A0A076FT89_COTJA Loading...

Follistatin

AlphaFold DB , UniProt , Accession A0A076FT89, Species COTJA (Coturnix japonica, Japanese quail), Gene FST, Length 343 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	40.2	Very low	53.5	Low	243 Å²	243	145.3 Å²	145.3	100%	1.197	74%	0.736	S	S	*	*				0	99.8	0	-67.4	-174.4	175.2	0	0	107.4	N3	M1-N3 PolarHBondContact O-N 3.15Å
2	L	38	Very low	54.7	Low	165 Å²	165	140 Å²	140	86%	0.864	72%	0.716	S	S	*	*			trans	-80.9	108.2	-173.4	-148	80.4	0	0	0	108.8	Q4	L2-Q4 PolarHBondContact O-N 3.07Å
3	N	44.1	Very low	55.7	Low	154 Å²	154	137.9 Å²	137.9	82%	0.824	71%	0.706	S	S	*	*			trans	-80.5	95.5	179.7	-163	14.2	0	0	0	108.6	M1 R5	M1-N3 PolarHBondContact O-N 3.15Å; N3-R5 PolarHBondContact O-N 3.36Å
4	Q	51.6	Low	56.4	Low	163 Å²	163	135.8 Å²	135.8	76%	0.762	70%	0.696	S	S	*	*			trans	-76.8	109.8	176.7	-79.6	-174	-18.3	0	0	109.9	L2 I6	L2-Q4 PolarHBondContact O-N 3.07Å; Q4-I6 PolarHBondContact O-N 3.14Å
5	R	56.1	Low	57.3	Low	236 Å²	236	134.9 Å²	134.9	89%	0.891	69%	0.69	S	S	*	*			trans	-65.3	111.1	168.3	-78.8	179.7	174.4	178.3	-2.1	109.2	N3 H7	N3-R5 PolarHBondContact O-N 3.36Å; R5-H7 PolarHBondContact O-N 3.08Å
6	I	55.7	Low	57.6	Low	128 Å²	128	135.8 Å²	135.8	66%	0.656	69%	0.688	S	S	*	*			trans	-70.5	116.7	168.4	-58.3	172.6	0	0	0	107.4	Q4 L11	Q4-I6 PolarHBondContact O-N 3.14Å; I6-L11 HydrophobicContact CG2-CD1 3.71Å; I6-L11 HydrophobicContact CG2-CG 4.45Å
7	H	55.2	Low	57.7	Low	144 Å²	144	132.9 Å²	132.9	67%	0.667	67%	0.674	S	S	*	*			trans	-71.5	132	178.3	-109.8	-69.3	0	0	0	110.1	R5 G9 M10	R5-H7 PolarHBondContact O-N 3.08Å; H7-G9 PolarHBondContact O-N 3.47Å; H7-G9 VanDerWaalsContact O-N 3.1Å; H7-M10 WeakPolarHBondContact O-CB 3.04Å; H7-M10 PolarHBondContact O-N 3.07Å
8	P	58.9	Low	57.8	Low	95 Å²	95	134 Å²	134	62%	0.617	67%	0.67	S	S	*	*	H	α-helix	trans	-60.1	-25.8	-177.8	19.7	-30.4	0	0	0	113.6	M10 L11 V12	P8-M10 VanDerWaalsContact C-N 3.35Å; P8-M10 PolarHBondContact O-N 2.72Å; P8-L11 PolarHBondContact O-N 3.46Å; P8-V12 WeakPolarHBondContact O-CG2 3.25Å; P8-V12 PolarHBondContact O-N 3.07Å
9	G	61.2	Low	57.7	Low	48 Å²	48	133.5 Å²	133.5	50%	0.495	67%	0.665	S	S	.	*	H	α-helix	trans	-68.3	-27.5	174.3	0	0	0	0	0	114.6	H7 L13	H7-G9 PolarHBondContact O-N 3.47Å; H7-G9 VanDerWaalsContact O-N 3.1Å; G9-L13 WeakPolarHBondContact O-CB 3.35Å; G9-L13 PolarHBondContact O-N 3.25Å; G9-L13 VanDerWaalsContact O-N 3.11Å
10	M	64.1	Low	57.3	Low	126 Å²	126	134.1 Å²	134.1	62%	0.621	66%	0.664	S	S	*	*	H	α-helix	trans	-75.8	-32.9	178.9	-164.6	-171.7	-84.9	0	0	111.4	H7 P8 L14	H7-M10 WeakPolarHBondContact O-CB 3.04Å; H7-M10 PolarHBondContact O-N 3.07Å; P8-M10 VanDerWaalsContact C-N 3.35Å; P8-M10 PolarHBondContact O-N 2.72Å; M10-L14 HydrophobicContact CG-CD1 4.48Å; M10-L14 WeakPolarHBondContact O-CB 3.35Å; M10-L14 WeakPolarHBondContact O-CG 3.42Å; M10-L14 PolarHBondContact O-N 2.89Å
11	L	63.9	Low	57	Low	96 Å²	96	135 Å²	135	50%	0.503	67%	0.668	S	S	.	*	H	α-helix	trans	-68.2	-39.1	172.6	-101	145	0	0	0	112.1	I6 P8 L14 M15	I6-L11 HydrophobicContact CG2-CD1 3.71Å; I6-L11 HydrophobicContact CG2-CG 4.45Å; P8-L11 PolarHBondContact O-N 3.46Å; L11-L14 PolarHBondContact O-N 2.62Å; L11-M15 WeakPolarHBondContact O-CB 2.99Å; L11-M15 WeakPolarHBondContact O-CG 3.4Å; L11-M15 PolarHBondContact O-N 3.21Å
12	V	67.4	Low	57.3	Low	82 Å²	82	128.2 Å²	128.2	50%	0.497	63%	0.633	S	S	.	*	H	α-helix	trans	-68.8	-38.4	176.1	176.1	0	0	0	0	111.3	P8 M15 F16	P8-V12 WeakPolarHBondContact O-CG2 3.25Å; P8-V12 PolarHBondContact O-N 3.07Å; V12-M15 PolarHBondContact O-N 2.94Å; V12-F16 HydrophobicContact CG1-CD2 3.87Å; V12-F16 HydrophobicContact CG1-CE2 4.21Å; V12-F16 WeakPolarHBondContact O-CB 3.47Å; V12-F16 PolarHBondContact O-N 3.32Å
13	L	67.6	Low	57.5	Low	113 Å²	113	127 Å²	127	59%	0.592	63%	0.628	S	S	*	*	H	α-helix	trans	-68.8	-37.3	176.4	-130.2	146.2	0	0	0	112.1	G9 L17	G9-L13 WeakPolarHBondContact O-CB 3.35Å; G9-L13 PolarHBondContact O-N 3.25Å; G9-L13 VanDerWaalsContact O-N 3.11Å; L13-L17 HydrophobicContact CD2-CD1 3.9Å; L13-L17 HydrophobicContact CD2-CG 4.37Å; L13-L17 VanDerWaalsContact O-CB 3.3Å; L13-L17 WeakPolarHBondContact O-CB 3.4Å; L13-L17 VanDerWaalsContact O-CG 3.23Å; L13-L17 WeakPolarHBondContact O-CG 3.42Å; L13-L17 PolarHBondContact O-N 2.03Å
14	L	66.1	Low	57.4	Low	108 Å²	108	126.9 Å²	126.9	57%	0.565	62%	0.622	S	S	*	*	H	α-helix	trans	-68.2	-38.7	171.9	-83.6	161.6	0	0	0	112.5	M10 L11 L17 Y18	M10-L14 HydrophobicContact CG-CD1 4.48Å; M10-L14 WeakPolarHBondContact O-CB 3.35Å; M10-L14 WeakPolarHBondContact O-CG 3.42Å; M10-L14 PolarHBondContact O-N 2.89Å; L11-L14 PolarHBondContact O-N 2.62Å; L14-L17 PolarHBondContact O-N 3.44Å; L14-Y18 WeakPolarHBondContact O-CB 3.37Å; L14-Y18 PolarHBondContact O-N 3.29Å
15	M	68.7	Low	57.2	Low	123 Å²	123	124.7 Å²	124.7	61%	0.606	62%	0.62	S	S	*	*	H	α-helix	trans	-67.7	-39.8	173.5	-72.8	-86.8	-136.6	0	0	111.9	L11 V12 Y18 H19	L11-M15 WeakPolarHBondContact O-CB 2.99Å; L11-M15 WeakPolarHBondContact O-CG 3.4Å; L11-M15 PolarHBondContact O-N 3.21Å; V12-M15 PolarHBondContact O-N 2.94Å; M15-Y18 PolarHBondContact O-N 3.3Å; M15-H19 WeakPolarHBondContact O-CB 3.43Å; M15-H19 PolarHBondContact O-N 3.27Å
16	F	63.2	Low	57.2	Low	148 Å²	148	117.1 Å²	117.1	65%	0.649	61%	0.608	S	S	*	*	H	α-helix	trans	-65.7	-41.5	173	-102.9	-87.2	0	0	0	111.5	V12 Y18 F20	V12-F16 HydrophobicContact CG1-CD2 3.87Å; V12-F16 HydrophobicContact CG1-CE2 4.21Å; V12-F16 WeakPolarHBondContact O-CB 3.47Å; V12-F16 PolarHBondContact O-N 3.32Å; F16-Y18 VanDerWaalsContact C-N 3.35Å; F16-F20 WeakPolarHBondContact O-CB 3.29Å; F16-F20 PolarHBondContact O-N 2.99Å
17	L	59.6	Low	57.4	Low	87 Å²	87	116.3 Å²	116.3	46%	0.455	60%	0.604	S	S	.	*	H	α-helix	trans	-68	-34	173.8	-75.3	166.6	0	0	0	111.9	L13 L14 F20 M21	L13-L17 HydrophobicContact CD2-CD1 3.9Å; L13-L17 HydrophobicContact CD2-CG 4.37Å; L13-L17 VanDerWaalsContact O-CB 3.3Å; L13-L17 WeakPolarHBondContact O-CB 3.4Å; L13-L17 VanDerWaalsContact O-CG 3.23Å; L13-L17 WeakPolarHBondContact O-CG 3.42Å; L13-L17 PolarHBondContact O-N 2.03Å; L14-L17 PolarHBondContact O-N 3.44Å; L17-F20 PolarHBondContact O-N 2.99Å; L17-M21 VanDerWaalsContact O-CB 3.24Å; L17-M21 WeakPolarHBondContact O-CB 3.42Å; L17-M21 WeakPolarHBondContact O-CG 3.43Å; L17-M21 PolarHBondContact O-N 2.96Å
18	Y	58.9	Low	58.6	Low	153 Å²	153	111 Å²	111	60%	0.6	59%	0.585	S	S	*	*	H	α-helix	trans	-67.7	-45.8	175	-162.7	-94	0	0	0	111.3	L14 M15 F16 M21 E22	L14-Y18 WeakPolarHBondContact O-CB 3.37Å; L14-Y18 PolarHBondContact O-N 3.29Å; M15-Y18 PolarHBondContact O-N 3.3Å; F16-Y18 VanDerWaalsContact C-N 3.35Å; Y18-M21 PolarHBondContact O-N 3.21Å; Y18-E22 HydrophobicContact CE1-CG 4.46Å; Y18-E22 PolarHBondContact O-N 3.3Å
19	H	55.6	Low	60.1	Low	124 Å²	124	106.5 Å²	106.5	57%	0.574	56%	0.556	S	S	*	*	H	α-helix	trans	-67.5	-35.7	172.3	-83.6	1.4	0	0	0	113.2	M15 M21 E22 D23	M15-H19 WeakPolarHBondContact O-CB 3.43Å; M15-H19 PolarHBondContact O-N 3.27Å; H19-M21 VanDerWaalsContact C-N 3.29Å; H19-M21 PolarHBondContact O-N 2.99Å; H19-E22 IonicContact CE1-OE2 3.78Å; H19-E22 IonicContact ND1-OE2 3.12Å; H19-E22 PolarHBondContact ND1-OE2 3Å; H19-E22 VanDerWaalsContact ND1-OE2 3.12Å; H19-E22 PolarHBondContact O-N 2.86Å; H19-D23 PolarHBondContact O-N 3.49Å
20	F	49.8	Very low	61.6	Low	146 Å²	146	104.3 Å²	104.3	64%	0.64	53%	0.533	S	S	*	.	H	α-helix	trans	-72.1	-24.2	176	-156.2	-91.8	0	0	0	112.3	F16 L17	F16-F20 WeakPolarHBondContact O-CB 3.29Å; F16-F20 PolarHBondContact O-N 2.99Å; L17-F20 PolarHBondContact O-N 2.99Å
21	M	50.7	Low	63.1	Low	153 Å²	153	98.4 Å²	98.4	75%	0.754	50%	0.504	S	S	*	.	H	α-helix	trans	-85.1	-21.9	171	-74	-173.2	70.4	0	0	113.3	L17 Y18 H19	L17-M21 VanDerWaalsContact O-CB 3.24Å; L17-M21 WeakPolarHBondContact O-CB 3.42Å; L17-M21 WeakPolarHBondContact O-CG 3.43Å; L17-M21 PolarHBondContact O-N 2.96Å; Y18-M21 PolarHBondContact O-N 3.21Å; H19-M21 VanDerWaalsContact C-N 3.29Å; H19-M21 PolarHBondContact O-N 2.99Å
22	E	46.8	Very low	64.6	Low	100 Å²	100	93.9 Å²	93.9	47%	0.467	48%	0.48	S	S	.	.	H	α-helix	trans	-74.3	-25.4	172.8	-87.5	175.9	141.5	0	0	113.3	Y18 H19 H24	Y18-E22 HydrophobicContact CE1-CG 4.46Å; Y18-E22 PolarHBondContact O-N 3.3Å; H19-E22 IonicContact CE1-OE2 3.78Å; H19-E22 IonicContact ND1-OE2 3.12Å; H19-E22 PolarHBondContact ND1-OE2 3Å; H19-E22 VanDerWaalsContact ND1-OE2 3.12Å; H19-E22 PolarHBondContact O-N 2.86Å; E22-H24 PolarHBondContact O-N 3.25Å
23	D	41.4	Very low	65.9	Low	140 Å²	140	92.1 Å²	92.1	75%	0.749	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	5	-175.7	-101.2	-16.1	0	0	0	115.6	H19	H19-D23 PolarHBondContact O-N 3.49Å
24	H	43.1	Very low	67.2	Low	152 Å²	152	92.8 Å²	92.8	70%	0.704	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.9	48.7	171.9	-70.7	-33.4	0	0	0	111.9	E22 A26	E22-H24 PolarHBondContact O-N 3.25Å; H24-A26 VanDerWaalsContact C-N 3.29Å; H24-A26 PolarHBondContact O-N 3.07Å
25	T	48	Very low	68.6	Low	116 Å²	116	90.2 Å²	90.2	71%	0.712	45%	0.447	S	S	*	.			trans	-68.1	99.2	150.4	49.2	0	0	0	0	106.7	L27	T25-L27 PolarHBondContact O-N 2.95Å
26	A	54.6	Low	69.7	Low	77 Å²	77	85.3 Å²	85.3	64%	0.636	43%	0.426	S	S	*	.			trans	-54.8	117.2	168.3	0	0	0	0	0	106.6	H24 A28	H24-A26 VanDerWaalsContact C-N 3.29Å; H24-A26 PolarHBondContact O-N 3.07Å; A26-A28 PolarHBondContact O-N 3.42Å
27	L	61.4	Low	71	Confident	111 Å²	111	91 Å²	91	58%	0.581	44%	0.444	S	S	*	.			trans	-60.3	93.5	172.4	-74.4	161.7	0	0	0	106.9	T25	T25-L27 PolarHBondContact O-N 2.95Å
28	A	78.9	Confident	72.6	Confident	33 Å²	33	91.2 Å²	91.2	27%	0.273	45%	0.445	S	S	.	.			trans	-74.3	135.6	175.8	0	0	0	0	0	107.1	A26 D68	A26-A28 PolarHBondContact O-N 3.42Å; A28-D68 WeakPolarHBondContact CA-OD2 3.37Å; A28-D68 WeakPolarHBondContact CB-OD2 3.11Å
29	G	90.6	Very high	74.2	Confident	0 Å²	0	85.3 Å²	85.3	0%	0	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	-174.5	-176.3	0	0	0	0	0	110.7	D48 L49 T65 D68	G29-D48 PolarHBondContact O-N 3.46Å; G29-L49 CarbonylContact C-O 3.57Å; G29-L49 PolarHBondContact N-O 3.26Å; G29-L49 PolarHBondContact O-N 3.26Å; G29-T65 CarbonylContact C-O 3.52Å; G29-T65 VanDerWaalsContact CA-O 3.29Å; G29-T65 WeakPolarHBondContact CA-O 3.16Å; G29-D68 VanDerWaalsContact C-OD1 3.27Å; G29-D68 WeakPolarHBondContact CA-OD1 3.05Å; G29-D68 PolarHBondContact N-OD1 3.01Å
30	N	93.3	Very high	76.1	Confident	3 Å²	3	83.1 Å²	83.1	2%	0.016	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	133.3	-175.2	-69.6	-74.7	0	0	0	111.8	W32 L44 T47 W64 T65 E67 D68	N30-W32 HydrophobicContact CB-CZ2 3.9Å; N30-W32 PolarHBondContact O-NE1 2.84Å; N30-W32 VanDerWaalsContact O-NE1 3.15Å; N30-L44 HydrophobicContact CB-CD1 3.91Å; N30-T47 VanDerWaalsContact OD1-CG2 3.26Å; N30-T47 WeakPolarHBondContact OD1-CG2 3.46Å; N30-W64 CarbonylContact O-C 3.53Å; N30-W64 WeakPolarHBondContact O-CA 3.36Å; N30-T65 WeakPolarHBondContact CB-OG1 3.42Å; N30-T65 PolarHBondContact N-O 3.38Å; N30-T65 PolarHBondContact O-N 2.04Å; N30-E67 PolarHBondContact ND2-O 3.23Å; N30-D68 PolarHBondContact ND2-OD1 3.35Å
31	C	95.1	Very high	78.3	Confident	1 Å²	1	76.1 Å²	76.1	1%	0.007	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	133.6	178	-165.5	0	0	0	0	111.2	Y45 K46 L49 C54	C31-Y45 WeakPolarHBondContact O-CB 3.44Å; C31-Y45 PolarHBondContact O-N 2.92Å; C31-K46 HydrophobicContact CB-CB 4.45Å; C31-K46 PolarHBondContact N-O 3.36Å; C31-K46 PolarHBondContact O-N 3.37Å; C31-L49 HydrophobicContact CB-CD1 3.94Å; C31-C54 WeakPolarHBondContact CA-SG 3.29Å; C31-C54 HydrophobicContact CB-CB 3.65Å; C31-C54 WeakPolarHBondContact CB-SG 3.41Å; C31-C54 VanDerWaalsContact SG-CA 3.51Å; C31-C54 WeakPolarHBondContact SG-CB 3.44Å; C31-C54 CovalentContact SG-SG 2.04Å; C31-C54 PolarHBondContact SG-SG 3.34Å
32	W	95.8	Very high	80.4	Confident	1 Å²	1	70.7 Å²	70.7	0%	0.004	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	143.8	-169.2	-53.7	87.3	0	0	0	111.3	N30 R34 C41 L44 T62 S63 T65 L74 M78 A84	N30-W32 HydrophobicContact CB-CZ2 3.9Å; N30-W32 PolarHBondContact O-NE1 2.84Å; N30-W32 VanDerWaalsContact O-NE1 3.15Å; W32-R34 PolarHBondContact O-N 2.77Å; W32-C41 HydrophobicContact CB-CB 3.95Å; W32-C41 HydrophobicContact CD2-CB 3.61Å; W32-C41 HydrophobicContact CE3-CB 4.23Å; W32-C41 HydrophobicContact CG-CB 3.45Å; W32-C41 VanDerWaalsContact CG-CB 3.45Å; W32-L44 HydrophobicContact CD2-CD1 4.3Å; W32-L44 HydrophobicContact CE3-CB 4.04Å; W32-L44 HydrophobicContact CE3-CD1 4.28Å; W32-L44 HydrophobicContact CH2-CB 4.42Å; W32-L44 HydrophobicContact CH2-CD1 4.12Å; W32-L44 HydrophobicContact CZ2-CD1 4.12Å; W32-L44 HydrophobicContact CZ3-CB 3.82Å; W32-L44 HydrophobicContact CZ3-CD1 4.19Å; W32-T62 WeakPolarHBondContact O-CA 3.44Å; W32-S63 WeakPolarHBondContact CB-O 3.28Å; W32-S63 PolarHBondContact N-O 3.21Å; W32-S63 PolarHBondContact O-N 2.93Å; W32-T65 PolarHBondContact NE1-OG1 3.36Å; W32-L74 HydrophobicContact CH2-CD2 3.85Å; W32-L74 HydrophobicContact CZ2-CD2 4.02Å; W32-M78 HydrophobicContact CE3-SD 4.46Å; W32-M78 HydrophobicContact CH2-SD 4.27Å; W32-M78 HydrophobicContact CZ3-CG 4.29Å; W32-M78 HydrophobicContact CZ3-SD 3.59Å; W32-M78 VanDerWaalsContact CZ3-SD 3.59Å; W32-A84 HydrophobicContact CH2-CB 3.58Å; W32-A84 HydrophobicContact CZ2-CB 3.3Å; W32-A84 HydrophobicContact CZ3-CB 4.34Å
33	L	95.3	Very high	82.7	Confident	46 Å²	46	68.9 Å²	68.9	24%	0.241	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-23.7	-178.5	-64.3	-173.9	0	0	0	113.4	Q42 V43 Y45 R59 T61	L33-Q42 PolarHBondContact N-O 2.87Å; L33-V43 HydrophobicContact CB-CB 4.07Å; L33-V43 HydrophobicContact CB-CG1 4.18Å; L33-V43 HydrophobicContact CD1-CB 4.43Å; L33-V43 HydrophobicContact CD1-CG1 3.62Å; L33-V43 HydrophobicContact CG-CB 4.43Å; L33-V43 HydrophobicContact CG-CG1 4.05Å; L33-V43 PolarHBondContact N-O 3.36Å; L33-Y45 HydrophobicContact CD2-CD2 3.71Å; L33-Y45 HydrophobicContact CD2-CG 3.72Å; L33-R59 VanDerWaalsContact CD2-NH1 3.33Å; L33-R59 PolarHBondContact O-NH1 2.92Å; L33-T61 CarbonylContact O-C 3.58Å; L33-T61 WeakPolarHBondContact O-CB 3.47Å; L33-T61 PolarHBondContact O-OG1 2.99Å
34	R	94.4	Very high	85.1	Confident	127 Å²	127	65.6 Å²	65.6	48%	0.479	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	148.3	-179.3	69.2	-175.7	-169	-171	-0.1	114	W32 Q42 V43 T61	W32-R34 PolarHBondContact O-N 2.77Å; R34-Q42 HydrophobicContact CG-CB 4.09Å; R34-Q42 PolarHBondContact N-O 2.94Å; R34-Q42 PolarHBondContact O-N 3.41Å; R34-V43 HydrophobicContact CG-CG2 4.45Å; R34-T61 VanDerWaalsContact CA-O 3.25Å; R34-T61 WeakPolarHBondContact CA-O 3.41Å
35	Q	94.5	Very high	87.5	Confident	53 Å²	53	64.8 Å²	64.8	25%	0.248	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	123.7	158.8	-172.6	178.7	63.4	0	0	109.9	G39 R40 C87	Q35-G39 WeakPolarHBondContact CG-O 3.29Å; Q35-G39 PolarHBondContact NE2-O 2.79Å; Q35-R40 CarbonylContact C-O 3.45Å; Q35-R40 WeakPolarHBondContact CA-O 3.46Å; Q35-C87 PolarHBondContact NE2-O 3.3Å
36	A	92.9	Very high	89.6	Confident	20 Å²	20	64.4 Å²	64.4	17%	0.165	32%	0.317	C	S	.	.			trans	-73.6	171.1	176.6	0	0	0	0	0	112.3	N38 G39 R40 Q42	A36-N38 VanDerWaalsContact CB-OD1 3.23Å; A36-N38 WeakPolarHBondContact CB-OD1 3.3Å; A36-N38 PolarHBondContact O-N 3.41Å; A36-G39 PolarHBondContact O-N 3.13Å; A36-R40 PolarHBondContact N-O 3.11Å; A36-Q42 VanDerWaalsContact CB-CD 3.48Å; A36-Q42 HydrophobicContact CB-CG 3.96Å
37	R	90.6	Very high	91.3	Very high	269 Å²	269	63.5 Å²	63.5	100%	1.015	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-28.6	-178.3	-68.1	-175.7	-179.4	176.3	1.4	113.1	G39	R37-G39 PolarHBondContact O-N 3.36Å
38	N	92.4	Very high	92.6	Very high	91 Å²	91	63.5 Å²	63.5	49%	0.487	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	3.3	174.6	64.4	-2.7	0	0	0	113.4	A36 R40 G82	A36-N38 VanDerWaalsContact CB-OD1 3.23Å; A36-N38 WeakPolarHBondContact CB-OD1 3.3Å; A36-N38 PolarHBondContact O-N 3.41Å; N38-R40 VanDerWaalsContact C-N 3.28Å; N38-R40 PolarHBondContact O-N 2.95Å; N38-R40 WeakPolarHBondContact OD1-CB 3.41Å; N38-R40 PolarHBondContact OD1-N 2.83Å; N38-G82 PolarHBondContact ND2-O 3.13Å; N38-G82 VanDerWaalsContact ND2-O 3.11Å
39	G	92.4	Very high	93.1	Very high	29 Å²	29	63.4 Å²	63.4	30%	0.299	30%	0.299	S	S	.	.	S	Bend	trans	81.2	-0.8	-179.6	0	0	0	0	0	114.7	Q35 A36 R37 C87	Q35-G39 WeakPolarHBondContact CG-O 3.29Å; Q35-G39 PolarHBondContact NE2-O 2.79Å; A36-G39 PolarHBondContact O-N 3.13Å; R37-G39 PolarHBondContact O-N 3.36Å; G39-C87 VanDerWaalsContact O-CB 3.27Å; G39-C87 WeakPolarHBondContact O-CB 3.38Å
40	R	95.8	Very high	93.2	Very high	77 Å²	77	64.5 Å²	64.5	29%	0.291	31%	0.307	S	S	.	.			trans	-89	152.9	-179.5	-67.3	178.2	172.6	-116	5	112.4	Q35 A36 N38 N81 G83 A84	Q35-R40 CarbonylContact C-O 3.45Å; Q35-R40 WeakPolarHBondContact CA-O 3.46Å; A36-R40 PolarHBondContact N-O 3.11Å; N38-R40 VanDerWaalsContact C-N 3.28Å; N38-R40 PolarHBondContact O-N 2.95Å; N38-R40 WeakPolarHBondContact OD1-CB 3.41Å; N38-R40 PolarHBondContact OD1-N 2.83Å; R40-N81 WeakPolarHBondContact CD-O 3.46Å; R40-N81 VanDerWaalsContact CZ-O 3.29Å; R40-N81 PolarHBondContact NE-O 3.19Å; R40-N81 VanDerWaalsContact NH1-CB 3.3Å; R40-N81 PolarHBondContact NH1-O 3.49Å; R40-G83 WeakPolarHBondContact CD-O 3.44Å; R40-G83 PolarHBondContact NH1-O 2.81Å; R40-A84 WeakPolarHBondContact CA-O 3.44Å; R40-A84 VanDerWaalsContact CB-O 3.31Å; R40-A84 WeakPolarHBondContact CB-O 3.33Å
41	C	96.3	Very high	93.2	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	136.8	179.4	-92.1	0	0	0	0	110.3	W32 S63 T65 G83 A84 C87	W32-C41 HydrophobicContact CB-CB 3.95Å; W32-C41 HydrophobicContact CD2-CB 3.61Å; W32-C41 HydrophobicContact CE3-CB 4.23Å; W32-C41 HydrophobicContact CG-CB 3.45Å; W32-C41 VanDerWaalsContact CG-CB 3.45Å; C41-S63 WeakPolarHBondContact SG-CB 3.46Å; C41-T65 HydrophobicContact CB-CG2 4.04Å; C41-G83 CarbonylContact O-C 3.48Å; C41-G83 WeakPolarHBondContact O-CA 3.39Å; C41-A84 HydrophobicContact CB-CB 4.02Å; C41-A84 PolarHBondContact N-O 3.44Å; C41-A84 PolarHBondContact O-N 3.29Å; C41-C87 WeakPolarHBondContact CA-SG 3.17Å; C41-C87 HydrophobicContact CB-CB 3.63Å; C41-C87 WeakPolarHBondContact CB-SG 3.44Å; C41-C87 PolarHBondContact N-SG 2.81Å; C41-C87 VanDerWaalsContact SG-CA 3.56Å; C41-C87 WeakPolarHBondContact SG-CB 3.06Å; C41-C87 CovalentContact SG-SG 2.03Å; C41-C87 PolarHBondContact SG-SG 3.03Å
42	Q	95	Very high	93.1	Very high	38 Å²	38	76.7 Å²	76.7	18%	0.178	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	155	-178.4	-69	-172.6	-13.1	0	0	111.3	L33 R34 A36 M78 G82	L33-Q42 PolarHBondContact N-O 2.87Å; R34-Q42 HydrophobicContact CG-CB 4.09Å; R34-Q42 PolarHBondContact N-O 2.94Å; R34-Q42 PolarHBondContact O-N 3.41Å; A36-Q42 VanDerWaalsContact CB-CD 3.48Å; A36-Q42 HydrophobicContact CB-CG 3.96Å; Q42-M78 HydrophobicContact CB-CE 4.35Å; Q42-G82 PolarHBondContact NE2-O 2.93Å
43	V	94.3	Very high	93	Very high	62 Å²	62	82 Å²	82	38%	0.376	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	63.2	81.3	180	-166.7	0	0	0	0	110	L33 R34 Y45	L33-V43 HydrophobicContact CB-CB 4.07Å; L33-V43 HydrophobicContact CB-CG1 4.18Å; L33-V43 HydrophobicContact CD1-CB 4.43Å; L33-V43 HydrophobicContact CD1-CG1 3.62Å; L33-V43 HydrophobicContact CG-CB 4.43Å; L33-V43 HydrophobicContact CG-CG1 4.05Å; L33-V43 PolarHBondContact N-O 3.36Å; R34-V43 HydrophobicContact CG-CG2 4.45Å; V43-Y45 PolarHBondContact O-N 2.85Å
44	L	93	Very high	93	Very high	71 Å²	71	80.1 Å²	80.1	37%	0.372	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	128.9	176.1	-176	66.9	0	0	0	109.1	N30 W32 T47 L74	N30-L44 HydrophobicContact CB-CD1 3.91Å; W32-L44 HydrophobicContact CD2-CD1 4.3Å; W32-L44 HydrophobicContact CE3-CB 4.04Å; W32-L44 HydrophobicContact CE3-CD1 4.28Å; W32-L44 HydrophobicContact CH2-CB 4.42Å; W32-L44 HydrophobicContact CH2-CD1 4.12Å; W32-L44 HydrophobicContact CZ2-CD1 4.12Å; W32-L44 HydrophobicContact CZ3-CB 3.82Å; W32-L44 HydrophobicContact CZ3-CD1 4.19Å; L44-T47 HydrophobicContact CD1-CG2 4.35Å; L44-T47 HydrophobicContact CD2-CG2 3.96Å; L44-L74 HydrophobicContact CD2-CD1 4.09Å
45	Y	92.4	Very high	93	Very high	135 Å²	135	75 Å²	75	53%	0.529	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	-50	178.8	176.5	-122.9	0	0	0	111	C31 L33 V43	C31-Y45 WeakPolarHBondContact O-CB 3.44Å; C31-Y45 PolarHBondContact O-N 2.92Å; L33-Y45 HydrophobicContact CD2-CD2 3.71Å; L33-Y45 HydrophobicContact CD2-CG 3.72Å; V43-Y45 PolarHBondContact O-N 2.85Å
46	K	91.8	Very high	92.9	Very high	108 Å²	108	81.4 Å²	81.4	47%	0.47	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	146.3	-178.6	-74.3	-171.5	175.2	-172.4	0	110.1	C31 L49	C31-K46 HydrophobicContact CB-CB 4.45Å; C31-K46 PolarHBondContact N-O 3.36Å; C31-K46 PolarHBondContact O-N 3.37Å; K46-L49 HydrophobicContact CB-CD1 3.47Å; K46-L49 VanDerWaalsContact CB-CD1 3.47Å; K46-L49 HydrophobicContact CB-CG 4.19Å; K46-L49 HydrophobicContact CD-CD1 3.84Å; K46-L49 HydrophobicContact CG-CD1 4.27Å
47	T	90.7	Very high	92.9	Very high	59 Å²	59	83 Å²	83	36%	0.362	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	173.2	171.3	61.9	0	0	0	0	109.8	N30 L44 L49	N30-T47 VanDerWaalsContact OD1-CG2 3.26Å; N30-T47 WeakPolarHBondContact OD1-CG2 3.46Å; L44-T47 HydrophobicContact CD1-CG2 4.35Å; L44-T47 HydrophobicContact CD2-CG2 3.96Å; T47-L49 VanDerWaalsContact C-N 3.28Å; T47-L49 PolarHBondContact O-N 3.24Å
48	D	88.7	Confident	92.9	Very high	111 Å²	111	71.4 Å²	71.4	59%	0.594	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	57.3	38.9	170.9	-47.8	-71.1	0	0	0	113.3	G29	G29-D48 PolarHBondContact O-N 3.46Å
49	L	90.8	Very high	93	Very high	30 Å²	30	71.9 Å²	71.9	16%	0.157	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	136.9	-179.9	-73.3	-179	0	0	0	111.7	G29 C31 K46 T47 E53 W64	G29-L49 CarbonylContact C-O 3.57Å; G29-L49 PolarHBondContact N-O 3.26Å; G29-L49 PolarHBondContact O-N 3.26Å; C31-L49 HydrophobicContact CB-CD1 3.94Å; K46-L49 HydrophobicContact CB-CD1 3.47Å; K46-L49 VanDerWaalsContact CB-CD1 3.47Å; K46-L49 HydrophobicContact CB-CG 4.19Å; K46-L49 HydrophobicContact CD-CD1 3.84Å; K46-L49 HydrophobicContact CG-CD1 4.27Å; T47-L49 VanDerWaalsContact C-N 3.28Å; T47-L49 PolarHBondContact O-N 3.24Å; L49-E53 HydrophobicContact CD2-CB 4Å; L49-W64 PolarHBondContact O-NE1 2.78Å
50	S	92.7	Very high	93.1	Very high	24 Å²	24	71.8 Å²	71.8	17%	0.168	35%	0.35	C	S	.	.			trans	-63.1	157.8	164.4	67.7	0	0	0	0	111	E52 E53 C54	S50-E52 PolarHBondContact O-N 3.05Å; S50-E53 WeakPolarHBondContact CB-OE2 3.32Å; S50-E53 PolarHBondContact N-OE2 3.47Å; S50-E53 PolarHBondContact O-N 3.37Å; S50-E53 WeakPolarHBondContact OG-CB 3.3Å; S50-E53 VanDerWaalsContact OG-CD 3.25Å; S50-E53 WeakPolarHBondContact OG-CG 3.47Å; S50-E53 PolarHBondContact OG-N 2.9Å; S50-E53 PolarHBondContact OG-OE2 3.27Å; S50-C54 PolarHBondContact O-N 3.08Å
51	K	93	Very high	93.1	Very high	95 Å²	95	70.7 Å²	70.7	41%	0.413	35%	0.353	S	S	.	.	H	α-helix	trans	-56	-40.5	174.1	-174.2	179.5	177.5	-176.6	0	111.7	C54 C55 W64	K51-C54 PolarHBondContact O-N 3.3Å; K51-C55 WeakPolarHBondContact O-CB 3.35Å; K51-C55 PolarHBondContact O-N 2.87Å; K51-C55 PolarHBondContact O-SG 2.76Å; K51-W64 HydrophobicContact CB-CD2 3.73Å; K51-W64 HydrophobicContact CB-CE3 3.96Å; K51-W64 HydrophobicContact CB-CG 4.18Å; K51-W64 HydrophobicContact CB-CH2 4.26Å; K51-W64 HydrophobicContact CB-CZ2 4.1Å; K51-W64 HydrophobicContact CB-CZ3 4.21Å; K51-W64 HydrophobicContact CD-CE3 4.06Å; K51-W64 HydrophobicContact CD-CZ3 4.28Å; K51-W64 HydrophobicContact CG-CB 4.45Å; K51-W64 HydrophobicContact CG-CD2 3.99Å; K51-W64 HydrophobicContact CG-CE3 3.97Å; K51-W64 HydrophobicContact CG-CG 4.23Å; K51-W64 HydrophobicContact CG-CZ3 4.49Å
52	E	92.6	Very high	93.1	Very high	164 Å²	164	71 Å²	71	77%	0.766	35%	0.354	S	S	*	.	H	α-helix	trans	-63.4	-45.5	-179.4	-65.3	-179.4	-178	0	0	111.7	S50 C55 K56	S50-E52 PolarHBondContact O-N 3.05Å; E52-C55 PolarHBondContact O-N 2.84Å; E52-K56 WeakPolarHBondContact O-CB 3.5Å; E52-K56 PolarHBondContact O-N 3.48Å
53	E	94.1	Very high	93.1	Very high	113 Å²	113	69.2 Å²	69.2	53%	0.528	35%	0.346	S	S	.	.	H	α-helix	trans	-65.2	-42.9	177.8	-69.6	165.3	132.8	0	0	112	L49 S50 C55	L49-E53 HydrophobicContact CD2-CB 4Å; S50-E53 WeakPolarHBondContact CB-OE2 3.32Å; S50-E53 PolarHBondContact N-OE2 3.47Å; S50-E53 PolarHBondContact O-N 3.37Å; S50-E53 WeakPolarHBondContact OG-CB 3.3Å; S50-E53 VanDerWaalsContact OG-CD 3.25Å; S50-E53 WeakPolarHBondContact OG-CG 3.47Å; S50-E53 PolarHBondContact OG-N 2.9Å; S50-E53 PolarHBondContact OG-OE2 3.27Å; E53-C55 VanDerWaalsContact C-N 3.34Å; E53-C55 PolarHBondContact O-N 2.91Å
54	C	94.1	Very high	93.2	Very high	6 Å²	6	66.9 Å²	66.9	4%	0.041	33%	0.331	C	S	.	.	H	α-helix	trans	-62	-42.2	175.1	177.9	0	0	0	0	111.9	C31 S50 K51 W64	C31-C54 WeakPolarHBondContact CA-SG 3.29Å; C31-C54 HydrophobicContact CB-CB 3.65Å; C31-C54 WeakPolarHBondContact CB-SG 3.41Å; C31-C54 VanDerWaalsContact SG-CA 3.51Å; C31-C54 WeakPolarHBondContact SG-CB 3.44Å; C31-C54 CovalentContact SG-SG 2.04Å; C31-C54 PolarHBondContact SG-SG 3.34Å; S50-C54 PolarHBondContact O-N 3.08Å; K51-C54 PolarHBondContact O-N 3.3Å; C54-W64 HydrophobicContact CB-CB 4.45Å; C54-W64 HydrophobicContact CB-CG 4.41Å
55	C	94.7	Very high	93.3	Very high	21 Å²	21	63.6 Å²	63.6	14%	0.142	31%	0.314	C	S	.	.	H	α-helix	trans	-91.2	1.6	-172.9	-60.1	0	0	0	0	114.8	K51 E52 E53 S57 C90 K91	K51-C55 WeakPolarHBondContact O-CB 3.35Å; K51-C55 PolarHBondContact O-N 2.87Å; K51-C55 PolarHBondContact O-SG 2.76Å; E52-C55 PolarHBondContact O-N 2.84Å; E53-C55 VanDerWaalsContact C-N 3.34Å; E53-C55 PolarHBondContact O-N 2.91Å; C55-S57 PolarHBondContact O-N 3.49Å; C55-C90 WeakPolarHBondContact CA-SG 3.3Å; C55-C90 HydrophobicContact CB-CB 3.51Å; C55-C90 WeakPolarHBondContact CB-SG 3.47Å; C55-C90 WeakPolarHBondContact SG-CA 3.23Å; C55-C90 WeakPolarHBondContact SG-CB 3.37Å; C55-C90 CovalentContact SG-SG 2.04Å; C55-C90 PolarHBondContact SG-SG 2.76Å; C55-K91 PolarHBondContact O-NZ 2.94Å
56	K	93.7	Very high	93.4	Very high	186 Å²	186	62.1 Å²	62.1	81%	0.809	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-31.4	178.3	-171.3	173.5	-177.6	174.4	0	113.5	E52	E52-K56 WeakPolarHBondContact O-CB 3.5Å; E52-K56 PolarHBondContact O-N 3.48Å
57	S	91.8	Very high	93	Very high	54 Å²	54	61.5 Å²	61.5	38%	0.378	31%	0.31	S	S	.	.	S	Bend	trans	-73.8	151.7	178.2	73.2	0	0	0	0	112.5	C55 R59 K91	C55-S57 PolarHBondContact O-N 3.49Å; S57-R59 PolarHBondContact O-N 3.24Å; S57-K91 PolarHBondContact O-NZ 3.29Å
58	G	91.8	Very high	92.4	Very high	26 Å²	26	62.1 Å²	62.1	27%	0.268	31%	0.311	S	S	.	.			trans	-72.9	3.4	172.3	0	0	0	0	0	114.5	L60 N96 D98	G58-L60 PolarHBondContact O-N 3.22Å; G58-N96 VanDerWaalsContact CA-O 3.31Å; G58-N96 WeakPolarHBondContact CA-O 3.42Å; G58-D98 PolarHBondContact O-N 3.48Å
59	R	94.2	Very high	92	Very high	100 Å²	100	58.3 Å²	58.3	38%	0.377	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-69.7	118.4	-172.5	-174.8	168.6	-176.3	-90.3	0.9	111.3	L33 S57 T61 T62	L33-R59 VanDerWaalsContact CD2-NH1 3.33Å; L33-R59 PolarHBondContact O-NH1 2.92Å; S57-R59 PolarHBondContact O-N 3.24Å; R59-T61 PolarHBondContact O-N 2.04Å; R59-T62 WeakPolarHBondContact CB-OG1 3.43Å; R59-T62 WeakPolarHBondContact CG-OG1 3.43Å; R59-T62 PolarHBondContact NH1-OG1 2.03Å; R59-T62 PolarHBondContact O-N 3.4Å
60	L	93.9	Very high	91.7	Very high	27 Å²	27	61.6 Å²	61.6	14%	0.141	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-44.4	-173.2	175.5	62	0	0	0	114.9	G58 K91 V97 P113 C115	G58-L60 PolarHBondContact O-N 3.22Å; L60-K91 HydrophobicContact CD1-CB 4.45Å; L60-V97 HydrophobicContact CB-CG1 3.95Å; L60-V97 HydrophobicContact CD1-CG1 3.97Å; L60-V97 HydrophobicContact CD1-CG2 4.11Å; L60-V97 HydrophobicContact CG-CG1 4.44Å; L60-P113 HydrophobicContact CD1-CB 3.62Å; L60-P113 HydrophobicContact CD1-CG 3.63Å; L60-C115 HydrophobicContact CD2-CB 4.13Å; L60-C115 VanDerWaalsContact CD2-SG 3.58Å
61	T	94.8	Very high	91.4	Very high	55 Å²	55	66.6 Å²	66.6	34%	0.337	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-6.9	-167.9	58.8	0	0	0	0	113.8	L33 R34 R59 S63	L33-T61 CarbonylContact O-C 3.58Å; L33-T61 WeakPolarHBondContact O-CB 3.47Å; L33-T61 PolarHBondContact O-OG1 2.99Å; R34-T61 VanDerWaalsContact CA-O 3.25Å; R34-T61 WeakPolarHBondContact CA-O 3.41Å; R59-T61 PolarHBondContact O-N 2.04Å; T61-S63 PolarHBondContact O-N 3.39Å; T61-S63 PolarHBondContact O-OG 2.91Å
62	T	96.3	Very high	91.2	Very high	5 Å²	5	68.2 Å²	68.2	3%	0.031	35%	0.348	C	S	.	.			trans	-59.1	137.4	-178.4	-56.8	0	0	0	0	110.2	W32 R59 C90	W32-T62 WeakPolarHBondContact O-CA 3.44Å; R59-T62 WeakPolarHBondContact CB-OG1 3.43Å; R59-T62 WeakPolarHBondContact CG-OG1 3.43Å; R59-T62 PolarHBondContact NH1-OG1 2.03Å; R59-T62 PolarHBondContact O-N 3.4Å; T62-C90 VanDerWaalsContact O-CB 3.26Å; T62-C90 WeakPolarHBondContact O-CB 3.22Å; T62-C90 PolarHBondContact O-N 2.74Å
63	S	96.3	Very high	91	Very high	2 Å²	2	62.5 Å²	62.5	1%	0.014	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	159.8	-177.2	-54.4	0	0	0	0	109.3	W32 C41 T61 C87 I88	W32-S63 WeakPolarHBondContact CB-O 3.28Å; W32-S63 PolarHBondContact N-O 3.21Å; W32-S63 PolarHBondContact O-N 2.93Å; C41-S63 WeakPolarHBondContact SG-CB 3.46Å; T61-S63 PolarHBondContact O-N 3.39Å; T61-S63 PolarHBondContact O-OG 2.91Å; S63-C87 VanDerWaalsContact CB-SG 3.57Å; S63-I88 CarbonylContact C-O 3.56Å; S63-I88 VanDerWaalsContact CA-O 3.26Å; S63-I88 WeakPolarHBondContact CA-O 3.34Å; S63-I88 WeakPolarHBondContact CB-O 3.37Å
64	W	96.4	Very high	90.7	Very high	12 Å²	12	57.7 Å²	57.7	5%	0.045	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	151.7	-173.8	-179.9	83.5	0	0	0	110.6	N30 L49 K51 C54 E66 I88	N30-W64 CarbonylContact O-C 3.53Å; N30-W64 WeakPolarHBondContact O-CA 3.36Å; L49-W64 PolarHBondContact O-NE1 2.78Å; K51-W64 HydrophobicContact CB-CD2 3.73Å; K51-W64 HydrophobicContact CB-CE3 3.96Å; K51-W64 HydrophobicContact CB-CG 4.18Å; K51-W64 HydrophobicContact CB-CH2 4.26Å; K51-W64 HydrophobicContact CB-CZ2 4.1Å; K51-W64 HydrophobicContact CB-CZ3 4.21Å; K51-W64 HydrophobicContact CD-CE3 4.06Å; K51-W64 HydrophobicContact CD-CZ3 4.28Å; K51-W64 HydrophobicContact CG-CB 4.45Å; K51-W64 HydrophobicContact CG-CD2 3.99Å; K51-W64 HydrophobicContact CG-CE3 3.97Å; K51-W64 HydrophobicContact CG-CG 4.23Å; K51-W64 HydrophobicContact CG-CZ3 4.49Å; C54-W64 HydrophobicContact CB-CB 4.45Å; C54-W64 HydrophobicContact CB-CG 4.41Å; W64-E66 HydrophobicContact CH2-CB 3.4Å; W64-E66 VanDerWaalsContact CH2-CB 3.4Å; W64-E66 HydrophobicContact CH2-CG 3.69Å; W64-E66 HydrophobicContact CZ2-CB 4.2Å; W64-E66 HydrophobicContact CZ2-CG 4.49Å; W64-E66 HydrophobicContact CZ3-CB 3.63Å; W64-E66 HydrophobicContact CZ3-CG 4.31Å; W64-I88 HydrophobicContact CE3-CD1 3.79Å; W64-I88 HydrophobicContact CZ3-CD1 3.81Å; W64-I88 PolarHBondContact N-O 3.25Å; W64-I88 WeakPolarHBondContact O-CB 3.46Å; W64-I88 PolarHBondContact O-N 2.04Å
65	T	95.4	Very high	90.6	Very high	3 Å²	3	63.3 Å²	63.3	2%	0.018	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	139.3	171.4	55.2	0	0	0	0	109.3	G29 N30 W32 C41 A84 P85	G29-T65 CarbonylContact C-O 3.52Å; G29-T65 VanDerWaalsContact CA-O 3.29Å; G29-T65 WeakPolarHBondContact CA-O 3.16Å; N30-T65 WeakPolarHBondContact CB-OG1 3.42Å; N30-T65 PolarHBondContact N-O 3.38Å; N30-T65 PolarHBondContact O-N 2.04Å; W32-T65 PolarHBondContact NE1-OG1 3.36Å; C41-T65 HydrophobicContact CB-CG2 4.04Å; T65-A84 HydrophobicContact CG2-CB 4.15Å; T65-P85 VanDerWaalsContact CG2-O 3.3Å; T65-P85 WeakPolarHBondContact CG2-O 3.05Å
66	E	93	Very high	90.4	Very high	104 Å²	104	68.1 Å²	68.1	49%	0.486	35%	0.345	S	S	.	.	S	Bend	trans	-74.2	-31.3	-175.8	-172.9	166.3	-160.8	0	0	114.2	W64 D68	W64-E66 HydrophobicContact CH2-CB 3.4Å; W64-E66 VanDerWaalsContact CH2-CB 3.4Å; W64-E66 HydrophobicContact CH2-CG 3.69Å; W64-E66 HydrophobicContact CZ2-CB 4.2Å; W64-E66 HydrophobicContact CZ2-CG 4.49Å; W64-E66 HydrophobicContact CZ3-CB 3.63Å; W64-E66 HydrophobicContact CZ3-CG 4.31Å; E66-D68 PolarHBondContact O-N 3.22Å
67	E	83	Confident	90.3	Very high	94 Å²	94	60.7 Å²	60.7	44%	0.439	31%	0.312	S	S	.	.			trans	-74.8	118.1	-177.2	-66.5	179	-162.3	0	0	111.3	N30 V69 W77	N30-E67 PolarHBondContact ND2-O 3.23Å; E67-V69 HydrophobicContact CB-CG1 3.78Å; E67-V69 PolarHBondContact O-N 3.21Å; E67-W77 HydrophobicContact CB-CH2 4.25Å; E67-W77 WeakPolarHBondContact OE2-CH2 3.43Å; E67-W77 WeakPolarHBondContact OE2-CZ2 3.03Å
68	D	78.5	Confident	90.2	Very high	72 Å²	72	61.2 Å²	61.2	39%	0.385	31%	0.309	S	S	.	.			trans	-81.1	101.4	159.8	-82	-20.4	0	0	0	109.6	A28 G29 N30 E66	A28-D68 WeakPolarHBondContact CA-OD2 3.37Å; A28-D68 WeakPolarHBondContact CB-OD2 3.11Å; G29-D68 VanDerWaalsContact C-OD1 3.27Å; G29-D68 WeakPolarHBondContact CA-OD1 3.05Å; G29-D68 PolarHBondContact N-OD1 3.01Å; N30-D68 PolarHBondContact ND2-OD1 3.35Å; E66-D68 PolarHBondContact O-N 3.22Å
69	V	80.5	Confident	90.2	Very high	32 Å²	32	64.9 Å²	64.9	19%	0.194	32%	0.321	C	S	.	.			trans	-113	148.9	179.7	-54.2	0	0	0	0	110.7	E67 T73 L74 W77	E67-V69 HydrophobicContact CB-CG1 3.78Å; E67-V69 PolarHBondContact O-N 3.21Å; V69-T73 HydrophobicContact CB-CG2 3.79Å; V69-T73 HydrophobicContact CG1-CG2 4.16Å; V69-T73 HydrophobicContact CG2-CG2 3.72Å; V69-L74 HydrophobicContact CG2-CD2 3.6Å; V69-L74 HydrophobicContact CG2-CG 3.66Å; V69-W77 HydrophobicContact CB-CH2 4.37Å; V69-W77 HydrophobicContact CG1-CH2 3.58Å; V69-W77 HydrophobicContact CG1-CZ2 4.14Å; V69-W77 HydrophobicContact CG1-CZ3 4.19Å; V69-W77 HydrophobicContact CG2-CE3 4.14Å; V69-W77 HydrophobicContact CG2-CH2 3.86Å; V69-W77 HydrophobicContact CG2-CZ2 4.49Å; V69-W77 HydrophobicContact CG2-CZ3 3.66Å
70	N	83.9	Confident	90.2	Very high	99 Å²	99	67 Å²	67	53%	0.529	33%	0.333	S	S	.	.			trans	-61.5	161.8	178.1	64.4	30.9	0	0	0	112.8	N72 T73 L74	N70-N72 PolarHBondContact O-N 2.88Å; N70-N72 VanDerWaalsContact O-N 3.11Å; N70-N72 PolarHBondContact OD1-N 2.8Å; N70-T73 WeakPolarHBondContact O-CB 3.45Å; N70-T73 PolarHBondContact O-N 3Å; N70-T73 WeakPolarHBondContact OD1-CB 3.49Å; N70-T73 PolarHBondContact OD1-N 3.3Å; N70-T73 PolarHBondContact OD1-OG1 2.88Å; N70-L74 PolarHBondContact O-N 2.99Å
71	D	87.1	Confident	90.2	Very high	129 Å²	129	68.7 Å²	68.7	69%	0.69	34%	0.342	S	S	*	.	H	α-helix	trans	-53.7	-37	-177.2	-64.8	-15.3	0	0	0	113.3	T73 L74 F75	D71-T73 VanDerWaalsContact C-N 3.31Å; D71-T73 PolarHBondContact O-N 3.27Å; D71-L74 PolarHBondContact O-N 2.9Å; D71-F75 VanDerWaalsContact O-CB 3.24Å; D71-F75 WeakPolarHBondContact O-CB 3Å; D71-F75 PolarHBondContact O-N 2.04Å
72	N	89.7	Confident	90	Very high	129 Å²	129	67.3 Å²	67.3	69%	0.69	34%	0.34	S	S	*	.	H	α-helix	trans	-63.4	-37.9	177.9	-69.5	-21.5	0	0	0	112.1	N70 K76	N70-N72 PolarHBondContact O-N 2.88Å; N70-N72 VanDerWaalsContact O-N 3.11Å; N70-N72 PolarHBondContact OD1-N 2.8Å; N72-K76 WeakPolarHBondContact O-CB 3.35Å; N72-K76 PolarHBondContact O-N 2.77Å
73	T	88.8	Confident	89.9	Confident	43 Å²	43	67.1 Å²	67.1	26%	0.264	34%	0.338	S	S	.	.	H	α-helix	trans	-75.9	-42.8	179	-55	0	0	0	0	111	V69 N70 D71 F75 K76 W77	V69-T73 HydrophobicContact CB-CG2 3.79Å; V69-T73 HydrophobicContact CG1-CG2 4.16Å; V69-T73 HydrophobicContact CG2-CG2 3.72Å; N70-T73 WeakPolarHBondContact O-CB 3.45Å; N70-T73 PolarHBondContact O-N 3Å; N70-T73 WeakPolarHBondContact OD1-CB 3.49Å; N70-T73 PolarHBondContact OD1-N 3.3Å; N70-T73 PolarHBondContact OD1-OG1 2.88Å; D71-T73 VanDerWaalsContact C-N 3.31Å; D71-T73 PolarHBondContact O-N 3.27Å; T73-F75 VanDerWaalsContact C-N 3.3Å; T73-F75 PolarHBondContact O-N 2.73Å; T73-K76 PolarHBondContact O-N 3.42Å; T73-K76 VanDerWaalsContact O-N 3.17Å; T73-W77 HydrophobicContact CG2-CD2 4.26Å; T73-W77 HydrophobicContact CG2-CZ2 3.91Å; T73-W77 PolarHBondContact O-N 3.46Å
74	L	87.6	Confident	89.9	Confident	13 Å²	13	67 Å²	67	7%	0.068	34%	0.337	C	S	.	.	H	α-helix	trans	-56	-47.1	172.1	-72.2	174.8	0	0	0	110.8	W32 L44 V69 N70 D71 K76 W77 M78	W32-L74 HydrophobicContact CH2-CD2 3.85Å; W32-L74 HydrophobicContact CZ2-CD2 4.02Å; L44-L74 HydrophobicContact CD2-CD1 4.09Å; V69-L74 HydrophobicContact CG2-CD2 3.6Å; V69-L74 HydrophobicContact CG2-CG 3.66Å; N70-L74 PolarHBondContact O-N 2.99Å; D71-L74 PolarHBondContact O-N 2.9Å; L74-K76 PolarHBondContact O-N 2.87Å; L74-W77 HydrophobicContact CD2-CE3 4.47Å; L74-W77 PolarHBondContact O-N 3.06Å; L74-M78 WeakPolarHBondContact O-CB 3Å; L74-M78 VanDerWaalsContact O-CG 3.31Å; L74-M78 WeakPolarHBondContact O-CG 3.42Å; L74-M78 PolarHBondContact O-N 3.22Å
75	F	90.3	Very high	89.8	Confident	124 Å²	124	67.9 Å²	67.9	54%	0.544	35%	0.345	S	S	.	.	H	α-helix	trans	-58.6	-48.4	175.7	-180	-94.8	0	0	0	111.3	D71 T73 W77 M78 I79 F80	D71-F75 VanDerWaalsContact O-CB 3.24Å; D71-F75 WeakPolarHBondContact O-CB 3Å; D71-F75 PolarHBondContact O-N 2.04Å; T73-F75 VanDerWaalsContact C-N 3.3Å; T73-F75 PolarHBondContact O-N 2.73Å; F75-W77 VanDerWaalsContact C-N 3.31Å; F75-W77 PolarHBondContact O-N 3.38Å; F75-M78 PolarHBondContact O-N 3.02Å; F75-I79 HydrophobicContact CD1-CG1 4.39Å; F75-I79 HydrophobicContact CD2-CG1 3.89Å; F75-I79 HydrophobicContact CE1-CB 4.45Å; F75-I79 HydrophobicContact CE1-CG1 4.11Å; F75-I79 HydrophobicContact CE2-CD1 4.33Å; F75-I79 HydrophobicContact CE2-CG1 3.59Å; F75-I79 HydrophobicContact CG-CG1 4.29Å; F75-I79 HydrophobicContact CZ-CB 4.42Å; F75-I79 HydrophobicContact CZ-CG1 3.71Å; F75-I79 WeakPolarHBondContact O-CB 3.42Å; F75-I79 WeakPolarHBondContact O-CG1 3Å; F75-I79 PolarHBondContact O-N 3.1Å; F75-F80 HydrophobicContact CD1-CE2 4.48Å; F75-F80 HydrophobicContact CE1-CE2 4.06Å
76	K	92.4	Very high	89.7	Confident	122 Å²	122	73.3 Å²	73.3	53%	0.53	37%	0.374	S	S	.	.	H	α-helix	trans	-58	-44.3	179.6	-176.9	179.1	178.9	179.1	0	111.8	N72 T73 L74 F80 N81	N72-K76 WeakPolarHBondContact O-CB 3.35Å; N72-K76 PolarHBondContact O-N 2.77Å; T73-K76 PolarHBondContact O-N 3.42Å; T73-K76 VanDerWaalsContact O-N 3.17Å; L74-K76 PolarHBondContact O-N 2.87Å; K76-F80 HydrophobicContact CB-CD2 4.46Å; K76-F80 HydrophobicContact CG-CD2 4.08Å; K76-F80 WeakPolarHBondContact O-CB 3.4Å; K76-F80 PolarHBondContact O-N 3.25Å; K76-N81 PolarHBondContact O-N 3.08Å
77	W	91.5	Very high	89.8	Confident	30 Å²	30	69 Å²	69	11%	0.114	36%	0.355	C	S	.	.	H	α-helix	trans	-65.8	-44.6	178.7	-69.9	-7.7	0	0	0	112.9	E67 V69 T73 L74 F75 N81 G82 G83 A84 P85	E67-W77 HydrophobicContact CB-CH2 4.25Å; E67-W77 WeakPolarHBondContact OE2-CH2 3.43Å; E67-W77 WeakPolarHBondContact OE2-CZ2 3.03Å; V69-W77 HydrophobicContact CB-CH2 4.37Å; V69-W77 HydrophobicContact CG1-CH2 3.58Å; V69-W77 HydrophobicContact CG1-CZ2 4.14Å; V69-W77 HydrophobicContact CG1-CZ3 4.19Å; V69-W77 HydrophobicContact CG2-CE3 4.14Å; V69-W77 HydrophobicContact CG2-CH2 3.86Å; V69-W77 HydrophobicContact CG2-CZ2 4.49Å; V69-W77 HydrophobicContact CG2-CZ3 3.66Å; T73-W77 HydrophobicContact CG2-CD2 4.26Å; T73-W77 HydrophobicContact CG2-CZ2 3.91Å; T73-W77 PolarHBondContact O-N 3.46Å; L74-W77 HydrophobicContact CD2-CE3 4.47Å; L74-W77 PolarHBondContact O-N 3.06Å; F75-W77 VanDerWaalsContact C-N 3.31Å; F75-W77 PolarHBondContact O-N 3.38Å; W77-N81 CarbonylContact O-C 3.4Å; W77-N81 WeakPolarHBondContact O-CA 3.17Å; W77-N81 WeakPolarHBondContact O-CB 3.34Å; W77-N81 PolarHBondContact O-N 2.9Å; W77-G82 PolarHBondContact O-N 2.87Å; W77-G83 PolarHBondContact O-N 2.76Å; W77-A84 HydrophobicContact CE3-CB 3.62Å; W77-A84 HydrophobicContact CZ3-CB 4.04Å; W77-P85 HydrophobicContact CD2-CG 4.22Å; W77-P85 VanDerWaalsContact CE3-CD 3.41Å; W77-P85 HydrophobicContact CE3-CG 4.39Å; W77-P85 HydrophobicContact CH2-CG 3.93Å; W77-P85 HydrophobicContact CZ2-CG 3.76Å; W77-P85 HydrophobicContact CZ3-CG 4.26Å
78	M	88.5	Confident	90.4	Very high	64 Å²	64	66.9 Å²	66.9	32%	0.315	35%	0.346	S	S	.	.	H	α-helix	trans	-67.8	-40.4	-177.4	-74.5	-61.8	-65	0	0	112.5	W32 Q42 L74 F75	W32-M78 HydrophobicContact CE3-SD 4.46Å; W32-M78 HydrophobicContact CH2-SD 4.27Å; W32-M78 HydrophobicContact CZ3-CG 4.29Å; W32-M78 HydrophobicContact CZ3-SD 3.59Å; W32-M78 VanDerWaalsContact CZ3-SD 3.59Å; Q42-M78 HydrophobicContact CB-CE 4.35Å; L74-M78 WeakPolarHBondContact O-CB 3Å; L74-M78 VanDerWaalsContact O-CG 3.31Å; L74-M78 WeakPolarHBondContact O-CG 3.42Å; L74-M78 PolarHBondContact O-N 3.22Å; F75-M78 PolarHBondContact O-N 3.02Å
79	I	92.6	Very high	91.2	Very high	103 Å²	103	65.2 Å²	65.2	53%	0.528	34%	0.339	S	S	.	.	H	α-helix	trans	-89	-46.8	-174.8	-58.8	-55.5	0	0	0	112.3	F75	F75-I79 HydrophobicContact CD1-CG1 4.39Å; F75-I79 HydrophobicContact CD2-CG1 3.89Å; F75-I79 HydrophobicContact CE1-CB 4.45Å; F75-I79 HydrophobicContact CE1-CG1 4.11Å; F75-I79 HydrophobicContact CE2-CD1 4.33Å; F75-I79 HydrophobicContact CE2-CG1 3.59Å; F75-I79 HydrophobicContact CG-CG1 4.29Å; F75-I79 HydrophobicContact CZ-CB 4.42Å; F75-I79 HydrophobicContact CZ-CG1 3.71Å; F75-I79 WeakPolarHBondContact O-CB 3.42Å; F75-I79 WeakPolarHBondContact O-CG1 3Å; F75-I79 PolarHBondContact O-N 3.1Å
80	F	94.2	Very high	91.9	Very high	144 Å²	144	64.7 Å²	64.7	63%	0.632	34%	0.337	S	S	*	.	H	α-helix	trans	-97.9	-24.9	-171.6	-57.3	-70.5	0	0	0	113.7	F75 K76	F75-F80 HydrophobicContact CD1-CE2 4.48Å; F75-F80 HydrophobicContact CE1-CE2 4.06Å; K76-F80 HydrophobicContact CB-CD2 4.46Å; K76-F80 HydrophobicContact CG-CD2 4.08Å; K76-F80 WeakPolarHBondContact O-CB 3.4Å; K76-F80 PolarHBondContact O-N 3.25Å
81	N	92.4	Very high	92.5	Very high	63 Å²	63	61.2 Å²	61.2	34%	0.337	32%	0.317	S	S	.	.	S	Bend	trans	-111.9	6	-173.5	-54.5	-7.4	0	0	0	113.4	R40 K76 W77 G83	R40-N81 WeakPolarHBondContact CD-O 3.46Å; R40-N81 VanDerWaalsContact CZ-O 3.29Å; R40-N81 PolarHBondContact NE-O 3.19Å; R40-N81 VanDerWaalsContact NH1-CB 3.3Å; R40-N81 PolarHBondContact NH1-O 3.49Å; K76-N81 PolarHBondContact O-N 3.08Å; W77-N81 CarbonylContact O-C 3.4Å; W77-N81 WeakPolarHBondContact O-CA 3.17Å; W77-N81 WeakPolarHBondContact O-CB 3.34Å; W77-N81 PolarHBondContact O-N 2.9Å; N81-G83 VanDerWaalsContact C-N 3.27Å; N81-G83 PolarHBondContact O-N 3.11Å
82	G	91.9	Very high	92.8	Very high	27 Å²	27	61.4 Å²	61.4	28%	0.278	31%	0.314	S	S	.	.	S	Bend	trans	68.6	20.6	177.2	0	0	0	0	0	114.8	N38 Q42 W77	N38-G82 PolarHBondContact ND2-O 3.13Å; N38-G82 VanDerWaalsContact ND2-O 3.11Å; Q42-G82 PolarHBondContact NE2-O 2.93Å; W77-G82 PolarHBondContact O-N 2.87Å
83	G	94.8	Very high	93.1	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.302	C	S	.	.	S	Bend	trans	132.1	170.2	175	0	0	0	0	0	114.1	R40 C41 W77 N81	R40-G83 WeakPolarHBondContact CD-O 3.44Å; R40-G83 PolarHBondContact NH1-O 2.81Å; C41-G83 CarbonylContact O-C 3.48Å; C41-G83 WeakPolarHBondContact O-CA 3.39Å; W77-G83 PolarHBondContact O-N 2.76Å; N81-G83 VanDerWaalsContact C-N 3.27Å; N81-G83 PolarHBondContact O-N 3.11Å
84	A	94.8	Very high	93.4	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.303	C	S	.	.	B	Isolated β-bridge	trans	-68.2	136.9	177.2	0	0	0	0	0	111.7	W32 R40 C41 T65 W77	W32-A84 HydrophobicContact CH2-CB 3.58Å; W32-A84 HydrophobicContact CZ2-CB 3.3Å; W32-A84 HydrophobicContact CZ3-CB 4.34Å; R40-A84 WeakPolarHBondContact CA-O 3.44Å; R40-A84 VanDerWaalsContact CB-O 3.31Å; R40-A84 WeakPolarHBondContact CB-O 3.33Å; C41-A84 HydrophobicContact CB-CB 4.02Å; C41-A84 PolarHBondContact N-O 3.44Å; C41-A84 PolarHBondContact O-N 3.29Å; T65-A84 HydrophobicContact CG2-CB 4.15Å; W77-A84 HydrophobicContact CE3-CB 3.62Å; W77-A84 HydrophobicContact CZ3-CB 4.04Å
85	P	94.6	Very high	93.8	Very high	31 Å²	31	64.6 Å²	64.6	20%	0.201	33%	0.33	C	S	.	.	S	Bend	trans	-71.5	176.4	177.4	34.3	-35.5	0	0	0	111.3	T65 W77 C87	T65-P85 VanDerWaalsContact CG2-O 3.3Å; T65-P85 WeakPolarHBondContact CG2-O 3.05Å; W77-P85 HydrophobicContact CD2-CG 4.22Å; W77-P85 VanDerWaalsContact CE3-CD 3.41Å; W77-P85 HydrophobicContact CE3-CG 4.39Å; W77-P85 HydrophobicContact CH2-CG 3.93Å; W77-P85 HydrophobicContact CZ2-CG 3.76Å; W77-P85 HydrophobicContact CZ3-CG 4.26Å; P85-C87 PolarHBondContact O-N 3.17Å
86	N	94.1	Very high	93.9	Very high	116 Å²	116	64.7 Å²	64.7	62%	0.62	34%	0.336	S	S	*	.	S	Bend	trans	50.4	38.7	172.8	-56.3	-26.3	0	0	0	113.9	I88	N86-I88 PolarHBondContact O-N 2.7Å
87	C	95.4	Very high	94.1	Very high	15 Å²	15	60 Å²	60	10%	0.101	32%	0.318	C	S	.	.			trans	-76.4	116.6	-174	-178.3	0	0	0	0	111.5	Q35 G39 C41 S63 P85	Q35-C87 PolarHBondContact NE2-O 3.3Å; G39-C87 VanDerWaalsContact O-CB 3.27Å; G39-C87 WeakPolarHBondContact O-CB 3.38Å; C41-C87 WeakPolarHBondContact CA-SG 3.17Å; C41-C87 HydrophobicContact CB-CB 3.63Å; C41-C87 WeakPolarHBondContact CB-SG 3.44Å; C41-C87 PolarHBondContact N-SG 2.81Å; C41-C87 VanDerWaalsContact SG-CA 3.56Å; C41-C87 WeakPolarHBondContact SG-CB 3.06Å; C41-C87 CovalentContact SG-SG 2.03Å; C41-C87 PolarHBondContact SG-SG 3.03Å; S63-C87 VanDerWaalsContact CB-SG 3.57Å; P85-C87 PolarHBondContact O-N 3.17Å
88	I	95.4	Very high	94.3	Very high	48 Å²	48	64 Å²	64	25%	0.246	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	113.8	-178.1	-61.6	159.3	0	0	0	108.6	S63 W64 N86	S63-I88 CarbonylContact C-O 3.56Å; S63-I88 VanDerWaalsContact CA-O 3.26Å; S63-I88 WeakPolarHBondContact CA-O 3.34Å; S63-I88 WeakPolarHBondContact CB-O 3.37Å; W64-I88 HydrophobicContact CE3-CD1 3.79Å; W64-I88 HydrophobicContact CZ3-CD1 3.81Å; W64-I88 PolarHBondContact N-O 3.25Å; W64-I88 WeakPolarHBondContact O-CB 3.46Å; W64-I88 PolarHBondContact O-N 2.04Å; N86-I88 PolarHBondContact O-N 2.7Å
89	P	95.5	Very high	94.7	Very high	38 Å²	38	62.1 Å²	62.1	25%	0.247	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	137.7	175.9	28.8	-33.2	0	0	0	110.6	K91 E92	P89-K91 PolarHBondContact O-N 3.35Å; P89-E92 HydrophobicContact CG-CG 4.35Å
90	C	95.3	Very high	94.7	Very high	21 Å²	21	58.6 Å²	58.6	14%	0.142	32%	0.324	C	S	.	.	S	Bend	trans	-70.2	-18.9	177.3	-75.3	0	0	0	0	113.8	C55 T62	C55-C90 WeakPolarHBondContact CA-SG 3.3Å; C55-C90 HydrophobicContact CB-CB 3.51Å; C55-C90 WeakPolarHBondContact CB-SG 3.47Å; C55-C90 WeakPolarHBondContact SG-CA 3.23Å; C55-C90 WeakPolarHBondContact SG-CB 3.37Å; C55-C90 CovalentContact SG-SG 2.04Å; C55-C90 PolarHBondContact SG-SG 2.76Å; T62-C90 VanDerWaalsContact O-CB 3.26Å; T62-C90 WeakPolarHBondContact O-CB 3.22Å; T62-C90 PolarHBondContact O-N 2.74Å
91	K	95	Very high	94.7	Very high	25 Å²	25	58 Å²	58	11%	0.109	33%	0.334	C	S	.	.			trans	-132.1	108.3	-175.9	-60.3	-67.6	-175.2	-79.3	0	108.8	C55 S57 L60 P89 N96 V97 P113	C55-K91 PolarHBondContact O-NZ 2.94Å; S57-K91 PolarHBondContact O-NZ 3.29Å; L60-K91 HydrophobicContact CD1-CB 4.45Å; P89-K91 PolarHBondContact O-N 3.35Å; K91-N96 VanDerWaalsContact CE-O 3.25Å; K91-N96 WeakPolarHBondContact CE-O 3.46Å; K91-V97 HydrophobicContact CB-CG2 4Å; K91-V97 HydrophobicContact CD-CG2 3.99Å; K91-V97 HydrophobicContact CG-CG2 3.96Å; K91-P113 HydrophobicContact CB-CG 4.47Å; K91-P113 VanDerWaalsContact O-CG 3.31Å; K91-P113 WeakPolarHBondContact O-CG 3.27Å
92	E	93.7	Very high	94.7	Very high	134 Å²	134	56.7 Å²	56.7	63%	0.626	34%	0.336	S	S	*	.	S	Bend	trans	-94.6	-23.1	174.9	-63.5	-172.7	173.1	0	0	112.2	P89 M107 P113	P89-E92 HydrophobicContact CG-CG 4.35Å; E92-M107 WeakPolarHBondContact O-CE 3.46Å; E92-P113 WeakPolarHBondContact O-CD 3.41Å
93	T	95.7	Very high	94.9	Very high	72 Å²	72	59.8 Å²	59.8	44%	0.442	34%	0.342	S	S	.	.	S	Bend	trans	-122	-179.7	177	72.2	0	0	0	0	110.2	E95 V97 P113	T93-E95 PolarHBondContact O-N 2.98Å; T93-E95 VanDerWaalsContact OG1-CB 3.29Å; T93-E95 WeakPolarHBondContact OG1-CB 3.07Å; T93-E95 PolarHBondContact OG1-N 2.9Å; T93-V97 WeakPolarHBondContact O-CG2 3.29Å; T93-P113 WeakPolarHBondContact O-CB 3.28Å; T93-P113 WeakPolarHBondContact O-CG 3.45Å
94	C	96.7	Very high	95	Very high	41 Å²	41	66.7 Å²	66.7	28%	0.277	37%	0.372	S	S	.	.	S	Bend	trans	-81.9	2.5	172	-77.3	0	0	0	0	114	V97 C105 K106	C94-V97 PolarHBondContact O-N 3.07Å; C94-C105 WeakPolarHBondContact CA-SG 3.47Å; C94-C105 HydrophobicContact CB-CB 3.59Å; C94-C105 WeakPolarHBondContact CB-SG 3.33Å; C94-C105 WeakPolarHBondContact SG-CB 3.37Å; C94-C105 CovalentContact SG-SG 2.04Å; C94-C105 PolarHBondContact SG-SG 3Å; C94-K106 PolarHBondContact SG-N 2.78Å; C94-K106 VanDerWaalsContact SG-N 3.39Å
95	E	95.8	Very high	95.1	Very high	138 Å²	138	68.4 Å²	68.4	65%	0.645	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	132.3	177.8	-164.1	-179.7	166.9	0	0	110.5	T93 V97	T93-E95 PolarHBondContact O-N 2.98Å; T93-E95 VanDerWaalsContact OG1-CB 3.29Å; T93-E95 WeakPolarHBondContact OG1-CB 3.07Å; T93-E95 PolarHBondContact OG1-N 2.9Å; E95-V97 PolarHBondContact O-N 2.74Å; E95-V97 VanDerWaalsContact O-N 3.1Å
96	N	92.6	Very high	95.3	Very high	126 Å²	126	73.8 Å²	73.8	67%	0.674	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	26.1	-178.2	-56.4	-45.1	0	0	0	114.5	G58 K91	G58-N96 VanDerWaalsContact CA-O 3.31Å; G58-N96 WeakPolarHBondContact CA-O 3.42Å; K91-N96 VanDerWaalsContact CE-O 3.25Å; K91-N96 WeakPolarHBondContact CE-O 3.46Å
97	V	96.3	Very high	95.4	Very high	24 Å²	24	71.7 Å²	71.7	15%	0.145	39%	0.391	C	S	.	.			trans	-89.9	121	173.1	175.6	0	0	0	0	109.9	L60 K91 T93 C94 E95 C105	L60-V97 HydrophobicContact CB-CG1 3.95Å; L60-V97 HydrophobicContact CD1-CG1 3.97Å; L60-V97 HydrophobicContact CD1-CG2 4.11Å; L60-V97 HydrophobicContact CG-CG1 4.44Å; K91-V97 HydrophobicContact CB-CG2 4Å; K91-V97 HydrophobicContact CD-CG2 3.99Å; K91-V97 HydrophobicContact CG-CG2 3.96Å; T93-V97 WeakPolarHBondContact O-CG2 3.29Å; C94-V97 PolarHBondContact O-N 3.07Å; E95-V97 PolarHBondContact O-N 2.74Å; E95-V97 VanDerWaalsContact O-N 3.1Å; V97-C105 HydrophobicContact CB-CB 4.19Å; V97-C105 HydrophobicContact CG1-CB 4.04Å
98	D	96	Very high	95.3	Very high	115 Å²	115	73.3 Å²	73.3	62%	0.615	40%	0.399	S	S	*	.	B	Isolated β-bridge	trans	-97.9	115.8	168.9	-177.8	11.8	0	0	0	110	G58 G100	G58-D98 PolarHBondContact O-N 3.48Å; D98-G100 PolarHBondContact OD1-N 3.18Å
99	C	95.8	Very high	95.3	Very high	23 Å²	23	81.4 Å²	81.4	16%	0.155	43%	0.432	C	S	.	.			trans	-95.5	-4.3	178.8	-70.3	0	0	0	0	113.7	K103 C115	C99-K103 HydrophobicContact CB-CB 3.65Å; C99-C115 WeakPolarHBondContact CA-SG 3.35Å; C99-C115 HydrophobicContact CB-CB 3.63Å; C99-C115 WeakPolarHBondContact CB-SG 3.06Å; C99-C115 WeakPolarHBondContact SG-CA 3.46Å; C99-C115 WeakPolarHBondContact SG-CB 3.02Å; C99-C115 CovalentContact SG-SG 2.03Å; C99-C115 PolarHBondContact SG-SG 2.78Å
100	G	93.3	Very high	95.2	Very high	30 Å²	30	88 Å²	88	31%	0.309	46%	0.457	S	S	.	.			trans	71.8	-177.1	-170.5	0	0	0	0	0	113.7	D98	D98-G100 PolarHBondContact OD1-N 3.18Å
101	P	93.2	Very high	95.1	Very high	130 Å²	130	93.2 Å²	93.2	84%	0.844	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	142.5	-173.3	26.4	-34.7	0	0	0	112.6	K103	P101-K103 PolarHBondContact O-N 3.29Å
102	G	93	Very high	94.9	Very high	37 Å²	37	96.2 Å²	96.2	38%	0.381	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.1	11.8	176.1	0	0	0	0	0	115.1	A118	G102-A118 CarbonylContact O-C 3.54Å; G102-A118 VanDerWaalsContact O-C 3.24Å; G102-A118 PolarHBondContact O-N 3.28Å
103	K	96.8	Very high	95	Very high	91 Å²	91	90.4 Å²	90.4	40%	0.396	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	150	177.3	-66.7	177.9	-176.8	173.6	0	110.6	C99 P101 V116 C149	C99-K103 HydrophobicContact CB-CB 3.65Å; P101-K103 PolarHBondContact O-N 3.29Å; K103-V116 CarbonylContact C-O 3.59Å; K103-V116 WeakPolarHBondContact CA-O 3.44Å; K103-C149 VanDerWaalsContact CE-SG 3.5Å
104	K	96.4	Very high	95	Very high	146 Å²	146	93.1 Å²	93.1	64%	0.635	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.7	147.6	174.6	-71	-176.7	-179.3	-175.4	0	109.9	V116 A118	K104-V116 PolarHBondContact N-O 2.85Å; K104-V116 WeakPolarHBondContact O-CG2 3.26Å; K104-V116 PolarHBondContact O-N 2.77Å; K104-A118 HydrophobicContact CB-CB 3.99Å; K104-A118 HydrophobicContact CD-CB 3.94Å; K104-A118 HydrophobicContact CG-CB 3.81Å
105	C	97.6	Very high	95	Very high	35 Å²	35	93.2 Å²	93.2	24%	0.236	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	133.9	173.7	-171.2	0	0	0	0	110.3	C94 V97 R114	C94-C105 WeakPolarHBondContact CA-SG 3.47Å; C94-C105 HydrophobicContact CB-CB 3.59Å; C94-C105 WeakPolarHBondContact CB-SG 3.33Å; C94-C105 WeakPolarHBondContact SG-CB 3.37Å; C94-C105 CovalentContact SG-SG 2.04Å; C94-C105 PolarHBondContact SG-SG 3Å; V97-C105 HydrophobicContact CB-CB 4.19Å; V97-C105 HydrophobicContact CG1-CB 4.04Å; C105-R114 WeakPolarHBondContact CA-O 3.41Å
106	K	97.1	Very high	95	Very high	144 Å²	144	89.6 Å²	89.6	63%	0.626	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.3	141.3	172.1	-171.9	176.7	178.6	174.1	0	110.2	C94 R114 V116	C94-K106 PolarHBondContact SG-N 2.78Å; C94-K106 VanDerWaalsContact SG-N 3.39Å; K106-R114 PolarHBondContact N-O 3.3Å; K106-R114 PolarHBondContact O-N 2.77Å; K106-V116 HydrophobicContact CB-CG2 4.07Å
107	M	96.6	Very high	95.3	Very high	72 Å²	72	84.8 Å²	84.8	36%	0.355	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	131	171	-59.7	-54.9	-77.9	0	0	110.3	E92 N111 P113	E92-M107 WeakPolarHBondContact O-CE 3.46Å; M107-N111 VanDerWaalsContact CE-C 3.42Å; M107-N111 HydrophobicContact CE-CB 4.43Å; M107-N111 WeakPolarHBondContact CE-O 3.45Å; M107-P113 HydrophobicContact SD-CB 3.97Å
108	N	94.2	Very high	95.3	Very high	50 Å²	50	85.1 Å²	85.1	27%	0.267	44%	0.442	S	S	.	.			trans	-85.2	178.2	175	74.6	7.5	0	0	0	111.7	K110 N111 K112 R114	N108-K110 PolarHBondContact O-N 3.36Å; N108-K110 WeakPolarHBondContact OD1-CA 3.23Å; N108-K110 PolarHBondContact OD1-N 3.33Å; N108-N111 PolarHBondContact O-N 2.9Å; N108-N111 PolarHBondContact OD1-N 3.11Å; N108-K112 VanDerWaalsContact CG-O 3.24Å; N108-K112 PolarHBondContact N-O 2.92Å; N108-K112 PolarHBondContact OD1-N 3.43Å; N108-K112 PolarHBondContact OD1-O 2.92Å; N108-R114 HydrophobicContact CB-CG 4.08Å
109	K	95	Very high	95.3	Very high	218 Å²	218	81 Å²	81	95%	0.948	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-12.2	178.5	-60.9	-174.1	179.1	-175.2	0	114.9
110	K	92.3	Very high	95.2	Very high	177 Å²	177	85 Å²	85	77%	0.77	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	18.7	178.7	-60.4	-172.9	176.8	-172.4	0	111.8	N108 K112	N108-K110 PolarHBondContact O-N 3.36Å; N108-K110 WeakPolarHBondContact OD1-CA 3.23Å; N108-K110 PolarHBondContact OD1-N 3.33Å; K110-K112 PolarHBondContact O-N 2.99Å; K110-K112 VanDerWaalsContact O-N 3.13Å
111	N	93.3	Very high	95.4	Very high	129 Å²	129	85.1 Å²	85.1	69%	0.69	44%	0.437	S	S	*	.	S	Bend	trans	50.4	35.3	-174.5	-66.6	-7.8	0	0	0	113.9	M107 N108	M107-N111 VanDerWaalsContact CE-C 3.42Å; M107-N111 HydrophobicContact CE-CB 4.43Å; M107-N111 WeakPolarHBondContact CE-O 3.45Å; N108-N111 PolarHBondContact O-N 2.9Å; N108-N111 PolarHBondContact OD1-N 3.11Å
112	K	92.1	Very high	95.4	Very high	89 Å²	89	83.5 Å²	83.5	39%	0.387	43%	0.428	S	S	.	.			trans	-107.4	137.2	170.9	-66.6	-162.6	172.8	-164.7	0	110.6	N108 K110	N108-K112 VanDerWaalsContact CG-O 3.24Å; N108-K112 PolarHBondContact N-O 2.92Å; N108-K112 PolarHBondContact OD1-N 3.43Å; N108-K112 PolarHBondContact OD1-O 2.92Å; K110-K112 PolarHBondContact O-N 2.99Å; K110-K112 VanDerWaalsContact O-N 3.13Å
113	P	95.9	Very high	95.6	Very high	11 Å²	11	88.6 Å²	88.6	7%	0.071	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	139.4	179	26.6	-31.4	0	0	0	110.6	L60 K91 E92 T93 M107	L60-P113 HydrophobicContact CD1-CB 3.62Å; L60-P113 HydrophobicContact CD1-CG 3.63Å; K91-P113 HydrophobicContact CB-CG 4.47Å; K91-P113 VanDerWaalsContact O-CG 3.31Å; K91-P113 WeakPolarHBondContact O-CG 3.27Å; E92-P113 WeakPolarHBondContact O-CD 3.41Å; T93-P113 WeakPolarHBondContact O-CB 3.28Å; T93-P113 WeakPolarHBondContact O-CG 3.45Å; M107-P113 HydrophobicContact SD-CB 3.97Å
114	R	95.6	Very high	95.5	Very high	129 Å²	129	85.2 Å²	85.2	49%	0.487	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	130.4	179.1	-66.9	-64.5	178	175.5	-2.3	110.7	C105 K106 N108 V116	C105-R114 WeakPolarHBondContact CA-O 3.41Å; K106-R114 PolarHBondContact N-O 3.3Å; K106-R114 PolarHBondContact O-N 2.77Å; N108-R114 HydrophobicContact CB-CG 4.08Å; R114-V116 HydrophobicContact CB-CG1 4.48Å; R114-V116 PolarHBondContact O-N 2.8Å
115	C	96.3	Very high	95.5	Very high	44 Å²	44	84.4 Å²	84.4	30%	0.297	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	116.1	167.3	-66.9	0	0	0	0	109.4	L60 C99	L60-C115 HydrophobicContact CD2-CB 4.13Å; L60-C115 VanDerWaalsContact CD2-SG 3.58Å; C99-C115 WeakPolarHBondContact CA-SG 3.35Å; C99-C115 HydrophobicContact CB-CB 3.63Å; C99-C115 WeakPolarHBondContact CB-SG 3.06Å; C99-C115 WeakPolarHBondContact SG-CA 3.46Å; C99-C115 WeakPolarHBondContact SG-CB 3.02Å; C99-C115 CovalentContact SG-SG 2.03Å; C99-C115 PolarHBondContact SG-SG 2.78Å
116	V	96.4	Very high	95.4	Very high	62 Å²	62	87.2 Å²	87.2	38%	0.376	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	147.3	178.5	-63	0	0	0	0	110.3	K103 K104 K106 R114 A118	K103-V116 CarbonylContact C-O 3.59Å; K103-V116 WeakPolarHBondContact CA-O 3.44Å; K104-V116 PolarHBondContact N-O 2.85Å; K104-V116 WeakPolarHBondContact O-CG2 3.26Å; K104-V116 PolarHBondContact O-N 2.77Å; K106-V116 HydrophobicContact CB-CG2 4.07Å; R114-V116 HydrophobicContact CB-CG1 4.48Å; R114-V116 PolarHBondContact O-N 2.8Å; V116-A118 PolarHBondContact O-N 3.37Å
117	C	97.4	Very high	95.4	Very high	24 Å²	24	87.3 Å²	87.3	16%	0.162	45%	0.446	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	121.8	175	-68.9	0	0	0	0	111.2	K146 C149 K150	C117-K146 HydrophobicContact CB-CG 4.24Å; C117-C149 WeakPolarHBondContact CA-SG 3.45Å; C117-C149 HydrophobicContact CB-CB 3.66Å; C117-C149 WeakPolarHBondContact CB-SG 3.2Å; C117-C149 WeakPolarHBondContact SG-CB 3.25Å; C117-C149 PolarHBondContact SG-O 3.34Å; C117-C149 VanDerWaalsContact SG-O 3.36Å; C117-C149 CovalentContact SG-SG 2.04Å; C117-C149 PolarHBondContact SG-SG 3.19Å; C117-K150 HydrophobicContact CB-CG 4.32Å
118	A	96.8	Very high	95.4	Very high	32 Å²	32	85 Å²	85	26%	0.264	44%	0.441	S	S	.	.			trans	-141	67.2	179.2	0	0	0	0	0	108.3	G102 K104 V116	G102-A118 CarbonylContact O-C 3.54Å; G102-A118 VanDerWaalsContact O-C 3.24Å; G102-A118 PolarHBondContact O-N 3.28Å; K104-A118 HydrophobicContact CB-CB 3.99Å; K104-A118 HydrophobicContact CD-CB 3.94Å; K104-A118 HydrophobicContact CG-CB 3.81Å; V116-A118 PolarHBondContact O-N 3.37Å
119	P	96.1	Very high	95.6	Very high	28 Å²	28	84.5 Å²	84.5	18%	0.182	44%	0.441	C	S	.	.			trans	-61.3	150.8	174.9	28.8	-35	0	0	0	110.1	C121 L145 K146	P119-C121 PolarHBondContact O-N 2.91Å; P119-L145 HydrophobicContact CB-CB 3.85Å; P119-L145 HydrophobicContact CB-CD1 4.42Å; P119-L145 HydrophobicContact CG-CB 3.88Å; P119-K146 HydrophobicContact CG-CB 4.46Å
120	D	94.7	Very high	95.8	Very high	108 Å²	108	74.1 Å²	74.1	58%	0.578	40%	0.395	S	S	*	.			trans	-72.5	125.3	169.3	-176.7	14.9	0	0	0	109.3	S122	D120-S122 VanDerWaalsContact OD1-CB 3.29Å; D120-S122 WeakPolarHBondContact OD1-CB 3.07Å; D120-S122 PolarHBondContact OD1-N 3.07Å; D120-S122 PolarHBondContact OD1-OG 2.9Å
121	C	95.7	Very high	96.1	Very high	32 Å²	32	65.8 Å²	65.8	22%	0.216	36%	0.359	C	S	.	.			trans	-120.3	9.7	-178	-60.6	0	0	0	0	112.2	P119 I124 C142	P119-C121 PolarHBondContact O-N 2.91Å; C121-I124 HydrophobicContact CB-CD1 3.85Å; C121-C142 HydrophobicContact CB-CB 3.68Å; C121-C142 WeakPolarHBondContact CB-SG 3.32Å; C121-C142 VanDerWaalsContact SG-CA 3.6Å; C121-C142 WeakPolarHBondContact SG-CB 3.42Å; C121-C142 CovalentContact SG-SG 2.03Å; C121-C142 PolarHBondContact SG-SG 3.49Å
122	S	95.1	Very high	96.4	Very high	95 Å²	95	59.6 Å²	59.6	66%	0.664	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-38.5	-171.9	-45.9	0	0	0	0	112.1	D120 I124	D120-S122 VanDerWaalsContact OD1-CB 3.29Å; D120-S122 WeakPolarHBondContact OD1-CB 3.07Å; D120-S122 PolarHBondContact OD1-N 3.07Å; D120-S122 PolarHBondContact OD1-OG 2.9Å; S122-I124 VanDerWaalsContact C-N 3.33Å; S122-I124 PolarHBondContact O-N 3.01Å
123	N	95.2	Very high	96.6	Very high	145 Å²	145	59.3 Å²	59.3	78%	0.775	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	9	-176.1	-66.2	-21.2	0	0	0	114.3	T125	N123-T125 PolarHBondContact O-N 2.04Å
124	I	95.9	Very high	96.7	Very high	19 Å²	19	61 Å²	61	10%	0.097	34%	0.337	C	S	.	.			trans	-79.1	111.9	178.3	-63.1	173.9	0	0	0	108.8	C121 S122 W126 K127 E141 C142 L145	C121-I124 HydrophobicContact CB-CD1 3.85Å; S122-I124 VanDerWaalsContact C-N 3.33Å; S122-I124 PolarHBondContact O-N 3.01Å; I124-W126 VanDerWaalsContact CG2-O 3.26Å; I124-W126 WeakPolarHBondContact CG2-O 3.48Å; I124-K127 WeakPolarHBondContact O-CE 3.28Å; I124-K127 PolarHBondContact O-NZ 2.78Å; I124-E141 HydrophobicContact CD1-CB 4.1Å; I124-E141 HydrophobicContact CD1-CG 4.02Å; I124-E141 HydrophobicContact CG1-CG 4.46Å; I124-E141 HydrophobicContact CG2-CB 3.93Å; I124-E141 HydrophobicContact CG2-CG 4.41Å; I124-C142 HydrophobicContact CD1-CB 4.04Å; I124-L145 HydrophobicContact CD1-CD1 3.95Å
125	T	95.9	Very high	96.8	Very high	130 Å²	130	56 Å²	56	80%	0.798	33%	0.326	S	S	*	.			trans	-79.5	-41.9	-179.2	53.4	0	0	0	0	112.1	N123 K127	N123-T125 PolarHBondContact O-N 2.04Å; T125-K127 PolarHBondContact O-N 3.47Å
126	W	96.2	Very high	96.9	Very high	93 Å²	93	59.7 Å²	59.7	35%	0.352	34%	0.337	S	S	.	.			trans	-75.2	118.9	178.6	-179.5	-101.9	0	0	0	111.8	I124 G128 P129 Q160	I124-W126 VanDerWaalsContact CG2-O 3.26Å; I124-W126 WeakPolarHBondContact CG2-O 3.48Å; W126-G128 VanDerWaalsContact NE1-C 3.28Å; W126-G128 PolarHBondContact NE1-O 3.07Å; W126-P129 PolarHBondContact NE1-O 2.93Å; W126-Q160 HydrophobicContact CD2-CB 4.21Å; W126-Q160 HydrophobicContact CD2-CG 4.07Å; W126-Q160 HydrophobicContact CG-CG 4.07Å; W126-Q160 HydrophobicContact CZ2-CB 4.12Å
127	K	96.1	Very high	97	Very high	147 Å²	147	59.9 Å²	59.9	64%	0.639	34%	0.338	S	S	*	.			trans	-98.6	-10.3	-178.6	-58.1	-53.1	-172.8	-168.4	0	114.4	I124 T125	I124-K127 WeakPolarHBondContact O-CE 3.28Å; I124-K127 PolarHBondContact O-NZ 2.78Å; T125-K127 PolarHBondContact O-N 3.47Å
128	G	97.7	Very high	97	Very high	23 Å²	23	60.3 Å²	60.3	24%	0.237	34%	0.337	C	S	.	.	S	Bend	trans	-77.5	-176.8	179.2	0	0	0	0	0	113.7	W126 N140	W126-G128 VanDerWaalsContact NE1-C 3.28Å; W126-G128 PolarHBondContact NE1-O 3.07Å; G128-N140 WeakPolarHBondContact O-CA 3.14Å
129	P	98.6	Very high	97.1	Very high	40 Å²	40	68.2 Å²	68.2	26%	0.26	36%	0.359	S	S	.	.			trans	-65.2	159.9	174	28.7	-34.1	0	0	0	111.8	W126 T137 Y138 R139 G161 K162	W126-P129 PolarHBondContact NE1-O 2.93Å; P129-T137 HydrophobicContact CB-CG2 4.17Å; P129-Y138 VanDerWaalsContact CA-O 3.26Å; P129-Y138 WeakPolarHBondContact CA-O 2.97Å; P129-Y138 WeakPolarHBondContact CB-O 3.36Å; P129-R139 WeakPolarHBondContact CA-O 3.25Å; P129-G161 CarbonylContact C-O 3.59Å; P129-G161 CarbonylContact O-C 3.59Å; P129-G161 VanDerWaalsContact O-CA 3.3Å; P129-G161 WeakPolarHBondContact O-CA 3.02Å; P129-G161 PolarHBondContact O-N 3.05Å; P129-K162 HydrophobicContact CB-CG 4.15Å; P129-K162 HydrophobicContact CG-CG 3.89Å
130	V	98.6	Very high	97.2	Very high	0 Å²	0	69 Å²	69	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	149.4	176.4	-62.3	0	0	0	0	110.5	Y138 E141 L144 V157 G161	V130-Y138 PolarHBondContact N-O 3.36Å; V130-Y138 PolarHBondContact O-N 3.49Å; V130-E141 HydrophobicContact CG1-CB 4.2Å; V130-L144 HydrophobicContact CG2-CB 4.23Å; V130-L144 HydrophobicContact CG2-CD1 4Å; V130-V157 HydrophobicContact CB-CG1 4Å; V130-V157 HydrophobicContact CB-CG2 3.98Å; V130-V157 HydrophobicContact CG1-CG1 4.25Å; V130-V157 HydrophobicContact CG1-CG2 4.22Å; V130-V157 HydrophobicContact CG2-CG2 3.92Å; V130-G161 CarbonylContact C-O 3.57Å; V130-G161 WeakPolarHBondContact CA-O 3.29Å; V130-G161 PolarHBondContact N-O 3.32Å
131	C	98.7	Very high	97.4	Very high	1 Å²	1	66.7 Å²	66.7	1%	0.007	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	122.4	171.8	-173.1	0	0	0	0	109.6	Q158 Y159 G161 C163	C131-Q158 HydrophobicContact CB-CG 4.28Å; C131-Q158 VanDerWaalsContact O-CG 3.28Å; C131-Q158 WeakPolarHBondContact O-CG 3.41Å; C131-Q158 PolarHBondContact O-N 3.12Å; C131-Q158 PolarHBondContact SG-NE2 3.25Å; C131-Q158 VanDerWaalsContact SG-NE2 3.41Å; C131-Y159 HydrophobicContact CB-CD1 4.15Å; C131-Y159 HydrophobicContact CB-CD2 3.78Å; C131-Y159 HydrophobicContact CB-CE1 3.84Å; C131-Y159 HydrophobicContact CB-CE2 3.44Å; C131-Y159 VanDerWaalsContact CB-CE2 3.44Å; C131-Y159 HydrophobicContact CB-CG 4.14Å; C131-Y159 VanDerWaalsContact CB-CZ 3.49Å; C131-Y159 PolarHBondContact N-O 2.78Å; C131-Y159 PolarHBondContact SG-OH 3.35Å; C131-Y159 VanDerWaalsContact SG-OH 3.41Å; C131-G161 PolarHBondContact N-O 3Å; C131-C163 WeakPolarHBondContact CA-SG 3.47Å; C131-C163 HydrophobicContact CB-CB 4.02Å; C131-C163 WeakPolarHBondContact CB-SG 3.31Å; C131-C163 WeakPolarHBondContact SG-CA 3.49Å; C131-C163 WeakPolarHBondContact SG-CB 3.29Å; C131-C163 CovalentContact SG-SG 2.04Å; C131-C163 PolarHBondContact SG-SG 3.29Å
132	G	98.4	Very high	97.5	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	157.6	176	0	0	0	0	0	112.4	D134 G135 K136 E156 Q158	G132-D134 PolarHBondContact O-N 3.48Å; G132-D134 VanDerWaalsContact O-N 3.17Å; G132-G135 PolarHBondContact O-N 3.33Å; G132-K136 PolarHBondContact N-O 2.8Å; G132-E156 CarbonylContact C-O 3.52Å; G132-E156 VanDerWaalsContact CA-O 3.3Å; G132-E156 WeakPolarHBondContact CA-O 3.11Å; G132-Q158 PolarHBondContact O-NE2 2.87Å
133	L	97.9	Very high	97.6	Very high	82 Å²	82	63.7 Å²	63.7	43%	0.429	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-22.7	172.4	-76.8	173.8	0	0	0	113.1	G135 E156 Q158	L133-G135 PolarHBondContact O-N 3.44Å; L133-E156 HydrophobicContact CD1-CB 3.7Å; L133-E156 HydrophobicContact CD1-CG 4.21Å; L133-E156 HydrophobicContact CG-CB 4.29Å; L133-E156 PolarHBondContact N-O 2.62Å; L133-Q158 HydrophobicContact CD2-CB 3.81Å; L133-Q158 HydrophobicContact CG-CB 4.34Å
134	D	97.4	Very high	97.8	Very high	46 Å²	46	56.9 Å²	56.9	25%	0.246	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	5.9	174.4	68.3	-15.4	0	0	0	113.9	G132 K136 Y138 L155	G132-D134 PolarHBondContact O-N 3.48Å; G132-D134 VanDerWaalsContact O-N 3.17Å; D134-K136 PolarHBondContact O-N 3.34Å; D134-K136 WeakPolarHBondContact OD1-CB 3.44Å; D134-K136 PolarHBondContact OD1-N 2.87Å; D134-K136 WeakPolarHBondContact OD2-CD 3.41Å; D134-Y138 WeakPolarHBondContact OD1-CE2 3.04Å; D134-Y138 PolarHBondContact OD2-OH 2.98Å; D134-L155 HydrophobicContact CB-CD1 3.91Å; D134-L155 VanDerWaalsContact CG-CD1 3.46Å
135	G	97.1	Very high	97.8	Very high	25 Å²	25	57.2 Å²	57.2	26%	0.258	29%	0.293	S	S	.	.	S	Bend	trans	72.9	9.7	-178.2	0	0	0	0	0	114	G132 L133 C163	G132-G135 PolarHBondContact O-N 3.33Å; L133-G135 PolarHBondContact O-N 3.44Å; G135-C163 VanDerWaalsContact C-SG 3.52Å; G135-C163 PolarHBondContact O-SG 3.17Å; G135-C163 VanDerWaalsContact O-SG 3.38Å
136	K	98.1	Very high	97.9	Very high	121 Å²	121	55.8 Å²	55.8	53%	0.526	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-100.4	143	-179.3	-61.3	-176	-172.5	172.4	0	112	G132 D134 Y138 C163	G132-K136 PolarHBondContact N-O 2.8Å; D134-K136 PolarHBondContact O-N 3.34Å; D134-K136 WeakPolarHBondContact OD1-CB 3.44Å; D134-K136 PolarHBondContact OD1-N 2.87Å; D134-K136 WeakPolarHBondContact OD2-CD 3.41Å; K136-Y138 HydrophobicContact CB-CE2 3.86Å; K136-Y138 VanDerWaalsContact O-CD2 3.3Å; K136-Y138 WeakPolarHBondContact O-CD2 3.38Å; K136-C163 PolarHBondContact O-SG 2.81Å; K136-C163 VanDerWaalsContact O-SG 3.33Å
137	T	98.6	Very high	98	Very high	67 Å²	67	52.4 Å²	52.4	41%	0.411	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	124.6	172.2	-62.9	0	0	0	0	109.9	P129 K162 C163	P129-T137 HydrophobicContact CB-CG2 4.17Å; T137-K162 HydrophobicContact CG2-CB 3.95Å; T137-K162 HydrophobicContact CG2-CG 3.88Å; T137-C163 PolarHBondContact OG1-N 2.88Å
138	Y	98.6	Very high	98.1	Very high	33 Å²	33	50 Å²	50	13%	0.129	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	139.5	171.7	-66.9	-95.5	0	0	0	109.3	P129 V130 D134 K136 N140 L144 A147 L155	P129-Y138 VanDerWaalsContact CA-O 3.26Å; P129-Y138 WeakPolarHBondContact CA-O 2.97Å; P129-Y138 WeakPolarHBondContact CB-O 3.36Å; V130-Y138 PolarHBondContact N-O 3.36Å; V130-Y138 PolarHBondContact O-N 3.49Å; D134-Y138 WeakPolarHBondContact OD1-CE2 3.04Å; D134-Y138 PolarHBondContact OD2-OH 2.98Å; K136-Y138 HydrophobicContact CB-CE2 3.86Å; K136-Y138 VanDerWaalsContact O-CD2 3.3Å; K136-Y138 WeakPolarHBondContact O-CD2 3.38Å; Y138-N140 PolarHBondContact O-N 3.37Å; Y138-L144 HydrophobicContact CD1-CB 3.99Å; Y138-L144 HydrophobicContact CD2-CB 4.11Å; Y138-L144 HydrophobicContact CD2-CD1 3.71Å; Y138-L144 HydrophobicContact CD2-CG 4.07Å; Y138-L144 HydrophobicContact CE2-CD1 4.09Å; Y138-L144 HydrophobicContact CE2-CG 4.29Å; Y138-L144 HydrophobicContact CG-CB 3.74Å; Y138-L144 HydrophobicContact CG-CD1 4.21Å; Y138-L144 HydrophobicContact CG-CG 4.21Å; Y138-A147 HydrophobicContact CD1-CB 4.44Å; Y138-A147 HydrophobicContact CE1-CB 3.59Å; Y138-L155 HydrophobicContact CE1-CD2 4.24Å; Y138-L155 HydrophobicContact CE2-CD1 4.25Å; Y138-L155 HydrophobicContact CE2-CD2 4.19Å; Y138-L155 VanDerWaalsContact OH-CD2 3.31Å; Y138-L155 WeakPolarHBondContact OH-CD2 3.11Å
139	R	98.4	Very high	98	Very high	197 Å²	197	50.6 Å²	50.6	74%	0.743	26%	0.255	S	S	*	.	S	Bend	trans	-54.3	-27.8	-179.5	66.4	174.8	-172.4	164.2	4.7	113.9	P129 A143	P129-R139 WeakPolarHBondContact CA-O 3.25Å; R139-A143 HydrophobicContact CG-CB 3.6Å
140	N	98.3	Very high	97.9	Very high	44 Å²	44	55 Å²	55	24%	0.235	27%	0.27	C	S	.	.	S	Bend	trans	-168.9	170.7	171.9	53	47.4	0	0	0	110.1	G128 Y138 C142 A143 L144	G128-N140 WeakPolarHBondContact O-CA 3.14Å; Y138-N140 PolarHBondContact O-N 3.37Å; N140-C142 VanDerWaalsContact C-N 3.34Å; N140-C142 PolarHBondContact O-N 3.32Å; N140-C142 PolarHBondContact OD1-N 3.03Å; N140-A143 WeakPolarHBondContact O-CB 3.28Å; N140-A143 PolarHBondContact O-N 3.08Å; N140-A143 VanDerWaalsContact O-N 3.14Å; N140-A143 WeakPolarHBondContact OD1-CB 3.26Å; N140-A143 PolarHBondContact OD1-N 3.24Å; N140-L144 PolarHBondContact O-N 3.28Å
141	E	98.4	Very high	97.7	Very high	61 Å²	61	62.3 Å²	62.3	29%	0.285	30%	0.304	S	S	.	.	H	α-helix	trans	-60.6	-37.7	-179	-175.3	176	162.9	0	0	113.2	I124 V130 A143 L144 L145 V157	I124-E141 HydrophobicContact CD1-CB 4.1Å; I124-E141 HydrophobicContact CD1-CG 4.02Å; I124-E141 HydrophobicContact CG1-CG 4.46Å; I124-E141 HydrophobicContact CG2-CB 3.93Å; I124-E141 HydrophobicContact CG2-CG 4.41Å; V130-E141 HydrophobicContact CG1-CB 4.2Å; E141-A143 VanDerWaalsContact C-N 3.28Å; E141-A143 PolarHBondContact O-N 3.45Å; E141-L144 WeakPolarHBondContact O-CB 3.37Å; E141-L144 PolarHBondContact O-N 3.23Å; E141-L144 VanDerWaalsContact O-N 3.09Å; E141-L145 HydrophobicContact CG-CG 4.49Å; E141-L145 WeakPolarHBondContact O-CG 3.36Å; E141-L145 PolarHBondContact O-N 3.34Å; E141-V157 HydrophobicContact CG-CG2 4Å
142	C	97.7	Very high	97.6	Very high	45 Å²	45	65.4 Å²	65.4	30%	0.304	32%	0.319	S	S	.	.	H	α-helix	trans	-62.3	-35.8	176.8	-172.1	0	0	0	0	112.4	C121 I124 N140 K146	C121-C142 HydrophobicContact CB-CB 3.68Å; C121-C142 WeakPolarHBondContact CB-SG 3.32Å; C121-C142 VanDerWaalsContact SG-CA 3.6Å; C121-C142 WeakPolarHBondContact SG-CB 3.42Å; C121-C142 CovalentContact SG-SG 2.03Å; C121-C142 PolarHBondContact SG-SG 3.49Å; I124-C142 HydrophobicContact CD1-CB 4.04Å; N140-C142 VanDerWaalsContact C-N 3.34Å; N140-C142 PolarHBondContact O-N 3.32Å; N140-C142 PolarHBondContact OD1-N 3.03Å; C142-K146 WeakPolarHBondContact O-CB 3.32Å; C142-K146 PolarHBondContact O-N 2.89Å; C142-K146 VanDerWaalsContact O-N 3.07Å
143	A	98	Very high	97.4	Very high	19 Å²	19	70.7 Å²	70.7	16%	0.157	35%	0.353	C	S	.	.	H	α-helix	trans	-66.4	-40.1	174.4	0	0	0	0	0	111.7	R139 N140 E141 K146 A147	R139-A143 HydrophobicContact CG-CB 3.6Å; N140-A143 WeakPolarHBondContact O-CB 3.28Å; N140-A143 PolarHBondContact O-N 3.08Å; N140-A143 VanDerWaalsContact O-N 3.14Å; N140-A143 WeakPolarHBondContact OD1-CB 3.26Å; N140-A143 PolarHBondContact OD1-N 3.24Å; E141-A143 VanDerWaalsContact C-N 3.28Å; E141-A143 PolarHBondContact O-N 3.45Å; A143-K146 PolarHBondContact O-N 3.37Å; A143-A147 PolarHBondContact O-N 3.04Å
144	L	98.4	Very high	97.4	Very high	2 Å²	2	75.1 Å²	75.1	1%	0.01	37%	0.371	C	S	.	.	H	α-helix	trans	-62	-49.3	173.6	-176	152.9	0	0	0	111	V130 Y138 N140 E141 K146 A147 R148 L155 V157	V130-L144 HydrophobicContact CG2-CB 4.23Å; V130-L144 HydrophobicContact CG2-CD1 4Å; Y138-L144 HydrophobicContact CD1-CB 3.99Å; Y138-L144 HydrophobicContact CD2-CB 4.11Å; Y138-L144 HydrophobicContact CD2-CD1 3.71Å; Y138-L144 HydrophobicContact CD2-CG 4.07Å; Y138-L144 HydrophobicContact CE2-CD1 4.09Å; Y138-L144 HydrophobicContact CE2-CG 4.29Å; Y138-L144 HydrophobicContact CG-CB 3.74Å; Y138-L144 HydrophobicContact CG-CD1 4.21Å; Y138-L144 HydrophobicContact CG-CG 4.21Å; N140-L144 PolarHBondContact O-N 3.28Å; E141-L144 WeakPolarHBondContact O-CB 3.37Å; E141-L144 PolarHBondContact O-N 3.23Å; E141-L144 VanDerWaalsContact O-N 3.09Å; L144-K146 PolarHBondContact O-N 2.96Å; L144-A147 CarbonylContact O-C 2.98Å; L144-A147 WeakPolarHBondContact O-CA 3.41Å; L144-A147 WeakPolarHBondContact O-CB 3.48Å; L144-A147 PolarHBondContact O-N 2.86Å; L144-R148 PolarHBondContact O-N 3.38Å; L144-L155 HydrophobicContact CD1-CD1 4.45Å; L144-L155 HydrophobicContact CD1-CG 4.35Å; L144-L155 HydrophobicContact CD2-CD2 4.31Å; L144-L155 HydrophobicContact CD2-CG 3.95Å; L144-L155 HydrophobicContact CG-CD1 4.49Å; L144-L155 HydrophobicContact CG-CD2 3.94Å; L144-L155 HydrophobicContact CG-CG 3.89Å; L144-V157 HydrophobicContact CD1-CG2 3.79Å; L144-V157 HydrophobicContact CD2-CG2 4.37Å
145	L	97.8	Very high	97.4	Very high	25 Å²	25	73.1 Å²	73.1	13%	0.131	36%	0.361	C	S	.	.	H	α-helix	trans	-58.8	-33.6	177.9	-66.4	176.4	0	0	0	112.6	P119 I124 E141 C149	P119-L145 HydrophobicContact CB-CB 3.85Å; P119-L145 HydrophobicContact CB-CD1 4.42Å; P119-L145 HydrophobicContact CG-CB 3.88Å; I124-L145 HydrophobicContact CD1-CD1 3.95Å; E141-L145 HydrophobicContact CG-CG 4.49Å; E141-L145 WeakPolarHBondContact O-CG 3.36Å; E141-L145 PolarHBondContact O-N 3.34Å; L145-C149 PolarHBondContact O-N 3.02Å; L145-C149 VanDerWaalsContact O-N 3.07Å
146	K	97.4	Very high	97.5	Very high	100 Å²	100	77.3 Å²	77.3	44%	0.435	37%	0.374	S	S	.	.	H	α-helix	trans	-70.2	-39.3	174.5	-171.2	177.2	-176.5	177	0	112	C117 P119 C142 A143 L144 K150	C117-K146 HydrophobicContact CB-CG 4.24Å; P119-K146 HydrophobicContact CG-CB 4.46Å; C142-K146 WeakPolarHBondContact O-CB 3.32Å; C142-K146 PolarHBondContact O-N 2.89Å; C142-K146 VanDerWaalsContact O-N 3.07Å; A143-K146 PolarHBondContact O-N 3.37Å; L144-K146 PolarHBondContact O-N 2.96Å; K146-K150 WeakPolarHBondContact O-CG 3.5Å; K146-K150 PolarHBondContact O-N 3.33Å
147	A	97.6	Very high	97.5	Very high	23 Å²	23	73.8 Å²	73.8	19%	0.19	36%	0.362	C	S	.	.	H	α-helix	trans	-65	-43.6	173.2	0	0	0	0	0	111.1	Y138 A143 L144 C149 K150 E151 L155	Y138-A147 HydrophobicContact CD1-CB 4.44Å; Y138-A147 HydrophobicContact CE1-CB 3.59Å; A143-A147 PolarHBondContact O-N 3.04Å; L144-A147 CarbonylContact O-C 2.98Å; L144-A147 WeakPolarHBondContact O-CA 3.41Å; L144-A147 WeakPolarHBondContact O-CB 3.48Å; L144-A147 PolarHBondContact O-N 2.86Å; A147-C149 PolarHBondContact O-N 3.33Å; A147-K150 PolarHBondContact O-N 2.04Å; A147-E151 PolarHBondContact O-N 3.41Å; A147-L155 HydrophobicContact CB-CD2 3.86Å
148	R	97.9	Very high	97.5	Very high	97 Å²	97	71 Å²	71	37%	0.366	35%	0.345	S	S	.	.	H	α-helix	trans	-53	-50.2	174.6	-174.9	-175.9	68.8	153.9	-7.1	112.3	L144 K150 Q152 P153 L155	L144-R148 PolarHBondContact O-N 3.38Å; R148-K150 VanDerWaalsContact C-N 3.28Å; R148-K150 PolarHBondContact O-N 2.91Å; R148-Q152 WeakPolarHBondContact CA-O 3.3Å; R148-Q152 VanDerWaalsContact CG-O 3.26Å; R148-Q152 WeakPolarHBondContact CG-O 3.38Å; R148-Q152 CarbonylContact O-C 3.24Å; R148-Q152 PolarHBondContact O-N 3.41Å; R148-P153 WeakPolarHBondContact CG-O 3.29Å; R148-L155 HydrophobicContact CB-CB 4.11Å; R148-L155 HydrophobicContact CB-CD2 4.5Å; R148-L155 WeakPolarHBondContact CD-O 3.49Å; R148-L155 HydrophobicContact CG-CB 4.26Å; R148-L155 WeakPolarHBondContact CG-O 3.26Å
149	C	97.3	Very high	97.5	Very high	34 Å²	34	69.8 Å²	69.8	23%	0.23	34%	0.34	C	S	.	.	H	α-helix	trans	-64.9	-28.8	179.1	168.7	0	0	0	0	113.9	K103 C117 L145 A147	K103-C149 VanDerWaalsContact CE-SG 3.5Å; C117-C149 WeakPolarHBondContact CA-SG 3.45Å; C117-C149 HydrophobicContact CB-CB 3.66Å; C117-C149 WeakPolarHBondContact CB-SG 3.2Å; C117-C149 WeakPolarHBondContact SG-CB 3.25Å; C117-C149 PolarHBondContact SG-O 3.34Å; C117-C149 VanDerWaalsContact SG-O 3.36Å; C117-C149 CovalentContact SG-SG 2.04Å; C117-C149 PolarHBondContact SG-SG 3.19Å; L145-C149 PolarHBondContact O-N 3.02Å; L145-C149 VanDerWaalsContact O-N 3.07Å; A147-C149 PolarHBondContact O-N 3.33Å
150	K	95.4	Very high	97.5	Very high	134 Å²	134	65.8 Å²	65.8	58%	0.583	33%	0.33	S	S	*	.	H	α-helix	trans	-83.8	-46.6	-175.9	-79.9	-178.9	169.8	-167.7	0	112.9	C117 K146 A147 R148	C117-K150 HydrophobicContact CB-CG 4.32Å; K146-K150 WeakPolarHBondContact O-CG 3.5Å; K146-K150 PolarHBondContact O-N 3.33Å; A147-K150 PolarHBondContact O-N 2.04Å; R148-K150 VanDerWaalsContact C-N 3.28Å; R148-K150 PolarHBondContact O-N 2.91Å
151	E	94.4	Very high	97.4	Very high	153 Å²	153	64.6 Å²	64.6	72%	0.715	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.8	-35.8	-160.7	-75.8	164.7	-149.3	0	0	113.7	A147	A147-E151 PolarHBondContact O-N 3.41Å
152	Q	96.1	Very high	97.4	Very high	66 Å²	66	68.6 Å²	68.6	31%	0.308	34%	0.344	S	S	.	.			trans	-128.8	88	-169	-63.5	-176.6	11	0	0	111.6	R148 E154 L155	R148-Q152 WeakPolarHBondContact CA-O 3.3Å; R148-Q152 VanDerWaalsContact CG-O 3.26Å; R148-Q152 WeakPolarHBondContact CG-O 3.38Å; R148-Q152 CarbonylContact O-C 3.24Å; R148-Q152 PolarHBondContact O-N 3.41Å; Q152-E154 PolarHBondContact O-N 3Å; Q152-E154 VanDerWaalsContact O-N 3.13Å; Q152-L155 HydrophobicContact CB-CB 3.77Å; Q152-L155 HydrophobicContact CB-CD2 4.48Å; Q152-L155 VanDerWaalsContact O-CB 3.27Å; Q152-L155 WeakPolarHBondContact O-CB 3.47Å; Q152-L155 PolarHBondContact O-N 2.04Å
153	P	95.5	Very high	97.5	Very high	111 Å²	111	68.1 Å²	68.1	72%	0.721	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-29.8	-174.9	-27.3	36	0	0	0	115.1	R148	R148-P153 WeakPolarHBondContact CG-O 3.29Å
154	E	96.8	Very high	97.5	Very high	174 Å²	174	71 Å²	71	81%	0.813	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	2.6	-178.7	-58.3	-175.4	139.4	0	0	113.6	Q152 E156	Q152-E154 PolarHBondContact O-N 3Å; Q152-E154 VanDerWaalsContact O-N 3.13Å; E154-E156 PolarHBondContact O-N 3.41Å
155	L	98.3	Very high	97.4	Very high	5 Å²	5	77 Å²	77	3%	0.026	38%	0.375	C	S	.	.			trans	-70.6	117.8	-177.9	177.9	64.8	0	0	0	111.2	D134 Y138 L144 A147 R148 Q152	D134-L155 HydrophobicContact CB-CD1 3.91Å; D134-L155 VanDerWaalsContact CG-CD1 3.46Å; Y138-L155 HydrophobicContact CE1-CD2 4.24Å; Y138-L155 HydrophobicContact CE2-CD1 4.25Å; Y138-L155 HydrophobicContact CE2-CD2 4.19Å; Y138-L155 VanDerWaalsContact OH-CD2 3.31Å; Y138-L155 WeakPolarHBondContact OH-CD2 3.11Å; L144-L155 HydrophobicContact CD1-CD1 4.45Å; L144-L155 HydrophobicContact CD1-CG 4.35Å; L144-L155 HydrophobicContact CD2-CD2 4.31Å; L144-L155 HydrophobicContact CD2-CG 3.95Å; L144-L155 HydrophobicContact CG-CD1 4.49Å; L144-L155 HydrophobicContact CG-CD2 3.94Å; L144-L155 HydrophobicContact CG-CG 3.89Å; A147-L155 HydrophobicContact CB-CD2 3.86Å; R148-L155 HydrophobicContact CB-CB 4.11Å; R148-L155 HydrophobicContact CB-CD2 4.5Å; R148-L155 WeakPolarHBondContact CD-O 3.49Å; R148-L155 HydrophobicContact CG-CB 4.26Å; R148-L155 WeakPolarHBondContact CG-O 3.26Å; Q152-L155 HydrophobicContact CB-CB 3.77Å; Q152-L155 HydrophobicContact CB-CD2 4.48Å; Q152-L155 VanDerWaalsContact O-CB 3.27Å; Q152-L155 WeakPolarHBondContact O-CB 3.47Å; Q152-L155 PolarHBondContact O-N 2.04Å
156	E	98.1	Very high	97.3	Very high	113 Å²	113	79.3 Å²	79.3	53%	0.528	39%	0.391	S	S	.	.			trans	-128.8	165.3	176.6	-56.1	-173.3	157.2	0	0	111.4	G132 L133 E154	G132-E156 CarbonylContact C-O 3.52Å; G132-E156 VanDerWaalsContact CA-O 3.3Å; G132-E156 WeakPolarHBondContact CA-O 3.11Å; L133-E156 HydrophobicContact CD1-CB 3.7Å; L133-E156 HydrophobicContact CD1-CG 4.21Å; L133-E156 HydrophobicContact CG-CB 4.29Å; L133-E156 PolarHBondContact N-O 2.62Å; E154-E156 PolarHBondContact O-N 3.41Å
157	V	98.4	Very high	97.4	Very high	47 Å²	47	76.6 Å²	76.6	29%	0.285	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	125.5	169.8	176.4	0	0	0	0	108.3	V130 E141 L144 Y159	V130-V157 HydrophobicContact CB-CG1 4Å; V130-V157 HydrophobicContact CB-CG2 3.98Å; V130-V157 HydrophobicContact CG1-CG1 4.25Å; V130-V157 HydrophobicContact CG1-CG2 4.22Å; V130-V157 HydrophobicContact CG2-CG2 3.92Å; E141-V157 HydrophobicContact CG-CG2 4Å; L144-V157 HydrophobicContact CD1-CG2 3.79Å; L144-V157 HydrophobicContact CD2-CG2 4.37Å; V157-Y159 WeakPolarHBondContact CG1-O 3.3Å
158	Q	98.3	Very high	97.3	Very high	9 Å²	9	84.7 Å²	84.7	4%	0.042	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-30.8	171.7	52.9	167.3	-30.7	0	0	113.5	C131 G132 L133 P173 C188	C131-Q158 HydrophobicContact CB-CG 4.28Å; C131-Q158 VanDerWaalsContact O-CG 3.28Å; C131-Q158 WeakPolarHBondContact O-CG 3.41Å; C131-Q158 PolarHBondContact O-N 3.12Å; C131-Q158 PolarHBondContact SG-NE2 3.25Å; C131-Q158 VanDerWaalsContact SG-NE2 3.41Å; G132-Q158 PolarHBondContact O-NE2 2.87Å; L133-Q158 HydrophobicContact CD2-CB 3.81Å; L133-Q158 HydrophobicContact CG-CB 4.34Å; Q158-P173 VanDerWaalsContact O-CD 3.22Å; Q158-P173 WeakPolarHBondContact O-CD 3.43Å; Q158-P173 WeakPolarHBondContact O-CG 3.04Å; Q158-C188 WeakPolarHBondContact O-CB 3.3Å
159	Y	98.4	Very high	97.1	Very high	6 Å²	6	85.8 Å²	85.8	2%	0.024	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	160.3	170.4	55.2	-91.2	0	0	0	111.8	C131 V157 K162 C163 K164 V170 A186 C188	C131-Y159 HydrophobicContact CB-CD1 4.15Å; C131-Y159 HydrophobicContact CB-CD2 3.78Å; C131-Y159 HydrophobicContact CB-CE1 3.84Å; C131-Y159 HydrophobicContact CB-CE2 3.44Å; C131-Y159 VanDerWaalsContact CB-CE2 3.44Å; C131-Y159 HydrophobicContact CB-CG 4.14Å; C131-Y159 VanDerWaalsContact CB-CZ 3.49Å; C131-Y159 PolarHBondContact N-O 2.78Å; C131-Y159 PolarHBondContact SG-OH 3.35Å; C131-Y159 VanDerWaalsContact SG-OH 3.41Å; V157-Y159 WeakPolarHBondContact CG1-O 3.3Å; Y159-K162 WeakPolarHBondContact CE2-O 3.04Å; Y159-C163 VanDerWaalsContact OH-CA 3.28Å; Y159-C163 WeakPolarHBondContact OH-CA 3.28Å; Y159-K164 PolarHBondContact OH-N 2.84Å; Y159-V170 HydrophobicContact CD1-CG1 4.28Å; Y159-V170 HydrophobicContact CD2-CG1 4.34Å; Y159-V170 HydrophobicContact CE1-CG1 4.33Å; Y159-V170 HydrophobicContact CE2-CG1 4.38Å; Y159-V170 HydrophobicContact CG-CG1 4.28Å; Y159-A186 WeakPolarHBondContact CE1-O 3.37Å; Y159-A186 PolarHBondContact OH-O 3.49Å; Y159-A186 VanDerWaalsContact OH-O 3.07Å; Y159-C188 HydrophobicContact CD1-CB 4.18Å; Y159-C188 VanDerWaalsContact CD1-SG 3.51Å
160	Q	98.3	Very high	97.1	Very high	114 Å²	114	85 Å²	85	53%	0.533	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	146	176.5	-67.7	176.4	-2.6	0	0	111.1	W126	W126-Q160 HydrophobicContact CD2-CB 4.21Å; W126-Q160 HydrophobicContact CD2-CG 4.07Å; W126-Q160 HydrophobicContact CG-CG 4.07Å; W126-Q160 HydrophobicContact CZ2-CB 4.12Å
161	G	98	Very high	97.2	Very high	18 Å²	18	86.1 Å²	86.1	19%	0.186	43%	0.428	C	S	.	.	S	Bend	trans	99.3	-176.7	-175.3	0	0	0	0	0	113.2	P129 V130 C131	P129-G161 CarbonylContact C-O 3.59Å; P129-G161 CarbonylContact O-C 3.59Å; P129-G161 VanDerWaalsContact O-CA 3.3Å; P129-G161 WeakPolarHBondContact O-CA 3.02Å; P129-G161 PolarHBondContact O-N 3.05Å; V130-G161 CarbonylContact C-O 3.57Å; V130-G161 WeakPolarHBondContact CA-O 3.29Å; V130-G161 PolarHBondContact N-O 3.32Å; C131-G161 PolarHBondContact N-O 3Å
162	K	98.4	Very high	97.4	Very high	146 Å²	146	80.2 Å²	80.2	64%	0.635	40%	0.403	S	S	*	.	S	Bend	trans	-74.2	152.3	173.9	-57.2	-173.8	179.3	173.4	0	110.2	P129 T137 Y159	P129-K162 HydrophobicContact CB-CG 4.15Å; P129-K162 HydrophobicContact CG-CG 3.89Å; T137-K162 HydrophobicContact CG2-CB 3.95Å; T137-K162 HydrophobicContact CG2-CG 3.88Å; Y159-K162 WeakPolarHBondContact CE2-O 3.04Å
163	C	98.3	Very high	97.4	Very high	35 Å²	35	80.5 Å²	80.5	24%	0.236	41%	0.411	C	S	.	.			trans	-62.3	139.9	171.5	-60.1	0	0	0	0	110.9	C131 G135 K136 T137 Y159	C131-C163 WeakPolarHBondContact CA-SG 3.47Å; C131-C163 HydrophobicContact CB-CB 4.02Å; C131-C163 WeakPolarHBondContact CB-SG 3.31Å; C131-C163 WeakPolarHBondContact SG-CA 3.49Å; C131-C163 WeakPolarHBondContact SG-CB 3.29Å; C131-C163 CovalentContact SG-SG 2.04Å; C131-C163 PolarHBondContact SG-SG 3.29Å; G135-C163 VanDerWaalsContact C-SG 3.52Å; G135-C163 PolarHBondContact O-SG 3.17Å; G135-C163 VanDerWaalsContact O-SG 3.38Å; K136-C163 PolarHBondContact O-SG 2.81Å; K136-C163 VanDerWaalsContact O-SG 3.33Å; T137-C163 PolarHBondContact OG1-N 2.88Å; Y159-C163 VanDerWaalsContact OH-CA 3.28Å; Y159-C163 WeakPolarHBondContact OH-CA 3.28Å
164	K	98.1	Very high	97.5	Very high	80 Å²	80	79.4 Å²	79.4	35%	0.348	42%	0.42	S	S	.	.			trans	-114.3	157.4	-177	-58.9	-159.9	-179.9	-174.7	0	112.4	Y159 D169 V170 A186	Y159-K164 PolarHBondContact OH-N 2.84Å; K164-D169 PolarHBondContact NZ-O 2.03Å; K164-V170 HydrophobicContact CB-CG2 3.91Å; K164-V170 HydrophobicContact CD-CG2 3.75Å; K164-V170 HydrophobicContact CG-CG2 4.06Å; K164-A186 HydrophobicContact CB-CB 4.44Å; K164-A186 WeakPolarHBondContact O-CB 3.47Å; K164-A186 PolarHBondContact O-N 3.06Å
165	K	96.4	Very high	97.4	Very high	126 Å²	126	75.4 Å²	75.4	55%	0.548	41%	0.412	S	S	.	.	S	Bend	trans	-92.6	2.9	176.6	-71.9	-64.3	-166.2	176.5	0	114.2	N184 N185	K165-N184 CarbonylContact C-O 3.57Å; K165-N184 VanDerWaalsContact CA-O 3.23Å; K165-N184 WeakPolarHBondContact CA-O 3.4Å; K165-N184 CarbonylContact O-C 3.58Å; K165-N184 VanDerWaalsContact O-CB 3.28Å; K165-N184 WeakPolarHBondContact O-CB 3.42Å; K165-N185 WeakPolarHBondContact CD-OD1 3.46Å; K165-N185 WeakPolarHBondContact CE-OD1 3.37Å; K165-N185 PolarHBondContact NZ-OD1 2.93Å
166	T	96.6	Very high	97.4	Very high	75 Å²	75	76.8 Å²	76.8	46%	0.46	42%	0.421	S	S	.	.	S	Bend	trans	-151.5	165.9	170.7	66.7	0	0	0	0	108	R168 V170 A186	T166-R168 PolarHBondContact O-N 2.99Å; T166-R168 WeakPolarHBondContact OG1-CB 3.06Å; T166-R168 PolarHBondContact OG1-N 2.97Å; T166-V170 VanDerWaalsContact O-CG2 3.32Å; T166-V170 WeakPolarHBondContact O-CG2 3.26Å; T166-A186 WeakPolarHBondContact O-CB 3.22Å
167	C	98	Very high	97.4	Very high	42 Å²	42	72.8 Å²	72.8	28%	0.284	41%	0.405	S	S	.	.	S	Bend	trans	-75.2	2.4	171.2	-74.8	0	0	0	0	114.1	D169 V170 C178 V179	C167-D169 PolarHBondContact O-N 3.39Å; C167-V170 PolarHBondContact O-N 2.83Å; C167-C178 WeakPolarHBondContact CA-SG 3.37Å; C167-C178 HydrophobicContact CB-CB 3.72Å; C167-C178 WeakPolarHBondContact CB-SG 3.35Å; C167-C178 WeakPolarHBondContact SG-CB 3.02Å; C167-C178 CovalentContact SG-SG 2.04Å; C167-C178 PolarHBondContact SG-SG 3.09Å; C167-V179 PolarHBondContact SG-N 3.46Å
168	R	96	Very high	97.4	Very high	193 Å²	193	71.5 Å²	71.5	73%	0.728	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	125.7	175.6	-168.5	177.9	175.9	168.4	-1	109.1	T166 V170	T166-R168 PolarHBondContact O-N 2.99Å; T166-R168 WeakPolarHBondContact OG1-CB 3.06Å; T166-R168 PolarHBondContact OG1-N 2.97Å; R168-V170 PolarHBondContact O-N 3.46Å
169	D	94.4	Very high	97.4	Very high	121 Å²	121	72.2 Å²	72.2	65%	0.647	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	29.8	-179.3	-46.7	-44.4	0	0	0	113.8	K164 C167	K164-D169 PolarHBondContact NZ-O 2.03Å; C167-D169 PolarHBondContact O-N 3.39Å
170	V	97.6	Very high	97.4	Very high	18 Å²	18	73.3 Å²	73.3	11%	0.109	41%	0.41	C	S	.	.			trans	-97.2	115	168.1	178.1	0	0	0	0	108.2	Y159 K164 T166 C167 R168 C178 A186	Y159-V170 HydrophobicContact CD1-CG1 4.28Å; Y159-V170 HydrophobicContact CD2-CG1 4.34Å; Y159-V170 HydrophobicContact CE1-CG1 4.33Å; Y159-V170 HydrophobicContact CE2-CG1 4.38Å; Y159-V170 HydrophobicContact CG-CG1 4.28Å; K164-V170 HydrophobicContact CB-CG2 3.91Å; K164-V170 HydrophobicContact CD-CG2 3.75Å; K164-V170 HydrophobicContact CG-CG2 4.06Å; T166-V170 VanDerWaalsContact O-CG2 3.32Å; T166-V170 WeakPolarHBondContact O-CG2 3.26Å; C167-V170 PolarHBondContact O-N 2.83Å; R168-V170 PolarHBondContact O-N 3.46Å; V170-C178 HydrophobicContact CG1-CB 4.38Å; V170-A186 HydrophobicContact CG2-CB 4.04Å
171	L	97.1	Very high	97.3	Very high	156 Å²	156	69.4 Å²	69.4	82%	0.817	39%	0.392	S	S	*	.			trans	-98.5	102	175.9	-64.6	175.5	0	0	0	109
172	C	98.1	Very high	97.1	Very high	29 Å²	29	76.9 Å²	76.9	20%	0.196	42%	0.422	C	S	.	.			trans	-73.9	139	177.2	-68.4	0	0	0	0	111.7	S176 C178 C188	C172-S176 VanDerWaalsContact CB-O 3.28Å; C172-S176 WeakPolarHBondContact CB-O 3.49Å; C172-C178 VanDerWaalsContact SG-CA 3.6Å; C172-C178 PolarHBondContact SG-N 2.9Å; C172-C178 VanDerWaalsContact SG-N 3.41Å; C172-C188 WeakPolarHBondContact CA-SG 3.4Å; C172-C188 HydrophobicContact CB-CB 3.7Å; C172-C188 WeakPolarHBondContact CB-SG 3.46Å; C172-C188 WeakPolarHBondContact SG-CA 3.34Å; C172-C188 WeakPolarHBondContact SG-CB 3.48Å; C172-C188 CovalentContact SG-SG 2.04Å; C172-C188 PolarHBondContact SG-SG 3.07Å
173	P	97	Very high	96.8	Very high	72 Å²	72	73.4 Å²	73.4	47%	0.468	41%	0.414	S	S	.	.	S	Bend	trans	-70.9	147	179.5	29.5	-34.5	0	0	0	111.7	Q158 S175 S176	Q158-P173 VanDerWaalsContact O-CD 3.22Å; Q158-P173 WeakPolarHBondContact O-CD 3.43Å; Q158-P173 WeakPolarHBondContact O-CG 3.04Å; P173-S175 PolarHBondContact O-N 3.01Å; P173-S176 WeakPolarHBondContact O-CB 3.29Å; P173-S176 PolarHBondContact O-N 2.85Å; P173-S176 PolarHBondContact O-OG 3.24Å
174	G	96.1	Very high	96.7	Very high	88 Å²	88	76.2 Å²	76.2	91%	0.907	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	-123.7	173.3	0	0	0	0	0	113.3
175	S	95.4	Very high	96.6	Very high	91 Å²	91	74.3 Å²	74.3	64%	0.636	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	9.2	-179.7	59.9	0	0	0	0	113.6	P173	P173-S175 PolarHBondContact O-N 3.01Å
176	S	97.6	Very high	96.7	Very high	33 Å²	33	68.4 Å²	68.4	23%	0.231	40%	0.395	C	S	.	.			trans	-69.8	149.2	177.8	-60.7	0	0	0	0	111.3	C172 P173 V189	C172-S176 VanDerWaalsContact CB-O 3.28Å; C172-S176 WeakPolarHBondContact CB-O 3.49Å; P173-S176 WeakPolarHBondContact O-CB 3.29Å; P173-S176 PolarHBondContact O-N 2.85Å; P173-S176 PolarHBondContact O-OG 3.24Å; S176-V189 CarbonylContact C-O 3.56Å; S176-V189 VanDerWaalsContact CA-O 3.32Å; S176-V189 WeakPolarHBondContact CA-O 3.32Å
177	T	97.9	Very high	96.8	Very high	30 Å²	30	67.5 Å²	67.5	18%	0.184	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	142.7	179.4	-59.7	0	0	0	0	109.2	V189 C224	T177-V189 PolarHBondContact N-O 2.84Å; T177-V189 PolarHBondContact O-N 3.25Å; T177-C224 WeakPolarHBondContact CG2-O 3.42Å
178	C	98.6	Very high	96.9	Very high	19 Å²	19	66 Å²	66	13%	0.128	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	132.1	174.2	-171.9	0	0	0	0	111.1	C167 V170 C172 Y187 G227	C167-C178 WeakPolarHBondContact CA-SG 3.37Å; C167-C178 HydrophobicContact CB-CB 3.72Å; C167-C178 WeakPolarHBondContact CB-SG 3.35Å; C167-C178 WeakPolarHBondContact SG-CB 3.02Å; C167-C178 CovalentContact SG-SG 2.04Å; C167-C178 PolarHBondContact SG-SG 3.09Å; V170-C178 HydrophobicContact CG1-CB 4.38Å; C172-C178 VanDerWaalsContact SG-CA 3.6Å; C172-C178 PolarHBondContact SG-N 2.9Å; C172-C178 VanDerWaalsContact SG-N 3.41Å; C178-Y187 CarbonylContact C-O 3.59Å; C178-Y187 VanDerWaalsContact CA-O 3.29Å; C178-Y187 WeakPolarHBondContact CA-O 3.1Å; C178-G227 VanDerWaalsContact O-CA 3.28Å; C178-G227 WeakPolarHBondContact O-CA 3.47Å
179	V	98.6	Very high	97	Very high	25 Å²	25	59.2 Å²	59.2	15%	0.152	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	155.8	172.5	-59	0	0	0	0	110.3	C167 A186 Y187 V189 G227	C167-V179 PolarHBondContact SG-N 3.46Å; V179-A186 CarbonylContact O-C 3.52Å; V179-A186 WeakPolarHBondContact O-CA 3.45Å; V179-Y187 PolarHBondContact N-O 3.18Å; V179-Y187 PolarHBondContact O-N 3.37Å; V179-V189 HydrophobicContact CB-CG2 4.29Å; V179-V189 HydrophobicContact CG1-CG2 3.62Å; V179-V189 HydrophobicContact CG2-CB 4.45Å; V179-V189 HydrophobicContact CG2-CG1 3.92Å; V179-V189 HydrophobicContact CG2-CG2 3.63Å; V179-G227 CarbonylContact C-O 3.34Å; V179-G227 WeakPolarHBondContact CA-O 3.42Å
180	V	98.3	Very high	97.1	Very high	28 Å²	28	58.5 Å²	58.5	17%	0.17	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	147.6	171.2	-62.1	0	0	0	0	112.8	N185 A186 G227 R228	V180-N185 VanDerWaalsContact CA-O 3.26Å; V180-N185 WeakPolarHBondContact CA-O 3.28Å; V180-A186 HydrophobicContact CG1-CB 4.45Å; V180-G227 PolarHBondContact N-O 3.14Å; V180-R228 HydrophobicContact CG2-CB 3.99Å
181	D	96.8	Very high	97.1	Very high	32 Å²	32	58.1 Å²	58.1	17%	0.171	35%	0.351	C	S	.	.			trans	-84.9	-178.7	170.2	72.7	20.2	0	0	0	112.8	T183 N184 N185 Y187	D181-T183 PolarHBondContact O-N 2.94Å; D181-T183 VanDerWaalsContact OD1-C 3.23Å; D181-T183 VanDerWaalsContact OD1-CA 3.27Å; D181-T183 WeakPolarHBondContact OD1-CA 3.47Å; D181-T183 PolarHBondContact OD1-N 2.77Å; D181-T183 PolarHBondContact OD1-OG1 3.22Å; D181-T183 PolarHBondContact OD2-OG1 3.03Å; D181-N184 WeakPolarHBondContact O-CA 3.4Å; D181-N184 PolarHBondContact O-N 2.98Å; D181-N184 PolarHBondContact OD1-N 3.35Å; D181-N184 VanDerWaalsContact OD1-N 3.07Å; D181-N185 PolarHBondContact N-O 3.05Å; D181-N185 PolarHBondContact OD1-N 3.25Å; D181-N185 WeakPolarHBondContact OD2-CB 3.47Å; D181-N185 PolarHBondContact OD2-ND2 3.37Å; D181-Y187 HydrophobicContact CB-CE2 3.76Å; D181-Y187 VanDerWaalsContact OD2-CE2 3.25Å; D181-Y187 WeakPolarHBondContact OD2-CE2 3.28Å; D181-Y187 PolarHBondContact OD2-OH 3.04Å
182	Q	92.9	Very high	97.1	Very high	175 Å²	175	55.4 Å²	55.4	82%	0.818	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-16.5	179.2	69.9	-78.6	2.1	0	0	114.5
183	T	93.3	Very high	97.1	Very high	74 Å²	74	61.3 Å²	61.3	45%	0.454	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	16.3	174.5	64.7	0	0	0	0	112.2	D181 N185	D181-T183 PolarHBondContact O-N 2.94Å; D181-T183 VanDerWaalsContact OD1-C 3.23Å; D181-T183 VanDerWaalsContact OD1-CA 3.27Å; D181-T183 WeakPolarHBondContact OD1-CA 3.47Å; D181-T183 PolarHBondContact OD1-N 2.77Å; D181-T183 PolarHBondContact OD1-OG1 3.22Å; D181-T183 PolarHBondContact OD2-OG1 3.03Å; T183-N185 PolarHBondContact O-N 3Å; T183-N185 PolarHBondContact OG1-ND2 3.44Å
184	N	95.3	Very high	97.1	Very high	94 Å²	94	64.7 Å²	64.7	50%	0.503	37%	0.368	S	S	.	.			trans	62.2	14.6	-177.2	-68.5	-45.6	0	0	0	115.5	K165 D181 A186	K165-N184 CarbonylContact C-O 3.57Å; K165-N184 VanDerWaalsContact CA-O 3.23Å; K165-N184 WeakPolarHBondContact CA-O 3.4Å; K165-N184 CarbonylContact O-C 3.58Å; K165-N184 VanDerWaalsContact O-CB 3.28Å; K165-N184 WeakPolarHBondContact O-CB 3.42Å; D181-N184 WeakPolarHBondContact O-CA 3.4Å; D181-N184 PolarHBondContact O-N 2.98Å; D181-N184 PolarHBondContact OD1-N 3.35Å; D181-N184 VanDerWaalsContact OD1-N 3.07Å; N184-A186 PolarHBondContact O-N 2.86Å
185	N	97.4	Very high	97.2	Very high	39 Å²	39	61.4 Å²	61.4	21%	0.209	33%	0.331	C	S	.	.			trans	-67.7	134.4	174.9	-52.7	-51.2	0	0	0	110	K165 V180 D181 T183 Y187	K165-N185 WeakPolarHBondContact CD-OD1 3.46Å; K165-N185 WeakPolarHBondContact CE-OD1 3.37Å; K165-N185 PolarHBondContact NZ-OD1 2.93Å; V180-N185 VanDerWaalsContact CA-O 3.26Å; V180-N185 WeakPolarHBondContact CA-O 3.28Å; D181-N185 PolarHBondContact N-O 3.05Å; D181-N185 PolarHBondContact OD1-N 3.25Å; D181-N185 WeakPolarHBondContact OD2-CB 3.47Å; D181-N185 PolarHBondContact OD2-ND2 3.37Å; T183-N185 PolarHBondContact O-N 3Å; T183-N185 PolarHBondContact OG1-ND2 3.44Å; N185-Y187 HydrophobicContact CB-CE2 3.7Å; N185-Y187 WeakPolarHBondContact O-CD2 3.4Å; N185-Y187 WeakPolarHBondContact O-CE2 3.32Å
186	A	98.4	Very high	97.3	Very high	2 Å²	2	61.7 Å²	61.7	2%	0.017	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	133.9	-179.2	0	0	0	0	0	111.9	Y159 K164 T166 V170 V179 V180 N184	Y159-A186 WeakPolarHBondContact CE1-O 3.37Å; Y159-A186 PolarHBondContact OH-O 3.49Å; Y159-A186 VanDerWaalsContact OH-O 3.07Å; K164-A186 HydrophobicContact CB-CB 4.44Å; K164-A186 WeakPolarHBondContact O-CB 3.47Å; K164-A186 PolarHBondContact O-N 3.06Å; T166-A186 WeakPolarHBondContact O-CB 3.22Å; V170-A186 HydrophobicContact CG2-CB 4.04Å; V179-A186 CarbonylContact O-C 3.52Å; V179-A186 WeakPolarHBondContact O-CA 3.45Å; V180-A186 HydrophobicContact CG1-CB 4.45Å; N184-A186 PolarHBondContact O-N 2.86Å
187	Y	98.6	Very high	97.2	Very high	56 Å²	56	67.5 Å²	67.5	22%	0.22	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	145.2	178.3	-56.7	-94.8	0	0	0	112.2	C178 V179 D181 N185	C178-Y187 CarbonylContact C-O 3.59Å; C178-Y187 VanDerWaalsContact CA-O 3.29Å; C178-Y187 WeakPolarHBondContact CA-O 3.1Å; V179-Y187 PolarHBondContact N-O 3.18Å; V179-Y187 PolarHBondContact O-N 3.37Å; D181-Y187 HydrophobicContact CB-CE2 3.76Å; D181-Y187 VanDerWaalsContact OD2-CE2 3.25Å; D181-Y187 WeakPolarHBondContact OD2-CE2 3.28Å; D181-Y187 PolarHBondContact OD2-OH 3.04Å; N185-Y187 HydrophobicContact CB-CE2 3.7Å; N185-Y187 WeakPolarHBondContact O-CD2 3.4Å; N185-Y187 WeakPolarHBondContact O-CE2 3.32Å
188	C	98.6	Very high	97	Very high	11 Å²	11	67.7 Å²	67.7	7%	0.074	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	114.5	171.1	-70.5	0	0	0	0	110.1	Q158 Y159 C172	Q158-C188 WeakPolarHBondContact O-CB 3.3Å; Y159-C188 HydrophobicContact CD1-CB 4.18Å; Y159-C188 VanDerWaalsContact CD1-SG 3.51Å; C172-C188 WeakPolarHBondContact CA-SG 3.4Å; C172-C188 HydrophobicContact CB-CB 3.7Å; C172-C188 WeakPolarHBondContact CB-SG 3.46Å; C172-C188 WeakPolarHBondContact SG-CA 3.34Å; C172-C188 WeakPolarHBondContact SG-CB 3.48Å; C172-C188 CovalentContact SG-SG 2.04Å; C172-C188 PolarHBondContact SG-SG 3.07Å
189	V	98.2	Very high	96.8	Very high	51 Å²	51	72.7 Å²	72.7	31%	0.309	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	155.8	-173.5	-58.9	0	0	0	0	111.5	S176 T177 V179	S176-V189 CarbonylContact C-O 3.56Å; S176-V189 VanDerWaalsContact CA-O 3.32Å; S176-V189 WeakPolarHBondContact CA-O 3.32Å; T177-V189 PolarHBondContact N-O 2.84Å; T177-V189 PolarHBondContact O-N 3.25Å; V179-V189 HydrophobicContact CB-CG2 4.29Å; V179-V189 HydrophobicContact CG1-CG2 3.62Å; V179-V189 HydrophobicContact CG2-CB 4.45Å; V179-V189 HydrophobicContact CG2-CG1 3.92Å; V179-V189 HydrophobicContact CG2-CG2 3.63Å
190	T	97.9	Very high	96.6	Very high	105 Å²	105	73.3 Å²	73.3	64%	0.644	39%	0.392	S	S	*	.			trans	-92.4	109.7	173.5	-58.4	0	0	0	0	109.8	N192	T190-N192 PolarHBondContact O-N 2.81Å
191	C	97.9	Very high	96.3	Very high	10 Å²	10	77 Å²	77	7%	0.068	42%	0.417	C	S	.	.			trans	-70	130.8	176.9	-58.6	0	0	0	0	111.3	R193 C224 L225	C191-R193 PolarHBondContact O-N 3.11Å; C191-C224 WeakPolarHBondContact CA-SG 3.23Å; C191-C224 HydrophobicContact CB-CB 3.77Å; C191-C224 WeakPolarHBondContact CB-SG 3.43Å; C191-C224 WeakPolarHBondContact SG-CB 3.3Å; C191-C224 CovalentContact SG-SG 2.03Å; C191-C224 PolarHBondContact SG-SG 3.17Å; C191-L225 HydrophobicContact CB-CD2 4.22Å
192	N	97.3	Very high	96.1	Very high	99 Å²	99	83.8 Å²	83.8	53%	0.529	45%	0.447	S	S	.	.			trans	-67.6	115.9	168.3	-175.7	13.1	0	0	0	109.9	T190 I194 K221	T190-N192 PolarHBondContact O-N 2.81Å; N192-I194 PolarHBondContact ND2-O 2.99Å; N192-I194 PolarHBondContact OD1-N 2.05Å; N192-I194 VanDerWaalsContact OD1-N 3.07Å; N192-I194 PolarHBondContact OD1-O 3.35Å; N192-K221 WeakPolarHBondContact O-CG 3.26Å
193	R	96.1	Very high	96.3	Very high	154 Å²	154	78.8 Å²	78.8	58%	0.581	42%	0.424	S	S	*	.			trans	-95	-13.7	-179.1	-63.3	-170.8	179	-160.3	0	113.4	C191 K221	C191-R193 PolarHBondContact O-N 3.11Å; R193-K221 WeakPolarHBondContact O-CE 3.21Å; R193-K221 PolarHBondContact O-NZ 2.9Å
194	I	97.6	Very high	96.5	Very high	142 Å²	142	78.2 Å²	78.2	73%	0.728	41%	0.414	S	S	*	.			trans	-108.6	119.1	-176	-56	173.5	0	0	0	108.1	N192	N192-I194 PolarHBondContact ND2-O 2.99Å; N192-I194 PolarHBondContact OD1-N 2.05Å; N192-I194 VanDerWaalsContact OD1-N 3.07Å; N192-I194 PolarHBondContact OD1-O 3.35Å
195	C	97.9	Very high	96.6	Very high	19 Å²	19	74.8 Å²	74.8	13%	0.128	40%	0.395	C	S	.	.			trans	-119.2	140.8	176.4	-70.5	0	0	0	0	109.3	C217 H218	C195-C217 WeakPolarHBondContact CA-SG 2.95Å; C195-C217 HydrophobicContact CB-CB 3.76Å; C195-C217 WeakPolarHBondContact CB-SG 3.34Å; C195-C217 WeakPolarHBondContact SG-CB 3.41Å; C195-C217 PolarHBondContact SG-O 3.36Å; C195-C217 CovalentContact SG-SG 2.05Å; C195-C217 PolarHBondContact SG-SG 3.33Å; C195-H218 WeakPolarHBondContact CB-CE1 3.11Å; C195-H218 WeakPolarHBondContact CB-NE2 3.46Å
196	P	97.3	Very high	96.7	Very high	98 Å²	98	73.1 Å²	73.1	64%	0.636	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-65.9	146.5	170.8	28.4	-33.3	0	0	0	110.1
197	E	95.8	Very high	96.7	Very high	154 Å²	154	73.1 Å²	73.1	72%	0.72	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-62.7	143.8	172.2	-69.6	-57.7	141.8	0	0	110.5
198	P	94.9	Very high	96.6	Very high	34 Å²	34	71.8 Å²	71.8	22%	0.221	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-67.5	138.6	-178.2	30	-35.6	0	0	0	111	A214	P198-A214 HydrophobicContact CG-CB 4.15Å
199	T	94.5	Very high	96.6	Very high	125 Å²	125	73.7 Å²	73.7	77%	0.767	39%	0.393	S	S	*	.	S	Bend	trans	-95.8	-16.8	179.9	57.5	0	0	0	0	113	Q203	T199-Q203 PolarHBondContact OG1-NE2 3.2Å
200	S	94.2	Very high	96.5	Very high	38 Å²	38	72.8 Å²	72.8	27%	0.266	39%	0.394	S	S	.	.	S	Bend	trans	-147.6	154.1	178.1	71	0	0	0	0	112.3	E202 Q203	S200-E202 PolarHBondContact O-N 3.33Å; S200-Q203 PolarHBondContact O-N 3.26Å
201	P	92.3	Very high	96.6	Very high	106 Å²	106	72.1 Å²	72.1	69%	0.688	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-62.2	-19.7	174.5	-24.4	35.3	0	0	0	114.9	Q203 Y204	P201-Q203 PolarHBondContact O-N 3.24Å; P201-Y204 VanDerWaalsContact O-CD2 3.29Å; P201-Y204 WeakPolarHBondContact O-CD2 3.38Å; P201-Y204 PolarHBondContact O-N 3.19Å
202	E	92.5	Very high	96.6	Very high	173 Å²	173	74.3 Å²	74.3	81%	0.808	40%	0.398	S	S	*	.	G	3₁₀ helix	trans	-72.1	-16.7	179.6	-64.4	171.9	-175	0	0	112.7	S200 Y204	S200-E202 PolarHBondContact O-N 3.33Å; E202-Y204 VanDerWaalsContact C-N 3.3Å; E202-Y204 PolarHBondContact O-N 3.49Å
203	Q	95.7	Very high	96.6	Very high	70 Å²	70	70.6 Å²	70.6	33%	0.327	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-77.7	-14.9	178.6	-68.5	176.4	-12.3	0	0	113.6	T199 S200 P201 A214 S215	T199-Q203 PolarHBondContact OG1-NE2 3.2Å; S200-Q203 PolarHBondContact O-N 3.26Å; P201-Q203 PolarHBondContact O-N 3.24Å; Q203-A214 CarbonylContact C-O 3.38Å; Q203-S215 WeakPolarHBondContact O-CA 3.27Å
204	Y	97.9	Very high	96.7	Very high	63 Å²	63	64.3 Å²	64.3	25%	0.247	36%	0.358	C	S	.	.			trans	-64.3	146.7	179.9	-77.3	-96.2	0	0	0	110.8	P201 E202 T212 Y213 A214 G236 K237	P201-Y204 VanDerWaalsContact O-CD2 3.29Å; P201-Y204 WeakPolarHBondContact O-CD2 3.38Å; P201-Y204 PolarHBondContact O-N 3.19Å; E202-Y204 VanDerWaalsContact C-N 3.3Å; E202-Y204 PolarHBondContact O-N 3.49Å; Y204-T212 HydrophobicContact CD1-CG2 3.66Å; Y204-T212 HydrophobicContact CE1-CG2 4.37Å; Y204-Y213 CarbonylContact C-O 2.88Å; Y204-Y213 VanDerWaalsContact CA-O 3.3Å; Y204-Y213 WeakPolarHBondContact CA-O 3.26Å; Y204-A214 HydrophobicContact CE1-CB 4.31Å; Y204-G236 CarbonylContact C-O 3.49Å; Y204-G236 CarbonylContact O-C 3.51Å; Y204-G236 VanDerWaalsContact O-CA 3.25Å; Y204-G236 WeakPolarHBondContact O-CA 3.21Å; Y204-G236 PolarHBondContact O-N 2.91Å; Y204-K237 HydrophobicContact CD1-CG 4.09Å; Y204-K237 HydrophobicContact CG-CG 4.08Å
205	L	98.2	Very high	96.8	Very high	21 Å²	21	58.2 Å²	58.2	11%	0.11	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	143.7	-179.1	-59.4	175.4	0	0	0	110.2	T212 Y213 A216 L219 L232 E235 G236	L205-T212 CarbonylContact O-C 3.59Å; L205-T212 WeakPolarHBondContact O-CA 3.48Å; L205-Y213 PolarHBondContact N-O 3.01Å; L205-Y213 PolarHBondContact O-N 2.95Å; L205-A216 HydrophobicContact CD1-CB 3.96Å; L205-L219 HydrophobicContact CD1-CB 4.43Å; L205-L219 HydrophobicContact CD1-CD2 4.07Å; L205-L232 HydrophobicContact CB-CD1 3.7Å; L205-L232 HydrophobicContact CD1-CD1 4.2Å; L205-L232 HydrophobicContact CD2-CD1 3.83Å; L205-L232 HydrophobicContact CG-CD1 4.11Å; L205-E235 HydrophobicContact CD2-CG 4.21Å; L205-G236 CarbonylContact C-O 3.53Å; L205-G236 WeakPolarHBondContact CA-O 3.03Å; L205-G236 PolarHBondContact N-O 3.01Å
206	C	98.4	Very high	96.8	Very high	5 Å²	5	59.4 Å²	59.4	3%	0.034	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	121.1	168.2	-173.1	0	0	0	0	109.5	A233 Y234 G236 C238	C206-A233 HydrophobicContact CB-CB 4.43Å; C206-A233 WeakPolarHBondContact O-CA 3.48Å; C206-A233 VanDerWaalsContact O-CB 3.3Å; C206-A233 WeakPolarHBondContact O-CB 3.05Å; C206-A233 PolarHBondContact O-N 3.13Å; C206-Y234 HydrophobicContact CB-CD1 4.38Å; C206-Y234 HydrophobicContact CB-CD2 3.82Å; C206-Y234 HydrophobicContact CB-CE1 4.12Å; C206-Y234 HydrophobicContact CB-CE2 3.53Å; C206-Y234 HydrophobicContact CB-CG 4.23Å; C206-Y234 PolarHBondContact N-O 3.42Å; C206-Y234 PolarHBondContact O-N 3.43Å; C206-Y234 VanDerWaalsContact SG-CZ 3.57Å; C206-G236 PolarHBondContact N-O 2.96Å; C206-C238 WeakPolarHBondContact CA-SG 3.46Å; C206-C238 HydrophobicContact CB-CB 4Å; C206-C238 WeakPolarHBondContact CB-SG 3.38Å; C206-C238 WeakPolarHBondContact SG-CA 3.13Å; C206-C238 WeakPolarHBondContact SG-CB 3.01Å; C206-C238 CovalentContact SG-SG 2.04Å; C206-C238 PolarHBondContact SG-SG 3.31Å
207	G	98.4	Very high	96.8	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.01	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	159.2	172.9	0	0	0	0	0	112.3	D209 G210 I211	G207-D209 WeakPolarHBondContact CA-OD1 3.4Å; G207-D209 PolarHBondContact O-N 3.27Å; G207-G210 PolarHBondContact O-N 2.81Å; G207-I211 PolarHBondContact N-O 2.03Å
208	N	97.4	Very high	97	Very high	28 Å²	28	50.8 Å²	50.8	15%	0.15	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-14.6	174.9	-64.9	-51.2	0	0	0	113.8	G210 I230 G231 A233 R263 R265	N208-G210 PolarHBondContact O-N 2.88Å; N208-I230 WeakPolarHBondContact CB-O 3.43Å; N208-I230 PolarHBondContact ND2-O 2.92Å; N208-G231 PolarHBondContact N-O 3.07Å; N208-G231 VanDerWaalsContact N-O 3.11Å; N208-G231 WeakPolarHBondContact ND2-CA 3.13Å; N208-G231 PolarHBondContact ND2-O 3.46Å; N208-A233 VanDerWaalsContact OD1-CA 3.23Å; N208-A233 WeakPolarHBondContact OD1-CA 3.5Å; N208-A233 WeakPolarHBondContact OD1-CB 3.46Å; N208-A233 PolarHBondContact OD1-N 3.31Å; N208-R263 VanDerWaalsContact O-CZ 3.25Å; N208-R263 PolarHBondContact O-NE 2.91Å; N208-R263 PolarHBondContact O-NH2 3.41Å; N208-R265 VanDerWaalsContact CG-CZ 3.49Å; N208-R265 VanDerWaalsContact CG-NE 3.28Å; N208-R265 VanDerWaalsContact ND2-CZ 3.3Å; N208-R265 PolarHBondContact ND2-NE 2.85Å; N208-R265 PolarHBondContact ND2-NH2 2.69Å; N208-R265 PolarHBondContact OD1-NE 3.47Å; N208-R265 PolarHBondContact OD1-NH2 2.99Å
209	D	97.6	Very high	97.1	Very high	52 Å²	52	50 Å²	50	28%	0.278	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-5	170.2	62	-9	0	0	0	113.1	G207 I211 Y213 I230 R263	G207-D209 WeakPolarHBondContact CA-OD1 3.4Å; G207-D209 PolarHBondContact O-N 3.27Å; D209-I211 VanDerWaalsContact C-N 3.34Å; D209-I211 PolarHBondContact OD1-N 3.18Å; D209-I211 VanDerWaalsContact OD1-N 3.11Å; D209-I211 WeakPolarHBondContact OD2-CD1 3.46Å; D209-Y213 PolarHBondContact OD2-OH 3.07Å; D209-I230 HydrophobicContact CB-CG2 4.02Å; D209-R263 VanDerWaalsContact C-NH1 3.31Å; D209-R263 PolarHBondContact O-NH1 2.97Å
210	G	97.5	Very high	97.3	Very high	32 Å²	32	52.9 Å²	52.9	33%	0.33	28%	0.284	S	S	.	.	S	Bend	trans	81.5	12.8	-179.1	0	0	0	0	0	113.6	G207 N208 C238	G207-G210 PolarHBondContact O-N 2.81Å; N208-G210 PolarHBondContact O-N 2.88Å; G210-C238 PolarHBondContact O-SG 2.92Å
211	I	98.4	Very high	97.5	Very high	90 Å²	90	54.3 Å²	54.3	46%	0.462	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-94	135.2	178.3	-59.4	-176.6	0	0	0	109.9	G207 D209 Y213 C238	G207-I211 PolarHBondContact N-O 2.03Å; D209-I211 VanDerWaalsContact C-N 3.34Å; D209-I211 PolarHBondContact OD1-N 3.18Å; D209-I211 VanDerWaalsContact OD1-N 3.11Å; D209-I211 WeakPolarHBondContact OD2-CD1 3.46Å; I211-Y213 HydrophobicContact CB-CE2 3.87Å; I211-Y213 HydrophobicContact CG2-CE1 4.17Å; I211-Y213 HydrophobicContact CG2-CE2 4.06Å; I211-Y213 VanDerWaalsContact O-CD2 3.26Å; I211-Y213 WeakPolarHBondContact O-CD2 3.42Å; I211-Y213 WeakPolarHBondContact O-CE2 3.48Å; I211-C238 PolarHBondContact O-SG 2.88Å; I211-C238 VanDerWaalsContact O-SG 3.33Å
212	T	98.5	Very high	97.8	Very high	56 Å²	56	50.5 Å²	50.5	34%	0.344	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	120.8	170.9	-63.7	0	0	0	0	109.9	Y204 L205 K237 C238	Y204-T212 HydrophobicContact CD1-CG2 3.66Å; Y204-T212 HydrophobicContact CE1-CG2 4.37Å; L205-T212 CarbonylContact O-C 3.59Å; L205-T212 WeakPolarHBondContact O-CA 3.48Å; T212-K237 HydrophobicContact CG2-CB 3.98Å; T212-K237 HydrophobicContact CG2-CG 3.86Å; T212-C238 WeakPolarHBondContact OG1-CB 3.43Å; T212-C238 PolarHBondContact OG1-N 3.38Å
213	Y	98.6	Very high	98.1	Very high	21 Å²	21	43.9 Å²	43.9	8%	0.082	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	137.1	175.8	-65.1	-81.8	0	0	0	110.5	Y204 L205 D209 I211 S215 H218 L219 A222 I230	Y204-Y213 CarbonylContact C-O 2.88Å; Y204-Y213 VanDerWaalsContact CA-O 3.3Å; Y204-Y213 WeakPolarHBondContact CA-O 3.26Å; L205-Y213 PolarHBondContact N-O 3.01Å; L205-Y213 PolarHBondContact O-N 2.95Å; D209-Y213 PolarHBondContact OD2-OH 3.07Å; I211-Y213 HydrophobicContact CB-CE2 3.87Å; I211-Y213 HydrophobicContact CG2-CE1 4.17Å; I211-Y213 HydrophobicContact CG2-CE2 4.06Å; I211-Y213 VanDerWaalsContact O-CD2 3.26Å; I211-Y213 WeakPolarHBondContact O-CD2 3.42Å; I211-Y213 WeakPolarHBondContact O-CE2 3.48Å; Y213-S215 VanDerWaalsContact C-N 3.26Å; Y213-S215 PolarHBondContact O-N 2.91Å; Y213-H218 HydrophobicContact CD1-CB 4.29Å; Y213-L219 HydrophobicContact CD1-CB 4.26Å; Y213-L219 HydrophobicContact CD2-CB 4.13Å; Y213-L219 HydrophobicContact CD2-CD1 3.61Å; Y213-L219 HydrophobicContact CD2-CG 4.39Å; Y213-L219 HydrophobicContact CE1-CD1 4.47Å; Y213-L219 HydrophobicContact CE2-CD1 3.44Å; Y213-L219 VanDerWaalsContact CE2-CD1 3.44Å; Y213-L219 HydrophobicContact CG-CB 3.87Å; Y213-L219 HydrophobicContact CG-CD1 4.17Å; Y213-A222 HydrophobicContact CD1-CB 4.4Å; Y213-A222 HydrophobicContact CE1-CB 3.44Å; Y213-A222 VanDerWaalsContact CE1-CB 3.44Å; Y213-I230 WeakPolarHBondContact OH-CD1 3.24Å
214	A	98.2	Very high	98.3	Very high	23 Å²	23	41.6 Å²	41.6	19%	0.19	23%	0.226	C	C	.	.	S	Bend	trans	-65.2	-28.3	-179.8	0	0	0	0	0	113.4	P198 Q203 Y204	P198-A214 HydrophobicContact CG-CB 4.15Å; Q203-A214 CarbonylContact C-O 3.38Å; Y204-A214 HydrophobicContact CE1-CB 4.31Å
215	S	98	Very high	98.3	Very high	13 Å²	13	42.5 Å²	42.5	9%	0.091	23%	0.234	C	C	.	.	S	Bend	trans	-161.1	172	176	70.8	0	0	0	0	112.1	Q203 Y213 C217 H218 L219	Q203-S215 WeakPolarHBondContact O-CA 3.27Å; Y213-S215 VanDerWaalsContact C-N 3.26Å; Y213-S215 PolarHBondContact O-N 2.91Å; S215-C217 PolarHBondContact O-N 3.31Å; S215-C217 PolarHBondContact OG-N 2.04Å; S215-H218 WeakPolarHBondContact O-CB 3.02Å; S215-H218 PolarHBondContact O-N 3.22Å; S215-H218 PolarHBondContact OG-ND1 3.13Å; S215-L219 PolarHBondContact O-N 2.95Å; S215-L219 VanDerWaalsContact O-N 3.08Å
216	A	98.1	Very high	98.3	Very high	44 Å²	44	45.2 Å²	45.2	36%	0.364	25%	0.249	S	C	.	.	H	α-helix	trans	-56.3	-32.7	171.6	0	0	0	0	0	113	L205 R220	L205-A216 HydrophobicContact CD1-CB 3.96Å; A216-R220 WeakPolarHBondContact O-CB 3.38Å; A216-R220 VanDerWaalsContact O-CG 3.29Å; A216-R220 WeakPolarHBondContact O-CG 3.01Å; A216-R220 PolarHBondContact O-N 2.8Å
217	C	98.4	Very high	98.3	Very high	29 Å²	29	45.5 Å²	45.5	20%	0.196	25%	0.252	C	S	.	.	H	α-helix	trans	-62.4	-45.7	174.2	-177	0	0	0	0	111.1	C195 S215 R220 K221	C195-C217 WeakPolarHBondContact CA-SG 2.95Å; C195-C217 HydrophobicContact CB-CB 3.76Å; C195-C217 WeakPolarHBondContact CB-SG 3.34Å; C195-C217 WeakPolarHBondContact SG-CB 3.41Å; C195-C217 PolarHBondContact SG-O 3.36Å; C195-C217 CovalentContact SG-SG 2.05Å; C195-C217 PolarHBondContact SG-SG 3.33Å; S215-C217 PolarHBondContact O-N 3.31Å; S215-C217 PolarHBondContact OG-N 2.04Å; C217-R220 PolarHBondContact O-N 3.05Å; C217-K221 VanDerWaalsContact O-CB 3.32Å; C217-K221 WeakPolarHBondContact O-CB 3.48Å; C217-K221 PolarHBondContact O-N 3.41Å
218	H	98.6	Very high	98.2	Very high	43 Å²	43	52.5 Å²	52.5	20%	0.199	28%	0.278	C	S	.	.	H	α-helix	trans	-65	-40.6	-179.9	-67.9	91.2	0	0	0	112.1	C195 Y213 S215 K221 A222	C195-H218 WeakPolarHBondContact CB-CE1 3.11Å; C195-H218 WeakPolarHBondContact CB-NE2 3.46Å; Y213-H218 HydrophobicContact CD1-CB 4.29Å; S215-H218 WeakPolarHBondContact O-CB 3.02Å; S215-H218 PolarHBondContact O-N 3.22Å; S215-H218 PolarHBondContact OG-ND1 3.13Å; H218-K221 PolarHBondContact O-N 2.95Å; H218-A222 WeakPolarHBondContact O-CB 3.48Å; H218-A222 PolarHBondContact O-N 2.91Å
219	L	98.6	Very high	98.3	Very high	16 Å²	16	55.8 Å²	55.8	8%	0.084	30%	0.303	C	S	.	.	H	α-helix	trans	-63.1	-45.6	174.1	176	60.9	0	0	0	111.8	L205 Y213 S215 A222 T223 I230 L232	L205-L219 HydrophobicContact CD1-CB 4.43Å; L205-L219 HydrophobicContact CD1-CD2 4.07Å; Y213-L219 HydrophobicContact CD1-CB 4.26Å; Y213-L219 HydrophobicContact CD2-CB 4.13Å; Y213-L219 HydrophobicContact CD2-CD1 3.61Å; Y213-L219 HydrophobicContact CD2-CG 4.39Å; Y213-L219 HydrophobicContact CE1-CD1 4.47Å; Y213-L219 HydrophobicContact CE2-CD1 3.44Å; Y213-L219 VanDerWaalsContact CE2-CD1 3.44Å; Y213-L219 HydrophobicContact CG-CB 3.87Å; Y213-L219 HydrophobicContact CG-CD1 4.17Å; S215-L219 PolarHBondContact O-N 2.95Å; S215-L219 VanDerWaalsContact O-N 3.08Å; L219-A222 PolarHBondContact O-N 3.24Å; L219-T223 WeakPolarHBondContact O-CB 3.37Å; L219-T223 PolarHBondContact O-N 3.26Å; L219-T223 PolarHBondContact O-OG1 3.34Å; L219-I230 HydrophobicContact CD1-CB 4.3Å; L219-I230 HydrophobicContact CD1-CG2 4.16Å; L219-L232 HydrophobicContact CD2-CB 4.36Å; L219-L232 HydrophobicContact CD2-CD1 4.24Å
220	R	98.6	Very high	98.3	Very high	186 Å²	186	54.2 Å²	54.2	70%	0.702	30%	0.295	S	S	*	.	H	α-helix	trans	-64.8	-40.4	177.1	-73.4	173.8	-178.6	157.1	1.1	112.2	A216 C217 T223 C224	A216-R220 WeakPolarHBondContact O-CB 3.38Å; A216-R220 VanDerWaalsContact O-CG 3.29Å; A216-R220 WeakPolarHBondContact O-CG 3.01Å; A216-R220 PolarHBondContact O-N 2.8Å; C217-R220 PolarHBondContact O-N 3.05Å; R220-T223 PolarHBondContact O-N 2.98Å; R220-C224 WeakPolarHBondContact O-CB 3.43Å; R220-C224 PolarHBondContact O-N 3.34Å
221	K	98.5	Very high	98.2	Very high	68 Å²	68	54.2 Å²	54.2	30%	0.296	29%	0.294	S	S	.	.	H	α-helix	trans	-58	-50.9	173.8	173.1	179.3	171.2	178.5	0	110.4	N192 R193 C217 H218 T223 C224 L225	N192-K221 WeakPolarHBondContact O-CG 3.26Å; R193-K221 WeakPolarHBondContact O-CE 3.21Å; R193-K221 PolarHBondContact O-NZ 2.9Å; C217-K221 VanDerWaalsContact O-CB 3.32Å; C217-K221 WeakPolarHBondContact O-CB 3.48Å; C217-K221 PolarHBondContact O-N 3.41Å; H218-K221 PolarHBondContact O-N 2.95Å; K221-T223 PolarHBondContact O-N 2.95Å; K221-C224 PolarHBondContact O-N 3.49Å; K221-L225 HydrophobicContact CG-CD1 3.98Å; K221-L225 WeakPolarHBondContact O-CB 3.22Å; K221-L225 VanDerWaalsContact O-CG 3.26Å; K221-L225 WeakPolarHBondContact O-CG 3.31Å; K221-L225 PolarHBondContact O-N 2.98Å
222	A	98.6	Very high	98.2	Very high	26 Å²	26	52.9 Å²	52.9	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-62.6	-42.5	178.1	0	0	0	0	0	112.2	Y213 H218 L219 C224 L225 L226 I230	Y213-A222 HydrophobicContact CD1-CB 4.4Å; Y213-A222 HydrophobicContact CE1-CB 3.44Å; Y213-A222 VanDerWaalsContact CE1-CB 3.44Å; H218-A222 WeakPolarHBondContact O-CB 3.48Å; H218-A222 PolarHBondContact O-N 2.91Å; L219-A222 PolarHBondContact O-N 3.24Å; A222-C224 PolarHBondContact O-N 2.98Å; A222-L225 PolarHBondContact O-N 2.94Å; A222-L226 VanDerWaalsContact O-CB 3.28Å; A222-L226 WeakPolarHBondContact O-CB 3.31Å; A222-L226 PolarHBondContact O-N 2.74Å; A222-I230 HydrophobicContact CB-CD1 3.99Å
223	T	98.7	Very high	98.2	Very high	34 Å²	34	50.4 Å²	50.4	21%	0.209	27%	0.273	C	S	.	.	H	α-helix	trans	-57.7	-47	175.5	-60.6	0	0	0	0	111.6	L219 R220 K221 L226 G227 R228	L219-T223 WeakPolarHBondContact O-CB 3.37Å; L219-T223 PolarHBondContact O-N 3.26Å; L219-T223 PolarHBondContact O-OG1 3.34Å; R220-T223 PolarHBondContact O-N 2.98Å; K221-T223 PolarHBondContact O-N 2.95Å; T223-L226 PolarHBondContact O-N 3.45Å; T223-G227 PolarHBondContact O-N 3.46Å; T223-G227 VanDerWaalsContact O-N 3.12Å; T223-R228 WeakPolarHBondContact CG2-O 3.41Å
224	C	98.6	Very high	98.1	Very high	23 Å²	23	50.4 Å²	50.4	16%	0.155	27%	0.273	C	S	.	.	H	α-helix	trans	-66.5	-41.6	179.8	-169.7	0	0	0	0	112.1	T177 C191 R220 K221 A222 L226 G227	T177-C224 WeakPolarHBondContact CG2-O 3.42Å; C191-C224 WeakPolarHBondContact CA-SG 3.23Å; C191-C224 HydrophobicContact CB-CB 3.77Å; C191-C224 WeakPolarHBondContact CB-SG 3.43Å; C191-C224 WeakPolarHBondContact SG-CB 3.3Å; C191-C224 CovalentContact SG-SG 2.03Å; C191-C224 PolarHBondContact SG-SG 3.17Å; R220-C224 WeakPolarHBondContact O-CB 3.43Å; R220-C224 PolarHBondContact O-N 3.34Å; K221-C224 PolarHBondContact O-N 3.49Å; A222-C224 PolarHBondContact O-N 2.98Å; C224-L226 VanDerWaalsContact C-N 3.31Å; C224-L226 PolarHBondContact O-N 3.33Å; C224-G227 PolarHBondContact O-N 3.27Å
225	L	98.1	Very high	98.1	Very high	81 Å²	81	53.8 Å²	53.8	42%	0.424	29%	0.285	S	S	.	.	H	α-helix	trans	-70	-28.3	177.2	-65.9	176.3	0	0	0	112.9	C191 K221 A222 G227	C191-L225 HydrophobicContact CB-CD2 4.22Å; K221-L225 HydrophobicContact CG-CD1 3.98Å; K221-L225 WeakPolarHBondContact O-CB 3.22Å; K221-L225 VanDerWaalsContact O-CG 3.26Å; K221-L225 WeakPolarHBondContact O-CG 3.31Å; K221-L225 PolarHBondContact O-N 2.98Å; A222-L225 PolarHBondContact O-N 2.94Å; L225-G227 VanDerWaalsContact C-N 3.33Å
226	L	98.2	Very high	98	Very high	79 Å²	79	54.2 Å²	54.2	41%	0.414	29%	0.292	S	S	.	.	H	α-helix	trans	-73.5	-26.1	173.5	-177.7	63.5	0	0	0	112.4	A222 T223 C224 R228 I230	A222-L226 VanDerWaalsContact O-CB 3.28Å; A222-L226 WeakPolarHBondContact O-CB 3.31Å; A222-L226 PolarHBondContact O-N 2.74Å; T223-L226 PolarHBondContact O-N 3.45Å; C224-L226 VanDerWaalsContact C-N 3.31Å; C224-L226 PolarHBondContact O-N 3.33Å; L226-R228 VanDerWaalsContact C-N 3.34Å; L226-R228 HydrophobicContact CD2-CG 3.94Å; L226-R228 HydrophobicContact CG-CG 3.96Å; L226-I230 HydrophobicContact CD2-CD1 3.99Å; L226-I230 HydrophobicContact CD2-CG1 3.51Å
227	G	98.1	Very high	98	Very high	10 Å²	10	58 Å²	58	10%	0.103	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.5	4	-178.9	0	0	0	0	0	114.8	C178 V179 V180 T223 C224 L225	C178-G227 VanDerWaalsContact O-CA 3.28Å; C178-G227 WeakPolarHBondContact O-CA 3.47Å; V179-G227 CarbonylContact C-O 3.34Å; V179-G227 WeakPolarHBondContact CA-O 3.42Å; V180-G227 PolarHBondContact N-O 3.14Å; T223-G227 PolarHBondContact O-N 3.46Å; T223-G227 VanDerWaalsContact O-N 3.12Å; C224-G227 PolarHBondContact O-N 3.27Å; L225-G227 VanDerWaalsContact C-N 3.33Å
228	R	98	Very high	98	Very high	149 Å²	149	58 Å²	58	56%	0.562	30%	0.3	S	S	*	.	S	Bend	trans	-153.4	160.3	177.4	63.7	175.4	-176.4	-86.8	2.7	111.4	V180 T223 L226 I230	V180-R228 HydrophobicContact CG2-CB 3.99Å; T223-R228 WeakPolarHBondContact CG2-O 3.41Å; L226-R228 VanDerWaalsContact C-N 3.34Å; L226-R228 HydrophobicContact CD2-CG 3.94Å; L226-R228 HydrophobicContact CG-CG 3.96Å; R228-I230 PolarHBondContact O-N 2.84Å
229	S	97.7	Very high	97.9	Very high	96 Å²	96	60.1 Å²	60.1	67%	0.671	31%	0.312	S	S	*	.			trans	-56.9	121.2	178	-65.1	0	0	0	0	112.6
230	I	98.1	Very high	97.8	Very high	20 Å²	20	69.5 Å²	69.5	10%	0.103	35%	0.352	C	S	.	.			trans	-82.3	-46.8	164.4	-61.2	174.8	0	0	0	108.8	N208 D209 Y213 L219 A222 L226 R228	N208-I230 WeakPolarHBondContact CB-O 3.43Å; N208-I230 PolarHBondContact ND2-O 2.92Å; D209-I230 HydrophobicContact CB-CG2 4.02Å; Y213-I230 WeakPolarHBondContact OH-CD1 3.24Å; L219-I230 HydrophobicContact CD1-CB 4.3Å; L219-I230 HydrophobicContact CD1-CG2 4.16Å; A222-I230 HydrophobicContact CB-CD1 3.99Å; L226-I230 HydrophobicContact CD2-CD1 3.99Å; L226-I230 HydrophobicContact CD2-CG1 3.51Å; R228-I230 PolarHBondContact O-N 2.84Å
231	G	96.3	Very high	97.8	Very high	31 Å²	31	61.6 Å²	61.6	32%	0.32	33%	0.326	S	S	.	.			trans	77	152.4	-176.7	0	0	0	0	0	113.1	N208	N208-G231 PolarHBondContact N-O 3.07Å; N208-G231 VanDerWaalsContact N-O 3.11Å; N208-G231 WeakPolarHBondContact ND2-CA 3.13Å; N208-G231 PolarHBondContact ND2-O 3.46Å
232	L	97.9	Very high	97.7	Very high	63 Å²	63	67 Å²	67	33%	0.33	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	130	175.6	-179.3	66.2	0	0	0	109.3	L205 L219 Y234	L205-L232 HydrophobicContact CB-CD1 3.7Å; L205-L232 HydrophobicContact CD1-CD1 4.2Å; L205-L232 HydrophobicContact CD2-CD1 3.83Å; L205-L232 HydrophobicContact CG-CD1 4.11Å; L219-L232 HydrophobicContact CD2-CB 4.36Å; L219-L232 HydrophobicContact CD2-CD1 4.24Å; L232-Y234 WeakPolarHBondContact CD1-O 3.37Å
233	A	97.9	Very high	97.7	Very high	4 Å²	4	67.4 Å²	67.4	3%	0.033	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	-59	167.9	0	0	0	0	0	109.7	C206 N208 R265 C266	C206-A233 HydrophobicContact CB-CB 4.43Å; C206-A233 WeakPolarHBondContact O-CA 3.48Å; C206-A233 VanDerWaalsContact O-CB 3.3Å; C206-A233 WeakPolarHBondContact O-CB 3.05Å; C206-A233 PolarHBondContact O-N 3.13Å; N208-A233 VanDerWaalsContact OD1-CA 3.23Å; N208-A233 WeakPolarHBondContact OD1-CA 3.5Å; N208-A233 WeakPolarHBondContact OD1-CB 3.46Å; N208-A233 PolarHBondContact OD1-N 3.31Å; A233-R265 CarbonylContact O-C 3.58Å; A233-C266 PolarHBondContact O-N 2.04Å
234	Y	97.8	Very high	97.6	Very high	20 Å²	20	67.4 Å²	67.4	8%	0.078	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	164.3	178.3	50.3	-95	0	0	0	111.3	C206 L232 I239 I247 C266	C206-Y234 HydrophobicContact CB-CD1 4.38Å; C206-Y234 HydrophobicContact CB-CD2 3.82Å; C206-Y234 HydrophobicContact CB-CE1 4.12Å; C206-Y234 HydrophobicContact CB-CE2 3.53Å; C206-Y234 HydrophobicContact CB-CG 4.23Å; C206-Y234 PolarHBondContact N-O 3.42Å; C206-Y234 PolarHBondContact O-N 3.43Å; C206-Y234 VanDerWaalsContact SG-CZ 3.57Å; L232-Y234 WeakPolarHBondContact CD1-O 3.37Å; Y234-I239 VanDerWaalsContact OH-CG1 3.29Å; Y234-I239 WeakPolarHBondContact OH-CG1 3.48Å; Y234-I239 PolarHBondContact OH-N 3.04Å; Y234-I247 HydrophobicContact CD1-CG2 3.99Å; Y234-I247 HydrophobicContact CE1-CD1 4.14Å; Y234-I247 HydrophobicContact CE1-CG1 4.44Å; Y234-I247 HydrophobicContact CE1-CG2 4.32Å; Y234-I247 HydrophobicContact CG-CG2 4.19Å; Y234-C266 VanDerWaalsContact CB-SG 3.58Å
235	E	97.2	Very high	97.6	Very high	95 Å²	95	74.3 Å²	74.3	44%	0.444	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	145.2	177	-72.3	155.4	-147.9	0	0	110.9	L205 S250 K253	L205-E235 HydrophobicContact CD2-CG 4.21Å; E235-S250 PolarHBondContact OE2-OG 3.32Å; E235-K253 IonicContact OE1-NZ 2.8Å; E235-K253 PolarHBondContact OE1-NZ 2.75Å
236	G	96.4	Very high	97.5	Very high	22 Å²	22	74.1 Å²	74.1	23%	0.227	38%	0.382	C	S	.	.	S	Bend	trans	94.9	-173.3	-174.8	0	0	0	0	0	113.9	Y204 L205 C206	Y204-G236 CarbonylContact C-O 3.49Å; Y204-G236 CarbonylContact O-C 3.51Å; Y204-G236 VanDerWaalsContact O-CA 3.25Å; Y204-G236 WeakPolarHBondContact O-CA 3.21Å; Y204-G236 PolarHBondContact O-N 2.91Å; L205-G236 CarbonylContact C-O 3.53Å; L205-G236 WeakPolarHBondContact CA-O 3.03Å; L205-G236 PolarHBondContact N-O 3.01Å; C206-G236 PolarHBondContact N-O 2.96Å
237	K	97.7	Very high	97.5	Very high	122 Å²	122	70.8 Å²	70.8	53%	0.53	36%	0.364	S	S	.	.	S	Bend	trans	-75.9	150	178.8	-61.1	-173.5	177.4	177.8	0	110.8	Y204 T212	Y204-K237 HydrophobicContact CD1-CG 4.09Å; Y204-K237 HydrophobicContact CG-CG 4.08Å; T212-K237 HydrophobicContact CG2-CB 3.98Å; T212-K237 HydrophobicContact CG2-CG 3.86Å
238	C	97.8	Very high	97.4	Very high	31 Å²	31	78.1 Å²	78.1	21%	0.209	40%	0.396	C	S	.	.			trans	-62.7	142.7	170.9	-64.4	0	0	0	0	110.8	C206 G210 I211 T212	C206-C238 WeakPolarHBondContact CA-SG 3.46Å; C206-C238 HydrophobicContact CB-CB 4Å; C206-C238 WeakPolarHBondContact CB-SG 3.38Å; C206-C238 WeakPolarHBondContact SG-CA 3.13Å; C206-C238 WeakPolarHBondContact SG-CB 3.01Å; C206-C238 CovalentContact SG-SG 2.04Å; C206-C238 PolarHBondContact SG-SG 3.31Å; G210-C238 PolarHBondContact O-SG 2.92Å; I211-C238 PolarHBondContact O-SG 2.88Å; I211-C238 VanDerWaalsContact O-SG 3.33Å; T212-C238 WeakPolarHBondContact OG1-CB 3.43Å; T212-C238 PolarHBondContact OG1-N 3.38Å
239	I	97.7	Very high	97.4	Very high	86 Å²	86	72.8 Å²	72.8	44%	0.441	38%	0.38	S	S	.	.			trans	-123.5	153.6	176.9	56.6	164.3	0	0	0	108.5	Y234 A241 D246 I247	Y234-I239 VanDerWaalsContact OH-CG1 3.29Å; Y234-I239 WeakPolarHBondContact OH-CG1 3.48Å; Y234-I239 PolarHBondContact OH-N 3.04Å; I239-A241 HydrophobicContact CD1-CB 4.2Å; I239-A241 HydrophobicContact CG1-CB 4.24Å; I239-A241 PolarHBondContact O-N 2.85Å; I239-D246 HydrophobicContact CD1-CB 4.17Å; I239-D246 WeakPolarHBondContact CD1-O 3.27Å; I239-I247 HydrophobicContact CD1-CG1 4.21Å
240	K	96.6	Very high	97.1	Very high	214 Å²	214	70.4 Å²	70.4	93%	0.93	36%	0.364	S	S	*	.			trans	-83.3	62.4	175.2	-65.5	-176.1	179.5	-178.9	0	110
241	A	97.4	Very high	96.7	Very high	19 Å²	19	74.5 Å²	74.5	16%	0.157	40%	0.401	C	S	.	.			trans	-62.1	146	177.3	0	0	0	0	0	110.8	I239 D246 I247 W257	I239-A241 HydrophobicContact CD1-CB 4.2Å; I239-A241 HydrophobicContact CG1-CB 4.24Å; I239-A241 PolarHBondContact O-N 2.85Å; A241-D246 WeakPolarHBondContact CA-OD2 3.25Å; A241-D246 HydrophobicContact CB-CB 3.74Å; A241-I247 HydrophobicContact CB-CD1 3.92Å; A241-I247 HydrophobicContact CB-CG1 3.77Å; A241-W257 HydrophobicContact CB-CH2 4.22Å; A241-W257 HydrophobicContact CB-CZ3 4.1Å
242	K	97.3	Very high	96.3	Very high	182 Å²	182	75.9 Å²	75.9	79%	0.791	42%	0.415	S	S	*	.	S	Bend	trans	-104	-22.8	171.9	-65.2	179.8	-179.1	176.2	0	112.2	D246 W257	K242-D246 PolarHBondContact N-OD2 3.39Å; K242-W257 WeakPolarHBondContact O-CH2 3.3Å; K242-W257 WeakPolarHBondContact O-CZ2 3.46Å
243	S	97.5	Very high	96.2	Very high	34 Å²	34	75.6 Å²	75.6	24%	0.238	41%	0.411	C	S	.	.	S	Bend	trans	-152.3	177.3	176	73.5	0	0	0	0	110.2	E245 D246 W257	S243-E245 PolarHBondContact O-N 3.17Å; S243-E245 WeakPolarHBondContact OG-CB 3.38Å; S243-E245 PolarHBondContact OG-N 2.74Å; S243-D246 PolarHBondContact N-OD2 3.24Å; S243-D246 PolarHBondContact O-N 3.05Å; S243-W257 VanDerWaalsContact C-CE3 3.43Å; S243-W257 VanDerWaalsContact CA-CZ3 3.41Å; S243-W257 WeakPolarHBondContact O-CZ3 3.19Å
244	C	97.8	Very high	96.2	Very high	34 Å²	34	80.8 Å²	80.8	23%	0.23	43%	0.433	C	S	.	.	G	3₁₀ helix	trans	-64.7	-14.9	173.4	-87.2	0	0	0	0	114.1	D246 I247 C255	C244-D246 PolarHBondContact O-N 2.03Å; C244-I247 PolarHBondContact O-N 3.05Å; C244-C255 WeakPolarHBondContact CA-SG 3.08Å; C244-C255 HydrophobicContact CB-CB 3.58Å; C244-C255 WeakPolarHBondContact CB-SG 3.29Å; C244-C255 WeakPolarHBondContact SG-CB 3.01Å; C244-C255 CovalentContact SG-SG 2.04Å; C244-C255 PolarHBondContact SG-SG 3.45Å
245	E	97.4	Very high	96.2	Very high	169 Å²	169	80.8 Å²	80.8	79%	0.79	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-66.8	-28.4	178	-61.1	171.3	166.5	0	0	112	S243 I247	S243-E245 PolarHBondContact O-N 3.17Å; S243-E245 WeakPolarHBondContact OG-CB 3.38Å; S243-E245 PolarHBondContact OG-N 2.74Å; E245-I247 VanDerWaalsContact C-N 3.31Å
246	D	97.6	Very high	96.2	Very high	77 Å²	77	76.8 Å²	76.8	41%	0.412	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-78.4	-16.5	178.1	-61.4	-45.7	0	0	0	112.6	I239 A241 K242 S243 C244	I239-D246 HydrophobicContact CD1-CB 4.17Å; I239-D246 WeakPolarHBondContact CD1-O 3.27Å; A241-D246 WeakPolarHBondContact CA-OD2 3.25Å; A241-D246 HydrophobicContact CB-CB 3.74Å; K242-D246 PolarHBondContact N-OD2 3.39Å; S243-D246 PolarHBondContact N-OD2 3.24Å; S243-D246 PolarHBondContact O-N 3.05Å; C244-D246 PolarHBondContact O-N 2.03Å
247	I	97.6	Very high	96.3	Very high	9 Å²	9	76.9 Å²	76.9	5%	0.046	41%	0.411	C	S	.	.			trans	-103.5	118.3	-170.6	-61.4	170.9	0	0	0	110	Y234 I239 A241 C244 E245 W257	Y234-I247 HydrophobicContact CD1-CG2 3.99Å; Y234-I247 HydrophobicContact CE1-CD1 4.14Å; Y234-I247 HydrophobicContact CE1-CG1 4.44Å; Y234-I247 HydrophobicContact CE1-CG2 4.32Å; Y234-I247 HydrophobicContact CG-CG2 4.19Å; I239-I247 HydrophobicContact CD1-CG1 4.21Å; A241-I247 HydrophobicContact CB-CD1 3.92Å; A241-I247 HydrophobicContact CB-CG1 3.77Å; C244-I247 PolarHBondContact O-N 3.05Å; E245-I247 VanDerWaalsContact C-N 3.31Å; I247-W257 HydrophobicContact CD1-CZ3 4.08Å
248	Q	96.1	Very high	96.3	Very high	164 Å²	164	72.5 Å²	72.5	77%	0.766	39%	0.393	S	S	*	.			trans	-93.2	108.7	176.2	-62.8	-63.8	-44	0	0	110
249	C	96.7	Very high	96.1	Very high	36 Å²	36	78.1 Å²	78.1	24%	0.243	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-86.1	141.5	176.1	-64	0	0	0	0	111.8	K253 C266	C249-K253 HydrophobicContact CB-CB 3.98Å; C249-K253 WeakPolarHBondContact CB-O 3.48Å; C249-C266 WeakPolarHBondContact CA-SG 3.49Å; C249-C266 HydrophobicContact CB-CB 3.82Å; C249-C266 WeakPolarHBondContact CB-SG 3.31Å; C249-C266 WeakPolarHBondContact SG-CB 3Å; C249-C266 CovalentContact SG-SG 2.04Å; C249-C266 PolarHBondContact SG-SG 2.03Å
250	S	92.6	Very high	95.8	Very high	46 Å²	46	81.7 Å²	81.7	32%	0.322	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-60.1	158.7	172	-42.9	0	0	0	0	111.4	E235 G252 K253	E235-S250 PolarHBondContact OE2-OG 3.32Å; S250-G252 PolarHBondContact O-N 2.89Å; S250-K253 WeakPolarHBondContact O-CB 3.37Å; S250-K253 PolarHBondContact O-N 3.26Å
251	A	90	Very high	95.8	Very high	106 Å²	106	75.1 Å²	75.1	88%	0.876	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.9	133.6	-175.5	0	0	0	0	0	112.8	K253	A251-K253 VanDerWaalsContact C-N 3.3Å; A251-K253 PolarHBondContact O-N 3.49Å
252	G	88.1	Confident	95.7	Very high	60 Å²	60	76 Å²	76	62%	0.619	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.6	-7	-179.1	0	0	0	0	0	115.3	S250	S250-G252 PolarHBondContact O-N 2.89Å
253	K	95.9	Very high	95.7	Very high	57 Å²	57	72.1 Å²	72.1	25%	0.248	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	144.6	175.5	-62.8	173.8	-170.9	172.8	0	111.3	E235 C249 S250 A251 C266 A267 L268	E235-K253 IonicContact OE1-NZ 2.8Å; E235-K253 PolarHBondContact OE1-NZ 2.75Å; C249-K253 HydrophobicContact CB-CB 3.98Å; C249-K253 WeakPolarHBondContact CB-O 3.48Å; S250-K253 WeakPolarHBondContact O-CB 3.37Å; S250-K253 PolarHBondContact O-N 3.26Å; A251-K253 VanDerWaalsContact C-N 3.3Å; A251-K253 PolarHBondContact O-N 3.49Å; K253-C266 HydrophobicContact CB-CB 4.13Å; K253-C266 HydrophobicContact CD-CB 4.2Å; K253-A267 CarbonylContact C-O 3.43Å; K253-A267 WeakPolarHBondContact CA-O 3.43Å; K253-A267 WeakPolarHBondContact CB-O 3.4Å; K253-L268 HydrophobicContact CG-CD2 3.76Å; K253-L268 HydrophobicContact CG-CG 4.25Å
254	K	96.8	Very high	95.7	Very high	114 Å²	114	70.8 Å²	70.8	50%	0.496	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	149.5	170.1	-65	-177.2	179.1	176.1	0	110.3	C266 A267 C269	K254-C266 WeakPolarHBondContact O-CA 3.05Å; K254-A267 PolarHBondContact N-O 2.89Å; K254-A267 PolarHBondContact O-N 3.22Å; K254-C269 HydrophobicContact CD-CB 4.02Å; K254-C269 HydrophobicContact CG-CB 4.27Å
255	C	98.1	Very high	95.7	Very high	20 Å²	20	72.2 Å²	72.2	14%	0.135	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	131.2	174	-178.7	0	0	0	0	110.4	C244 R265	C244-C255 WeakPolarHBondContact CA-SG 3.08Å; C244-C255 HydrophobicContact CB-CB 3.58Å; C244-C255 WeakPolarHBondContact CB-SG 3.29Å; C244-C255 WeakPolarHBondContact SG-CB 3.01Å; C244-C255 CovalentContact SG-SG 2.04Å; C244-C255 PolarHBondContact SG-SG 3.45Å; C255-R265 CarbonylContact C-O 3.45Å; C255-R265 WeakPolarHBondContact CA-O 3.37Å
256	L	98.1	Very high	95.7	Very high	10 Å²	10	64.9 Å²	64.9	5%	0.052	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	124.7	171.6	-51.2	-175.2	0	0	0	108.6	G264 R265 A267 A300 L306	L256-G264 CarbonylContact O-C 3Å; L256-G264 WeakPolarHBondContact O-CA 2.99Å; L256-R265 PolarHBondContact N-O 2.85Å; L256-R265 PolarHBondContact O-N 3.11Å; L256-A267 HydrophobicContact CD1-CB 3.66Å; L256-A267 HydrophobicContact CG-CB 4.1Å; L256-A300 HydrophobicContact CD1-CB 4.46Å; L256-A300 WeakPolarHBondContact CD2-O 3.47Å; L256-L306 HydrophobicContact CB-CB 4.25Å; L256-L306 HydrophobicContact CD1-CD1 4.25Å
257	W	98.1	Very high	95.7	Very high	24 Å²	24	62.3 Å²	62.3	9%	0.091	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	128.1	-179.3	-166.5	-100.4	0	0	0	111.8	A241 K242 S243 I247 F259 G304 L306	A241-W257 HydrophobicContact CB-CH2 4.22Å; A241-W257 HydrophobicContact CB-CZ3 4.1Å; K242-W257 WeakPolarHBondContact O-CH2 3.3Å; K242-W257 WeakPolarHBondContact O-CZ2 3.46Å; S243-W257 VanDerWaalsContact C-CE3 3.43Å; S243-W257 VanDerWaalsContact CA-CZ3 3.41Å; S243-W257 WeakPolarHBondContact O-CZ3 3.19Å; I247-W257 HydrophobicContact CD1-CZ3 4.08Å; W257-F259 AromaticContact CD1-CD1 3.63Å; W257-F259 AromaticContact CD1-CE1 3.58Å; W257-F259 AromaticContact CD1-CE2 4Å; W257-F259 AromaticContact CD1-CG 3.86Å; W257-F259 AromaticContact CD1-CZ 3.77Å; W257-F259 AromaticContact NE1-CD1 3.91Å; W257-G304 PolarHBondContact N-O 3.5Å; W257-L306 PolarHBondContact O-N 2.94Å
258	D	96.6	Very high	95.5	Very high	30 Å²	30	67 Å²	67	16%	0.16	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	106.9	171.1	-175.4	-16.2	0	0	0	109.9	K260 V261 G262 R263 L306	D258-K260 VanDerWaalsContact C-N 3.31Å; D258-K260 PolarHBondContact O-N 3.44Å; D258-K260 WeakPolarHBondContact OD1-CA 3.42Å; D258-K260 VanDerWaalsContact OD1-CB 3.3Å; D258-K260 WeakPolarHBondContact OD1-CB 3.41Å; D258-K260 PolarHBondContact OD1-N 3.03Å; D258-V261 HydrophobicContact CB-CG2 3.87Å; D258-V261 PolarHBondContact OD1-N 2.76Å; D258-V261 WeakPolarHBondContact OD2-CG2 3.29Å; D258-G262 VanDerWaalsContact O-CA 3.29Å; D258-G262 WeakPolarHBondContact O-CA 3.4Å; D258-G262 PolarHBondContact O-N 3.42Å; D258-R263 WeakPolarHBondContact CB-O 3.48Å; D258-R263 PolarHBondContact N-O 2.97Å; D258-R263 PolarHBondContact O-N 3.36Å; D258-L306 HydrophobicContact CB-CB 4.1Å; D258-L306 HydrophobicContact CB-CD2 3.78Å
259	F	94.1	Very high	95.3	Very high	149 Å²	149	60.9 Å²	60.9	65%	0.654	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-21.5	178.7	-69.3	-80.6	0	0	0	113.9	W257 V305	W257-F259 AromaticContact CD1-CD1 3.63Å; W257-F259 AromaticContact CD1-CE1 3.58Å; W257-F259 AromaticContact CD1-CE2 4Å; W257-F259 AromaticContact CD1-CG 3.86Å; W257-F259 AromaticContact CD1-CZ 3.77Å; W257-F259 AromaticContact NE1-CD1 3.91Å; F259-V305 HydrophobicContact CD2-CG1 3.87Å; F259-V305 HydrophobicContact CE2-CB 4.37Å; F259-V305 HydrophobicContact CE2-CG1 3.76Å; F259-V305 HydrophobicContact CE2-CG2 3.79Å
260	K	92.6	Very high	94.9	Very high	162 Å²	162	64.7 Å²	64.7	70%	0.704	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-39.9	-179.7	-63.4	179.7	179.4	175	0	111.1	D258	D258-K260 VanDerWaalsContact C-N 3.31Å; D258-K260 PolarHBondContact O-N 3.44Å; D258-K260 WeakPolarHBondContact OD1-CA 3.42Å; D258-K260 VanDerWaalsContact OD1-CB 3.3Å; D258-K260 WeakPolarHBondContact OD1-CB 3.41Å; D258-K260 PolarHBondContact OD1-N 3.03Å
261	V	94.9	Very high	94.6	Very high	75 Å²	75	68.7 Å²	68.7	46%	0.455	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-10.4	-178.9	-52.1	0	0	0	0	113.6	D258 R263	D258-V261 HydrophobicContact CB-CG2 3.87Å; D258-V261 PolarHBondContact OD1-N 2.76Å; D258-V261 WeakPolarHBondContact OD2-CG2 3.29Å; V261-R263 HydrophobicContact CG2-CB 3.94Å; V261-R263 HydrophobicContact CG2-CG 4.19Å
262	G	96.4	Very high	94.6	Very high	38 Å²	38	71.6 Å²	71.6	39%	0.392	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.6	42.1	-178.8	0	0	0	0	0	113.2	D258	D258-G262 VanDerWaalsContact O-CA 3.29Å; D258-G262 WeakPolarHBondContact O-CA 3.4Å; D258-G262 PolarHBondContact O-N 3.42Å
263	R	97	Very high	94.6	Very high	101 Å²	101	70.7 Å²	70.7	38%	0.381	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	151	-179.7	-62.8	-172.6	-75.3	-134.8	4.4	111.4	N208 D209 D258 V261	N208-R263 VanDerWaalsContact O-CZ 3.25Å; N208-R263 PolarHBondContact O-NE 2.91Å; N208-R263 PolarHBondContact O-NH2 3.41Å; D209-R263 VanDerWaalsContact C-NH1 3.31Å; D209-R263 PolarHBondContact O-NH1 2.97Å; D258-R263 WeakPolarHBondContact CB-O 3.48Å; D258-R263 PolarHBondContact N-O 2.97Å; D258-R263 PolarHBondContact O-N 3.36Å; V261-R263 HydrophobicContact CG2-CB 3.94Å; V261-R263 HydrophobicContact CG2-CG 4.19Å
264	G	97.4	Very high	94.3	Very high	5 Å²	5	72.9 Å²	72.9	5%	0.052	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	154.3	174.4	0	0	0	0	0	113.5	L256	L256-G264 CarbonylContact O-C 3Å; L256-G264 WeakPolarHBondContact O-CA 2.99Å
265	R	97.4	Very high	93.8	Very high	64 Å²	64	77.1 Å²	77.1	24%	0.242	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	136.9	174.6	173.6	-176	-60	165.5	10.5	109.6	N208 A233 C255 L256	N208-R265 VanDerWaalsContact CG-CZ 3.49Å; N208-R265 VanDerWaalsContact CG-NE 3.28Å; N208-R265 VanDerWaalsContact ND2-CZ 3.3Å; N208-R265 PolarHBondContact ND2-NE 2.85Å; N208-R265 PolarHBondContact ND2-NH2 2.69Å; N208-R265 PolarHBondContact OD1-NE 3.47Å; N208-R265 PolarHBondContact OD1-NH2 2.99Å; A233-R265 CarbonylContact O-C 3.58Å; C255-R265 CarbonylContact C-O 3.45Å; C255-R265 WeakPolarHBondContact CA-O 3.37Å; L256-R265 PolarHBondContact N-O 2.85Å; L256-R265 PolarHBondContact O-N 3.11Å
266	C	97.9	Very high	92.8	Very high	15 Å²	15	78.3 Å²	78.3	10%	0.101	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	116.4	170	-65.8	0	0	0	0	110.1	A233 Y234 C249 K253 K254	A233-C266 PolarHBondContact O-N 2.04Å; Y234-C266 VanDerWaalsContact CB-SG 3.58Å; C249-C266 WeakPolarHBondContact CA-SG 3.49Å; C249-C266 HydrophobicContact CB-CB 3.82Å; C249-C266 WeakPolarHBondContact CB-SG 3.31Å; C249-C266 WeakPolarHBondContact SG-CB 3Å; C249-C266 CovalentContact SG-SG 2.04Å; C249-C266 PolarHBondContact SG-SG 2.03Å; K253-C266 HydrophobicContact CB-CB 4.13Å; K253-C266 HydrophobicContact CD-CB 4.2Å; K254-C266 WeakPolarHBondContact O-CA 3.05Å
267	A	96.3	Very high	91.9	Very high	24 Å²	24	85.1 Å²	85.1	20%	0.198	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	151.4	178.6	0	0	0	0	0	111.2	K253 K254 L256	K253-A267 CarbonylContact C-O 3.43Å; K253-A267 WeakPolarHBondContact CA-O 3.43Å; K253-A267 WeakPolarHBondContact CB-O 3.4Å; K254-A267 PolarHBondContact N-O 2.89Å; K254-A267 PolarHBondContact O-N 3.22Å; L256-A267 HydrophobicContact CD1-CB 3.66Å; L256-A267 HydrophobicContact CG-CB 4.1Å
268	L	94.8	Very high	90.6	Very high	106 Å²	106	88.8 Å²	88.8	56%	0.555	47%	0.468	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.5	136.5	166.2	-70.7	172	0	0	0	108.8	K253	K253-L268 HydrophobicContact CG-CD2 3.76Å; K253-L268 HydrophobicContact CG-CG 4.25Å
269	C	92.2	Very high	89.9	Confident	36 Å²	36	94.3 Å²	94.3	24%	0.243	50%	0.497	C	S	.	.			trans	-132.6	36.8	-174.4	-69.5	0	0	0	0	111.2	K254 C301	K254-C269 HydrophobicContact CD-CB 4.02Å; K254-C269 HydrophobicContact CG-CB 4.27Å; C269-C301 VanDerWaalsContact CA-SG 3.51Å; C269-C301 HydrophobicContact CB-CB 3.59Å; C269-C301 WeakPolarHBondContact CB-SG 3.49Å; C269-C301 WeakPolarHBondContact SG-CB 3.1Å; C269-C301 CovalentContact SG-SG 2.03Å; C269-C301 PolarHBondContact SG-SG 2.95Å
270	D	88.3	Confident	89.6	Confident	117 Å²	117	92.2 Å²	92.2	63%	0.626	49%	0.49	S	S	*	.			trans	-113	1.1	-176.3	60.9	-23.3	0	0	0	113.3	L272	D270-L272 PolarHBondContact O-N 3.32Å
271	E	85.4	Confident	89.7	Confident	130 Å²	130	85.3 Å²	85.3	61%	0.607	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-67.6	126.9	176.2	-73.6	-171.1	160.3	0	0	111.3
272	L	89.3	Confident	89.8	Confident	167 Å²	167	82.2 Å²	82.2	87%	0.874	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-89.4	123.6	169.3	-64	175	0	0	0	109	D270	D270-L272 PolarHBondContact O-N 3.32Å
273	C	89.5	Confident	89.8	Confident	41 Å²	41	80.4 Å²	80.4	28%	0.277	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-86.1	122.7	-178.7	-62.2	0	0	0	0	111.7	C294	C273-C294 WeakPolarHBondContact CA-SG 2.97Å; C273-C294 HydrophobicContact CB-CB 3.89Å; C273-C294 WeakPolarHBondContact CB-SG 3.42Å; C273-C294 WeakPolarHBondContact SG-CB 3.31Å; C273-C294 PolarHBondContact SG-O 2.93Å; C273-C294 VanDerWaalsContact SG-O 3.39Å; C273-C294 CovalentContact SG-SG 2.04Å; C273-C294 PolarHBondContact SG-SG 3.27Å
274	P	89.6	Confident	89.7	Confident	103 Å²	103	75.6 Å²	75.6	67%	0.669	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-68.9	161.9	171.2	29.4	-33.3	0	0	0	111.3	S276	P274-S276 PolarHBondContact O-N 3.43Å
275	E	84.9	Confident	89.6	Confident	203 Å²	203	76.8 Å²	76.8	95%	0.949	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-58.3	124.3	171.8	-72.1	-171	168.9	0	0	110.1
276	S	77.9	Confident	89.5	Confident	45 Å²	45	76.6 Å²	76.6	32%	0.315	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-100	151	-174.9	28.6	0	0	0	0	111.3	P274 E280 S292	P274-S276 PolarHBondContact O-N 3.43Å; S276-E280 WeakPolarHBondContact CA-OE2 3.5Å; S276-E280 WeakPolarHBondContact CB-OE2 3.48Å; S276-S292 PolarHBondContact OG-OG 3.28Å
277	K	78.7	Confident	89.4	Confident	153 Å²	153	80.4 Å²	80.4	67%	0.665	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-85	159	174.1	-67	-179.4	-178.9	176.7	0	110.5	D279 E280	K277-D279 PolarHBondContact O-N 2.78Å; K277-D279 VanDerWaalsContact O-N 3.13Å; K277-E280 PolarHBondContact N-OE2 2.79Å; K277-E280 PolarHBondContact O-N 2.94Å; K277-E280 VanDerWaalsContact O-N 3.13Å
278	S	72.1	Confident	89.4	Confident	100 Å²	100	82.2 Å²	82.2	70%	0.699	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-53.6	-34.7	177.4	51	0	0	0	0	113.7	E280 A281	S278-E280 PolarHBondContact O-N 2.84Å; S278-A281 WeakPolarHBondContact O-CB 3.5Å; S278-A281 PolarHBondContact O-N 3.35Å
279	D	80.5	Confident	89.4	Confident	147 Å²	147	79.8 Å²	79.8	79%	0.786	44%	0.436	S	S	*	.	G	3₁₀ helix	trans	-77.6	-6.8	-172.8	-51.4	-12.8	0	0	0	112.5	K277	K277-D279 PolarHBondContact O-N 2.78Å; K277-D279 VanDerWaalsContact O-N 3.13Å
280	E	89.1	Confident	89.6	Confident	105 Å²	105	79.3 Å²	79.3	49%	0.491	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-95.3	1	177.2	-62.8	173.2	167.9	0	0	112.3	S276 K277 S278 P291 S292	S276-E280 WeakPolarHBondContact CA-OE2 3.5Å; S276-E280 WeakPolarHBondContact CB-OE2 3.48Å; K277-E280 PolarHBondContact N-OE2 2.79Å; K277-E280 PolarHBondContact O-N 2.94Å; K277-E280 VanDerWaalsContact O-N 3.13Å; S278-E280 PolarHBondContact O-N 2.84Å; E280-P291 CarbonylContact C-O 3.46Å; E280-S292 WeakPolarHBondContact O-CA 3.26Å
281	A	94.2	Very high	89.9	Confident	17 Å²	17	77.3 Å²	77.3	14%	0.14	42%	0.423	C	S	.	.			trans	-58.4	146.9	179.7	0	0	0	0	0	111.9	S278 T289 Y290 P291 G313	S278-A281 WeakPolarHBondContact O-CB 3.5Å; S278-A281 PolarHBondContact O-N 3.35Å; A281-T289 HydrophobicContact CB-CG2 4.39Å; A281-Y290 VanDerWaalsContact CA-O 3.29Å; A281-Y290 WeakPolarHBondContact CA-O 3.47Å; A281-P291 WeakPolarHBondContact CA-O 3.26Å; A281-P291 PolarHBondContact N-O 3.42Å; A281-G313 WeakPolarHBondContact O-CA 3.16Å; A281-G313 PolarHBondContact O-N 2.94Å
282	V	95.7	Very high	90.3	Very high	9 Å²	9	71.7 Å²	71.7	6%	0.055	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	145	178.8	-62.9	0	0	0	0	111.2	T289 Y290 E293 M296 V309 G313	V282-T289 WeakPolarHBondContact O-CA 3.29Å; V282-Y290 PolarHBondContact N-O 2.87Å; V282-Y290 PolarHBondContact O-N 2.87Å; V282-E293 HydrophobicContact CG1-CB 4.42Å; V282-M296 HydrophobicContact CG2-CB 4.29Å; V282-M296 HydrophobicContact CG2-SD 4.37Å; V282-V309 HydrophobicContact CB-CG1 4.2Å; V282-V309 HydrophobicContact CB-CG2 4.35Å; V282-V309 HydrophobicContact CG1-CG1 4.23Å; V282-V309 HydrophobicContact CG1-CG2 4.32Å; V282-V309 HydrophobicContact CG2-CG2 4.42Å; V282-G313 CarbonylContact C-O 3.15Å; V282-G313 WeakPolarHBondContact CA-O 3.48Å
283	C	96.4	Very high	90.6	Very high	1 Å²	1	68 Å²	68	1%	0.007	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	121	166.1	-176.2	0	0	0	0	108.8	K310 H311 G313 C315	C283-K310 WeakPolarHBondContact O-CA 3.37Å; C283-K310 VanDerWaalsContact O-CB 3.32Å; C283-K310 WeakPolarHBondContact O-CB 3.38Å; C283-K310 PolarHBondContact O-N 3.05Å; C283-H311 VanDerWaalsContact CB-CE1 3.42Å; C283-H311 WeakPolarHBondContact CB-CE1 3.23Å; C283-H311 WeakPolarHBondContact CB-NE2 3.3Å; C283-H311 PolarHBondContact N-O 3.12Å; C283-H311 PolarHBondContact O-N 3.3Å; C283-G313 PolarHBondContact N-O 2.79Å; C283-C315 WeakPolarHBondContact CA-SG 3.49Å; C283-C315 HydrophobicContact CB-CB 3.95Å; C283-C315 WeakPolarHBondContact CB-SG 3.49Å; C283-C315 WeakPolarHBondContact SG-CA 3.41Å; C283-C315 WeakPolarHBondContact SG-CB 3.46Å; C283-C315 CovalentContact SG-SG 2.03Å; C283-C315 PolarHBondContact SG-SG 2.87Å
284	A	96.5	Very high	90.8	Very high	0 Å²	0	67.5 Å²	67.5	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	173.3	-178.9	0	0	0	0	0	112.6	D286 N287 T288 Y290 M296 E308	A284-D286 VanDerWaalsContact CB-OD1 3.3Å; A284-D286 WeakPolarHBondContact CB-OD1 3.5Å; A284-D286 PolarHBondContact O-N 2.94Å; A284-N287 WeakPolarHBondContact O-CA 3.46Å; A284-N287 PolarHBondContact O-N 3.15Å; A284-T288 PolarHBondContact N-O 2.85Å; A284-Y290 HydrophobicContact CB-CD2 3.59Å; A284-Y290 HydrophobicContact CB-CE2 3.5Å; A284-Y290 VanDerWaalsContact CB-CE2 3.5Å; A284-M296 HydrophobicContact CB-CG 3.76Å; A284-M296 HydrophobicContact CB-SD 3.56Å; A284-M296 VanDerWaalsContact CB-SD 3.56Å; A284-E308 CarbonylContact C-O 3.58Å; A284-E308 WeakPolarHBondContact CA-O 3.35Å
285	S	95.5	Very high	91.1	Very high	29 Å²	29	63.4 Å²	63.4	20%	0.203	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-16.9	-177.7	53.5	0	0	0	0	115.2	N287 L307 E308	S285-N287 VanDerWaalsContact C-N 3.28Å; S285-L307 WeakPolarHBondContact OG-CA 3.35Å; S285-E308 PolarHBondContact N-O 3.42Å; S285-E308 PolarHBondContact OG-N 3.02Å; S285-E308 VanDerWaalsContact OG-N 3.11Å
286	D	94.8	Very high	91.6	Very high	60 Å²	60	54 Å²	54	32%	0.321	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	2.4	172.4	69.5	-23.5	0	0	0	112.8	A284 T288 Y290 L307	A284-D286 VanDerWaalsContact CB-OD1 3.3Å; A284-D286 WeakPolarHBondContact CB-OD1 3.5Å; A284-D286 PolarHBondContact O-N 2.94Å; D286-T288 VanDerWaalsContact CG-OG1 3.23Å; D286-T288 PolarHBondContact O-N 3.36Å; D286-T288 WeakPolarHBondContact OD1-CB 3.29Å; D286-T288 PolarHBondContact OD1-N 2.81Å; D286-T288 PolarHBondContact OD1-OG1 3.44Å; D286-T288 VanDerWaalsContact OD2-CB 3.25Å; D286-T288 WeakPolarHBondContact OD2-CB 3.43Å; D286-T288 PolarHBondContact OD2-OG1 3.37Å; D286-Y290 PolarHBondContact OD2-OH 2.8Å; D286-L307 HydrophobicContact CB-CD2 3.86Å
287	N	95	Very high	92.4	Very high	96 Å²	96	56 Å²	56	51%	0.513	31%	0.307	S	S	.	.	S	Bend	trans	62.7	25.9	-172.7	-47.8	-69.8	0	0	0	114	A284 S285 K310 C315	A284-N287 WeakPolarHBondContact O-CA 3.46Å; A284-N287 PolarHBondContact O-N 3.15Å; S285-N287 VanDerWaalsContact C-N 3.28Å; N287-K310 PolarHBondContact OD1-NZ 3.47Å; N287-C315 PolarHBondContact O-SG 3.34Å
288	T	96.1	Very high	93.2	Very high	61 Å²	61	53.8 Å²	53.8	37%	0.374	30%	0.298	S	S	.	.			trans	-95.3	138.5	169.7	-54.3	0	0	0	0	110.1	A284 D286 Y290 C315	A284-T288 PolarHBondContact N-O 2.85Å; D286-T288 VanDerWaalsContact CG-OG1 3.23Å; D286-T288 PolarHBondContact O-N 3.36Å; D286-T288 WeakPolarHBondContact OD1-CB 3.29Å; D286-T288 PolarHBondContact OD1-N 2.81Å; D286-T288 PolarHBondContact OD1-OG1 3.44Å; D286-T288 VanDerWaalsContact OD2-CB 3.25Å; D286-T288 WeakPolarHBondContact OD2-CB 3.43Å; D286-T288 PolarHBondContact OD2-OG1 3.37Å; T288-Y290 HydrophobicContact CG2-CD2 4.41Å; T288-Y290 HydrophobicContact CG2-CE2 3.92Å; T288-Y290 WeakPolarHBondContact O-CD2 3.26Å; T288-C315 PolarHBondContact O-SG 2.79Å
289	T	96.3	Very high	94.3	Very high	55 Å²	55	50.1 Å²	50.1	34%	0.337	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	123.9	171.6	-56.7	0	0	0	0	109.4	A281 V282 S314 C315	A281-T289 HydrophobicContact CB-CG2 4.39Å; V282-T289 WeakPolarHBondContact O-CA 3.29Å; T289-S314 PolarHBondContact OG1-OG 2.87Å; T289-S314 VanDerWaalsContact OG1-OG 3.08Å; T289-C315 PolarHBondContact OG1-N 3.32Å
290	Y	95.3	Very high	95.1	Very high	27 Å²	27	43.2 Å²	43.2	11%	0.106	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	147.5	173.3	-68.6	-89.1	0	0	0	110.1	A281 V282 A284 D286 T288 S292 M296 A299 L307	A281-Y290 VanDerWaalsContact CA-O 3.29Å; A281-Y290 WeakPolarHBondContact CA-O 3.47Å; V282-Y290 PolarHBondContact N-O 2.87Å; V282-Y290 PolarHBondContact O-N 2.87Å; A284-Y290 HydrophobicContact CB-CD2 3.59Å; A284-Y290 HydrophobicContact CB-CE2 3.5Å; A284-Y290 VanDerWaalsContact CB-CE2 3.5Å; D286-Y290 PolarHBondContact OD2-OH 2.8Å; T288-Y290 HydrophobicContact CG2-CD2 4.41Å; T288-Y290 HydrophobicContact CG2-CE2 3.92Å; T288-Y290 WeakPolarHBondContact O-CD2 3.26Å; Y290-S292 PolarHBondContact O-N 3.17Å; Y290-M296 HydrophobicContact CD1-CB 4.18Å; Y290-M296 HydrophobicContact CD2-CB 3.88Å; Y290-M296 HydrophobicContact CD2-CG 3.79Å; Y290-M296 HydrophobicContact CE2-CB 4.48Å; Y290-M296 HydrophobicContact CE2-CG 4.05Å; Y290-M296 HydrophobicContact CG-CB 3.69Å; Y290-M296 HydrophobicContact CG-CG 4.14Å; Y290-A299 HydrophobicContact CD1-CB 4.23Å; Y290-A299 HydrophobicContact CE1-CB 3.38Å; Y290-L307 HydrophobicContact CE2-CD1 4.04Å; Y290-L307 VanDerWaalsContact OH-CD1 3.29Å; Y290-L307 WeakPolarHBondContact OH-CD1 3.24Å
291	P	94.9	Very high	95.4	Very high	75 Å²	75	39 Å²	39	49%	0.487	22%	0.219	S	C	.	.	S	Bend	trans	-66.5	-22.1	-178.5	26.7	-34.3	0	0	0	113.1	E280 A281 A295	E280-P291 CarbonylContact C-O 3.46Å; A281-P291 WeakPolarHBondContact CA-O 3.26Å; A281-P291 PolarHBondContact N-O 3.42Å; P291-A295 HydrophobicContact CG-CB 3.62Å
292	S	94.9	Very high	95.4	Very high	11 Å²	11	42.6 Å²	42.6	8%	0.077	24%	0.244	C	C	.	.	S	Bend	trans	-157.5	165.4	171.1	59.7	0	0	0	0	111.4	S276 E280 Y290 C294 A295 M296	S276-S292 PolarHBondContact OG-OG 3.28Å; E280-S292 WeakPolarHBondContact O-CA 3.26Å; Y290-S292 PolarHBondContact O-N 3.17Å; S292-C294 PolarHBondContact O-N 3.5Å; S292-A295 PolarHBondContact O-N 3.45Å; S292-A295 PolarHBondContact OG-N 2.98Å; S292-M296 PolarHBondContact O-N 3.1Å
293	E	94.2	Very high	95.4	Very high	91 Å²	91	47.6 Å²	47.6	43%	0.425	27%	0.268	S	S	.	.	H	α-helix	trans	-58.4	-32	170.4	-171.3	-175.3	151.3	0	0	112	V282 M296 K297 V309	V282-E293 HydrophobicContact CG1-CB 4.42Å; E293-M296 HydrophobicContact CG-CE 4.09Å; E293-M296 WeakPolarHBondContact O-CB 3.08Å; E293-M296 PolarHBondContact O-N 3.28Å; E293-K297 WeakPolarHBondContact O-CG 3.25Å; E293-K297 PolarHBondContact O-N 2.86Å; E293-K297 VanDerWaalsContact O-N 3.08Å; E293-K297 WeakPolarHBondContact OE1-CE 3.06Å; E293-K297 IonicContact OE1-NZ 2.73Å; E293-K297 PolarHBondContact OE1-NZ 3.33Å; E293-V309 HydrophobicContact CB-CG2 4.42Å; E293-V309 HydrophobicContact CG-CG2 3.77Å
294	C	94.6	Very high	95.4	Very high	29 Å²	29	48.7 Å²	48.7	20%	0.196	28%	0.279	C	S	.	.	H	α-helix	trans	-65.2	-51	175.6	-169.5	0	0	0	0	111.2	C273 S292 M296 K297 E298	C273-C294 WeakPolarHBondContact CA-SG 2.97Å; C273-C294 HydrophobicContact CB-CB 3.89Å; C273-C294 WeakPolarHBondContact CB-SG 3.42Å; C273-C294 WeakPolarHBondContact SG-CB 3.31Å; C273-C294 PolarHBondContact SG-O 2.93Å; C273-C294 VanDerWaalsContact SG-O 3.39Å; C273-C294 CovalentContact SG-SG 2.04Å; C273-C294 PolarHBondContact SG-SG 3.27Å; S292-C294 PolarHBondContact O-N 3.5Å; C294-M296 PolarHBondContact O-N 3.19Å; C294-K297 WeakPolarHBondContact O-CA 3.35Å; C294-K297 WeakPolarHBondContact O-CB 3Å; C294-K297 PolarHBondContact O-N 2.89Å; C294-E298 PolarHBondContact O-N 3.49Å
295	A	94.8	Very high	95.4	Very high	18 Å²	18	50.1 Å²	50.1	15%	0.149	29%	0.288	C	S	.	.	H	α-helix	trans	-61	-33.9	178.3	0	0	0	0	0	112.3	P291 S292 E298 A299	P291-A295 HydrophobicContact CG-CB 3.62Å; S292-A295 PolarHBondContact O-N 3.45Å; S292-A295 PolarHBondContact OG-N 2.98Å; A295-E298 PolarHBondContact O-N 2.91Å; A295-A299 WeakPolarHBondContact O-CB 3.11Å; A295-A299 PolarHBondContact O-N 2.97Å
296	M	95.6	Very high	95.5	Very high	4 Å²	4	49.8 Å²	49.8	2%	0.02	28%	0.284	C	S	.	.	H	α-helix	trans	-61.5	-45.5	171.2	-177.7	-161.9	73.1	0	0	111.8	V282 A284 Y290 S292 E293 C294 A299 A300 L307 V309	V282-M296 HydrophobicContact CG2-CB 4.29Å; V282-M296 HydrophobicContact CG2-SD 4.37Å; A284-M296 HydrophobicContact CB-CG 3.76Å; A284-M296 HydrophobicContact CB-SD 3.56Å; A284-M296 VanDerWaalsContact CB-SD 3.56Å; Y290-M296 HydrophobicContact CD1-CB 4.18Å; Y290-M296 HydrophobicContact CD2-CB 3.88Å; Y290-M296 HydrophobicContact CD2-CG 3.79Å; Y290-M296 HydrophobicContact CE2-CB 4.48Å; Y290-M296 HydrophobicContact CE2-CG 4.05Å; Y290-M296 HydrophobicContact CG-CB 3.69Å; Y290-M296 HydrophobicContact CG-CG 4.14Å; S292-M296 PolarHBondContact O-N 3.1Å; E293-M296 HydrophobicContact CG-CE 4.09Å; E293-M296 WeakPolarHBondContact O-CB 3.08Å; E293-M296 PolarHBondContact O-N 3.28Å; C294-M296 PolarHBondContact O-N 3.19Å; M296-A299 PolarHBondContact O-N 2.04Å; M296-A300 WeakPolarHBondContact O-CB 3.18Å; M296-A300 PolarHBondContact O-N 3.19Å; M296-L307 HydrophobicContact CG-CB 3.88Å; M296-L307 HydrophobicContact CG-CD1 4.19Å; M296-L307 HydrophobicContact SD-CB 4.21Å; M296-V309 HydrophobicContact CE-CG2 3.84Å; M296-V309 HydrophobicContact SD-CG2 3.96Å
297	K	95.2	Very high	95.6	Very high	89 Å²	89	47.5 Å²	47.5	39%	0.387	27%	0.271	S	S	.	.	H	α-helix	trans	-65.9	-39	177.7	-72.3	172.1	-175.9	163.8	0	112.1	E293 C294 A300 C301	E293-K297 WeakPolarHBondContact O-CG 3.25Å; E293-K297 PolarHBondContact O-N 2.86Å; E293-K297 VanDerWaalsContact O-N 3.08Å; E293-K297 WeakPolarHBondContact OE1-CE 3.06Å; E293-K297 IonicContact OE1-NZ 2.73Å; E293-K297 PolarHBondContact OE1-NZ 3.33Å; C294-K297 WeakPolarHBondContact O-CA 3.35Å; C294-K297 WeakPolarHBondContact O-CB 3Å; C294-K297 PolarHBondContact O-N 2.89Å; K297-A300 WeakPolarHBondContact O-CB 3.39Å; K297-A300 PolarHBondContact O-N 3.34Å; K297-C301 WeakPolarHBondContact O-CB 3.46Å; K297-C301 PolarHBondContact O-N 3.26Å; K297-C301 PolarHBondContact O-SG 3.19Å; K297-C301 VanDerWaalsContact O-SG 3.4Å
298	E	94.8	Very high	95.5	Very high	106 Å²	106	47.6 Å²	47.6	50%	0.495	27%	0.269	S	S	.	.	H	α-helix	trans	-61.3	-44.2	174.4	-174.5	179.5	-166.6	0	0	111.5	C294 A295 C301 S302	C294-E298 PolarHBondContact O-N 3.49Å; A295-E298 PolarHBondContact O-N 2.91Å; E298-C301 WeakPolarHBondContact O-CB 2.99Å; E298-C301 PolarHBondContact O-N 2.04Å; E298-S302 WeakPolarHBondContact O-CB 3.46Å; E298-S302 PolarHBondContact O-N 3.3Å; E298-S302 PolarHBondContact O-OG 3.45Å
299	A	95.4	Very high	95.5	Very high	22 Å²	22	47.5 Å²	47.5	18%	0.182	27%	0.268	C	S	.	.	H	α-helix	trans	-63.9	-45.3	174.8	0	0	0	0	0	112.2	Y290 A295 M296 C301 S302 M303	Y290-A299 HydrophobicContact CD1-CB 4.23Å; Y290-A299 HydrophobicContact CE1-CB 3.38Å; A295-A299 WeakPolarHBondContact O-CB 3.11Å; A295-A299 PolarHBondContact O-N 2.97Å; M296-A299 PolarHBondContact O-N 2.04Å; A299-C301 VanDerWaalsContact C-N 3.3Å; A299-C301 PolarHBondContact O-N 2.93Å; A299-S302 PolarHBondContact O-N 2.95Å; A299-S302 VanDerWaalsContact O-N 3.07Å; A299-M303 WeakPolarHBondContact O-CB 3.48Å; A299-M303 WeakPolarHBondContact O-CG 3.21Å; A299-M303 PolarHBondContact O-N 3.28Å
300	A	97	Very high	95.4	Very high	3 Å²	3	51 Å²	51	3%	0.025	28%	0.278	C	S	.	.	H	α-helix	trans	-53.4	-48.6	174.1	0	0	0	0	0	111.2	L256 M296 K297 S302 M303 G304 V305 L307	L256-A300 HydrophobicContact CD1-CB 4.46Å; L256-A300 WeakPolarHBondContact CD2-O 3.47Å; M296-A300 WeakPolarHBondContact O-CB 3.18Å; M296-A300 PolarHBondContact O-N 3.19Å; K297-A300 WeakPolarHBondContact O-CB 3.39Å; K297-A300 PolarHBondContact O-N 3.34Å; A300-S302 VanDerWaalsContact C-N 3.33Å; A300-S302 PolarHBondContact O-N 3.03Å; A300-M303 PolarHBondContact O-N 3.24Å; A300-G304 PolarHBondContact O-N 3.29Å; A300-V305 VanDerWaalsContact CA-O 3.28Å; A300-V305 WeakPolarHBondContact CA-O 3.19Å; A300-V305 WeakPolarHBondContact CB-O 3.2Å; A300-V305 PolarHBondContact O-N 2.71Å; A300-L307 HydrophobicContact CB-CB 3.98Å; A300-L307 HydrophobicContact CB-CD1 4.05Å; A300-L307 HydrophobicContact CB-CG 3.91Å
301	C	96.1	Very high	95.2	Very high	16 Å²	16	51.6 Å²	51.6	11%	0.108	28%	0.282	C	S	.	.	H	α-helix	trans	-62	-34.2	175.9	-80.8	0	0	0	0	114.6	C269 K297 E298 A299	C269-C301 VanDerWaalsContact CA-SG 3.51Å; C269-C301 HydrophobicContact CB-CB 3.59Å; C269-C301 WeakPolarHBondContact CB-SG 3.49Å; C269-C301 WeakPolarHBondContact SG-CB 3.1Å; C269-C301 CovalentContact SG-SG 2.03Å; C269-C301 PolarHBondContact SG-SG 2.95Å; K297-C301 WeakPolarHBondContact O-CB 3.46Å; K297-C301 PolarHBondContact O-N 3.26Å; K297-C301 PolarHBondContact O-SG 3.19Å; K297-C301 VanDerWaalsContact O-SG 3.4Å; E298-C301 WeakPolarHBondContact O-CB 2.99Å; E298-C301 PolarHBondContact O-N 2.04Å; A299-C301 VanDerWaalsContact C-N 3.3Å; A299-C301 PolarHBondContact O-N 2.93Å
302	S	94.7	Very high	95.1	Very high	93 Å²	93	52.6 Å²	52.6	65%	0.65	29%	0.291	S	S	*	.	H	α-helix	trans	-76.6	-35	179.4	-59.7	0	0	0	0	111.7	E298 A299 A300	E298-S302 WeakPolarHBondContact O-CB 3.46Å; E298-S302 PolarHBondContact O-N 3.3Å; E298-S302 PolarHBondContact O-OG 3.45Å; A299-S302 PolarHBondContact O-N 2.95Å; A299-S302 VanDerWaalsContact O-N 3.07Å; A300-S302 VanDerWaalsContact C-N 3.33Å; A300-S302 PolarHBondContact O-N 3.03Å
303	M	95.5	Very high	95	Very high	113 Å²	113	53.3 Å²	53.3	56%	0.557	30%	0.3	S	S	*	.	H	α-helix	trans	-87.1	-19.8	-179.4	-64.9	171.5	62.1	0	0	113.3	A299 A300 V305	A299-M303 WeakPolarHBondContact O-CB 3.48Å; A299-M303 WeakPolarHBondContact O-CG 3.21Å; A299-M303 PolarHBondContact O-N 3.28Å; A300-M303 PolarHBondContact O-N 3.24Å; M303-V305 VanDerWaalsContact C-N 3.29Å; M303-V305 HydrophobicContact CB-CB 4.37Å; M303-V305 HydrophobicContact CB-CG2 4.16Å
304	G	96.8	Very high	94.9	Very high	24 Å²	24	50.8 Å²	50.8	25%	0.247	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	71	25.1	-172.4	0	0	0	0	0	113	W257 A300	W257-G304 PolarHBondContact N-O 3.5Å; A300-G304 PolarHBondContact O-N 3.29Å
305	V	97.2	Very high	94.9	Very high	31 Å²	31	50.8 Å²	50.8	19%	0.188	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-121.7	133.6	-176.9	-178.3	0	0	0	0	109	F259 A300 M303 L307	F259-V305 HydrophobicContact CD2-CG1 3.87Å; F259-V305 HydrophobicContact CE2-CB 4.37Å; F259-V305 HydrophobicContact CE2-CG1 3.76Å; F259-V305 HydrophobicContact CE2-CG2 3.79Å; A300-V305 VanDerWaalsContact CA-O 3.28Å; A300-V305 WeakPolarHBondContact CA-O 3.19Å; A300-V305 WeakPolarHBondContact CB-O 3.2Å; A300-V305 PolarHBondContact O-N 2.71Å; M303-V305 VanDerWaalsContact C-N 3.29Å; M303-V305 HydrophobicContact CB-CB 4.37Å; M303-V305 HydrophobicContact CB-CG2 4.16Å; V305-L307 PolarHBondContact O-N 2.75Å
306	L	96.9	Very high	94.6	Very high	21 Å²	21	56.9 Å²	56.9	11%	0.11	32%	0.323	C	S	.	.			trans	-70.7	122	176.8	-177.2	67.8	0	0	0	109.9	L256 W257 D258 E308	L256-L306 HydrophobicContact CB-CB 4.25Å; L256-L306 HydrophobicContact CD1-CD1 4.25Å; W257-L306 PolarHBondContact O-N 2.94Å; D258-L306 HydrophobicContact CB-CB 4.1Å; D258-L306 HydrophobicContact CB-CD2 3.78Å; L306-E308 HydrophobicContact CD2-CG 4.5Å; L306-E308 HydrophobicContact CG-CG 4.37Å
307	L	96.3	Very high	93.7	Very high	12 Å²	12	59.3 Å²	59.3	6%	0.063	34%	0.34	C	S	.	.			trans	-114.5	134	170.3	-58.2	177.8	0	0	0	109.9	S285 D286 Y290 M296 A300 V305	S285-L307 WeakPolarHBondContact OG-CA 3.35Å; D286-L307 HydrophobicContact CB-CD2 3.86Å; Y290-L307 HydrophobicContact CE2-CD1 4.04Å; Y290-L307 VanDerWaalsContact OH-CD1 3.29Å; Y290-L307 WeakPolarHBondContact OH-CD1 3.24Å; M296-L307 HydrophobicContact CG-CB 3.88Å; M296-L307 HydrophobicContact CG-CD1 4.19Å; M296-L307 HydrophobicContact SD-CB 4.21Å; A300-L307 HydrophobicContact CB-CB 3.98Å; A300-L307 HydrophobicContact CB-CD1 4.05Å; A300-L307 HydrophobicContact CB-CG 3.91Å; V305-L307 PolarHBondContact O-N 2.75Å
308	E	94.1	Very high	92.4	Very high	99 Å²	99	62.6 Å²	62.6	46%	0.463	36%	0.36	S	S	.	.			trans	-122.8	149.9	174.7	-64.2	-171.4	152.4	0	0	110	A284 S285 L306 K310	A284-E308 CarbonylContact C-O 3.58Å; A284-E308 WeakPolarHBondContact CA-O 3.35Å; S285-E308 PolarHBondContact N-O 3.42Å; S285-E308 PolarHBondContact OG-N 3.02Å; S285-E308 VanDerWaalsContact OG-N 3.11Å; L306-E308 HydrophobicContact CD2-CG 4.5Å; L306-E308 HydrophobicContact CG-CG 4.37Å; E308-K310 PolarHBondContact O-N 3.34Å
309	V	94.8	Very high	90.6	Very high	58 Å²	58	62.2 Å²	62.2	35%	0.352	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	123.2	175.7	178.7	0	0	0	0	109	V282 E293 M296	V282-V309 HydrophobicContact CB-CG1 4.2Å; V282-V309 HydrophobicContact CB-CG2 4.35Å; V282-V309 HydrophobicContact CG1-CG1 4.23Å; V282-V309 HydrophobicContact CG1-CG2 4.32Å; V282-V309 HydrophobicContact CG2-CG2 4.42Å; E293-V309 HydrophobicContact CB-CG2 4.42Å; E293-V309 HydrophobicContact CG-CG2 3.77Å; M296-V309 HydrophobicContact CE-CG2 3.84Å; M296-V309 HydrophobicContact SD-CG2 3.96Å
310	K	93.9	Very high	88.2	Confident	129 Å²	129	70 Å²	70	56%	0.561	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.9	-46.8	173.4	-169.8	-173.9	-178.2	-174.4	0	110.6	C283 N287 E308	C283-K310 WeakPolarHBondContact O-CA 3.37Å; C283-K310 VanDerWaalsContact O-CB 3.32Å; C283-K310 WeakPolarHBondContact O-CB 3.38Å; C283-K310 PolarHBondContact O-N 3.05Å; N287-K310 PolarHBondContact OD1-NZ 3.47Å; E308-K310 PolarHBondContact O-N 3.34Å
311	H	92	Very high	85.5	Confident	40 Å²	40	76.2 Å²	76.2	19%	0.185	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.3	163.2	171.4	59.5	89.8	0	0	0	110.5	C283 S314	C283-H311 VanDerWaalsContact CB-CE1 3.42Å; C283-H311 WeakPolarHBondContact CB-CE1 3.23Å; C283-H311 WeakPolarHBondContact CB-NE2 3.3Å; C283-H311 PolarHBondContact N-O 3.12Å; C283-H311 PolarHBondContact O-N 3.3Å; H311-S314 PolarHBondContact CE1-O 3.5Å
312	S	92.4	Very high	82.9	Confident	96 Å²	96	81.2 Å²	81.2	67%	0.671	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.9	153.7	170.3	-55.6	0	0	0	0	111.1
313	G	92.3	Very high	80.2	Confident	26 Å²	26	85.4 Å²	85.4	27%	0.268	47%	0.469	S	S	.	.	S	Bend	trans	84.1	-172.4	-177.8	0	0	0	0	0	114	A281 V282 C283	A281-G313 WeakPolarHBondContact O-CA 3.16Å; A281-G313 PolarHBondContact O-N 2.94Å; V282-G313 CarbonylContact C-O 3.15Å; V282-G313 WeakPolarHBondContact CA-O 3.48Å; C283-G313 PolarHBondContact N-O 2.79Å
314	S	93.3	Very high	77.5	Confident	38 Å²	38	88.3 Å²	88.3	27%	0.266	48%	0.481	S	S	.	.			trans	-75.8	148.1	179.3	179.8	0	0	0	0	111.8	T289 H311 N316 S317	T289-S314 PolarHBondContact OG1-OG 2.87Å; T289-S314 VanDerWaalsContact OG1-OG 3.08Å; H311-S314 PolarHBondContact CE1-O 3.5Å; S314-N316 PolarHBondContact O-N 3.46Å; S314-N316 VanDerWaalsContact O-N 3.14Å; S314-N316 PolarHBondContact OG-N 2.85Å; S314-S317 PolarHBondContact N-OG 2.9Å; S314-S317 PolarHBondContact O-N 3.39Å; S314-S317 VanDerWaalsContact O-N 3.07Å; S314-S317 PolarHBondContact O-OG 3Å
315	C	93.1	Very high	74.5	Confident	29 Å²	29	96 Å²	96	20%	0.196	51%	0.51	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-19.9	173.1	-61.2	0	0	0	0	113.8	C283 N287 T288 T289	C283-C315 WeakPolarHBondContact CA-SG 3.49Å; C283-C315 HydrophobicContact CB-CB 3.95Å; C283-C315 WeakPolarHBondContact CB-SG 3.49Å; C283-C315 WeakPolarHBondContact SG-CA 3.41Å; C283-C315 WeakPolarHBondContact SG-CB 3.46Å; C283-C315 CovalentContact SG-SG 2.03Å; C283-C315 PolarHBondContact SG-SG 2.87Å; N287-C315 PolarHBondContact O-SG 3.34Å; T288-C315 PolarHBondContact O-SG 2.79Å; T289-C315 PolarHBondContact OG1-N 3.32Å
316	N	89.9	Confident	71.6	Confident	146 Å²	146	101.8 Å²	101.8	78%	0.781	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-13.6	178	-65.7	-24.5	0	0	0	113.1	S314 I318	S314-N316 PolarHBondContact O-N 3.46Å; S314-N316 VanDerWaalsContact O-N 3.14Å; S314-N316 PolarHBondContact OG-N 2.85Å; N316-I318 PolarHBondContact O-N 2.82Å; N316-I318 VanDerWaalsContact O-N 3.15Å
317	S	76.7	Confident	68.8	Low	55 Å²	55	109 Å²	109	39%	0.385	57%	0.568	S	S	.	*	S	Bend	trans	-75.3	100.5	170.3	3.5	0	0	0	0	107.4	S314 N319	S314-S317 PolarHBondContact N-OG 2.9Å; S314-S317 PolarHBondContact O-N 3.39Å; S314-S317 VanDerWaalsContact O-N 3.07Å; S314-S317 PolarHBondContact O-OG 3Å; S317-N319 PolarHBondContact O-N 3.49Å
318	I	66.7	Low	65.8	Low	157 Å²	157	114.8 Å²	114.8	81%	0.805	60%	0.599	S	S	*	*			trans	-65.1	117.1	167.8	-56	169.3	0	0	0	105.4	N316 E320	N316-I318 PolarHBondContact O-N 2.82Å; N316-I318 VanDerWaalsContact O-N 3.15Å; I318-E320 PolarHBondContact O-N 3.11Å; I318-E320 VanDerWaalsContact O-N 3.07Å
319	N	57.5	Low	63.3	Low	99 Å²	99	118.6 Å²	118.6	53%	0.529	62%	0.617	S	S	.	*			trans	-64.9	109.9	168.5	-71	-33.1	0	0	0	106.8	S317 D321	S317-N319 PolarHBondContact O-N 3.49Å; N319-D321 VanDerWaalsContact C-N 3.29Å; N319-D321 PolarHBondContact O-N 3.3Å
320	E	44.1	Very low	60.5	Low	184 Å²	184	123.1 Å²	123.1	86%	0.86	64%	0.639	S	S	*	*			trans	-58.9	103.1	149.6	-71.5	172.8	172.9	0	0	105.2	I318	I318-E320 PolarHBondContact O-N 3.11Å; I318-E320 VanDerWaalsContact O-N 3.07Å
321	D	40.3	Very low	57.9	Low	135 Å²	135	125.5 Å²	125.5	72%	0.722	65%	0.653	S	S	*	*			trans	-55.1	134.4	161.6	-77.4	-42.1	0	0	0	106.5	N319 E323	N319-D321 VanDerWaalsContact C-N 3.29Å; N319-D321 PolarHBondContact O-N 3.3Å; D321-E323 PolarHBondContact O-N 3.49Å
322	P	42.4	Very low	55.1	Low	121 Å²	121	131.1 Å²	131.1	79%	0.786	68%	0.684	S	S	*	*			trans	-64.7	106.7	168.4	10.4	-1.8	0	0	0	106.2	E324	P322-E324 PolarHBondContact O-N 3.48Å
323	E	37.5	Very low	52.4	Low	181 Å²	181	136.7 Å²	136.7	85%	0.846	69%	0.692	S	S	*	*			trans	-47.8	130.5	159.7	-74.9	-179.4	162.7	0	0	107.1	D321 E325	D321-E323 PolarHBondContact O-N 3.49Å; E323-E325 PolarHBondContact O-N 2.97Å
324	E	38.7	Very low	49.6	Very low	174 Å²	174	139.3 Å²	139.3	81%	0.813	71%	0.706	S	S	*	*			trans	-49.9	112.6	171	-65.5	176	154.3	0	0	107.1	P322 E326	P322-E324 PolarHBondContact O-N 3.48Å; E324-E326 PolarHBondContact O-N 3.1Å
325	E	34.8	Very low	46.6	Very low	186 Å²	186	145.3 Å²	145.3	87%	0.869	73%	0.728	S	S	*	*			trans	-63.8	89.6	163.6	-73.6	-178.3	175.2	0	0	106	E323 E327	E323-E325 PolarHBondContact O-N 2.97Å; E325-E327 PolarHBondContact O-N 3.35Å; E325-E327 VanDerWaalsContact O-N 3.1Å
326	E	36.3	Very low	43.8	Very low	152 Å²	152	150.3 Å²	150.3	71%	0.71	76%	0.76	S	S	*	*			trans	-60.4	105.7	155.7	-69.2	-164.3	163.5	0	0	105.8	E324 D328	E324-E326 PolarHBondContact O-N 3.1Å; E326-D328 PolarHBondContact O-N 3.24Å
327	E	37	Very low	41.2	Very low	172 Å²	172	150.2 Å²	150.2	80%	0.804	76%	0.758	S	S	*	*			trans	-64.3	88.3	167.2	-73	179.3	164.1	0	0	107.9	E325 E329	E325-E327 PolarHBondContact O-N 3.35Å; E325-E327 VanDerWaalsContact O-N 3.1Å; E327-E329 VanDerWaalsContact C-N 3.34Å; E327-E329 PolarHBondContact O-N 3.3Å
328	D	34.9	Very low	39.3	Very low	134 Å²	134	152.5 Å²	152.5	72%	0.717	77%	0.773	S	S	*	*			trans	-68.4	92.3	163.9	-77.7	-33.5	0	0	0	108.6	E326 D330	E326-D328 PolarHBondContact O-N 3.24Å; D328-D330 PolarHBondContact O-N 3.28Å
329	E	39.9	Very low	37.8	Very low	178 Å²	178	149.3 Å²	149.3	83%	0.832	77%	0.765	S	S	*	*			trans	-71.4	78.4	163.4	-80.6	-168.6	156.9	0	0	110.3	E327	E327-E329 VanDerWaalsContact C-N 3.34Å; E327-E329 PolarHBondContact O-N 3.3Å
330	D	37.8	Very low	36.7	Very low	153 Å²	153	151.3 Å²	151.3	82%	0.818	77%	0.774	S	S	*	*			trans	-94	85.5	161.2	-83	-23.3	0	0	0	109.7	D328	D328-D330 PolarHBondContact O-N 3.28Å
331	Q	39.1	Very low	36.2	Very low	180 Å²	180	148.9 Å²	148.9	84%	0.841	77%	0.767	S	S	*	*			trans	-97.6	97.3	159.6	-81.7	-174.7	21.4	0	0	110.3	Y333	Q331-Y333 PolarHBondContact O-N 3.32Å
332	D	33.5	Very low	36.1	Very low	158 Å²	158	149.6 Å²	149.6	85%	0.845	77%	0.765	S	S	*	*			trans	-51.9	107.7	170.4	-164.4	5.1	0	0	0	112
333	Y	35.5	Very low	36.1	Very low	212 Å²	212	158.6 Å²	158.6	83%	0.831	78%	0.784	S	S	*	*			trans	-104.9	94.7	167.4	-113.2	-88.1	0	0	0	108.9	Q331	Q331-Y333 PolarHBondContact O-N 3.32Å
334	S	33.2	Very low	36.1	Very low	81 Å²	81	157.5 Å²	157.5	57%	0.566	78%	0.781	S	S	*	*			trans	-176.5	120.2	136.8	-96.5	0	0	0	0	117
335	F	30.1	Very low	35.9	Very low	165 Å²	165	156.6 Å²	156.6	72%	0.724	78%	0.779	S	S	*	*			trans	67	142.2	141.1	-59.4	-63.4	0	0	0	121.3	I337	F335-I337 HydrophobicContact CD1-CG1 4.38Å
336	P	33.4	Very low	36	Very low	134 Å²	134	154.9 Å²	154.9	87%	0.87	77%	0.774	S	S	*	*				-122.6	127.9	116.6	32.7	-25.3	0	0	0	112
337	I	35.8	Very low	36	Very low	144 Å²	144	155.1 Å²	155.1	74%	0.738	78%	0.778	S	S	*	*			trans	-97.8	143.2	160.7	-69.9	177.4	0	0	0	108.3	F335	F335-I337 HydrophobicContact CD1-CG1 4.38Å
338	S	37.5	Very low	35.9	Very low	102 Å²	102	154.1 Å²	154.1	71%	0.713	78%	0.776	S	S	*	*			trans	119.3	123.9	152.3	-167.5	0	0	0	0	111.2
339	S	35.4	Very low	36	Very low	90 Å²	90	155.4 Å²	155.4	63%	0.629	78%	0.78	S	S	*	*			cis	-175.7	178.4	4.9	37.6	0	0	0	0	108.4
340	I	34.5	Very low	35.7	Very low	142 Å²	142	153.8 Å²	153.8	73%	0.728	78%	0.777	S	S	*	*			trans	111.5	106.1	147.4	-75.4	163.1	0	0	0	118
341	L	33.8	Very low	35.5	Very low	133 Å²	133	153.8 Å²	153.8	70%	0.696	77%	0.773	S	S	*	*			trans	72.8	125	133.1	-70.3	161.1	0	0	0	121.7
342	E	37.1	Very low	35.2	Very low	149 Å²	149	151.7 Å²	151.7	70%	0.696	77%	0.768	S	S	*	*				91.4	117.6	126.4	-86.9	-177.1	-148.4	0	0	121.1
343	W	43.2	Very low	35.4	Very low	310 Å²	310	151.1 Å²	151.1	100%	1.174	76%	0.761	S	S	*	*			trans	99.6	0	154	-60.9	27.4	0	0	0	117

Retrieved 343 of 343 residues in 54.2 ms (Link to these results)

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