HydrophobicContact CG-CG1 4.15Å; P228-M262 HydrophobicContact CB-CE 4.49Å; P228-M262 HydrophobicContact CG-CE 3.69Å; P228-V286 HydrophobicContact CG-CG1 4.13Å; P228-V286 HydrophobicContact CG-CG2 4.15Å; P228-M291 HydrophobicContact CG-CE 4.18Å; P228-M291 HydrophobicContact CG-SD 4.13Å; P228-I293 WeakPolarHBondContact O-CA 3.48Å; P228-V294 PolarHBondContact O-N 3.08Å
229	T	94.8	Very high	94	Very high	11 Å²	11	48.4 Å²	48.4	7%	0.067	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	134.7	-179	-48.6	0	0	0	0	110.2	H224 L231 S252 A253 V294	H224-T229 WeakPolarHBondContact CB-OG1 3.49Å; T229-L231 HydrophobicContact CG2-CD1 4.03Å; T229-L231 HydrophobicContact CG2-CD2 3.77Å; T229-L231 WeakPolarHBondContact O-CD2 3.42Å; T229-S252 CarbonylContact O-C 3.5Å; T229-S252 VanDerWaalsContact O-CA 3.26Å; T229-S252 WeakPolarHBondContact O-CA 3.45Å; T229-S252 WeakPolarHBondContact O-CB 3.28Å; T229-A253 PolarHBondContact N-O 3.33Å; T229-A253 PolarHBondContact O-N 2.83Å; T229-V294 CarbonylContact C-O 3.5Å; T229-V294 VanDerWaalsContact CA-O 3.3Å; T229-V294 WeakPolarHBondContact CA-O 3.15Å
230	H	95.4	Very high	93.8	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	115.5	170.7	173	-112.9	0	0	0	109.1	S232 V233 Y247 F248 G249 I293 V294 R295 P296	H230-S232 PolarHBondContact CE1-O 2.82Å; H230-S232 PolarHBondContact NE2-O 2.87Å; H230-S232 PolarHBondContact NE2-OG 3.02Å; H230-V233 VanDerWaalsContact O-CG1 3.29Å; H230-V233 WeakPolarHBondContact O-CG1 3.16Å; H230-Y247 AromaticContact CE1-CD1 3.67Å; H230-Y247 AromaticContact NE2-CD1 3.59Å; H230-Y247 AromaticContact NE2-CE1 3.67Å; H230-F248 HydrophobicContact CB-CD2 3.61Å; H230-F248 HydrophobicContact CB-CE2 3.77Å; H230-G249 PolarHBondContact NE2-O 2.78Å; H230-I293 HydrophobicContact CB-CG2 3.81Å; H230-V294 PolarHBondContact N-O 3.28Å; H230-R295 HydrophobicContact CB-CG 4.04Å; H230-R295 PolarHBondContact ND1-NE 2.96Å; H230-P296 WeakPolarHBondContact O-CD 3.44Å
231	L	96.1	Very high	93.5	Very high	5 Å²	5	58.8 Å²	58.8	3%	0.026	25%	0.254	C	S	.	.			trans	-93.7	-37.6	-168.3	-72.3	-62	0	0	0	111.5	F206 N219 T229 V233 V251 A253 P296 Y303	F206-L231 HydrophobicContact CE1-CD2 4.07Å; F206-L231 HydrophobicContact CE1-CG 3.87Å; F206-L231 HydrophobicContact CZ-CD2 4.23Å; F206-L231 HydrophobicContact CZ-CG 4.25Å; N219-L231 VanDerWaalsContact OD1-CD1 3.26Å; N219-L231 WeakPolarHBondContact OD1-CD1 3.32Å; T229-L231 HydrophobicContact CG2-CD1 4.03Å; T229-L231 HydrophobicContact CG2-CD2 3.77Å; T229-L231 WeakPolarHBondContact O-CD2 3.42Å; L231-V233 PolarHBondContact O-N 3.25Å; L231-V251 HydrophobicContact CB-CB 4.35Å; L231-V251 HydrophobicContact CB-CG1 4.15Å; L231-V251 PolarHBondContact N-O 2.92Å; L231-A253 HydrophobicContact CD2-CB 3.69Å; L231-P296 HydrophobicContact CD1-CG 4.4Å; L231-Y303 HydrophobicContact CB-CE2 4.15Å; L231-Y303 WeakPolarHBondContact O-CE2 3.25Å
232	S	94.9	Very high	93.1	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	27%	0.269	C	S	.	.			trans	-79.8	57.3	-179.3	48.6	0	0	0	0	113.3	H230 M235 G249 V251 Y303	H230-S232 PolarHBondContact CE1-O 2.82Å; H230-S232 PolarHBondContact NE2-O 2.87Å; H230-S232 PolarHBondContact NE2-OG 3.02Å; S232-M235 WeakPolarHBondContact O-CE 3.33Å; S232-G249 PolarHBondContact OG-O 3.24Å; S232-V251 PolarHBondContact N-O 3.5Å; S232-V251 PolarHBondContact OG-N 3.27Å; S232-V251 PolarHBondContact OG-O 2.69Å; S232-Y303 VanDerWaalsContact CA-CD2 3.46Å
233	V	93.1	Very high	92.7	Very high	6 Å²	6	62.7 Å²	62.7	4%	0.036	28%	0.277	C	S	.	.			trans	-72.8	-30.1	-175.7	-53.8	0	0	0	0	113.1	H230 L231 L242 R295 P296 G301	H230-V233 VanDerWaalsContact O-CG1 3.29Å; H230-V233 WeakPolarHBondContact O-CG1 3.16Å; L231-V233 PolarHBondContact O-N 3.25Å; V233-L242 WeakPolarHBondContact O-CA 3.5Å; V233-L242 PolarHBondContact O-N 2.95Å; V233-R295 HydrophobicContact CG1-CB 3.8Å; V233-R295 HydrophobicContact CG1-CG 3.72Å; V233-P296 HydrophobicContact CG1-CG 4.16Å; V233-G301 WeakPolarHBondContact CG2-O 3.49Å; V233-G301 PolarHBondContact N-O 3.19Å
234	A	93.6	Very high	92.3	Very high	0 Å²	0	65.5 Å²	65.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	92.8	-176.6	0	0	0	0	0	109.5	Y240 V298 G301 H302 Y303	A234-Y240 HydrophobicContact CB-CD1 4.23Å; A234-Y240 WeakPolarHBondContact O-CD1 3.36Å; A234-V298 HydrophobicContact CB-CG1 4.15Å; A234-G301 PolarHBondContact N-O 3.16Å; A234-H302 CarbonylContact O-C 3.53Å; A234-H302 VanDerWaalsContact O-CA 3.32Å; A234-H302 WeakPolarHBondContact O-CA 3.41Å; A234-Y303 PolarHBondContact O-N 3.01Å
235	M	94.4	Very high	91.8	Very high	5 Å²	5	66.3 Å²	66.3	3%	0.025	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	141.6	177.3	-69	169.7	-86.4	0	0	111.9	L212 S232 K237 F238 R239 Y240 Y247 Y303	L212-M235 HydrophobicContact CD1-SD 4.19Å; L212-M235 HydrophobicContact CD2-CG 4.2Å; L212-M235 HydrophobicContact CD2-SD 3.91Å; S232-M235 WeakPolarHBondContact O-CE 3.33Å; M235-K237 VanDerWaalsContact C-N 3.29Å; M235-K237 PolarHBondContact O-N 2.86Å; M235-F238 HydrophobicContact CB-CD2 4.01Å; M235-F238 HydrophobicContact CE-CD2 3.56Å; M235-F238 HydrophobicContact CE-CE2 3.56Å; M235-F238 CarbonylContact O-C 3.32Å; M235-F238 PolarHBondContact O-N 3.36Å; M235-F238 HydrophobicContact SD-CD2 4.17Å; M235-F238 HydrophobicContact SD-CE2 4.05Å; M235-R239 PolarHBondContact O-N 3.02Å; M235-Y240 WeakPolarHBondContact O-CA 3.21Å; M235-Y240 PolarHBondContact O-N 2.8Å; M235-Y247 HydrophobicContact CE-CD1 4.24Å; M235-Y247 HydrophobicContact CE-CE1 3.27Å; M235-Y247 WeakPolarHBondContact CE-OH 3.31Å; M235-Y303 VanDerWaalsContact CA-O 3.29Å; M235-Y303 WeakPolarHBondContact CA-O 3.07Å
236	D	92.3	Very high	91.3	Very high	35 Å²	35	60.3 Å²	60.3	19%	0.187	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-54.4	-41.1	178	76.2	-37.4	0	0	0	113.1	F238 R239 Y240 Y303 K304 M305	D236-F238 PolarHBondContact O-N 3.37Å; D236-F238 VanDerWaalsContact O-N 3.17Å; D236-R239 WeakPolarHBondContact O-CA 3.43Å; D236-R239 PolarHBondContact O-N 3.17Å; D236-Y240 HydrophobicContact CB-CE1 3.99Å; D236-Y240 HydrophobicContact CB-CE2 4.19Å; D236-Y240 WeakPolarHBondContact CB-OH 3.09Å; D236-Y303 PolarHBondContact N-O 3.1Å; D236-K304 HydrophobicContact CB-CG 4.43Å; D236-M305 WeakPolarHBondContact OD1-CB 3.43Å; D236-M305 PolarHBondContact OD1-N 3.29Å
237	K	90.1	Very high	91.1	Very high	121 Å²	121	55.4 Å²	55.4	53%	0.526	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-57.2	-30.4	176	175.8	174.7	171.9	-175.2	0	113.2	M235 M305	M235-K237 VanDerWaalsContact C-N 3.29Å; M235-K237 PolarHBondContact O-N 2.86Å; K237-M305 HydrophobicContact CB-CB 4.49Å; K237-M305 HydrophobicContact CB-SD 4.29Å; K237-M305 HydrophobicContact CD-SD 3.36Å; K237-M305 WeakPolarHBondContact CD-SD 3.27Å; K237-M305 HydrophobicContact CG-SD 4.45Å
238	F	90.1	Very high	90.9	Very high	72 Å²	72	53.7 Å²	53.7	32%	0.316	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-103.2	22.3	177.2	-55.8	-58.6	0	0	0	112.2	M235 D236 Y240 R241 P243	M235-F238 HydrophobicContact CB-CD2 4.01Å; M235-F238 HydrophobicContact CE-CD2 3.56Å; M235-F238 HydrophobicContact CE-CE2 3.56Å; M235-F238 CarbonylContact O-C 3.32Å; M235-F238 PolarHBondContact O-N 3.36Å; M235-F238 HydrophobicContact SD-CD2 4.17Å; M235-F238 HydrophobicContact SD-CE2 4.05Å; D236-F238 PolarHBondContact O-N 3.37Å; D236-F238 VanDerWaalsContact O-N 3.17Å; F238-Y240 PolarHBondContact O-N 3.47Å; F238-R241 WeakPolarHBondContact CB-O 3.2Å; F238-R241 PolarHBondContact O-N 3.48Å; F238-R241 VanDerWaalsContact O-N 3.15Å; F238-P243 HydrophobicContact CB-CG 4.25Å; F238-P243 HydrophobicContact CD1-CG 4.03Å; F238-P243 HydrophobicContact CD2-CG 3.57Å; F238-P243 HydrophobicContact CE1-CG 4.25Å; F238-P243 HydrophobicContact CE2-CG 3.83Å; F238-P243 HydrophobicContact CG-CG 3.69Å; F238-P243 HydrophobicContact CZ-CG 4.15Å
239	R	92.2	Very high	90.7	Very high	218 Å²	218	53.7 Å²	53.7	82%	0.823	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.1	41	-178.3	-55.4	-177.6	-179.6	175.6	-0.5	112.3	M235 D236 R241	M235-R239 PolarHBondContact O-N 3.02Å; D236-R239 WeakPolarHBondContact O-CA 3.43Å; D236-R239 PolarHBondContact O-N 3.17Å; R239-R241 PolarHBondContact O-N 2.97Å
240	Y	92.7	Very high	90.7	Very high	81 Å²	81	53.2 Å²	53.2	32%	0.318	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	31.8	-179.2	-59.3	-72.4	0	0	0	113.9	E215 A234 M235 D236 F238 H302	E215-Y240 PolarHBondContact OE1-OH 2.88Å; E215-Y240 VanDerWaalsContact OE2-CE1 3.23Å; E215-Y240 WeakPolarHBondContact OE2-CE1 3.45Å; E215-Y240 PolarHBondContact OE2-OH 3.16Å; A234-Y240 HydrophobicContact CB-CD1 4.23Å; A234-Y240 WeakPolarHBondContact O-CD1 3.36Å; M235-Y240 WeakPolarHBondContact O-CA 3.21Å; M235-Y240 PolarHBondContact O-N 2.8Å; D236-Y240 HydrophobicContact CB-CE1 3.99Å; D236-Y240 HydrophobicContact CB-CE2 4.19Å; D236-Y240 WeakPolarHBondContact CB-OH 3.09Å; F238-Y240 PolarHBondContact O-N 3.47Å; Y240-H302 HydrophobicContact CD1-CB 4.46Å; Y240-H302 AromaticContact CD1-ND1 3.89Å; Y240-H302 HydrophobicContact CE1-CB 4.38Å
241	R	90.3	Very high	90.7	Very high	194 Å²	194	53.2 Å²	53.2	73%	0.732	24%	0.237	S	C	*	.	S	Bend	trans	-121.8	140.4	175.1	-65.6	-179.1	-178.3	-167.9	-1.3	110.3	F238 R239 P243	F238-R241 WeakPolarHBondContact CB-O 3.2Å; F238-R241 PolarHBondContact O-N 3.48Å; F238-R241 VanDerWaalsContact O-N 3.15Å; R239-R241 PolarHBondContact O-N 2.97Å; R241-P243 WeakPolarHBondContact O-CD 3.27Å
242	L	89.3	Confident	90.8	Very high	58 Å²	58	53 Å²	53	30%	0.304	24%	0.236	S	C	.	.			trans	-63.7	124.1	172.6	-171.1	70.1	0	0	0	108.8	V233 Y244 Y247	V233-L242 WeakPolarHBondContact O-CA 3.5Å; V233-L242 PolarHBondContact O-N 2.95Å; L242-Y244 VanDerWaalsContact C-N 3.32Å; L242-Y244 WeakPolarHBondContact CD2-O 3.25Å; L242-Y244 WeakPolarHBondContact CG-O 3.46Å; L242-Y244 PolarHBondContact O-N 2.64Å; L242-Y247 HydrophobicContact CD1-CD1 3.99Å; L242-Y247 HydrophobicContact CD1-CG 4.46Å
243	P	87.9	Confident	90.9	Very high	52 Å²	52	53 Å²	53	34%	0.338	24%	0.236	S	C	.	.	S	Bend	trans	-58.9	-41.8	-175.7	-28.3	36.2	0	0	0	113.5	F238 R241 Y247	F238-P243 HydrophobicContact CB-CG 4.25Å; F238-P243 HydrophobicContact CD1-CG 4.03Å; F238-P243 HydrophobicContact CD2-CG 3.57Å; F238-P243 HydrophobicContact CE1-CG 4.25Å; F238-P243 HydrophobicContact CE2-CG 3.83Å; F238-P243 HydrophobicContact CG-CG 3.69Å; F238-P243 HydrophobicContact CZ-CG 4.15Å; R241-P243 WeakPolarHBondContact O-CD 3.27Å; P243-Y247 HydrophobicContact CB-CD2 4.37Å; P243-Y247 HydrophobicContact CB-CG 4.49Å; P243-Y247 HydrophobicContact CG-CD1 4.42Å; P243-Y247 HydrophobicContact CG-CD2 4.13Å; P243-Y247 HydrophobicContact CG-CE2 4.38Å; P243-Y247 HydrophobicContact CG-CG 4.14Å
244	Y	87	Confident	91	Very high	83 Å²	83	52.8 Å²	52.8	33%	0.325	23%	0.234	S	C	.	.	S	Bend	trans	-161.2	158	175.3	46.2	-89.4	0	0	0	110.3	L242 Q246 Y247 D277	L242-Y244 VanDerWaalsContact C-N 3.32Å; L242-Y244 WeakPolarHBondContact CD2-O 3.25Å; L242-Y244 WeakPolarHBondContact CG-O 3.46Å; L242-Y244 PolarHBondContact O-N 2.64Å; Y244-Q246 HydrophobicContact CD2-CB 4.1Å; Y244-Q246 HydrophobicContact CE2-CB 4.38Å; Y244-Q246 PolarHBondContact O-N 2.88Å; Y244-Q246 VanDerWaalsContact O-N 3.09Å; Y244-Y247 AromaticContact CE1-CD2 3.96Å; Y244-Y247 HydrophobicContact CE1-CD2 3.96Å; Y244-Y247 HydrophobicContact CE2-CD2 4.25Å; Y244-Y247 AromaticContact CZ-CD2 3.69Å; Y244-Y247 WeakPolarHBondContact O-CB 3.47Å; Y244-Y247 PolarHBondContact O-N 3.42Å; Y244-D277 VanDerWaalsContact CE2-OD1 3.3Å; Y244-D277 WeakPolarHBondContact CE2-OD1 3.42Å; Y244-D277 VanDerWaalsContact CZ-OD1 3.31Å; Y244-D277 VanDerWaalsContact OH-CG 3.28Å; Y244-D277 PolarHBondContact OH-OD1 3.12Å; Y244-D277 PolarHBondContact OH-OD2 3.39Å
245	P	84.4	Confident	91.2	Very high	89 Å²	89	53.7 Å²	53.7	58%	0.578	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.6	-171.8	-26.7	35.8	0	0	0	115.8	R295	P245-R295 PolarHBondContact O-NH1 3.42Å; P245-R295 VanDerWaalsContact O-NH1 3.17Å; P245-R295 PolarHBondContact O-NH2 3.45Å
246	Q	82.5	Confident	91.3	Very high	67 Å²	67	54.7 Å²	54.7	31%	0.313	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	0.7	178.9	-59.2	76.7	14.2	0	0	113.1	Y244 F248 A280	Y244-Q246 HydrophobicContact CD2-CB 4.1Å; Y244-Q246 HydrophobicContact CE2-CB 4.38Å; Y244-Q246 PolarHBondContact O-N 2.88Å; Y244-Q246 VanDerWaalsContact O-N 3.09Å; Q246-F248 PolarHBondContact O-N 3.29Å; Q246-A280 WeakPolarHBondContact O-CB 3.49Å
247	Y	85.6	Confident	91.5	Very high	30 Å²	30	59.3 Å²	59.3	12%	0.118	27%	0.272	C	S	.	.			trans	-66.3	130.4	-179.7	-175.4	-93.6	0	0	0	111.2	H230 M235 L242 P243 Y244 G249 R295	H230-Y247 AromaticContact CE1-CD1 3.67Å; H230-Y247 AromaticContact NE2-CD1 3.59Å; H230-Y247 AromaticContact NE2-CE1 3.67Å; M235-Y247 HydrophobicContact CE-CD1 4.24Å; M235-Y247 HydrophobicContact CE-CE1 3.27Å; M235-Y247 WeakPolarHBondContact CE-OH 3.31Å; L242-Y247 HydrophobicContact CD1-CD1 3.99Å; L242-Y247 HydrophobicContact CD1-CG 4.46Å; P243-Y247 HydrophobicContact CB-CD2 4.37Å; P243-Y247 HydrophobicContact CB-CG 4.49Å; P243-Y247 HydrophobicContact CG-CD1 4.42Å; P243-Y247 HydrophobicContact CG-CD2 4.13Å; P243-Y247 HydrophobicContact CG-CE2 4.38Å; P243-Y247 HydrophobicContact CG-CG 4.14Å; Y244-Y247 AromaticContact CE1-CD2 3.96Å; Y244-Y247 HydrophobicContact CE1-CD2 3.96Å; Y244-Y247 HydrophobicContact CE2-CD2 4.25Å; Y244-Y247 AromaticContact CZ-CD2 3.69Å; Y244-Y247 WeakPolarHBondContact O-CB 3.47Å; Y244-Y247 PolarHBondContact O-N 3.42Å; Y247-G249 WeakPolarHBondContact CE1-O 3.22Å; Y247-R295 PolarHBondContact O-NH2 3.49Å
248	F	89	Confident	91.7	Very high	1 Å²	1	53.9 Å²	53.9	0%	0.004	25%	0.248	C	C	.	.			trans	-140.4	16	-177.9	-163.9	-102	0	0	0	112.7	P228 H230 Q246 S252 I279 A280 I293	P228-F248 HydrophobicContact CB-CE2 4.27Å; P228-F248 HydrophobicContact CB-CZ 3.92Å; H230-F248 HydrophobicContact CB-CD2 3.61Å; H230-F248 HydrophobicContact CB-CE2 3.77Å; Q246-F248 PolarHBondContact O-N 3.29Å; F248-S252 VanDerWaalsContact CE1-CB 3.45Å; F248-S252 VanDerWaalsContact CZ-CB 3.46Å; F248-I279 HydrophobicContact CD1-CB 4.2Å; F248-I279 HydrophobicContact CD1-CG2 3.68Å; F248-I279 HydrophobicContact CE1-CG2 3.73Å; F248-A280 HydrophobicContact CB-CB 3.15Å; F248-A280 HydrophobicContact CD1-CB 4.47Å; F248-A280 HydrophobicContact CD2-CB 4.4Å; F248-A280 HydrophobicContact CG-CB 3.82Å; F248-I293 HydrophobicContact CB-CD1 4.43Å; F248-I293 HydrophobicContact CD2-CB 4.46Å; F248-I293 HydrophobicContact CD2-CD1 3.65Å; F248-I293 HydrophobicContact CD2-CG1 3.8Å; F248-I293 HydrophobicContact CD2-CG2 3.8Å; F248-I293 HydrophobicContact CE2-CB 4.47Å; F248-I293 HydrophobicContact CE2-CD1 4.27Å; F248-I293 HydrophobicContact CE2-CG1 3.91Å; F248-I293 HydrophobicContact CE2-CG2 3.86Å; F248-I293 HydrophobicContact CG-CD1 4.3Å
249	G	89.4	Confident	91.9	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	23%	0.233	C	C	.	.			trans	-80.2	170	178.3	0	0	0	0	0	113.2	H230 S232 Y247 V251 D276	H230-G249 PolarHBondContact NE2-O 2.78Å; S232-G249 PolarHBondContact OG-O 3.24Å; Y247-G249 WeakPolarHBondContact CE1-O 3.22Å; G249-V251 PolarHBondContact O-N 3.14Å; G249-D276 WeakPolarHBondContact CA-OD2 3.34Å
250	G	93.4	Very high	92	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.01	22%	0.218	C	C	.	.	S	Bend	trans	88.1	-99.1	179.9	0	0	0	0	0	113.3	D209	D209-G250 PolarHBondContact N-O 2.84Å; D209-G250 WeakPolarHBondContact OD2-CA 3.31Å
251	V	97.2	Very high	92	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	122.5	-178.2	-172.7	0	0	0	0	110.7	F206 L207 H208 L212 L231 S232 G249 Y303	F206-V251 HydrophobicContact CD1-CG1 4Å; F206-V251 HydrophobicContact CE1-CG1 4.36Å; L207-V251 WeakPolarHBondContact O-CA 3.34Å; H208-V251 VanDerWaalsContact CD2-CG1 3.46Å; H208-V251 WeakPolarHBondContact CD2-CG1 3.48Å; L212-V251 HydrophobicContact CB-CG2 3.99Å; L212-V251 HydrophobicContact CD1-CG2 3.95Å; L231-V251 HydrophobicContact CB-CB 4.35Å; L231-V251 HydrophobicContact CB-CG1 4.15Å; L231-V251 PolarHBondContact N-O 2.92Å; S232-V251 PolarHBondContact N-O 3.5Å; S232-V251 PolarHBondContact OG-N 3.27Å; S232-V251 PolarHBondContact OG-O 2.69Å; G249-V251 PolarHBondContact O-N 3.14Å; V251-Y303 HydrophobicContact CB-CE1 4.2Å; V251-Y303 HydrophobicContact CG2-CD1 4.25Å; V251-Y303 HydrophobicContact CG2-CE1 3.67Å
252	S	96.4	Very high	92	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.007	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	158.2	177.1	58.7	0	0	0	0	111.7	F206 L207 T229 F248	F206-S252 WeakPolarHBondContact CA-O 3.36Å; L207-S252 PolarHBondContact N-O 2.99Å; L207-S252 PolarHBondContact O-N 3.01Å; T229-S252 CarbonylContact O-C 3.5Å; T229-S252 VanDerWaalsContact O-CA 3.26Å; T229-S252 WeakPolarHBondContact O-CA 3.45Å; T229-S252 WeakPolarHBondContact O-CB 3.28Å; F248-S252 VanDerWaalsContact CE1-CB 3.45Å; F248-S252 VanDerWaalsContact CZ-CB 3.46Å
253	A	97	Very high	92.2	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	138.5	-179.9	0	0	0	0	0	111.4	I205 F206 T229 L231	I205-A253 VanDerWaalsContact O-CA 3.31Å; I205-A253 WeakPolarHBondContact O-CA 3.08Å; F206-A253 HydrophobicContact CD1-CB 4.38Å; F206-A253 HydrophobicContact CD2-CB 3.76Å; F206-A253 HydrophobicContact CE1-CB 4.03Å; F206-A253 HydrophobicContact CE2-CB 3.35Å; F206-A253 HydrophobicContact CG-CB 4.25Å; F206-A253 HydrophobicContact CZ-CB 3.45Å; F206-A253 VanDerWaalsContact CZ-CB 3.45Å; T229-A253 PolarHBondContact N-O 3.33Å; T229-A253 PolarHBondContact O-N 2.83Å; L231-A253 HydrophobicContact CD2-CB 3.69Å
254	V	96.6	Very high	92.4	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	142	-175.7	-71.3	0	0	0	0	109.7	I205 L207 C223 P228 Q258 Y259 M262	I205-V254 HydrophobicContact CB-CG2 4.09Å; I205-V254 WeakPolarHBondContact CB-O 3.38Å; I205-V254 HydrophobicContact CG2-CG2 4.42Å; I205-V254 PolarHBondContact N-O 3.13Å; I205-V254 PolarHBondContact O-N 3.26Å; L207-V254 HydrophobicContact CD1-CG2 3.95Å; L207-V254 HydrophobicContact CG-CG2 4.48Å; C223-V254 PolarHBondContact SG-O 2.94Å; P228-V254 HydrophobicContact CB-CG1 3.82Å; P228-V254 HydrophobicContact CG-CG1 4.15Å; V254-Q258 HydrophobicContact CB-CB 4.35Å; V254-Y259 HydrophobicContact CG2-CD2 3.67Å; V254-Y259 HydrophobicContact CG2-CG 4.42Å; V254-M262 HydrophobicContact CG1-CE 3.86Å
255	T	97.5	Very high	92.7	Very high	20 Å²	20	29.1 Å²	29.1	12%	0.123	15%	0.151	C	C	.	.			trans	-72.3	158.2	166.9	69.6	0	0	0	0	109.8	C223 D257 Q258 Y259	C223-T255 HydrophobicContact CB-CG2 3.82Å; T255-D257 PolarHBondContact O-N 2.83Å; T255-Q258 PolarHBondContact O-N 3.35Å; T255-Q258 VanDerWaalsContact O-N 3.12Å; T255-Q258 VanDerWaalsContact OG1-CD 3.28Å; T255-Q258 WeakPolarHBondContact OG1-CG 3.26Å; T255-Q258 PolarHBondContact OG1-N 3.12Å; T255-Q258 VanDerWaalsContact OG1-N 3.16Å; T255-Y259 PolarHBondContact O-N 2.89Å
256	P	96.8	Very high	93.1	Very high	25 Å²	25	24.9 Å²	24.9	16%	0.162	12%	0.123	C	C	.	.	H	α-helix	trans	-52.3	-44.4	173.1	-24.3	31.4	0	0	0	112.1	L197 W202 I205 Q258 Y259 M260	L197-P256 HydrophobicContact CD1-CB 4.42Å; L197-P256 HydrophobicContact CD2-CB 4.08Å; L197-P256 HydrophobicContact CD2-CG 3.92Å; W202-P256 WeakPolarHBondContact O-CG 3.08Å; I205-P256 HydrophobicContact CD1-CB 4.32Å; I205-P256 HydrophobicContact CD1-CG 4.15Å; I205-P256 HydrophobicContact CG1-CG 4.48Å; P256-Q258 PolarHBondContact O-N 3.08Å; P256-Y259 WeakPolarHBondContact O-CB 3.41Å; P256-Y259 PolarHBondContact O-N 3.18Å; P256-Y259 VanDerWaalsContact O-N 3.12Å; P256-M260 VanDerWaalsContact O-CG 3.3Å; P256-M260 WeakPolarHBondContact O-CG 3.38Å; P256-M260 PolarHBondContact O-N 3.09Å
257	D	95.6	Very high	93.6	Very high	132 Å²	132	22.2 Å²	22.2	71%	0.706	11%	0.111	S	C	*	.	H	α-helix	trans	-60	-44.3	177.5	-64.3	-23.1	0	0	0	112.6	T255 Y259 M260 K261	T255-D257 PolarHBondContact O-N 2.83Å; D257-Y259 VanDerWaalsContact C-N 3.3Å; D257-Y259 PolarHBondContact O-N 3.2Å; D257-M260 PolarHBondContact O-N 3.22Å; D257-K261 VanDerWaalsContact O-CB 3.26Å; D257-K261 WeakPolarHBondContact O-CB 3.26Å; D257-K261 PolarHBondContact O-N 3.42Å
258	Q	94.6	Very high	93.9	Very high	8 Å²	8	25.1 Å²	25.1	4%	0.037	13%	0.126	C	C	.	.	H	α-helix	trans	-62	-41.4	176.3	-69.4	163.5	12.5	0	0	110.7	H224 K225 F227 V254 T255 P256 K261 M262 M291	H224-Q258 PolarHBondContact O-NE2 2.67Å; K225-Q258 PolarHBondContact O-NE2 3.19Å; K225-Q258 VanDerWaalsContact O-NE2 3.09Å; F227-Q258 VanDerWaalsContact N-NE2 3.14Å; V254-Q258 HydrophobicContact CB-CB 4.35Å; T255-Q258 PolarHBondContact O-N 3.35Å; T255-Q258 VanDerWaalsContact O-N 3.12Å; T255-Q258 VanDerWaalsContact OG1-CD 3.28Å; T255-Q258 WeakPolarHBondContact OG1-CG 3.26Å; T255-Q258 PolarHBondContact OG1-N 3.12Å; T255-Q258 VanDerWaalsContact OG1-N 3.16Å; P256-Q258 PolarHBondContact O-N 3.08Å; Q258-K261 PolarHBondContact O-N 3.27Å; Q258-M262 HydrophobicContact CB-CE 4.46Å; Q258-M262 WeakPolarHBondContact O-CE 3.38Å; Q258-M262 WeakPolarHBondContact O-CG 3.36Å; Q258-M262 PolarHBondContact O-N 3.36Å; Q258-M262 VanDerWaalsContact O-N 3.13Å; Q258-M291 HydrophobicContact CB-CE 4.33Å; Q258-M291 HydrophobicContact CB-SD 4.03Å; Q258-M291 HydrophobicContact CG-SD 3.81Å
259	Y	94.9	Very high	94	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-63.8	-44.2	178.3	-160.5	-98	0	0	0	112.3	N190 V193 L207 V254 T255 P256 D257 M262 N263 G264 F265 L336	N190-Y259 WeakPolarHBondContact CA-OH 3Å; N190-Y259 PolarHBondContact OD1-OH 3.46Å; V193-Y259 HydrophobicContact CB-CD1 4.41Å; V193-Y259 HydrophobicContact CB-CE1 3.9Å; V193-Y259 HydrophobicContact CG1-CD1 3.65Å; V193-Y259 HydrophobicContact CG1-CE1 3.63Å; V193-Y259 HydrophobicContact CG1-CG 4.25Å; V193-Y259 HydrophobicContact CG2-CE1 4.1Å; V193-Y259 HydrophobicContact CG2-CE2 4.06Å; L207-Y259 HydrophobicContact CD1-CE2 4.12Å; L207-Y259 HydrophobicContact CD2-CE2 4.08Å; V254-Y259 HydrophobicContact CG2-CD2 3.67Å; V254-Y259 HydrophobicContact CG2-CG 4.42Å; T255-Y259 PolarHBondContact O-N 2.89Å; P256-Y259 WeakPolarHBondContact O-CB 3.41Å; P256-Y259 PolarHBondContact O-N 3.18Å; P256-Y259 VanDerWaalsContact O-N 3.12Å; D257-Y259 VanDerWaalsContact C-N 3.3Å; D257-Y259 PolarHBondContact O-N 3.2Å; Y259-M262 WeakPolarHBondContact O-CG 3.17Å; Y259-M262 PolarHBondContact O-N 3.47Å; Y259-N263 PolarHBondContact O-N 2.67Å; Y259-G264 VanDerWaalsContact CE1-CA 3.49Å; Y259-G264 PolarHBondContact O-N 2.96Å; Y259-F265 AromaticContact CE2-CD2 3.65Å; Y259-F265 HydrophobicContact CE2-CD2 3.65Å; Y259-F265 AromaticContact CE2-CE2 3.8Å; Y259-F265 HydrophobicContact CE2-CE2 3.8Å; Y259-F265 AromaticContact CZ-CD2 3.96Å; Y259-F265 WeakPolarHBondContact OH-CD2 3.3Å; Y259-L336 HydrophobicContact CD1-CD2 4.05Å; Y259-L336 HydrophobicContact CE1-CD1 4.43Å; Y259-L336 HydrophobicContact CE1-CD2 4.1Å
260	M	93.7	Very high	94.1	Very high	101 Å²	101	26 Å²	26	50%	0.498	13%	0.13	S	C	.	.	H	α-helix	trans	-65	-43.1	175.8	-64.1	-57.8	172.7	0	0	111.1	L197 P256 D257 M262 N263 L336	L197-M260 HydrophobicContact CD1-CE 3.61Å; P256-M260 VanDerWaalsContact O-CG 3.3Å; P256-M260 WeakPolarHBondContact O-CG 3.38Å; P256-M260 PolarHBondContact O-N 3.09Å; D257-M260 PolarHBondContact O-N 3.22Å; M260-M262 PolarHBondContact O-N 2.84Å; M260-N263 PolarHBondContact O-N 2.55Å; M260-L336 HydrophobicContact CE-CD2 3.81Å; M260-L336 HydrophobicContact SD-CD2 3.35Å; M260-L336 WeakPolarHBondContact SD-CD2 3.36Å
261	K	92.7	Very high	93.9	Very high	115 Å²	115	26.3 Å²	26.3	50%	0.5	13%	0.132	S	C	.	.	H	α-helix	trans	-60.2	-31.9	179.2	-161.1	-171.2	-169.8	-168.3	0	112.8	D257 Q258 N263 S289 M291	D257-K261 VanDerWaalsContact O-CB 3.26Å; D257-K261 WeakPolarHBondContact O-CB 3.26Å; D257-K261 PolarHBondContact O-N 3.42Å; Q258-K261 PolarHBondContact O-N 3.27Å; K261-N263 VanDerWaalsContact C-N 3.35Å; K261-S289 WeakPolarHBondContact CE-O 3.43Å; K261-S289 PolarHBondContact NZ-O 2.56Å; K261-M291 HydrophobicContact CB-CE 4.3Å; K261-M291 HydrophobicContact CD-CE 4.17Å; K261-M291 HydrophobicContact CD-CG 4.43Å; K261-M291 HydrophobicContact CD-SD 4.15Å
262	M	90.4	Very high	93.4	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	3	176.9	70.8	178.1	69.8	0	0	113.9	P228 V254 Q258 Y259 M260 G264 R285 V286 M291	P228-M262 HydrophobicContact CB-CE 4.49Å; P228-M262 HydrophobicContact CG-CE 3.69Å; V254-M262 HydrophobicContact CG1-CE 3.86Å; Q258-M262 HydrophobicContact CB-CE 4.46Å; Q258-M262 WeakPolarHBondContact O-CE 3.38Å; Q258-M262 WeakPolarHBondContact O-CG 3.36Å; Q258-M262 PolarHBondContact O-N 3.36Å; Q258-M262 VanDerWaalsContact O-N 3.13Å; Y259-M262 WeakPolarHBondContact O-CG 3.17Å; Y259-M262 PolarHBondContact O-N 3.47Å; M260-M262 PolarHBondContact O-N 2.84Å; M262-G264 PolarHBondContact O-N 2.85Å; M262-R285 HydrophobicContact CB-CB 4Å; M262-R285 WeakPolarHBondContact O-CD 3.35Å; M262-V286 HydrophobicContact CE-CG2 4.05Å; M262-M291 HydrophobicContact CB-CE 4.31Å; M262-M291 HydrophobicContact CE-CE 3.81Å
263	N	93.7	Very high	92.8	Very high	20 Å²	20	32.8 Å²	32.8	11%	0.107	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	37.8	-171.6	-171.1	29	0	0	0	112.4	Y259 M260 K261 R285 W331 G335 L336 N337	Y259-N263 PolarHBondContact O-N 2.67Å; M260-N263 PolarHBondContact O-N 2.55Å; K261-N263 VanDerWaalsContact C-N 3.35Å; N263-R285 PolarHBondContact O-NH1 3.23Å; N263-W331 HydrophobicContact CB-CE3 4.46Å; N263-W331 PolarHBondContact ND2-O 3.33Å; N263-G335 CarbonylContact O-C 3.57Å; N263-G335 WeakPolarHBondContact O-CA 3.3Å; N263-L336 PolarHBondContact O-N 3.35Å; N263-L336 PolarHBondContact OD1-N 3.42Å; N263-N337 PolarHBondContact ND2-OD1 2.91Å; N263-N337 VanDerWaalsContact OD1-CG 3.28Å; N263-N337 PolarHBondContact OD1-N 2.89Å; N263-N337 PolarHBondContact OD1-OD1 2.73Å
264	G	92.9	Very high	92.2	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.161	C	C	.	.	S	Bend	trans	54.4	-152.8	-176.9	0	0	0	0	0	114.6	Y259 M262 R285	Y259-G264 VanDerWaalsContact CE1-CA 3.49Å; Y259-G264 PolarHBondContact O-N 2.96Å; M262-G264 PolarHBondContact O-N 2.85Å; G264-R285 VanDerWaalsContact O-CD 3.28Å; G264-R285 WeakPolarHBondContact O-CD 3.15Å
265	F	93.2	Very high	91.6	Very high	1 Å²	1	33.8 Å²	33.8	0%	0.004	16%	0.164	C	C	.	.	S	Bend	trans	-90.9	156.2	-179.1	-82.7	-112.7	0	0	0	112.6	A186 L189 N190 L207 Y259 I279 G335	A186-F265 HydrophobicContact CB-CB 3.9Å; A186-F265 HydrophobicContact CB-CD1 4.05Å; A186-F265 HydrophobicContact CB-CG 4.43Å; L189-F265 HydrophobicContact CD1-CD1 4.13Å; L189-F265 HydrophobicContact CD1-CE1 3.93Å; L189-F265 HydrophobicContact CD1-CZ 4.18Å; N190-F265 PolarHBondContact ND2-O 3.12Å; N190-F265 PolarHBondContact OD1-N 3.38Å; L207-F265 HydrophobicContact CD1-CD2 4.41Å; L207-F265 HydrophobicContact CD1-CE2 3.32Å; L207-F265 HydrophobicContact CD1-CZ 3.63Å; L207-F265 HydrophobicContact CD2-CE2 4.49Å; L207-F265 HydrophobicContact CG-CE2 4.46Å; Y259-F265 AromaticContact CE2-CD2 3.65Å; Y259-F265 HydrophobicContact CE2-CD2 3.65Å; Y259-F265 AromaticContact CE2-CE2 3.8Å; Y259-F265 HydrophobicContact CE2-CE2 3.8Å; Y259-F265 AromaticContact CZ-CD2 3.96Å; Y259-F265 WeakPolarHBondContact OH-CD2 3.3Å; F265-I279 HydrophobicContact CB-CD1 4.32Å; F265-I279 HydrophobicContact CD1-CD1 3.68Å; F265-I279 HydrophobicContact CD1-CG1 3.63Å; F265-I279 HydrophobicContact CD2-CD1 4.12Å; F265-I279 HydrophobicContact CE1-CD1 3.95Å; F265-I279 HydrophobicContact CE1-CG1 3.42Å; F265-I279 VanDerWaalsContact CE1-CG1 3.42Å; F265-I279 HydrophobicContact CE2-CD1 4.29Å; F265-I279 HydrophobicContact CE2-CG1 4.32Å; F265-I279 HydrophobicContact CG-CD1 3.79Å; F265-I279 HydrophobicContact CG-CG1 4.22Å; F265-I279 HydrophobicContact CZ-CD1 4.23Å; F265-I279 HydrophobicContact CZ-CG1 3.78Å; F265-G335 WeakPolarHBondContact O-CA 3.35Å
266	P	92.8	Very high	90.9	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.164	C	C	.	.			trans	-68.4	138.3	174.7	30.2	-37.5	0	0	0	112	A186 Y269 E275 D278	A186-P266 HydrophobicContact CB-CG 4.45Å; A186-P266 WeakPolarHBondContact CB-O 3.41Å; P266-Y269 HydrophobicContact CB-CD2 3.64Å; P266-Y269 HydrophobicContact CB-CE2 3.64Å; P266-Y269 HydrophobicContact CG-CD2 3.39Å; P266-Y269 HydrophobicContact CG-CE2 3.44Å; P266-Y269 VanDerWaalsContact CG-CE2 3.44Å; P266-E275 HydrophobicContact CG-CB 4.47Å; P266-D278 HydrophobicContact CG-CB 3.92Å
267	N	93.3	Very high	90.2	Very high	12 Å²	12	34.2 Å²	34.2	6%	0.064	16%	0.164	C	C	.	.	S	Bend	trans	-89.8	-8.6	-179.1	-60.3	-54.5	0	0	0	113.5	N184 K187 N190 D334 G335	N184-N267 PolarHBondContact ND2-O 2.84Å; K187-N267 HydrophobicContact CD-CB 4.11Å; K187-N267 HydrophobicContact CG-CB 4.27Å; N190-N267 PolarHBondContact ND2-OD1 2.92Å; N267-D334 VanDerWaalsContact CB-OD1 3.31Å; N267-D334 WeakPolarHBondContact CB-OD1 3.49Å; N267-D334 PolarHBondContact N-OD1 3.34Å; N267-D334 PolarHBondContact N-OD2 3.03Å; N267-D334 PolarHBondContact ND2-OD1 3.44Å; N267-G335 PolarHBondContact ND2-O 2.87Å
268	Q	91.6	Very high	89.4	Confident	91 Å²	91	28.1 Å²	28.1	43%	0.425	13%	0.132	S	C	.	.			trans	-89.7	-4	-170.4	-65.7	-177.5	6.6	0	0	115.1	W270 L323 D334	Q268-W270 PolarHBondContact O-N 3.01Å; Q268-L323 HydrophobicContact CB-CD2 4.29Å; Q268-D334 WeakPolarHBondContact CG-OD2 3.49Å
269	Y	91.1	Very high	88.5	Confident	3 Å²	3	27.8 Å²	27.8	1%	0.012	13%	0.13	C	C	.	.			trans	-82.8	81.8	-179.2	-72.8	-98.3	0	0	0	111.6	N184 P266 G274 E275 D278 L323 L324	N184-Y269 VanDerWaalsContact CG-O 3.28Å; N184-Y269 PolarHBondContact OD1-O 2.95Å; P266-Y269 HydrophobicContact CB-CD2 3.64Å; P266-Y269 HydrophobicContact CB-CE2 3.64Å; P266-Y269 HydrophobicContact CG-CD2 3.39Å; P266-Y269 HydrophobicContact CG-CE2 3.44Å; P266-Y269 VanDerWaalsContact CG-CE2 3.44Å; Y269-G274 WeakPolarHBondContact CE1-O 3.22Å; Y269-E275 HydrophobicContact CD1-CB 3.91Å; Y269-E275 HydrophobicContact CD2-CB 3.99Å; Y269-E275 HydrophobicContact CG-CB 3.59Å; Y269-D278 HydrophobicContact CE2-CB 3.96Å; Y269-D278 PolarHBondContact OH-OD2 3.39Å; Y269-L323 HydrophobicContact CD1-CD1 3.74Å; Y269-L323 HydrophobicContact CD2-CD1 4.2Å; Y269-L323 HydrophobicContact CE1-CB 3.73Å; Y269-L323 HydrophobicContact CE1-CD1 3.76Å; Y269-L323 HydrophobicContact CE1-CG 4.4Å; Y269-L323 HydrophobicContact CE2-CB 4.06Å; Y269-L323 HydrophobicContact CE2-CD1 4.24Å; Y269-L323 HydrophobicContact CG-CD1 3.98Å; Y269-L323 VanDerWaalsContact CZ-CB 3.46Å; Y269-L323 WeakPolarHBondContact OH-CB 3.39Å; Y269-L324 PolarHBondContact OH-N 3.47Å
270	W	91	Very high	87.2	Confident	17 Å²	17	27.8 Å²	27.8	6%	0.064	13%	0.131	C	C	.	.			trans	-84.7	116.7	171.9	-63.1	95.4	0	0	0	110.8	T182 N184 K187 Q268 N317 I359 G360 E361 D362 R364	T182-W270 HydrophobicContact CG2-CB 3.92Å; T182-W270 WeakPolarHBondContact O-CZ3 3.37Å; N184-W270 HydrophobicContact CB-CD2 4.18Å; N184-W270 HydrophobicContact CB-CE3 3.69Å; N184-W270 HydrophobicContact CB-CH2 4.49Å; N184-W270 HydrophobicContact CB-CZ3 3.87Å; K187-W270 HydrophobicContact CD-CZ2 4.49Å; Q268-W270 PolarHBondContact O-N 3.01Å; W270-N317 PolarHBondContact O-ND2 3.08Å; W270-I359 HydrophobicContact CH2-CD1 4.02Å; W270-I359 HydrophobicContact CH2-CG1 3.98Å; W270-I359 HydrophobicContact CZ3-CD1 3.91Å; W270-I359 HydrophobicContact CZ3-CG1 4.18Å; W270-G360 WeakPolarHBondContact CH2-O 3.05Å; W270-E361 WeakPolarHBondContact CZ2-O 3.46Å; W270-D362 HydrophobicContact CB-CB 4.18Å; W270-D362 HydrophobicContact CD2-CB 3.98Å; W270-D362 HydrophobicContact CE3-CB 4.15Å; W270-D362 HydrophobicContact CG-CB 4Å; W270-R364 PolarHBondContact O-NH2 2.88Å
271	G	89.5	Confident	85.4	Confident	6 Å²	6	24.3 Å²	24.3	6%	0.062	12%	0.118	C	C	.	.	S	Bend	trans	95.6	-171.2	-176.2	0	0	0	0	0	112.2	T182 F183 E315	T182-G271 VanDerWaalsContact CG2-N 3.27Å; F183-G271 PolarHBondContact O-N 3.44Å; G271-E315 WeakPolarHBondContact CA-O 3.38Å
272	W	85.6	Confident	83.1	Confident	132 Å²	132	22.6 Å²	22.6	50%	0.5	12%	0.12	S	C	.	.	B	Isolated β-bridge	trans	-81.4	131.2	-172.3	178.9	87	0	0	0	112.9	N314 E315 Q316 N317	W272-N314 WeakPolarHBondContact CB-O 3.48Å; W272-N314 PolarHBondContact N-OD1 2.94Å; W272-E315 PolarHBondContact N-O 3.11Å; W272-Q316 HydrophobicContact CE3-CB 4.05Å; W272-Q316 HydrophobicContact CE3-CG 3.88Å; W272-Q316 HydrophobicContact CZ3-CG 4.15Å; W272-Q316 VanDerWaalsContact CZ3-NE2 3.29Å; W272-N317 PolarHBondContact O-N 2.81Å
273	G	85.3	Confident	81.2	Confident	6 Å²	6	27 Å²	27	6%	0.062	14%	0.141	C	C	.	.	S	Bend	trans	101.5	145.7	156.8	0	0	0	0	0	116	R320	G273-R320 VanDerWaalsContact O-CB 3.23Å; G273-R320 WeakPolarHBondContact O-CB 3.37Å
274	G	83.1	Confident	79.8	Confident	5 Å²	5	26.1 Å²	26.1	5%	0.052	14%	0.136	C	C	.	.	S	Bend	trans	90.4	-12.2	174.2	0	0	0	0	0	114.8	Y269 D277 D278 L324	Y269-G274 WeakPolarHBondContact CE1-O 3.22Å; G274-D277 PolarHBondContact O-N 2.78Å; G274-D278 PolarHBondContact O-N 3.29Å; G274-D278 VanDerWaalsContact O-N 3.08Å; G274-L324 WeakPolarHBondContact O-CD2 3.38Å
275	E	84.9	Confident	78.7	Confident	16 Å²	16	26.2 Å²	26.2	8%	0.075	14%	0.136	C	C	.	.	H	α-helix	trans	-71.7	-38.2	179.8	85.2	-70.1	-170.5	0	0	112	R185 A186 P266 Y269 D277 D278 I279	R185-E275 WeakPolarHBondContact CD-OE1 3.49Å; R185-E275 IonicContact CZ-OE1 3.57Å; R185-E275 IonicContact NE-OE1 2.72Å; R185-E275 IonicContact NH1-OE1 2.87Å; R185-E275 PolarHBondContact NH1-OE1 3.37Å; A186-E275 HydrophobicContact CB-CB 3.91Å; A186-E275 HydrophobicContact CB-CG 3.84Å; P266-E275 HydrophobicContact CG-CB 4.47Å; Y269-E275 HydrophobicContact CD1-CB 3.91Å; Y269-E275 HydrophobicContact CD2-CB 3.99Å; Y269-E275 HydrophobicContact CG-CB 3.59Å; E275-D277 VanDerWaalsContact C-N 3.32Å; E275-D278 VanDerWaalsContact O-CB 3.27Å; E275-D278 WeakPolarHBondContact O-CB 3.35Å; E275-D278 PolarHBondContact O-N 2.79Å; E275-I279 PolarHBondContact O-N 2.92Å
276	D	82.4	Confident	77.7	Confident	20 Å²	20	26.2 Å²	26.2	11%	0.107	14%	0.136	C	C	.	.	H	α-helix	trans	-69.2	-34.2	176.1	-65.6	-40.6	0	0	0	111.6	R185 G249 D278 I279 A280	R185-D276 IonicContact CZ-OD1 2.98Å; R185-D276 IonicContact NH1-OD1 3.03Å; R185-D276 PolarHBondContact NH1-OD1 2.69Å; R185-D276 IonicContact NH1-OD2 3.78Å; R185-D276 IonicContact NH2-OD1 3.85Å; G249-D276 WeakPolarHBondContact CA-OD2 3.34Å; D276-D278 VanDerWaalsContact C-N 3.31Å; D276-I279 WeakPolarHBondContact O-CB 3.45Å; D276-I279 PolarHBondContact O-N 3.39Å; D276-A280 PolarHBondContact O-N 2.96Å
277	D	81.1	Confident	76.9	Confident	33 Å²	33	32.8 Å²	32.8	18%	0.176	16%	0.161	C	C	.	.	H	α-helix	trans	-68.1	-32.4	175.1	-66.5	-42.3	0	0	0	111.1	Y244 G274 E275 I279 A280 A281 L324	Y244-D277 VanDerWaalsContact CE2-OD1 3.3Å; Y244-D277 WeakPolarHBondContact CE2-OD1 3.42Å; Y244-D277 VanDerWaalsContact CZ-OD1 3.31Å; Y244-D277 VanDerWaalsContact OH-CG 3.28Å; Y244-D277 PolarHBondContact OH-OD1 3.12Å; Y244-D277 PolarHBondContact OH-OD2 3.39Å; G274-D277 PolarHBondContact O-N 2.78Å; E275-D277 VanDerWaalsContact C-N 3.32Å; D277-I279 PolarHBondContact O-N 2.98Å; D277-A280 PolarHBondContact O-N 3.24Å; D277-A281 WeakPolarHBondContact O-CB 3.49Å; D277-A281 PolarHBondContact O-N 3.5Å; D277-L324 HydrophobicContact CB-CD1 4Å; D277-L324 HydrophobicContact CB-CD2 3.63Å; D277-L324 HydrophobicContact CB-CG 4.46Å
278	D	79.3	Confident	75.6	Confident	5 Å²	5	35.4 Å²	35.4	3%	0.027	18%	0.175	C	C	.	.	H	α-helix	trans	-61.4	-31.1	173.8	-162.8	-90.2	0	0	0	111.9	P266 Y269 G274 E275 D276 S284 R285 L324 T327	P266-D278 HydrophobicContact CG-CB 3.92Å; Y269-D278 HydrophobicContact CE2-CB 3.96Å; Y269-D278 PolarHBondContact OH-OD2 3.39Å; G274-D278 PolarHBondContact O-N 3.29Å; G274-D278 VanDerWaalsContact O-N 3.08Å; E275-D278 VanDerWaalsContact O-CB 3.27Å; E275-D278 WeakPolarHBondContact O-CB 3.35Å; E275-D278 PolarHBondContact O-N 2.79Å; D276-D278 VanDerWaalsContact C-N 3.31Å; D278-S284 WeakPolarHBondContact O-CA 3.43Å; D278-S284 WeakPolarHBondContact O-CB 3.34Å; D278-R285 PolarHBondContact O-N 3.03Å; D278-R285 IonicContact OD1-CZ 2.92Å; D278-R285 IonicContact OD1-NE 3.31Å; D278-R285 PolarHBondContact OD1-NE 3.48Å; D278-R285 IonicContact OD1-NH2 2.94Å; D278-L324 HydrophobicContact CB-CD2 4.15Å; D278-L324 VanDerWaalsContact N-CD2 3.33Å; D278-T327 WeakPolarHBondContact OD1-CG2 3.3Å; D278-T327 WeakPolarHBondContact OD2-CB 3.43Å; D278-T327 WeakPolarHBondContact OD2-CG2 3.42Å; D278-T327 PolarHBondContact OD2-OG1 3.21Å
279	I	76.8	Confident	74.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-78	-35.4	176.5	-54.6	-52.8	0	0	0	112	F248 F265 E275 D276 D277 S284 V286	F248-I279 HydrophobicContact CD1-CB 4.2Å; F248-I279 HydrophobicContact CD1-CG2 3.68Å; F248-I279 HydrophobicContact CE1-CG2 3.73Å; F265-I279 HydrophobicContact CB-CD1 4.32Å; F265-I279 HydrophobicContact CD1-CD1 3.68Å; F265-I279 HydrophobicContact CD1-CG1 3.63Å; F265-I279 HydrophobicContact CD2-CD1 4.12Å; F265-I279 HydrophobicContact CE1-CD1 3.95Å; F265-I279 HydrophobicContact CE1-CG1 3.42Å; F265-I279 VanDerWaalsContact CE1-CG1 3.42Å; F265-I279 HydrophobicContact CE2-CD1 4.29Å; F265-I279 HydrophobicContact CE2-CG1 4.32Å; F265-I279 HydrophobicContact CG-CD1 3.79Å; F265-I279 HydrophobicContact CG-CG1 4.22Å; F265-I279 HydrophobicContact CZ-CD1 4.23Å; F265-I279 HydrophobicContact CZ-CG1 3.78Å; E275-I279 PolarHBondContact O-N 2.92Å; D276-I279 WeakPolarHBondContact O-CB 3.45Å; D276-I279 PolarHBondContact O-N 3.39Å; D277-I279 PolarHBondContact O-N 2.98Å; I279-S284 WeakPolarHBondContact O-CB 3.26Å; I279-S284 PolarHBondContact O-OG 3.37Å; I279-V286 HydrophobicContact CG2-CG2 3.76Å; I279-V286 WeakPolarHBondContact O-CB 3.18Å; I279-V286 VanDerWaalsContact O-CG2 3.26Å; I279-V286 WeakPolarHBondContact O-CG2 3.06Å; I279-V286 PolarHBondContact O-N 2.9Å
280	A	66.6	Low	74.2	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.008	19%	0.188	C	C	.	.	H	α-helix	trans	-120.9	-14.2	-163.2	0	0	0	0	0	118.2	Q246 F248 D276 D277 S284 I293	Q246-A280 WeakPolarHBondContact O-CB 3.49Å; F248-A280 HydrophobicContact CB-CB 3.15Å; F248-A280 HydrophobicContact CD1-CB 4.47Å; F248-A280 HydrophobicContact CD2-CB 4.4Å; F248-A280 HydrophobicContact CG-CB 3.82Å; D276-A280 PolarHBondContact O-N 2.96Å; D277-A280 PolarHBondContact O-N 3.24Å; A280-S284 VanDerWaalsContact C-OG 3.31Å; A280-S284 WeakPolarHBondContact CA-OG 3.24Å; A280-S284 PolarHBondContact N-OG 3.4Å; A280-I293 HydrophobicContact CB-CD1 3.56Å
281	A	56.2	Low	74.1	Confident	28 Å²	28	34.2 Å²	34.2	23%	0.231	19%	0.188	C	C	.	.	S	Bend	trans	-57.2	167.6	176.9	0	0	0	0	0	114.2	D277 Q283 S284	D277-A281 WeakPolarHBondContact O-CB 3.49Å; D277-A281 PolarHBondContact O-N 3.5Å; A281-Q283 PolarHBondContact O-N 3.36Å; A281-S284 VanDerWaalsContact N-CB 3.33Å; A281-S284 WeakPolarHBondContact O-CB 3.35Å; A281-S284 PolarHBondContact O-N 2.94Å; A281-S284 PolarHBondContact O-OG 3.31Å
282	S	44	Very low	74.1	Confident	78 Å²	78	39.9 Å²	39.9	55%	0.545	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-16.7	-179.1	58	0	0	0	0	115
283	Q	51.4	Low	74.3	Confident	94 Å²	94	35.4 Å²	35.4	44%	0.439	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.7	27.3	177.5	-59	-170.8	-45.4	0	0	112.4	A281 L288	A281-Q283 PolarHBondContact O-N 3.36Å; Q283-L288 WeakPolarHBondContact O-CD1 3.35Å
284	S	63.2	Low	74.6	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.204	C	C	.	.	S	Bend	trans	-96.7	166.9	-168.2	77.7	0	0	0	0	115.2	D278 I279 A280 A281 V286 R287 L288	D278-S284 WeakPolarHBondContact O-CA 3.43Å; D278-S284 WeakPolarHBondContact O-CB 3.34Å; I279-S284 WeakPolarHBondContact O-CB 3.26Å; I279-S284 PolarHBondContact O-OG 3.37Å; A280-S284 VanDerWaalsContact C-OG 3.31Å; A280-S284 WeakPolarHBondContact CA-OG 3.24Å; A280-S284 PolarHBondContact N-OG 3.4Å; A281-S284 VanDerWaalsContact N-CB 3.33Å; A281-S284 WeakPolarHBondContact O-CB 3.35Å; A281-S284 PolarHBondContact O-N 2.94Å; A281-S284 PolarHBondContact O-OG 3.31Å; S284-V286 VanDerWaalsContact C-N 3.3Å; S284-V286 PolarHBondContact O-N 3.38Å; S284-R287 PolarHBondContact O-N 2.84Å; S284-R287 VanDerWaalsContact O-N 3.14Å; S284-L288 VanDerWaalsContact O-CB 3.26Å; S284-L288 WeakPolarHBondContact O-CB 3.49Å; S284-L288 WeakPolarHBondContact O-CG 3.37Å; S284-L288 PolarHBondContact O-N 2.89Å
285	R	70.7	Confident	75.1	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.008	22%	0.215	C	C	.	.	H	α-helix	trans	-52.6	-42.1	178.1	-61.4	171.9	-173.7	-99.8	-7.9	113.7	M262 N263 G264 D278 S289 W331 D334	M262-R285 HydrophobicContact CB-CB 4Å; M262-R285 WeakPolarHBondContact O-CD 3.35Å; N263-R285 PolarHBondContact O-NH1 3.23Å; G264-R285 VanDerWaalsContact O-CD 3.28Å; G264-R285 WeakPolarHBondContact O-CD 3.15Å; D278-R285 PolarHBondContact O-N 3.03Å; D278-R285 IonicContact OD1-CZ 2.92Å; D278-R285 IonicContact OD1-NE 3.31Å; D278-R285 PolarHBondContact OD1-NE 3.48Å; D278-R285 IonicContact OD1-NH2 2.94Å; R285-S289 VanDerWaalsContact O-CB 3.24Å; R285-S289 WeakPolarHBondContact O-CB 3.44Å; R285-S289 PolarHBondContact O-N 2.73Å; R285-S289 PolarHBondContact O-OG 3.01Å; R285-W331 HydrophobicContact CG-CB 3.91Å; R285-W331 HydrophobicContact CG-CE3 4.39Å; R285-W331 PolarHBondContact NH1-O 2.94Å; R285-W331 VanDerWaalsContact NH1-O 3.08Å; R285-D334 PolarHBondContact NH1-O 3.13Å; R285-D334 PolarHBondContact NH2-O 3.23Å
286	V	72.6	Confident	75.6	Confident	1 Å²	1	40.4 Å²	40.4	1%	0.006	22%	0.218	C	C	.	.	H	α-helix	trans	-63.8	-46.7	179	173.2	0	0	0	0	111	P228 M262 I279 S284 S289 M291 I293	P228-V286 HydrophobicContact CG-CG1 4.13Å; P228-V286 HydrophobicContact CG-CG2 4.15Å; M262-V286 HydrophobicContact CE-CG2 4.05Å; I279-V286 HydrophobicContact CG2-CG2 3.76Å; I279-V286 WeakPolarHBondContact O-CB 3.18Å; I279-V286 VanDerWaalsContact O-CG2 3.26Å; I279-V286 WeakPolarHBondContact O-CG2 3.06Å; I279-V286 PolarHBondContact O-N 2.9Å; S284-V286 VanDerWaalsContact C-N 3.3Å; S284-V286 PolarHBondContact O-N 3.38Å; V286-S289 PolarHBondContact O-OG 3.16Å; V286-M291 HydrophobicContact CG1-CB 3.83Å; V286-M291 CarbonylContact O-C 3.59Å; V286-M291 WeakPolarHBondContact O-CA 3.07Å; V286-M291 WeakPolarHBondContact O-CB 3.28Å; V286-M291 PolarHBondContact O-N 2.94Å; V286-M291 VanDerWaalsContact O-O 3.11Å; V286-I293 HydrophobicContact CG1-CG1 4.17Å
287	R	74.9	Confident	76.1	Confident	138 Å²	138	41.7 Å²	41.7	52%	0.521	23%	0.227	S	C	.	.	H	α-helix	trans	-72.1	-39.6	178.4	-75.4	-178.1	168	-160.4	-2.2	112.6	S284 S289 G290	S284-R287 PolarHBondContact O-N 2.84Å; S284-R287 VanDerWaalsContact O-N 3.14Å; R287-S289 PolarHBondContact O-N 2.59Å; R287-G290 PolarHBondContact O-N 2.87Å
288	L	66.4	Low	76.6	Confident	67 Å²	67	44.4 Å²	44.4	35%	0.351	25%	0.245	S	C	.	.	H	α-helix	trans	-66.2	-27.9	178.7	-69.3	172.4	0	0	0	112.3	Q283 S284 G290 W331	Q283-L288 WeakPolarHBondContact O-CD1 3.35Å; S284-L288 VanDerWaalsContact O-CB 3.26Å; S284-L288 WeakPolarHBondContact O-CB 3.49Å; S284-L288 WeakPolarHBondContact O-CG 3.37Å; S284-L288 PolarHBondContact O-N 2.89Å; L288-G290 VanDerWaalsContact C-N 3.26Å; L288-G290 PolarHBondContact O-N 2.72Å; L288-W331 HydrophobicContact CB-CZ2 4.01Å; L288-W331 HydrophobicContact CD1-CD2 4.47Å; L288-W331 HydrophobicContact CD1-CG 4.15Å
289	S	72.4	Confident	77.1	Confident	12 Å²	12	45.2 Å²	45.2	8%	0.084	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	8.4	171.1	58	0	0	0	0	113.7	K261 R285 V286 R287 M291	K261-S289 WeakPolarHBondContact CE-O 3.43Å; K261-S289 PolarHBondContact NZ-O 2.56Å; R285-S289 VanDerWaalsContact O-CB 3.24Å; R285-S289 WeakPolarHBondContact O-CB 3.44Å; R285-S289 PolarHBondContact O-N 2.73Å; R285-S289 PolarHBondContact O-OG 3.01Å; V286-S289 PolarHBondContact O-OG 3.16Å; R287-S289 PolarHBondContact O-N 2.59Å; S289-M291 VanDerWaalsContact C-N 3.33Å; S289-M291 PolarHBondContact O-N 3.4Å; S289-M291 WeakPolarHBondContact OG-CE 3.35Å
290	G	81.3	Confident	78	Confident	61 Å²	61	46.3 Å²	46.3	63%	0.629	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.1	21.1	177.7	0	0	0	0	0	114.4	R287 L288	R287-G290 PolarHBondContact O-N 2.87Å; L288-G290 VanDerWaalsContact C-N 3.26Å; L288-G290 PolarHBondContact O-N 2.72Å
291	M	88.8	Confident	79.3	Confident	14 Å²	14	46.2 Å²	46.2	7%	0.069	26%	0.257	C	S	.	.			trans	-103.8	160.8	177.9	-61.2	-172.5	-74.8	0	0	111.3	F227 P228 Q258 K261 M262 V286 S289	F227-M291 HydrophobicContact CD1-CB 4.23Å; P228-M291 HydrophobicContact CG-CE 4.18Å; P228-M291 HydrophobicContact CG-SD 4.13Å; Q258-M291 HydrophobicContact CB-CE 4.33Å; Q258-M291 HydrophobicContact CB-SD 4.03Å; Q258-M291 HydrophobicContact CG-SD 3.81Å; K261-M291 HydrophobicContact CB-CE 4.3Å; K261-M291 HydrophobicContact CD-CE 4.17Å; K261-M291 HydrophobicContact CD-CG 4.43Å; K261-M291 HydrophobicContact CD-SD 4.15Å; M262-M291 HydrophobicContact CB-CE 4.31Å; M262-M291 HydrophobicContact CE-CE 3.81Å; V286-M291 HydrophobicContact CG1-CB 3.83Å; V286-M291 CarbonylContact O-C 3.59Å; V286-M291 WeakPolarHBondContact O-CA 3.07Å; V286-M291 WeakPolarHBondContact O-CB 3.28Å; V286-M291 PolarHBondContact O-N 2.94Å; V286-M291 VanDerWaalsContact O-O 3.11Å; S289-M291 VanDerWaalsContact C-N 3.33Å; S289-M291 PolarHBondContact O-N 3.4Å; S289-M291 WeakPolarHBondContact OG-CE 3.35Å
292	K	88.8	Confident	81.2	Confident	125 Å²	125	46.1 Å²	46.1	54%	0.543	25%	0.252	S	S	.	.			trans	-118.5	162	171	61.2	177.4	174.9	179.7	0	110.1	F227	F227-K292 HydrophobicContact CB-CG 4.42Å; F227-K292 WeakPolarHBondContact CB-O 3.36Å; F227-K292 HydrophobicContact CD1-CG 3.62Å; F227-K292 HydrophobicContact CD2-CD 4.29Å; F227-K292 VanDerWaalsContact CD2-CE 3.42Å; F227-K292 HydrophobicContact CD2-CG 3.85Å; F227-K292 HydrophobicContact CE1-CG 3.8Å; F227-K292 HydrophobicContact CE2-CD 4.19Å; F227-K292 HydrophobicContact CE2-CG 4.06Å; F227-K292 HydrophobicContact CG-CG 3.66Å; F227-K292 HydrophobicContact CZ-CD 4.3Å; F227-K292 HydrophobicContact CZ-CG 4.02Å
293	I	89.9	Confident	83.7	Confident	37 Å²	37	42.4 Å²	42.4	19%	0.19	23%	0.226	C	C	.	.			trans	-88.6	127.1	174	-64.5	163.1	0	0	0	108.2	P228 H230 F248 A280 V286 R295	P228-I293 WeakPolarHBondContact O-CA 3.48Å; H230-I293 HydrophobicContact CB-CG2 3.81Å; F248-I293 HydrophobicContact CB-CD1 4.43Å; F248-I293 HydrophobicContact CD2-CB 4.46Å; F248-I293 HydrophobicContact CD2-CD1 3.65Å; F248-I293 HydrophobicContact CD2-CG1 3.8Å; F248-I293 HydrophobicContact CD2-CG2 3.8Å; F248-I293 HydrophobicContact CE2-CB 4.47Å; F248-I293 HydrophobicContact CE2-CD1 4.27Å; F248-I293 HydrophobicContact CE2-CG1 3.91Å; F248-I293 HydrophobicContact CE2-CG2 3.86Å; F248-I293 HydrophobicContact CG-CD1 4.3Å; A280-I293 HydrophobicContact CB-CD1 3.56Å; V286-I293 HydrophobicContact CG1-CG1 4.17Å; I293-R295 HydrophobicContact CG2-CG 4.2Å
294	V	92.8	Very high	85.9	Confident	37 Å²	37	40.6 Å²	40.6	22%	0.224	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-98.1	147.7	169.5	177.2	0	0	0	0	108.8	F227 P228 T229 H230	F227-V294 HydrophobicContact CB-CG2 3.58Å; F227-V294 HydrophobicContact CD2-CG2 3.95Å; F227-V294 HydrophobicContact CG-CG2 4.15Å; P228-V294 PolarHBondContact O-N 3.08Å; T229-V294 CarbonylContact C-O 3.5Å; T229-V294 VanDerWaalsContact CA-O 3.3Å; T229-V294 WeakPolarHBondContact CA-O 3.15Å; H230-V294 PolarHBondContact N-O 3.28Å
295	R	93.8	Very high	87.3	Confident	75 Å²	75	41.9 Å²	41.9	28%	0.283	22%	0.223	S	C	.	.			trans	-136.1	139.9	-178.9	-76.7	-174.8	-175	103	-3	109.5	H230 V233 P245 Y247 I293	H230-R295 HydrophobicContact CB-CG 4.04Å; H230-R295 PolarHBondContact ND1-NE 2.96Å; V233-R295 HydrophobicContact CG1-CB 3.8Å; V233-R295 HydrophobicContact CG1-CG 3.72Å; P245-R295 PolarHBondContact O-NH1 3.42Å; P245-R295 VanDerWaalsContact O-NH1 3.17Å; P245-R295 PolarHBondContact O-NH2 3.45Å; Y247-R295 PolarHBondContact O-NH2 3.49Å; I293-R295 HydrophobicContact CG2-CG 4.2Å
296	P	93.9	Very high	88.4	Confident	21 Å²	21	42.4 Å²	42.4	14%	0.136	23%	0.226	C	C	.	.			trans	-65.3	160.4	167	30.4	-34.2	0	0	0	110.3	H230 L231 V233 I300	H230-P296 WeakPolarHBondContact O-CD 3.44Å; L231-P296 HydrophobicContact CD1-CG 4.4Å; V233-P296 HydrophobicContact CG1-CG 4.16Å; P296-I300 HydrophobicContact CB-CD1 3.79Å; P296-I300 HydrophobicContact CB-CG1 3.72Å
297	P	93.1	Very high	89.1	Confident	46 Å²	46	50.9 Å²	50.9	30%	0.299	26%	0.263	S	S	.	.			trans	-44.9	142.7	164.7	-33.7	38.9	0	0	0	112.9	E45 A299 I300 G301	E45-P297 VanDerWaalsContact OE2-CB 3.28Å; E45-P297 WeakPolarHBondContact OE2-CB 3.42Å; P297-A299 PolarHBondContact O-N 3.5Å; P297-I300 HydrophobicContact CB-CG1 4.17Å; P297-I300 HydrophobicContact CG-CD1 4.32Å; P297-I300 HydrophobicContact CG-CG1 4.5Å; P297-I300 WeakPolarHBondContact O-CG1 3.48Å; P297-I300 PolarHBondContact O-N 3.3Å; P297-I300 VanDerWaalsContact O-N 3.1Å; P297-G301 PolarHBondContact O-N 3.13Å
298	V	91.3	Very high	89.4	Confident	90 Å²	90	47.9 Å²	47.9	55%	0.545	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-38.5	175.1	173.5	0	0	0	0	110	A234 I300 G301 H302	A234-V298 HydrophobicContact CB-CG1 4.15Å; V298-I300 PolarHBondContact O-N 3.35Å; V298-G301 PolarHBondContact O-N 2.98Å; V298-H302 PolarHBondContact O-CD2 2.91Å; V298-H302 PolarHBondContact O-NE2 3.21Å
299	A	91.3	Very high	90	Very high	23 Å²	23	53.8 Å²	53.8	19%	0.19	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-9.7	-179.3	0	0	0	0	0	115.6	P46 F48 Y50 P297	P46-A299 WeakPolarHBondContact O-CB 3.21Å; F48-A299 HydrophobicContact CD2-CB 4.26Å; F48-A299 WeakPolarHBondContact CD2-O 3.44Å; Y50-A299 PolarHBondContact OH-O 3.07Å; P297-A299 PolarHBondContact O-N 3.5Å
300	I	94	Very high	90	Very high	22 Å²	22	56.9 Å²	56.9	11%	0.113	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.3	-30.7	175	69.9	179.7	0	0	0	112.9	F48 H218 P296 P297 V298 H302	F48-I300 HydrophobicContact CD2-CG2 3.91Å; F48-I300 HydrophobicContact CE2-CG2 3.3Å; F48-I300 HydrophobicContact CZ-CG2 4.01Å; H218-I300 HydrophobicContact CB-CB 4.47Å; H218-I300 HydrophobicContact CB-CG2 4.12Å; P296-I300 HydrophobicContact CB-CD1 3.79Å; P296-I300 HydrophobicContact CB-CG1 3.72Å; P297-I300 HydrophobicContact CB-CG1 4.17Å; P297-I300 HydrophobicContact CG-CD1 4.32Å; P297-I300 HydrophobicContact CG-CG1 4.5Å; P297-I300 WeakPolarHBondContact O-CG1 3.48Å; P297-I300 PolarHBondContact O-N 3.3Å; P297-I300 VanDerWaalsContact O-N 3.1Å; V298-I300 PolarHBondContact O-N 3.35Å; I300-H302 PolarHBondContact O-N 2.48Å
301	G	95.3	Very high	89.7	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.296	C	S	.	.			trans	-79.4	37.6	-176.5	0	0	0	0	0	114.5	V233 A234 P297 V298	V233-G301 WeakPolarHBondContact CG2-O 3.49Å; V233-G301 PolarHBondContact N-O 3.19Å; A234-G301 PolarHBondContact N-O 3.16Å; P297-G301 PolarHBondContact O-N 3.13Å; V298-G301 PolarHBondContact O-N 2.98Å
302	H	95.7	Very high	89	Confident	25 Å²	25	64 Å²	64	12%	0.116	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	133.1	176.4	-77.7	-154.1	0	0	0	111	Y50 E215 A234 Y240 V298 I300	Y50-H302 AromaticContact CD1-ND1 3.97Å; Y50-H302 HydrophobicContact CE1-CB 4.06Å; Y50-H302 AromaticContact CE1-CG 3.97Å; Y50-H302 AromaticContact CE1-ND1 3.51Å; Y50-H302 AromaticContact CE2-CE1 3.73Å; Y50-H302 AromaticContact CE2-ND1 3.71Å; Y50-H302 AromaticContact CZ-CE1 3.85Å; Y50-H302 AromaticContact CZ-CG 3.69Å; Y50-H302 AromaticContact CZ-ND1 3.36Å; E215-H302 HydrophobicContact CB-CB 3.89Å; E215-H302 PolarHBondContact N-O 3.09Å; A234-H302 CarbonylContact O-C 3.53Å; A234-H302 VanDerWaalsContact O-CA 3.32Å; A234-H302 WeakPolarHBondContact O-CA 3.41Å; Y240-H302 HydrophobicContact CD1-CB 4.46Å; Y240-H302 AromaticContact CD1-ND1 3.89Å; Y240-H302 HydrophobicContact CE1-CB 4.38Å; V298-H302 PolarHBondContact O-CD2 2.91Å; V298-H302 PolarHBondContact O-NE2 3.21Å; I300-H302 PolarHBondContact O-N 2.48Å
303	Y	97	Very high	88.4	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	143.7	174.2	-81.2	-102.3	0	0	0	111	L212 L213 P214 N219 Y221 L231 S232 A234 M235 D236 V251	L212-Y303 HydrophobicContact CB-CD1 3.92Å; L213-Y303 CarbonylContact O-C 3.47Å; L213-Y303 WeakPolarHBondContact O-CA 3.45Å; P214-Y303 HydrophobicContact CB-CD1 4.18Å; P214-Y303 HydrophobicContact CB-CE1 3.69Å; P214-Y303 HydrophobicContact CB-CE2 4.4Å; P214-Y303 HydrophobicContact CG-CE1 4.24Å; N219-Y303 WeakPolarHBondContact ND2-CE2 3.37Å; N219-Y303 PolarHBondContact ND2-OH 2.84Å; Y221-Y303 PolarHBondContact OH-OH 3.3Å; Y221-Y303 VanDerWaalsContact OH-OH 3.09Å; L231-Y303 HydrophobicContact CB-CE2 4.15Å; L231-Y303 WeakPolarHBondContact O-CE2 3.25Å; S232-Y303 VanDerWaalsContact CA-CD2 3.46Å; A234-Y303 PolarHBondContact O-N 3.01Å; M235-Y303 VanDerWaalsContact CA-O 3.29Å; M235-Y303 WeakPolarHBondContact CA-O 3.07Å; D236-Y303 PolarHBondContact N-O 3.1Å; V251-Y303 HydrophobicContact CB-CE1 4.2Å; V251-Y303 HydrophobicContact CG2-CD1 4.25Å; V251-Y303 HydrophobicContact CG2-CE1 3.67Å
304	K	95.9	Very high	88	Confident	56 Å²	56	58.4 Å²	58.4	24%	0.243	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	130	171.3	-160.6	174	-169.3	169.3	0	110.9	V100 L102 L213 E215 D236	V100-K304 HydrophobicContact CB-CB 4.23Å; V100-K304 HydrophobicContact CB-CD 3.6Å; V100-K304 HydrophobicContact CG1-CB 4.11Å; V100-K304 HydrophobicContact CG1-CD 3.65Å; V100-K304 HydrophobicContact CG1-CG 4.37Å; V100-K304 HydrophobicContact CG2-CB 4.26Å; V100-K304 HydrophobicContact CG2-CD 4.42Å; V100-K304 PolarHBondContact O-NZ 2.95Å; L102-K304 HydrophobicContact CD1-CD 4.11Å; L102-K304 HydrophobicContact CD1-CG 4.31Å; L102-K304 HydrophobicContact CG-CD 4.45Å; L213-K304 PolarHBondContact N-O 2.8Å; L213-K304 PolarHBondContact O-N 2.99Å; E215-K304 HydrophobicContact CG-CB 4.12Å; D236-K304 HydrophobicContact CB-CG 4.43Å
305	M	94.1	Very high	87.6	Confident	27 Å²	27	61.8 Å²	61.8	13%	0.133	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	127.5	176.5	-167.6	-175.3	-176.2	0	0	111.3	D211 L212 D236 K237 K307 H308	D211-M305 CarbonylContact O-C 3.59Å; D211-M305 VanDerWaalsContact O-CA 3.25Å; D211-M305 WeakPolarHBondContact O-CA 3.32Å; D211-M305 WeakPolarHBondContact OD2-CE 3.16Å; L212-M305 HydrophobicContact CD2-CB 3.91Å; L212-M305 HydrophobicContact CD2-CG 4.03Å; D236-M305 WeakPolarHBondContact OD1-CB 3.43Å; D236-M305 PolarHBondContact OD1-N 3.29Å; K237-M305 HydrophobicContact CB-CB 4.49Å; K237-M305 HydrophobicContact CB-SD 4.29Å; K237-M305 HydrophobicContact CD-SD 3.36Å; K237-M305 WeakPolarHBondContact CD-SD 3.27Å; K237-M305 HydrophobicContact CG-SD 4.45Å; M305-K307 PolarHBondContact O-N 2.87Å; M305-H308 VanDerWaalsContact CE-NE2 3.31Å; M305-H308 WeakPolarHBondContact CE-NE2 3.38Å
306	I	92.2	Very high	87.3	Confident	13 Å²	13	63.4 Å²	63.4	7%	0.067	33%	0.33	C	S	.	.			trans	-66.6	115.9	168.9	-47.4	-177.5	0	0	0	108	L102 H147 D211 L213 H308	L102-I306 HydrophobicContact CD2-CB 4.43Å; L102-I306 HydrophobicContact CD2-CD1 4.48Å; L102-I306 HydrophobicContact CD2-CG1 3.77Å; L102-I306 HydrophobicContact CD2-CG2 4.49Å; H147-I306 HydrophobicContact CB-CD1 3.97Å; D211-I306 HydrophobicContact CB-CB 3.94Å; D211-I306 HydrophobicContact CB-CG1 4.25Å; D211-I306 PolarHBondContact O-N 3.1Å; L213-I306 HydrophobicContact CD1-CD1 4.16Å; L213-I306 HydrophobicContact CD1-CG1 4.13Å; L213-I306 HydrophobicContact CG-CD1 4.48Å; L213-I306 HydrophobicContact CG-CG1 4.39Å; I306-H308 PolarHBondContact O-CD2 2.88Å; I306-H308 PolarHBondContact O-N 3.24Å
307	K	88.2	Confident	86.8	Confident	180 Å²	180	62.6 Å²	62.6	78%	0.783	32%	0.324	S	S	*	.			trans	-66.9	132.1	-177.3	-65.3	-179.2	-178.6	176	0	110.8	M305	M305-K307 PolarHBondContact O-N 2.87Å
308	H	81.4	Confident	86.3	Confident	75 Å²	75	65.1 Å²	65.1	35%	0.347	34%	0.341	S	S	.	.			trans	-145.9	159.5	174.3	64.8	78.5	0	0	0	111.2	R144 H147 D211 M305 I306	R144-H308 PolarHBondContact NH1-CD2 3.24Å; R144-H308 PolarHBondContact NH1-NE2 2.92Å; R144-H308 VanDerWaalsContact NH1-NE2 3.16Å; R144-H308 PolarHBondContact NH2-CD2 3.28Å; R144-H308 PolarHBondContact NH2-CE1 3.1Å; R144-H308 PolarHBondContact NH2-ND1 3.49Å; R144-H308 PolarHBondContact NH2-NE2 3.14Å; H147-H308 AromaticContact CE1-CD2 3.97Å; D211-H308 IonicContact OD2-CD2 2.69Å; D211-H308 PolarHBondContact OD2-CD2 2.99Å; D211-H308 VanDerWaalsContact OD2-CD2 3.24Å; D211-H308 IonicContact OD2-NE2 3.88Å; D211-H308 PolarHBondContact OD2-NE2 3.42Å; M305-H308 VanDerWaalsContact CE-NE2 3.31Å; M305-H308 WeakPolarHBondContact CE-NE2 3.38Å; I306-H308 PolarHBondContact O-CD2 2.88Å; I306-H308 PolarHBondContact O-N 3.24Å
309	K	78.6	Confident	85.9	Confident	190 Å²	190	67.1 Å²	67.1	83%	0.826	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-79.2	167.7	169.8	-64.5	-177.2	-179.3	179.3	0	109.8	D311	K309-D311 PolarHBondContact O-N 3.02Å
310	G	72.9	Confident	85.5	Confident	78 Å²	78	68 Å²	68	80%	0.804	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-57.9	132.1	172.8	0	0	0	0	0	111
311	D	74.1	Confident	85	Confident	57 Å²	57	72.5 Å²	72.5	31%	0.305	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-84.1	137.9	-179.3	-65.7	-17.1	0	0	0	111	R144 K309 G313 N314	R144-D311 IonicContact CZ-OD1 3.41Å; R144-D311 IonicContact CZ-OD2 2.64Å; R144-D311 IonicContact NE-OD1 3.93Å; R144-D311 IonicContact NE-OD2 3.82Å; R144-D311 PolarHBondContact NE-OD2 2.83Å; R144-D311 IonicContact NH2-OD1 2.63Å; R144-D311 PolarHBondContact NH2-OD1 3.09Å; R144-D311 IonicContact NH2-OD2 3.17Å; R144-D311 PolarHBondContact NH2-OD2 3.25Å; K309-D311 PolarHBondContact O-N 3.02Å; D311-G313 PolarHBondContact O-N 3.37Å; D311-N314 HydrophobicContact CB-CB 4.07Å; D311-N314 PolarHBondContact O-N 2.92Å
312	K	75.6	Confident	84.5	Confident	168 Å²	168	76.2 Å²	76.2	73%	0.73	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	129.3	169.9	-173.2	177.3	-178.6	178.3	0	110.3	N314	K312-N314 VanDerWaalsContact C-N 3.32Å
313	G	75.1	Confident	83.9	Confident	8 Å²	8	76.3 Å²	76.3	8%	0.082	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	7.2	-174.6	0	0	0	0	0	113.9	R142 T182 F183 D311 E315	R142-G313 VanDerWaalsContact NH2-C 3.3Å; R142-G313 PolarHBondContact NH2-O 3.16Å; T182-G313 CarbonylContact C-O 3.54Å; T182-G313 WeakPolarHBondContact CA-O 3.43Å; F183-G313 PolarHBondContact N-O 2.61Å; D311-G313 PolarHBondContact O-N 3.37Å; G313-E315 VanDerWaalsContact C-OE2 3.23Å; G313-E315 WeakPolarHBondContact CA-OE2 3.49Å; G313-E315 VanDerWaalsContact N-CD 3.29Å; G313-E315 PolarHBondContact N-OE1 3.24Å; G313-E315 PolarHBondContact N-OE2 3.14Å; G313-E315 VanDerWaalsContact N-OE2 3.09Å
314	N	81.6	Confident	83.2	Confident	36 Å²	36	77.8 Å²	77.8	19%	0.193	38%	0.384	C	S	.	.			trans	-125.1	37.9	167.9	-165.6	27.4	0	0	0	110.2	F183 W272 D311 K312	F183-N314 HydrophobicContact CB-CB 4.1Å; W272-N314 WeakPolarHBondContact CB-O 3.48Å; W272-N314 PolarHBondContact N-OD1 2.94Å; D311-N314 HydrophobicContact CB-CB 4.07Å; D311-N314 PolarHBondContact O-N 2.92Å; K312-N314 VanDerWaalsContact C-N 3.32Å
315	E	85.8	Confident	82.7	Confident	107 Å²	107	82.3 Å²	82.3	50%	0.5	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-63.4	153.6	176.9	-62.3	77.7	-170.6	0	0	110.4	G271 W272 G313 N317	G271-E315 WeakPolarHBondContact CA-O 3.38Å; W272-E315 PolarHBondContact N-O 3.11Å; G313-E315 VanDerWaalsContact C-OE2 3.23Å; G313-E315 WeakPolarHBondContact CA-OE2 3.49Å; G313-E315 VanDerWaalsContact N-CD 3.29Å; G313-E315 PolarHBondContact N-OE1 3.24Å; G313-E315 PolarHBondContact N-OE2 3.14Å; G313-E315 VanDerWaalsContact N-OE2 3.09Å; E315-N317 PolarHBondContact O-N 2.89Å
316	Q	85.4	Confident	82.2	Confident	110 Å²	110	86.4 Å²	86.4	51%	0.514	42%	0.421	S	S	.	.	B	Isolated β-bridge	trans	-56.2	126.3	179.4	176.5	173.3	106.9	0	0	110.8	W272 P318 R320	W272-Q316 HydrophobicContact CE3-CB 4.05Å; W272-Q316 HydrophobicContact CE3-CG 3.88Å; W272-Q316 HydrophobicContact CZ3-CG 4.15Å; W272-Q316 VanDerWaalsContact CZ3-NE2 3.29Å; Q316-P318 VanDerWaalsContact O-CD 3.23Å; Q316-P318 WeakPolarHBondContact O-CD 3.23Å; Q316-R320 VanDerWaalsContact OE1-NH2 3.16Å
317	N	84.1	Confident	81.8	Confident	4 Å²	4	86 Å²	86	2%	0.021	42%	0.42	C	S	.	.	P	Polyproline II helix	trans	-70.5	116.6	177.6	-176.8	-5.8	0	0	0	109.8	W270 W272 E315 R319 R320 R364	W270-N317 PolarHBondContact O-ND2 3.08Å; W272-N317 PolarHBondContact O-N 2.81Å; E315-N317 PolarHBondContact O-N 2.89Å; N317-R319 PolarHBondContact O-N 3.06Å; N317-R319 PolarHBondContact OD1-N 3.29Å; N317-R320 HydrophobicContact CB-CB 4.37Å; N317-R320 WeakPolarHBondContact O-CG 3.48Å; N317-R320 PolarHBondContact O-N 3.21Å; N317-R320 PolarHBondContact O-NH1 3.22Å; N317-R364 PolarHBondContact OD1-NH1 2.95Å
318	P	83.5	Confident	81.3	Confident	99 Å²	99	85.4 Å²	85.4	64%	0.643	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-25.5	179.2	26.7	-35.5	0	0	0	112.8	Q316	Q316-P318 VanDerWaalsContact O-CD 3.23Å; Q316-P318 WeakPolarHBondContact O-CD 3.23Å
319	R	83.4	Confident	81.5	Confident	131 Å²	131	88.2 Å²	88.2	49%	0.494	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	7.7	-179.4	-64.2	-164.1	-168.9	178.1	4.5	113.8	N317 F321 D322 L323	N317-R319 PolarHBondContact O-N 3.06Å; N317-R319 PolarHBondContact OD1-N 3.29Å; R319-F321 PolarHBondContact O-N 3.28Å; R319-F321 VanDerWaalsContact O-N 3.13Å; R319-D322 HydrophobicContact CB-CB 4.4Å; R319-D322 WeakPolarHBondContact O-CB 3.23Å; R319-D322 PolarHBondContact O-N 2.98Å; R319-L323 WeakPolarHBondContact O-CG 3.44Å; R319-L323 PolarHBondContact O-N 3.39Å
320	R	81.3	Confident	81.7	Confident	43 Å²	43	81.6 Å²	81.6	16%	0.162	40%	0.403	C	S	.	.	H	α-helix	trans	-52.4	-40.8	-175.7	67.9	179.1	179.5	-84.6	9.4	112.9	G273 Q316 N317 L324	G273-R320 VanDerWaalsContact O-CB 3.23Å; G273-R320 WeakPolarHBondContact O-CB 3.37Å; Q316-R320 VanDerWaalsContact OE1-NH2 3.16Å; N317-R320 HydrophobicContact CB-CB 4.37Å; N317-R320 WeakPolarHBondContact O-CG 3.48Å; N317-R320 PolarHBondContact O-N 3.21Å; N317-R320 PolarHBondContact O-NH1 3.22Å; R320-L324 WeakPolarHBondContact O-CB 3.42Å; R320-L324 VanDerWaalsContact O-CG 3.25Å; R320-L324 WeakPolarHBondContact O-CG 3.43Å; R320-L324 PolarHBondContact O-N 2.57Å
321	F	84.6	Confident	82.4	Confident	116 Å²	116	79.1 Å²	79.1	51%	0.509	37%	0.369	S	S	.	.	H	α-helix	trans	-75	-29.9	178.7	-62.1	-65.8	0	0	0	113.2	R319 L324 K325	R319-F321 PolarHBondContact O-N 3.28Å; R319-F321 VanDerWaalsContact O-N 3.13Å; F321-L324 HydrophobicContact CD1-CD1 4.22Å; F321-K325 WeakPolarHBondContact O-CG 3.35Å; F321-K325 PolarHBondContact O-N 3.04Å; F321-K325 VanDerWaalsContact O-N 3.07Å
322	D	84.6	Confident	83	Confident	78 Å²	78	82.1 Å²	82.1	42%	0.417	38%	0.381	S	S	.	.	H	α-helix	trans	-71.6	-37.6	175.5	-63.6	-26.8	0	0	0	111.4	R319 K326	R319-D322 HydrophobicContact CB-CB 4.4Å; R319-D322 WeakPolarHBondContact O-CB 3.23Å; R319-D322 PolarHBondContact O-N 2.98Å; D322-K326 WeakPolarHBondContact O-CG 3.33Å; D322-K326 PolarHBondContact O-N 3.43Å
323	L	82.8	Confident	83.7	Confident	27 Å²	27	77.7 Å²	77.7	14%	0.141	37%	0.372	C	S	.	.	H	α-helix	trans	-64	-46.5	172.8	-66.7	173.5	0	0	0	110.3	Q268 Y269 R319 K325 K326 T327	Q268-L323 HydrophobicContact CB-CD2 4.29Å; Y269-L323 HydrophobicContact CD1-CD1 3.74Å; Y269-L323 HydrophobicContact CD2-CD1 4.2Å; Y269-L323 HydrophobicContact CE1-CB 3.73Å; Y269-L323 HydrophobicContact CE1-CD1 3.76Å; Y269-L323 HydrophobicContact CE1-CG 4.4Å; Y269-L323 HydrophobicContact CE2-CB 4.06Å; Y269-L323 HydrophobicContact CE2-CD1 4.24Å; Y269-L323 HydrophobicContact CG-CD1 3.98Å; Y269-L323 VanDerWaalsContact CZ-CB 3.46Å; Y269-L323 WeakPolarHBondContact OH-CB 3.39Å; R319-L323 WeakPolarHBondContact O-CG 3.44Å; R319-L323 PolarHBondContact O-N 3.39Å; L323-K325 VanDerWaalsContact C-N 3.32Å; L323-K325 PolarHBondContact O-N 2.88Å; L323-K326 CarbonylContact O-C 3.51Å; L323-K326 WeakPolarHBondContact O-CA 3.46Å; L323-K326 WeakPolarHBondContact O-CB 3.37Å; L323-K326 PolarHBondContact O-N 2.86Å; L323-T327 PolarHBondContact O-N 3.33Å; L323-T327 VanDerWaalsContact O-N 3.12Å; L323-T327 PolarHBondContact O-OG1 2.72Å
324	L	83.3	Confident	84.5	Confident	30 Å²	30	77.9 Å²	77.9	16%	0.157	37%	0.371	C	S	.	.	H	α-helix	trans	-58.5	-39.3	176.9	-77.1	171.4	0	0	0	113.7	Y269 G274 D277 D278 R320 F321 K326 T327	Y269-L324 PolarHBondContact OH-N 3.47Å; G274-L324 WeakPolarHBondContact O-CD2 3.38Å; D277-L324 HydrophobicContact CB-CD1 4Å; D277-L324 HydrophobicContact CB-CD2 3.63Å; D277-L324 HydrophobicContact CB-CG 4.46Å; D278-L324 HydrophobicContact CB-CD2 4.15Å; D278-L324 VanDerWaalsContact N-CD2 3.33Å; R320-L324 WeakPolarHBondContact O-CB 3.42Å; R320-L324 VanDerWaalsContact O-CG 3.25Å; R320-L324 WeakPolarHBondContact O-CG 3.43Å; R320-L324 PolarHBondContact O-N 2.57Å; F321-L324 HydrophobicContact CD1-CD1 4.22Å; L324-K326 PolarHBondContact O-N 3.12Å; L324-T327 WeakPolarHBondContact CA-OG1 3.38Å; L324-T327 PolarHBondContact O-N 2.69Å; L324-T327 PolarHBondContact O-OG1 2.87Å
325	K	84.6	Confident	85	Confident	151 Å²	151	76.1 Å²	76.1	66%	0.657	36%	0.361	S	S	*	.	H	α-helix	trans	-64.3	-25.2	174.7	-73.8	171.2	-175.7	173.6	0	112.6	F321 L323	F321-K325 WeakPolarHBondContact O-CG 3.35Å; F321-K325 PolarHBondContact O-N 3.04Å; F321-K325 VanDerWaalsContact O-N 3.07Å; L323-K325 VanDerWaalsContact C-N 3.32Å; L323-K325 PolarHBondContact O-N 2.88Å
326	K	84.3	Confident	85.4	Confident	113 Å²	113	72 Å²	72	49%	0.491	34%	0.343	S	S	.	.	H	α-helix	trans	-96.3	-5.7	-177.1	-68.3	177.3	-178.8	-177.5	0	113.5	D322 L323 L324 R328 L329 N330	D322-K326 WeakPolarHBondContact O-CG 3.33Å; D322-K326 PolarHBondContact O-N 3.43Å; L323-K326 CarbonylContact O-C 3.51Å; L323-K326 WeakPolarHBondContact O-CA 3.46Å; L323-K326 WeakPolarHBondContact O-CB 3.37Å; L323-K326 PolarHBondContact O-N 2.86Å; L324-K326 PolarHBondContact O-N 3.12Å; K326-R328 VanDerWaalsContact C-N 3.31Å; K326-R328 PolarHBondContact O-N 3.45Å; K326-L329 WeakPolarHBondContact O-CB 3.31Å; K326-L329 PolarHBondContact O-N 2.78Å; K326-N330 PolarHBondContact O-N 3.05Å
327	T	82.2	Confident	85.9	Confident	6 Å²	6	71.9 Å²	71.9	4%	0.037	35%	0.345	C	S	.	.	H	α-helix	trans	-49.6	-49.6	-179.3	-53.1	0	0	0	0	112.1	D278 L323 L324 L329 N330 W331	D278-T327 WeakPolarHBondContact OD1-CG2 3.3Å; D278-T327 WeakPolarHBondContact OD2-CB 3.43Å; D278-T327 WeakPolarHBondContact OD2-CG2 3.42Å; D278-T327 PolarHBondContact OD2-OG1 3.21Å; L323-T327 PolarHBondContact O-N 3.33Å; L323-T327 VanDerWaalsContact O-N 3.12Å; L323-T327 PolarHBondContact O-OG1 2.72Å; L324-T327 WeakPolarHBondContact CA-OG1 3.38Å; L324-T327 PolarHBondContact O-N 2.69Å; L324-T327 PolarHBondContact O-OG1 2.87Å; T327-L329 PolarHBondContact O-N 3.25Å; T327-L329 VanDerWaalsContact O-N 3.14Å; T327-N330 PolarHBondContact O-N 3.42Å; T327-N330 VanDerWaalsContact O-N 3.16Å; T327-W331 WeakPolarHBondContact O-CB 3.39Å; T327-W331 PolarHBondContact O-N 3.43Å
328	R	79.4	Confident	86.5	Confident	166 Å²	166	73.9 Å²	73.9	63%	0.626	36%	0.36	S	S	*	.	H	α-helix	trans	-58.6	-30.7	-179.7	-176.3	177.8	169.4	-171.2	-2.5	113.4	K326	K326-R328 VanDerWaalsContact C-N 3.31Å; K326-R328 PolarHBondContact O-N 3.45Å
329	L	84.1	Confident	87.1	Confident	134 Å²	134	69.7 Å²	69.7	70%	0.702	33%	0.332	S	S	*	.	H	α-helix	trans	-83.7	-37	-179.9	-60.6	173.7	0	0	0	111.7	K326 T327	K326-L329 WeakPolarHBondContact O-CB 3.31Å; K326-L329 PolarHBondContact O-N 2.78Å; T327-L329 PolarHBondContact O-N 3.25Å; T327-L329 VanDerWaalsContact O-N 3.14Å
330	N	84.3	Confident	87.7	Confident	51 Å²	51	68 Å²	68	27%	0.273	34%	0.336	S	S	.	.	H	α-helix	trans	-105.2	-11.2	-164.9	-66.2	-5.4	0	0	0	114.2	K326 T327 H332 S333 D334	K326-N330 PolarHBondContact O-N 3.05Å; T327-N330 PolarHBondContact O-N 3.42Å; T327-N330 VanDerWaalsContact O-N 3.16Å; N330-H332 PolarHBondContact O-N 3.05Å; N330-H332 VanDerWaalsContact O-N 3.11Å; N330-S333 PolarHBondContact O-N 2.92Å; N330-S333 PolarHBondContact O-OG 2.82Å; N330-S333 VanDerWaalsContact O-OG 3.12Å; N330-D334 PolarHBondContact O-N 3.07Å
331	W	85.6	Confident	88.5	Confident	27 Å²	27	67.7 Å²	67.7	10%	0.102	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-27.7	-170.4	77.1	-82.8	0	0	0	114.8	N263 R285 L288 T327	N263-W331 HydrophobicContact CB-CE3 4.46Å; N263-W331 PolarHBondContact ND2-O 3.33Å; R285-W331 HydrophobicContact CG-CB 3.91Å; R285-W331 HydrophobicContact CG-CE3 4.39Å; R285-W331 PolarHBondContact NH1-O 2.94Å; R285-W331 VanDerWaalsContact NH1-O 3.08Å; L288-W331 HydrophobicContact CB-CZ2 4.01Å; L288-W331 HydrophobicContact CD1-CD2 4.47Å; L288-W331 HydrophobicContact CD1-CG 4.15Å; T327-W331 WeakPolarHBondContact O-CB 3.39Å; T327-W331 PolarHBondContact O-N 3.43Å
332	H	86.9	Confident	89.1	Confident	119 Å²	119	67.3 Å²	67.3	55%	0.551	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-22.3	174.5	-72.4	-71.1	0	0	0	113.7	N330 N337	N330-H332 PolarHBondContact O-N 3.05Å; N330-H332 VanDerWaalsContact O-N 3.11Å; H332-N337 PolarHBondContact O-ND2 3.29Å
333	S	90.8	Very high	89.7	Confident	76 Å²	76	66.6 Å²	66.6	53%	0.531	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-24.6	-175.7	56.9	0	0	0	0	113.6	N330 S338	N330-S333 PolarHBondContact O-N 2.92Å; N330-S333 PolarHBondContact O-OG 2.82Å; N330-S333 VanDerWaalsContact O-OG 3.12Å; S333-S338 WeakPolarHBondContact O-CB 3.24Å; S333-S338 PolarHBondContact O-OG 3.3Å
334	D	91.3	Very high	90.4	Very high	11 Å²	11	69.4 Å²	69.4	6%	0.059	35%	0.345	C	S	.	.	S	Bend	trans	-106.7	113.3	172.1	-178.6	25.5	0	0	0	109.3	N267 Q268 R285 N330 S338	N267-D334 VanDerWaalsContact CB-OD1 3.31Å; N267-D334 WeakPolarHBondContact CB-OD1 3.49Å; N267-D334 PolarHBondContact N-OD1 3.34Å; N267-D334 PolarHBondContact N-OD2 3.03Å; N267-D334 PolarHBondContact ND2-OD1 3.44Å; Q268-D334 WeakPolarHBondContact CG-OD2 3.49Å; R285-D334 PolarHBondContact NH1-O 3.13Å; R285-D334 PolarHBondContact NH2-O 3.23Å; N330-D334 PolarHBondContact O-N 3.07Å; D334-S338 WeakPolarHBondContact CA-OG 3.34Å
335	G	93.6	Very high	91.1	Very high	0 Å²	0	69.4 Å²	69.4	0%	0	35%	0.348	C	S	.	.	S	Bend	trans	169.8	-154	-177.8	0	0	0	0	0	113.4	N263 F265 N267 N337 S338 L339	N263-G335 CarbonylContact O-C 3.57Å; N263-G335 WeakPolarHBondContact O-CA 3.3Å; F265-G335 WeakPolarHBondContact O-CA 3.35Å; N267-G335 PolarHBondContact ND2-O 2.87Å; G335-N337 PolarHBondContact O-N 2.84Å; G335-S338 PolarHBondContact N-OG 3.27Å; G335-S338 PolarHBondContact O-N 2.88Å; G335-S338 PolarHBondContact O-OG 2.96Å; G335-L339 PolarHBondContact O-N 2.75Å
336	L	93.9	Very high	91.8	Very high	21 Å²	21	65.7 Å²	65.7	11%	0.11	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-59.5	-34.9	177	-172.5	61.5	0	0	0	112.1	N190 R194 Y259 M260 N263 S338 L339	N190-L336 HydrophobicContact CB-CD1 4.37Å; R194-L336 HydrophobicContact CB-CD1 4.41Å; Y259-L336 HydrophobicContact CD1-CD2 4.05Å; Y259-L336 HydrophobicContact CE1-CD1 4.43Å; Y259-L336 HydrophobicContact CE1-CD2 4.1Å; M260-L336 HydrophobicContact CE-CD2 3.81Å; M260-L336 HydrophobicContact SD-CD2 3.35Å; M260-L336 WeakPolarHBondContact SD-CD2 3.36Å; N263-L336 PolarHBondContact O-N 3.35Å; N263-L336 PolarHBondContact OD1-N 3.42Å; L336-S338 VanDerWaalsContact C-N 3.33Å; L336-S338 PolarHBondContact O-N 3.34Å; L336-L339 HydrophobicContact CD1-CD2 3.92Å; L336-L339 VanDerWaalsContact O-CB 3.24Å; L336-L339 WeakPolarHBondContact O-CB 2.98Å; L336-L339 PolarHBondContact O-N 2.96Å
337	N	95.1	Very high	92.4	Very high	106 Å²	106	64.4 Å²	64.4	57%	0.567	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-66.8	-27.2	178.8	66.7	-13.1	0	0	0	114.8	N263 H332 G335	N263-N337 PolarHBondContact ND2-OD1 2.91Å; N263-N337 VanDerWaalsContact OD1-CG 3.28Å; N263-N337 PolarHBondContact OD1-N 2.89Å; N263-N337 PolarHBondContact OD1-OD1 2.73Å; H332-N337 PolarHBondContact O-ND2 3.29Å; G335-N337 PolarHBondContact O-N 2.84Å
338	S	95.9	Very high	93.2	Very high	46 Å²	46	69 Å²	69	32%	0.322	35%	0.351	S	S	.	.	G	3₁₀ helix	trans	-106.1	14.3	177.8	53.4	0	0	0	0	113	S333 D334 G335 L336 T340	S333-S338 WeakPolarHBondContact O-CB 3.24Å; S333-S338 PolarHBondContact O-OG 3.3Å; D334-S338 WeakPolarHBondContact CA-OG 3.34Å; G335-S338 PolarHBondContact N-OG 3.27Å; G335-S338 PolarHBondContact O-N 2.88Å; G335-S338 PolarHBondContact O-OG 2.96Å; L336-S338 VanDerWaalsContact C-N 3.33Å; L336-S338 PolarHBondContact O-N 3.34Å; S338-T340 PolarHBondContact O-N 2.76Å
339	L	97.2	Very high	94.1	Very high	11 Å²	11	64.2 Å²	64.2	6%	0.058	34%	0.336	C	S	.	.			trans	-66.7	114.8	-179.4	179.8	66.6	0	0	0	111.7	K187 N190 V191 R194 G335 L336 Y341	K187-L339 HydrophobicContact CG-CD1 3.88Å; N190-L339 HydrophobicContact CB-CD1 3.76Å; N190-L339 HydrophobicContact CB-CD2 3.86Å; N190-L339 HydrophobicContact CB-CG 4.34Å; V191-L339 HydrophobicContact CG2-CD1 4.01Å; V191-L339 HydrophobicContact CG2-CD2 4.33Å; R194-L339 HydrophobicContact CB-CD2 4.31Å; R194-L339 PolarHBondContact NH1-O 3.32Å; G335-L339 PolarHBondContact O-N 2.75Å; L336-L339 HydrophobicContact CD1-CD2 3.92Å; L336-L339 VanDerWaalsContact O-CB 3.24Å; L336-L339 WeakPolarHBondContact O-CB 2.98Å; L336-L339 PolarHBondContact O-N 2.96Å; L339-Y341 HydrophobicContact CD1-CD1 4.21Å; L339-Y341 HydrophobicContact CD2-CD1 3.94Å; L339-Y341 HydrophobicContact CD2-CE1 3.55Å; L339-Y341 HydrophobicContact CG-CD1 3.77Å; L339-Y341 HydrophobicContact CG-CE1 3.9Å
340	T	96.4	Very high	94.8	Very high	95 Å²	95	60.6 Å²	60.6	58%	0.583	32%	0.321	S	S	*	.			trans	-114.2	128.2	173.2	56.2	0	0	0	0	111.3	K187 S338	K187-T340 WeakPolarHBondContact CE-O 3.28Å; K187-T340 PolarHBondContact NZ-O 2.92Å; K187-T340 PolarHBondContact NZ-OG1 2.78Å; S338-T340 PolarHBondContact O-N 2.76Å
341	Y	97.1	Very high	95.5	Very high	38 Å²	38	58.3 Å²	58.3	15%	0.149	31%	0.309	C	S	.	.			trans	-164.3	168.5	172.3	67.4	-84.1	0	0	0	110.2	V191 R194 E195 L339 L343 V357 N358	V191-Y341 HydrophobicContact CB-CD1 4.37Å; V191-Y341 HydrophobicContact CB-CE1 4.23Å; V191-Y341 HydrophobicContact CG1-CD1 4.25Å; V191-Y341 HydrophobicContact CG1-CD2 3.75Å; V191-Y341 HydrophobicContact CG1-CE1 3.96Å; V191-Y341 HydrophobicContact CG1-CE2 3.54Å; V191-Y341 HydrophobicContact CG1-CG 4.11Å; V191-Y341 HydrophobicContact CG2-CD1 3.47Å; V191-Y341 VanDerWaalsContact CG2-CD1 3.47Å; V191-Y341 HydrophobicContact CG2-CD2 4.15Å; V191-Y341 HydrophobicContact CG2-CE1 3.77Å; V191-Y341 HydrophobicContact CG2-CG 3.64Å; R194-Y341 VanDerWaalsContact CZ-OH 3.31Å; R194-Y341 PolarHBondContact NE-OH 3.19Å; R194-Y341 PolarHBondContact NH2-OH 3.33Å; E195-Y341 PolarHBondContact OE1-OH 3.47Å; L339-Y341 HydrophobicContact CD1-CD1 4.21Å; L339-Y341 HydrophobicContact CD2-CD1 3.94Å; L339-Y341 HydrophobicContact CD2-CE1 3.55Å; L339-Y341 HydrophobicContact CG-CD1 3.77Å; L339-Y341 HydrophobicContact CG-CE1 3.9Å; Y341-L343 HydrophobicContact CE2-CB 4.17Å; Y341-V357 HydrophobicContact CD2-CG1 4.41Å; Y341-N358 CarbonylContact C-O 3.6Å; Y341-N358 VanDerWaalsContact CA-O 3.24Å; Y341-N358 WeakPolarHBondContact CA-O 3.24Å; Y341-N358 WeakPolarHBondContact CB-O 3.26Å
342	E	97.4	Very high	96.1	Very high	107 Å²	107	58 Å²	58	50%	0.5	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	127	169.8	178.9	-175.5	-162.2	0	0	108.7	L344 V357 N358	E342-L344 HydrophobicContact CG-CD2 3.83Å; E342-V357 WeakPolarHBondContact O-CA 3.48Å; E342-N358 HydrophobicContact CB-CB 4.26Å; E342-N358 PolarHBondContact N-O 3.03Å; E342-N358 PolarHBondContact O-N 2.79Å
343	L	97.8	Very high	96.6	Very high	63 Å²	63	52.4 Å²	52.4	33%	0.33	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	111.6	171.9	-179.4	66.3	0	0	0	107.9	Y341 S345 K346 L355 V357	Y341-L343 HydrophobicContact CE2-CB 4.17Å; L343-S345 WeakPolarHBondContact CD1-O 3.46Å; L343-K346 HydrophobicContact CD2-CB 4.47Å; L343-L355 HydrophobicContact CD1-CB 4.36Å; L343-L355 HydrophobicContact CD1-CD2 4.23Å; L343-V357 HydrophobicContact CD1-CG1 3.7Å
344	L	97.5	Very high	97	Very high	86 Å²	86	49.8 Å²	49.8	45%	0.45	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-41.5	-175.8	-61.3	171.7	0	0	0	111.6	V174 E342 T356 N358	V174-L344 HydrophobicContact CB-CD1 4.39Å; V174-L344 HydrophobicContact CG1-CD1 3.5Å; V174-L344 VanDerWaalsContact CG1-CD1 3.5Å; V174-L344 HydrophobicContact CG2-CD1 4.13Å; E342-L344 HydrophobicContact CG-CD2 3.83Å; L344-T356 HydrophobicContact CB-CG2 4.28Å; L344-T356 WeakPolarHBondContact CB-O 3.22Å; L344-T356 HydrophobicContact CD1-CG2 4.33Å; L344-T356 PolarHBondContact N-O 3.21Å; L344-N358 HydrophobicContact CD1-CB 4.05Å; L344-N358 HydrophobicContact CG-CB 4.38Å
345	S	98	Very high	97.4	Very high	31 Å²	31	49.2 Å²	49.2	22%	0.217	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	154.2	172.6	78.7	0	0	0	0	111.9	L343 E347 T356	L343-S345 WeakPolarHBondContact CD1-O 3.46Å; S345-E347 WeakPolarHBondContact CB-OE1 3.45Å; S345-E347 PolarHBondContact OG-OE1 3.12Å; S345-T356 PolarHBondContact N-O 3.43Å; S345-T356 PolarHBondContact O-N 3.05Å; S345-T356 WeakPolarHBondContact OG-CB 3.36Å; S345-T356 PolarHBondContact OG-OG1 2.93Å; S345-T356 VanDerWaalsContact OG-OG1 3.14Å
346	K	98.4	Very high	97.6	Very high	73 Å²	73	50.5 Å²	50.5	32%	0.317	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	111.7	171	175.2	170.8	-170.9	163.6	0	108.2	D199 L343 T353 N354 L355	D199-K346 IonicContact OD1-NZ 2.78Å; D199-K346 PolarHBondContact OD1-NZ 3.36Å; D199-K346 WeakPolarHBondContact OD2-CE 3.18Å; D199-K346 IonicContact OD2-NZ 2.83Å; D199-K346 PolarHBondContact OD2-NZ 2.88Å; L343-K346 HydrophobicContact CD2-CB 4.47Å; K346-T353 HydrophobicContact CG-CG2 4.29Å; K346-N354 WeakPolarHBondContact CA-O 3.41Å; K346-L355 HydrophobicContact CB-CD2 4.03Å; K346-L355 HydrophobicContact CD-CD2 3.89Å; K346-L355 HydrophobicContact CG-CD2 3.7Å
347	E	98.4	Very high	97.7	Very high	85 Å²	85	49.5 Å²	49.5	40%	0.397	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.4	-173.7	-70.8	157.1	-141.1	0	0	109.8	S345 E349 T353 N354	S345-E347 WeakPolarHBondContact CB-OE1 3.45Å; S345-E347 PolarHBondContact OG-OE1 3.12Å; E347-E349 PolarHBondContact O-N 3.12Å; E347-T353 CarbonylContact O-C 3.59Å; E347-T353 WeakPolarHBondContact O-CA 3.37Å; E347-N354 HydrophobicContact CB-CB 4.33Å; E347-N354 PolarHBondContact N-O 2.81Å; E347-N354 PolarHBondContact O-N 2.95Å
348	L	98.4	Very high	97.7	Very high	102 Å²	102	46.5 Å²	46.5	53%	0.534	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	84	176.5	-59.4	-178.8	0	0	0	108.9	P120 T353	P120-L348 HydrophobicContact CB-CB 4.47Å; L348-T353 HydrophobicContact CD2-CG2 4.03Å
349	E	98.3	Very high	97.6	Very high	67 Å²	67	44.5 Å²	44.5	31%	0.313	23%	0.231	S	C	.	.			trans	-69.4	159	176	-65.1	-76	-169	0	0	110.8	G121 E347 L351 Y352 N354	G121-E349 PolarHBondContact N-O 3.02Å; E347-E349 PolarHBondContact O-N 3.12Å; E349-L351 PolarHBondContact O-N 2.92Å; E349-Y352 CarbonylContact C-O 3.44Å; E349-Y352 WeakPolarHBondContact CA-O 3.06Å; E349-Y352 HydrophobicContact CB-CD1 4.14Å; E349-Y352 HydrophobicContact CB-CD2 4.36Å; E349-Y352 HydrophobicContact CB-CE1 3.97Å; E349-Y352 HydrophobicContact CB-CE2 4.28Å; E349-Y352 HydrophobicContact CB-CG 4.32Å; E349-Y352 VanDerWaalsContact CB-O 3.22Å; E349-Y352 WeakPolarHBondContact CB-O 3.48Å; E349-Y352 HydrophobicContact CG-CD2 4.47Å; E349-Y352 HydrophobicContact CG-CE1 4.29Å; E349-Y352 HydrophobicContact CG-CE2 4Å; E349-Y352 PolarHBondContact N-O 3.41Å; E349-Y352 PolarHBondContact O-N 2.78Å; E349-N354 HydrophobicContact CG-CB 4.23Å
350	P	98.1	Very high	97.3	Very high	57 Å²	57	45.6 Å²	45.6	37%	0.37	25%	0.245	S	C	.	.	S	Bend	trans	-56.9	-28.2	-176.4	-28	35.4	0	0	0	115.2	R112	R112-P350 HydrophobicContact CG-CB 4.11Å
351	L	98.6	Very high	96.9	Very high	4 Å²	4	45.1 Å²	45.1	2%	0.021	24%	0.236	C	C	.	.	S	Bend	trans	-119.4	-6.9	-173.2	-68.5	174.2	0	0	0	113.9	L108 I111 R112 V118 G122 L152 H156 E349	L108-L351 HydrophobicContact CD2-CD1 4.16Å; L108-L351 WeakPolarHBondContact O-CD1 3.23Å; I111-L351 HydrophobicContact CB-CD1 3.8Å; I111-L351 HydrophobicContact CG2-CD1 3.58Å; I111-L351 HydrophobicContact CG2-CD2 4.33Å; R112-L351 HydrophobicContact CB-CD1 4.38Å; R112-L351 HydrophobicContact CB-CD2 4.38Å; R112-L351 HydrophobicContact CB-CG 4.37Å; V118-L351 HydrophobicContact CG1-CD2 4.25Å; G122-L351 WeakPolarHBondContact CA-O 3.33Å; L152-L351 HydrophobicContact CD1-CB 4.12Å; L152-L351 HydrophobicContact CD1-CD1 4.47Å; H156-L351 PolarHBondContact CE1-O 3.1Å; H156-L351 PolarHBondContact NE2-O 2.82Å; E349-L351 PolarHBondContact O-N 2.92Å
352	Y	98.8	Very high	96.3	Very high	21 Å²	21	43.5 Å²	43.5	8%	0.082	23%	0.23	C	C	.	.	S	Bend	trans	-164	167.9	-179.1	60.6	-81.9	0	0	0	111.1	G121 L148 L152 I168 I170 E349 N354	G121-Y352 CarbonylContact C-O 3.57Å; G121-Y352 WeakPolarHBondContact CA-O 3.46Å; G121-Y352 CarbonylContact O-C 3.36Å; G121-Y352 VanDerWaalsContact O-C 3.24Å; G121-Y352 WeakPolarHBondContact O-CA 3.4Å; L148-Y352 HydrophobicContact CD2-CE1 4.36Å; L148-Y352 HydrophobicContact CD2-CE2 4.46Å; L152-Y352 HydrophobicContact CD1-CD1 3.64Å; L152-Y352 HydrophobicContact CD1-CE1 4.02Å; L152-Y352 HydrophobicContact CD2-CD1 4.43Å; I168-Y352 CarbonylContact O-C 3.47Å; I168-Y352 WeakPolarHBondContact O-CA 3.42Å; I170-Y352 HydrophobicContact CB-CD2 3.67Å; I170-Y352 HydrophobicContact CB-CE2 4Å; I170-Y352 HydrophobicContact CG1-CD2 3.22Å; I170-Y352 HydrophobicContact CG1-CE2 3.83Å; I170-Y352 HydrophobicContact CG1-CG 3.65Å; E349-Y352 CarbonylContact C-O 3.44Å; E349-Y352 WeakPolarHBondContact CA-O 3.06Å; E349-Y352 HydrophobicContact CB-CD1 4.14Å; E349-Y352 HydrophobicContact CB-CD2 4.36Å; E349-Y352 HydrophobicContact CB-CE1 3.97Å; E349-Y352 HydrophobicContact CB-CE2 4.28Å; E349-Y352 HydrophobicContact CB-CG 4.32Å; E349-Y352 VanDerWaalsContact CB-O 3.22Å; E349-Y352 WeakPolarHBondContact CB-O 3.48Å; E349-Y352 HydrophobicContact CG-CD2 4.47Å; E349-Y352 HydrophobicContact CG-CE1 4.29Å; E349-Y352 HydrophobicContact CG-CE2 4Å; E349-Y352 PolarHBondContact N-O 3.41Å; E349-Y352 PolarHBondContact O-N 2.78Å; Y352-N354 HydrophobicContact CD2-CB 4.2Å; Y352-N354 HydrophobicContact CE2-CB 3.76Å
353	T	98.8	Very high	95.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	119.4	167.9	-63	0	0	0	0	108.5	G121 I168 Y169 I170 K346 E347 L348 L355	G121-T353 VanDerWaalsContact CA-OG1 3.27Å; G121-T353 WeakPolarHBondContact CA-OG1 3.49Å; G121-T353 PolarHBondContact O-N 3.05Å; G121-T353 VanDerWaalsContact O-N 3.12Å; G121-T353 PolarHBondContact O-OG1 2.88Å; I168-T353 PolarHBondContact O-N 2.9Å; Y169-T353 HydrophobicContact CD1-CG2 3.85Å; Y169-T353 HydrophobicContact CE1-CG2 3.95Å; I170-T353 PolarHBondContact N-O 3.26Å; K346-T353 HydrophobicContact CG-CG2 4.29Å; E347-T353 CarbonylContact O-C 3.59Å; E347-T353 WeakPolarHBondContact O-CA 3.37Å; L348-T353 HydrophobicContact CD2-CG2 4.03Å; T353-L355 HydrophobicContact CG2-CD2 4.16Å; T353-L355 HydrophobicContact CG2-CG 4.41Å
354	N	98.6	Very high	94.3	Very high	21 Å²	21	42.1 Å²	42.1	11%	0.112	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	121.3	176.9	-173.7	26.5	0	0	0	110.1	K346 E347 E349 Y352	K346-N354 WeakPolarHBondContact CA-O 3.41Å; E347-N354 HydrophobicContact CB-CB 4.33Å; E347-N354 PolarHBondContact N-O 2.81Å; E347-N354 PolarHBondContact O-N 2.95Å; E349-N354 HydrophobicContact CG-CB 4.23Å; Y352-N354 HydrophobicContact CD2-CB 4.2Å; Y352-N354 HydrophobicContact CE2-CB 3.76Å
355	L	98.6	Very high	92.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	99.9	175.1	-60.5	175.5	0	0	0	108.8	Y169 I170 V171 Q172 E195 L343 K346 T353 V357	Y169-L355 HydrophobicContact CD1-CD1 4.05Å; I170-L355 PolarHBondContact O-N 2.92Å; V171-L355 CarbonylContact C-O 3.54Å; V171-L355 HydrophobicContact CG2-CD1 4.42Å; Q172-L355 PolarHBondContact N-O 2.77Å; E195-L355 HydrophobicContact CB-CD1 3.63Å; E195-L355 HydrophobicContact CB-CD2 4.34Å; E195-L355 HydrophobicContact CG-CD1 4.09Å; L343-L355 HydrophobicContact CD1-CB 4.36Å; L343-L355 HydrophobicContact CD1-CD2 4.23Å; K346-L355 HydrophobicContact CB-CD2 4.03Å; K346-L355 HydrophobicContact CD-CD2 3.89Å; K346-L355 HydrophobicContact CG-CD2 3.7Å; T353-L355 HydrophobicContact CG2-CD2 4.16Å; T353-L355 HydrophobicContact CG2-CG 4.41Å; L355-V357 HydrophobicContact CB-CG1 4.39Å
356	T	97.9	Very high	91.1	Very high	26 Å²	26	44.5 Å²	44.5	16%	0.16	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	117.4	177.2	-56.8	0	0	0	0	109.4	V174 L344 S345	V174-T356 HydrophobicContact CG1-CG2 3.37Å; L344-T356 HydrophobicContact CB-CG2 4.28Å; L344-T356 WeakPolarHBondContact CB-O 3.22Å; L344-T356 HydrophobicContact CD1-CG2 4.33Å; L344-T356 PolarHBondContact N-O 3.21Å; S345-T356 PolarHBondContact N-O 3.43Å; S345-T356 PolarHBondContact O-N 3.05Å; S345-T356 WeakPolarHBondContact OG-CB 3.36Å; S345-T356 PolarHBondContact OG-OG1 2.93Å; S345-T356 VanDerWaalsContact OG-OG1 3.14Å
357	V	97.2	Very high	88.9	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	142.2	-168.5	-60.1	0	0	0	0	112.6	V171 Q172 V174 L188 V191 Y341 E342 L343 L355 I359	V171-V357 HydrophobicContact CG1-CG1 4.46Å; V171-V357 HydrophobicContact CG1-CG2 3.72Å; Q172-V357 PolarHBondContact O-N 3.43Å; V174-V357 PolarHBondContact N-O 3.38Å; V174-V357 VanDerWaalsContact N-O 3.1Å; L188-V357 HydrophobicContact CD2-CG2 3.62Å; V191-V357 HydrophobicContact CG1-CB 4.33Å; V191-V357 HydrophobicContact CG1-CG1 3.7Å; V191-V357 HydrophobicContact CG1-CG2 4.42Å; Y341-V357 HydrophobicContact CD2-CG1 4.41Å; E342-V357 WeakPolarHBondContact O-CA 3.48Å; L343-V357 HydrophobicContact CD1-CG1 3.7Å; L355-V357 HydrophobicContact CB-CG1 4.39Å; V357-I359 HydrophobicContact CG2-CG2 4.02Å
358	N	95.1	Very high	86.4	Confident	44 Å²	44	44.8 Å²	44.8	24%	0.235	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	113.9	167.8	176.9	9.3	0	0	0	109.4	V174 Y341 E342 L344 G360	V174-N358 HydrophobicContact CG2-CB 3.92Å; Y341-N358 CarbonylContact C-O 3.6Å; Y341-N358 VanDerWaalsContact CA-O 3.24Å; Y341-N358 WeakPolarHBondContact CA-O 3.24Å; Y341-N358 WeakPolarHBondContact CB-O 3.26Å; E342-N358 HydrophobicContact CB-CB 4.26Å; E342-N358 PolarHBondContact N-O 3.03Å; E342-N358 PolarHBondContact O-N 2.79Å; L344-N358 HydrophobicContact CD1-CB 4.05Å; L344-N358 HydrophobicContact CG-CB 4.38Å; N358-G360 PolarHBondContact OD1-N 2.92Å
359	I	94.2	Very high	83.8	Confident	3 Å²	3	47.3 Å²	47.3	2%	0.015	26%	0.26	C	S	.	.			trans	-101.4	11.1	-176.8	62.9	169.6	0	0	0	113.2	Q173 N184 K187 L188 V191 W270 V357	Q173-I359 HydrophobicContact CG-CD1 4.04Å; Q173-I359 HydrophobicContact CG-CG1 4.09Å; N184-I359 HydrophobicContact CB-CD1 3.73Å; K187-I359 HydrophobicContact CD-CB 4.05Å; K187-I359 HydrophobicContact CD-CD1 4.44Å; K187-I359 HydrophobicContact CG-CB 4.41Å; K187-I359 PolarHBondContact NZ-O 2.63Å; L188-I359 HydrophobicContact CD2-CD1 4.19Å; L188-I359 HydrophobicContact CD2-CG2 3.92Å; L188-I359 HydrophobicContact CG-CD1 4.24Å; V191-I359 HydrophobicContact CG2-CG2 4.19Å; W270-I359 HydrophobicContact CH2-CD1 4.02Å; W270-I359 HydrophobicContact CH2-CG1 3.98Å; W270-I359 HydrophobicContact CZ3-CD1 3.91Å; W270-I359 HydrophobicContact CZ3-CG1 4.18Å; V357-I359 HydrophobicContact CG2-CG2 4.02Å
360	G	90.8	Very high	81.1	Confident	34 Å²	34	47.4 Å²	47.4	35%	0.351	27%	0.272	S	S	.	.			trans	80.2	-170.4	-174.6	0	0	0	0	0	113.6	W270 N358	W270-G360 WeakPolarHBondContact CH2-O 3.05Å; N358-G360 PolarHBondContact OD1-N 2.92Å
361	E	87.1	Confident	78.4	Confident	86 Å²	86	52.8 Å²	52.8	40%	0.402	29%	0.292	S	S	.	.			trans	-105.1	158	-178.5	-49.1	-158.4	148.1	0	0	112.3	L176 W270 P363	L176-E361 HydrophobicContact CD1-CB 4.3Å; L176-E361 HydrophobicContact CD1-CG 3.62Å; L176-E361 HydrophobicContact CD2-CG 4.36Å; W270-E361 WeakPolarHBondContact CZ2-O 3.46Å; E361-P363 VanDerWaalsContact O-CD 3.26Å; E361-P363 WeakPolarHBondContact O-CD 3.27Å
362	D	85.3	Confident	75.5	Confident	3 Å²	3	58 Å²	58	2%	0.016	33%	0.329	C	S	.	.			trans	-66.3	116.6	169.7	-178.3	-12.9	0	0	0	110.3	T182 W270 R364 L365	T182-D362 WeakPolarHBondContact OG1-CB 3.39Å; T182-D362 PolarHBondContact OG1-OD2 3.44Å; W270-D362 HydrophobicContact CB-CB 4.18Å; W270-D362 HydrophobicContact CD2-CB 3.98Å; W270-D362 HydrophobicContact CE3-CB 4.15Å; W270-D362 HydrophobicContact CG-CB 4Å; D362-R364 VanDerWaalsContact CG-NE 3.32Å; D362-R364 PolarHBondContact O-N 3.23Å; D362-R364 VanDerWaalsContact OD1-CB 3.27Å; D362-R364 WeakPolarHBondContact OD1-CB 3.5Å; D362-R364 VanDerWaalsContact OD1-CG 3.24Å; D362-R364 WeakPolarHBondContact OD1-CG 3.46Å; D362-R364 IonicContact OD1-CZ 2.67Å; D362-R364 PolarHBondContact OD1-N 2.94Å; D362-R364 IonicContact OD1-NE 3.47Å; D362-R364 PolarHBondContact OD1-NE 3.32Å; D362-R364 IonicContact OD1-NH2 3.93Å; D362-R364 IonicContact OD2-CZ 3.37Å; D362-R364 IonicContact OD2-NE 2.92Å; D362-R364 PolarHBondContact OD2-NE 2.93Å; D362-R364 IonicContact OD2-NH2 3.9Å; D362-R364 PolarHBondContact OD2-NH2 2.94Å; D362-L365 HydrophobicContact CB-CD1 4.16Å; D362-L365 HydrophobicContact CB-CG 4.2Å; D362-L365 PolarHBondContact O-N 2.99Å
363	P	81.4	Confident	72.8	Confident	71 Å²	71	60.3 Å²	60.3	46%	0.461	35%	0.352	S	S	.	.	H	α-helix	trans	-58.6	-15.6	-178.5	-24.2	34.4	0	0	0	114.3	E361 T366 Q367	E361-P363 VanDerWaalsContact O-CD 3.26Å; E361-P363 WeakPolarHBondContact O-CD 3.27Å; P363-T366 PolarHBondContact O-OG1 3.44Å; P363-Q367 WeakPolarHBondContact O-CG 3.24Å; P363-Q367 PolarHBondContact O-N 2.97Å
364	R	71.3	Confident	69.9	Low	70 Å²	70	66.3 Å²	66.3	26%	0.264	39%	0.388	S	S	.	.	H	α-helix	trans	-72.8	-33.7	176.3	-59.4	175.1	-63	-176	4.2	112.5	W270 N317 D362 T366 G368	W270-R364 PolarHBondContact O-NH2 2.88Å; N317-R364 PolarHBondContact OD1-NH1 2.95Å; D362-R364 VanDerWaalsContact CG-NE 3.32Å; D362-R364 PolarHBondContact O-N 3.23Å; D362-R364 VanDerWaalsContact OD1-CB 3.27Å; D362-R364 WeakPolarHBondContact OD1-CB 3.5Å; D362-R364 VanDerWaalsContact OD1-CG 3.24Å; D362-R364 WeakPolarHBondContact OD1-CG 3.46Å; D362-R364 IonicContact OD1-CZ 2.67Å; D362-R364 PolarHBondContact OD1-N 2.94Å; D362-R364 IonicContact OD1-NE 3.47Å; D362-R364 PolarHBondContact OD1-NE 3.32Å; D362-R364 IonicContact OD1-NH2 3.93Å; D362-R364 IonicContact OD2-CZ 3.37Å; D362-R364 IonicContact OD2-NE 2.92Å; D362-R364 PolarHBondContact OD2-NE 2.93Å; D362-R364 IonicContact OD2-NH2 3.9Å; D362-R364 PolarHBondContact OD2-NH2 2.94Å; R364-T366 VanDerWaalsContact C-N 3.31Å; R364-G368 PolarHBondContact O-N 3.15Å
365	L	68.4	Low	66.9	Low	98 Å²	98	75.4 Å²	75.4	51%	0.513	43%	0.427	S	S	.	.	H	α-helix	trans	-74.9	-24.9	-177.6	-63.9	177.7	0	0	0	112	D362	D362-L365 HydrophobicContact CB-CD1 4.16Å; D362-L365 HydrophobicContact CB-CG 4.2Å; D362-L365 PolarHBondContact O-N 2.99Å
366	T	59	Low	63.9	Low	69 Å²	69	79.2 Å²	79.2	42%	0.423	46%	0.458	S	S	.	.	H	α-helix	trans	-80.1	-37	175	55.3	0	0	0	0	112	P363 R364 G368 K369	P363-T366 PolarHBondContact O-OG1 3.44Å; R364-T366 VanDerWaalsContact C-N 3.31Å; T366-G368 PolarHBondContact O-N 3.34Å; T366-K369 PolarHBondContact O-N 3.39Å
367	Q	52.6	Low	60.9	Low	116 Å²	116	83.7 Å²	83.7	54%	0.542	49%	0.486	S	S	.	.	H	α-helix	trans	-66.7	-32.2	175.8	-71.8	-176.8	-2.3	0	0	113.4	P363 K369 A370 H371	P363-Q367 WeakPolarHBondContact O-CG 3.24Å; P363-Q367 PolarHBondContact O-N 2.97Å; Q367-K369 VanDerWaalsContact C-N 3.28Å; Q367-K369 PolarHBondContact O-N 3.48Å; Q367-A370 PolarHBondContact O-N 3.46Å; Q367-H371 PolarHBondContact O-CD2 3.5Å
368	G	45.9	Very low	57.7	Low	49 Å²	49	89.4 Å²	89.4	51%	0.505	52%	0.523	S	S	.	.	H	α-helix	trans	-67.1	-24.7	175.3	0	0	0	0	0	114.3	R364 T366	R364-G368 PolarHBondContact O-N 3.15Å; T366-G368 PolarHBondContact O-N 3.34Å
369	K	45	Very low	54.6	Low	155 Å²	155	93.8 Å²	93.8	67%	0.674	55%	0.551	S	S	*	*	H	α-helix	trans	-81.1	-26.3	176.3	-70.2	-178.4	179.8	176	0	112.8	T366 Q367 H371	T366-K369 PolarHBondContact O-N 3.39Å; Q367-K369 VanDerWaalsContact C-N 3.28Å; Q367-K369 PolarHBondContact O-N 3.48Å; K369-H371 VanDerWaalsContact C-N 3.34Å; K369-H371 PolarHBondContact O-N 3.28Å
370	A	40.3	Very low	51.6	Low	68 Å²	68	102.1 Å²	102.1	56%	0.562	59%	0.59	S	S	*	*	H	α-helix	trans	-72.8	-24.3	-179.7	0	0	0	0	0	113.4	Q367	Q367-A370 PolarHBondContact O-N 3.46Å
371	H	40.8	Very low	49.1	Very low	171 Å²	171	104.7 Å²	104.7	79%	0.792	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-5.3	-179.6	-71.3	-54.9	0	0	0	115.2	Q367 K369	Q367-H371 PolarHBondContact O-CD2 3.5Å; K369-H371 VanDerWaalsContact C-N 3.34Å; K369-H371 PolarHBondContact O-N 3.28Å
372	S	39.2	Very low	46.3	Very low	114 Å²	114	109.1 Å²	109.1	80%	0.797	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	1.2	174.1	-68	0	0	0	0	113.6
373	A	41.3	Very low	43.5	Very low	68 Å²	68	113.6 Å²	113.6	56%	0.562	65%	0.652	S	S	*	*	S	Bend	trans	-101.7	109.9	175	0	0	0	0	0	110.3
374	V	38.4	Very low	40.9	Very low	126 Å²	126	115.9 Å²	115.9	76%	0.764	67%	0.67	S	S	*	*			trans	77.1	98.3	159.3	-166.1	0	0	0	0	116.7	A376	V374-A376 HydrophobicContact CG1-CB 3.69Å
375	K	34.3	Very low	38.8	Very low	212 Å²	212	117 Å²	117	92%	0.922	69%	0.688	S	S	*	*			trans	-111	69.2	140.4	-142.7	179.3	-168.8	-177.9	0	108
376	A	36.3	Very low	37	Very low	80 Å²	80	121.7 Å²	121.7	66%	0.661	71%	0.705	S	S	*	*			trans	-83.3	110.9	161.8	0	0	0	0	0	106.9	V374	V374-A376 HydrophobicContact CG1-CB 3.69Å
377	T	34.3	Very low	35.6	Very low	120 Å²	120	124.7 Å²	124.7	74%	0.736	72%	0.718	S	S	*	*			trans	-64.2	133	176.8	-32.3	0	0	0	0	109.5
378	P	31.8	Very low	34.5	Very low	121 Å²	121	127.8 Å²	127.8	79%	0.786	73%	0.73	S	S	*	*			trans	-79.8	128.2	173.9	9	6	0	0	0	109.7
379	V	28.6	Very low	33.6	Very low	136 Å²	136	129.2 Å²	129.2	82%	0.824	74%	0.744	S	S	*	*			trans	-110	121.4	166.6	179.1	0	0	0	0	108
380	Q	30.7	Very low	32.7	Very low	178 Å²	178	130 Å²	130	83%	0.832	76%	0.755	S	S	*	*			trans	-110.1	157.7	166.8	-88.6	-94.1	-19.9	0	0	109.4
381	P	38.8	Very low	32.2	Very low	87 Å²	87	131 Å²	131	57%	0.565	76%	0.763	S	S	*	*			trans	-105.9	178	-151	39.4	-31.7	0	0	0	115.5
382	H	28.4	Very low	31.7	Very low	180 Å²	180	131.4 Å²	131.4	83%	0.833	76%	0.762	S	S	*	*			trans	99.9	138.6	174.3	-61.3	-68.3	0	0	0	115.3
383	S	26.9	Very low	31.2	Very low	96 Å²	96	133.7 Å²	133.7	67%	0.671	76%	0.761	S	S	*	*			cis	-174.7	144.4	-4.4	49.5	0	0	0	0	110.6
384	S	26.8	Very low	30.6	Very low	119 Å²	119	136.8 Å²	136.8	83%	0.832	77%	0.772	S	S	*	*			trans	64.2	147	156.4	78.1	0	0	0	0	117.9
385	S	27.3	Very low	30.2	Very low	93 Å²	93	139.8 Å²	139.8	65%	0.65	78%	0.775	S	S	*	*			cis	-163.4	159.9	15.5	70.7	0	0	0	0	110.9
386	K	30	Very low	29.9	Very low	198 Å²	198	134 Å²	134	86%	0.861	76%	0.762	S	S	*	*			trans	66.1	146.4	153.8	-68.1	177.5	-177.9	-178.7	0	118
387	D	29.1	Very low	29.4	Very low	131 Å²	131	137 Å²	137	70%	0.701	77%	0.766	S	S	*	*			cis	-175.2	155.4	-13.6	-169.1	9.5	0	0	0	105.5
388	K	29.8	Very low	29.1	Very low	182 Å²	182	139.5 Å²	139.5	79%	0.791	77%	0.769	S	S	*	*			trans	80.4	111.5	160.1	-53.8	-168.8	179.7	176.8	0	123.6
389	G	26.6	Very low	28.8	Very low	79 Å²	79	143 Å²	143	81%	0.814	78%	0.775	S	S	*	*				85.6	137.3	127.6	0	0	0	0	0	117.4
390	L	28	Very low	28.7	Very low	171 Å²	171	140.6 Å²	140.6	90%	0.895	77%	0.769	S	S	*	*			cis	-169.5	134.9	6.9	-175.6	78.9	0	0	0	107.8
391	A	28.5	Very low	28.4	Very low	89 Å²	89	138.8 Å²	138.8	74%	0.736	77%	0.77	S	S	*	*			trans	58.1	137.1	156.1	0	0	0	0	0	119.4
392	K	30.6	Very low	27.9	Very low	179 Å²	179	138.3 Å²	138.3	78%	0.778	77%	0.773	S	S	*	*			cis	-169.6	136.8	33.2	-145.3	174.7	-178	179.4	0	111
393	Q	29.5	Very low	27.9	Very low	162 Å²	162	138.9 Å²	138.9	76%	0.757	77%	0.773	S	S	*	*			trans	40.8	117	148.8	-75	167	-37.1	0	0	120.3
394	V	28.4	Very low	27.8	Very low	133 Å²	133	140.9 Å²	140.9	81%	0.806	78%	0.777	S	S	*	*				72.9	107.2	51	-178.3	0	0	0	0	115.5
395	K	29.1	Very low	28	Very low	190 Å²	190	139.3 Å²	139.3	83%	0.826	77%	0.765	S	S	*	*				154.9	110.7	125.2	-110.2	170.9	174.2	-172.9	0	109.6
396	S	27.7	Very low	28	Very low	91 Å²	91	140.5 Å²	140.5	64%	0.636	77%	0.769	S	S	*	*				67.9	116.7	77.2	106.6	0	0	0	0	115.7
397	L	25.7	Very low	28.1	Very low	143 Å²	143	138.3 Å²	138.3	75%	0.749	77%	0.766	S	S	*	*			trans	52.4	120.3	142.6	-78	100.6	0	0	0	121
398	E	28.5	Very low	28	Very low	172 Å²	172	138.6 Å²	138.6	80%	0.804	77%	0.772	S	S	*	*				43.6	113.1	127.4	-62.4	-177.2	151.8	0	0	118.9
399	E	25.5	Very low	28.1	Very low	194 Å²	194	138.4 Å²	138.4	91%	0.907	77%	0.771	S	S	*	*				-167.8	124.3	126.9	-107.9	171.9	-171.4	0	0	112.5
400	A	26.2	Very low	28.7	Very low	85 Å²	85	140.1 Å²	140.1	70%	0.702	77%	0.768	S	S	*	*			trans	45.5	124	132.3	0	0	0	0	0	123.2
401	V	26	Very low	28.7	Very low	140 Å²	140	136.8 Å²	136.8	85%	0.848	76%	0.759	S	S	*	*				72.3	110.4	124.7	179.8	0	0	0	0	119
402	A	26.3	Very low	28.7	Very low	77 Å²	77	136.3 Å²	136.3	64%	0.636	76%	0.762	S	S	*	*				145.9	135.4	118.9	0	0	0	0	0	114.5
403	K	28.8	Very low	28.8	Very low	193 Å²	193	135.2 Å²	135.2	84%	0.839	76%	0.76	S	S	*	*			trans	71.6	137.4	157	-63.4	166.6	-178	179.8	0	116
404	N	26.3	Very low	28.9	Very low	138 Å²	138	135.3 Å²	135.3	74%	0.738	76%	0.758	S	S	*	*			cis	-168.3	132.6	2.1	-123.6	-1.8	0	0	0	107.5
405	S	29.1	Very low	29	Very low	85 Å²	85	135.8 Å²	135.8	59%	0.594	76%	0.761	S	S	*	*				35.7	134.8	128.2	61.7	0	0	0	0	119.9
406	T	29.3	Very low	28.9	Very low	118 Å²	118	130.3 Å²	130.3	72%	0.724	76%	0.759	S	S	*	*				-165.8	129	68.2	24.7	0	0	0	0	111.7
407	L	31	Very low	29	Very low	153 Å²	153	133.7 Å²	133.7	80%	0.801	77%	0.769	S	S	*	*				72	133.1	110.4	-92.8	104	0	0	0	115.8
408	V	28.1	Very low	29.1	Very low	136 Å²	136	134.4 Å²	134.4	82%	0.824	77%	0.772	S	S	*	*				-157.4	154.9	51.6	172.7	0	0	0	0	112.2
409	K	30.1	Very low	29.2	Very low	178 Å²	178	133.3 Å²	133.3	77%	0.774	77%	0.771	S	S	*	*			trans	-92.6	177.1	-177.1	-128.7	177.6	-169.4	179.6	0	112.4
410	P	39.3	Very low	29.3	Very low	115 Å²	115	129.4 Å²	129.4	75%	0.747	77%	0.765	S	S	*	*				-139.5	136.6	74.6	13.7	12	0	0	0	115
411	S	29.2	Very low	29.4	Very low	102 Å²	102	134.5 Å²	134.5	71%	0.713	77%	0.772	S	S	*	*				61.8	120.5	94.3	69.9	0	0	0	0	114.9
412	G	28.9	Very low	29.6	Very low	78 Å²	78	134.1 Å²	134.1	80%	0.804	77%	0.769	S	S	*	*				93.3	139.4	53.9	0	0	0	0	0	108.7
413	E	31.8	Very low	29.8	Very low	156 Å²	156	134.9 Å²	134.9	73%	0.729	78%	0.776	S	S	*	*			cis	-172	162.4	9.3	-157	179.5	171	0	0	108.3
414	K	31.5	Very low	29.8	Very low	164 Å²	164	132.9 Å²	132.9	71%	0.713	77%	0.774	S	S	*	*			trans	16	149.7	153	-67.2	167	-170.1	153.3	0	120.6
415	T	31	Very low	30	Very low	143 Å²	143	135.7 Å²	135.7	88%	0.877	78%	0.783	S	S	*	*				174.9	159.5	60.8	-24.8	0	0	0	0	109
416	G	26.5	Very low	30	Very low	76 Å²	76	137.3 Å²	137.3	78%	0.784	79%	0.789	S	S	*	*			trans	124.3	108.5	141.7	0	0	0	0	0	118.9
417	L	29.5	Very low	30.1	Very low	161 Å²	161	138 Å²	138	84%	0.843	79%	0.794	S	S	*	*			trans	-77.9	153.9	165.7	-146.7	93.3	0	0	0	110.7
418	I	28.8	Very low	30.2	Very low	159 Å²	159	138.1 Å²	138.1	82%	0.815	79%	0.79	S	S	*	*			trans	167.5	143.5	131.1	-83.8	158.7	0	0	0	112.3
419	L	29.4	Very low	30.3	Very low	148 Å²	148	139.2 Å²	139.2	78%	0.775	79%	0.786	S	S	*	*			trans	-61.4	156.3	178.4	-66	97.2	0	0	0	116.7
420	S	28.2	Very low	30.5	Very low	112 Å²	112	140.5 Å²	140.5	78%	0.783	79%	0.792	S	S	*	*				158.4	121.8	119	52.4	0	0	0	0	110
421	K	29.4	Very low	30.3	Very low	193 Å²	193	139.9 Å²	139.9	84%	0.839	80%	0.796	S	S	*	*				74	121.2	83.2	-118.6	-174.8	-170.4	-176.9	0	115
422	T	29.1	Very low	30.5	Very low	131 Å²	131	138.8 Å²	138.8	80%	0.804	80%	0.801	S	S	*	*			trans	79.6	121	148	-5.3	0	0	0	0	119
423	A	29.7	Very low	30.8	Very low	93 Å²	93	141.2 Å²	141.2	77%	0.769	80%	0.8	S	S	*	*				157.1	133.7	96	0	0	0	0	0	113.1
424	N	29	Very low	31	Very low	152 Å²	152	141.8 Å²	141.8	81%	0.813	81%	0.805	S	S	*	*			trans	-39.4	149.7	160.5	-67.6	-25.6	0	0	0	114.2
425	Q	30.6	Very low	31.5	Very low	197 Å²	197	147 Å²	147	92%	0.921	83%	0.828	S	S	*	*				-159.6	134.2	121	-113.5	169.9	14.5	0	0	114.3
426	T	29.9	Very low	31.5	Very low	118 Å²	118	147.3 Å²	147.3	72%	0.724	83%	0.825	S	S	*	*			trans	-75.9	146.1	172.2	-30	0	0	0	0	111.2
427	T	32.3	Very low	31.7	Very low	134 Å²	134	151 Å²	151	82%	0.822	83%	0.827	S	S	*	*			trans	-175.7	104	147.6	7.6	0	0	0	0	106.4
428	Q	31.1	Very low	31.9	Very low	154 Å²	154	150.4 Å²	150.4	72%	0.72	83%	0.827	S	S	*	*				74	113.5	65.3	-153.9	177.5	2.5	0	0	114.3
429	E	31.4	Very low	32	Very low	159 Å²	159	149.9 Å²	149.9	74%	0.743	83%	0.827	S	S	*	*			trans	51.4	124.9	151.4	-71.7	175	124.8	0	0	121.6
430	K	33.1	Very low	32.2	Very low	206 Å²	206	150.1 Å²	150.1	90%	0.896	83%	0.831	S	S	*	*				-165.1	135.3	101.3	-107.2	174.5	-177.2	177.8	0	113.9
431	A	36	Very low	32.5	Very low	101 Å²	101	152.6 Å²	152.6	84%	0.835	83%	0.834	S	S	*	*			trans	-63	152.7	163.4	0	0	0	0	0	112.2
432	G	34.1	Very low	32.7	Very low	79 Å²	79	149.7 Å²	149.7	81%	0.814	83%	0.833	S	S	*	*			trans	-158.1	103.5	170.9	0	0	0	0	0	110.2
433	V	34.6	Very low	33	Very low	130 Å²	130	151.2 Å²	151.2	79%	0.788	84%	0.836	S	S	*	*			trans	-80.8	159.4	178.4	159.5	0	0	0	0	111.1
434	M	36.2	Very low	33.3	Very low	168 Å²	168	156 Å²	156	83%	0.828	84%	0.841	S	S	*	*			trans	79.7	106.9	163.2	-83.5	166.4	85.6	0	0	118.7
435	K	40.8	Very low	33.6	Very low	274 Å²	274	156.4 Å²	156.4	100%	1.191	84%	0.844	S	S	*	*				-159.3	0	83.1	-103.7	-177.1	179.4	178.2	0	111.2

Retrieved 435 of 435 residues in 563.7 ms (Link to these results)

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