A0A2K5TP20_MACFA Loading...

Leucine-rich repeat-containing protein 61

AlphaFold DB , UniProt , Accession A0A2K5TP20, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene n/a, Length 259 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	43.2	Very low	40.8	Very low	244 Å²	244	150.6 Å²	150.6	100%	1.202	88%	0.877	S	S	*	*				0	107.3	0	-84.5	168.9	155	0	0	105.4
2	E	37.7	Very low	41.6	Very low	186 Å²	186	143.8 Å²	143.8	87%	0.869	86%	0.863	S	S	*	*			cis	-147.7	162.2	13.6	-66.8	171.9	115.2	0	0	107
3	P	38.6	Very low	43.7	Very low	121 Å²	121	135.6 Å²	135.6	79%	0.786	83%	0.826	S	S	*	*			trans	-89.7	155	159.7	34.2	-25.2	0	0	0	111.1
4	P	47	Very low	46.8	Very low	129 Å²	129	133.4 Å²	133.4	84%	0.838	81%	0.806	S	S	*	*			trans	-91	140.1	-161.7	34.7	-31.8	0	0	0	113.3
5	G	41.1	Very low	49.8	Very low	71 Å²	71	130.8 Å²	130.8	73%	0.732	78%	0.782	S	S	*	*			trans	45.9	88.5	140	0	0	0	0	0	118.1	K7	G5-K7 PolarHBondContact O-N 2.99Å
6	E	38.5	Very low	52.4	Low	198 Å²	198	122.8 Å²	122.8	93%	0.925	73%	0.734	S	S	*	*			trans	-58.8	122	156.9	-74.8	178	158.3	0	0	109.7
7	K	35.2	Very low	54.6	Low	199 Å²	199	118.2 Å²	118.2	87%	0.865	71%	0.707	S	S	*	*			trans	-72.6	131	170.2	-70.7	-179.8	178.3	176.7	0	108.8	G5 G9	G5-K7 PolarHBondContact O-N 2.99Å; K7-G9 PolarHBondContact O-N 3.05Å
8	P	42	Very low	56.5	Low	136 Å²	136	115.4 Å²	115.4	88%	0.883	69%	0.693	S	S	*	*	S	Bend	trans	-82.5	112.1	172.9	31.8	-27.9	0	0	0	108.5
9	G	38.2	Very low	58.1	Low	75 Å²	75	116.7 Å²	116.7	77%	0.773	69%	0.69	S	S	*	*			trans	173.5	2.8	177.8	0	0	0	0	0	119.9	K7	K7-G9 PolarHBondContact O-N 3.05Å
10	E	42	Very low	59.6	Low	191 Å²	191	112.5 Å²	112.5	89%	0.893	66%	0.664	S	S	*	*			trans	-100.3	98.6	172.3	-75.4	-177.3	176.5	0	0	109.9	G12	E10-G12 PolarHBondContact O-N 2.79Å
11	A	45	Very low	61	Low	107 Å²	107	107.2 Å²	107.2	88%	0.884	63%	0.633	S	S	*	*			trans	-68.5	76.8	159.5	0	0	0	0	0	107.9	G13	A11-G13 PolarHBondContact O-N 3.36Å
12	G	51.1	Low	63.1	Low	69 Å²	69	100.7 Å²	100.7	71%	0.711	60%	0.598	S	S	*	*			trans	-64.9	103.2	178.4	0	0	0	0	0	109.6	E10	E10-G12 PolarHBondContact O-N 2.79Å
13	G	68.9	Low	65.5	Low	37 Å²	37	98.9 Å²	98.9	38%	0.381	59%	0.593	S	S	.	*			trans	-62.3	152.5	171.6	0	0	0	0	0	110.8	A11	A11-G13 PolarHBondContact O-N 3.36Å
14	L	87.4	Confident	67.8	Low	104 Å²	104	98.8 Å²	98.8	55%	0.545	58%	0.578	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-67.4	144.7	-177.6	-80.4	145.3	0	0	0	110.6	L41 G42 L43 A44 D45	L14-L41 WeakPolarHBondContact CD1-O 3.4Å; L14-G42 PolarHBondContact N-O 3.26Å; L14-L43 HydrophobicContact CB-CD2 3.91Å; L14-L43 CarbonylContact O-C 3.34Å; L14-L43 WeakPolarHBondContact O-CA 3.48Å; L14-L43 WeakPolarHBondContact O-CD2 3.49Å; L14-A44 PolarHBondContact O-N 2.88Å; L14-D45 PolarHBondContact O-N 2.91Å
15	Q	91.3	Very high	69.7	Low	95 Å²	95	94.5 Å²	94.5	44%	0.444	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	145.7	176.2	-175.3	-178.8	31.2	0	0	110.1	T17 D45	Q15-T17 PolarHBondContact O-N 2.85Å; Q15-D45 WeakPolarHBondContact CA-O 3.37Å; Q15-D45 HydrophobicContact CB-CB 4.16Å; Q15-D45 VanDerWaalsContact CD-OD2 3.31Å; Q15-D45 HydrophobicContact CG-CB 3.87Å; Q15-D45 PolarHBondContact NE2-OD2 3.45Å
16	I	90.8	Very high	71.6	Confident	2 Å²	2	93.4 Å²	93.4	1%	0.01	54%	0.537	C	S	.	.			trans	-72.4	119.8	170.3	-59.1	179.6	0	0	0	109.6	L21 L38 L43 D45 L46 C48 L49 L60	I16-L21 HydrophobicContact CG2-CD1 4.03Å; I16-L21 HydrophobicContact CG2-CD2 3.7Å; I16-L21 HydrophobicContact CG2-CG 3.78Å; I16-L38 HydrophobicContact CD1-CD1 3.64Å; I16-L38 HydrophobicContact CG1-CD1 4.12Å; I16-L43 HydrophobicContact CD1-CD1 4.13Å; I16-L43 HydrophobicContact CG1-CD1 3.88Å; I16-L43 HydrophobicContact CG1-CD2 3.93Å; I16-L43 HydrophobicContact CG1-CG 4.49Å; I16-D45 PolarHBondContact N-O 3.34Å; I16-D45 VanDerWaalsContact N-O 3.07Å; I16-L46 WeakPolarHBondContact CB-O 3.5Å; I16-L46 HydrophobicContact CD1-CB 4.48Å; I16-L46 HydrophobicContact CD1-CD2 3.78Å; I16-C48 PolarHBondContact O-N 3.07Å; I16-L49 HydrophobicContact CD1-CB 4.08Å; I16-L49 HydrophobicContact CD1-CD1 4.39Å; I16-L49 HydrophobicContact CD1-CD2 3.86Å; I16-L49 HydrophobicContact CD1-CG 4.35Å; I16-L49 HydrophobicContact CG2-CB 4.47Å; I16-L60 HydrophobicContact CD1-CD2 4.2Å
17	T	90.8	Very high	73.6	Confident	46 Å²	46	88.2 Å²	88.2	28%	0.282	51%	0.513	S	S	.	.			trans	-118.5	158.5	177.6	63	0	0	0	0	111.4	Q15 Q19 L20 L21	Q15-T17 PolarHBondContact O-N 2.85Å; T17-Q19 PolarHBondContact O-N 2.89Å; T17-Q19 PolarHBondContact OG1-OE1 3.37Å; T17-L20 WeakPolarHBondContact O-CB 3.44Å; T17-L20 PolarHBondContact O-N 3.48Å; T17-L20 WeakPolarHBondContact OG1-CB 3.42Å; T17-L20 PolarHBondContact OG1-N 3.36Å; T17-L21 PolarHBondContact O-N 2.85Å
18	P	87.6	Confident	75.5	Confident	68 Å²	68	86.9 Å²	86.9	44%	0.442	51%	0.508	S	S	.	.	H	α-helix	trans	-57	-34.4	175.7	-25.8	35.2	0	0	0	113	L21 K22 C48	P18-L21 PolarHBondContact O-N 3.38Å; P18-K22 WeakPolarHBondContact O-CB 3.39Å; P18-K22 PolarHBondContact O-N 3.49Å; P18-C48 VanDerWaalsContact CD-SG 3.54Å
19	Q	86.6	Confident	77.5	Confident	139 Å²	139	83.1 Å²	83.1	65%	0.65	48%	0.484	S	S	*	.	H	α-helix	trans	-65.9	-41.9	176.6	-61.4	82.1	-2.5	0	0	111.5	T17 L23	T17-Q19 PolarHBondContact O-N 2.89Å; T17-Q19 PolarHBondContact OG1-OE1 3.37Å; Q19-L23 WeakPolarHBondContact O-CB 3.4Å; Q19-L23 PolarHBondContact O-N 2.94Å
20	L	88.3	Confident	79.7	Confident	33 Å²	33	81.1 Å²	81.1	17%	0.173	46%	0.456	C	S	.	.	H	α-helix	trans	-63.5	-45.1	174.8	-177.1	154.2	0	0	0	110.6	T17 K22 L23 R24 L38	T17-L20 WeakPolarHBondContact O-CB 3.44Å; T17-L20 PolarHBondContact O-N 3.48Å; T17-L20 WeakPolarHBondContact OG1-CB 3.42Å; T17-L20 PolarHBondContact OG1-N 3.36Å; L20-K22 PolarHBondContact O-N 3.39Å; L20-L23 PolarHBondContact O-N 3.33Å; L20-R24 HydrophobicContact CD2-CG 4.25Å; L20-R24 WeakPolarHBondContact O-CG 3.5Å; L20-R24 PolarHBondContact O-N 3.2Å; L20-R24 VanDerWaalsContact O-N 3.1Å; L20-L38 HydrophobicContact CD2-CD1 4.28Å; L20-L38 HydrophobicContact CD2-CD2 3.67Å
21	L	89.9	Confident	81.6	Confident	1 Å²	1	78.5 Å²	78.5	1%	0.005	44%	0.444	C	S	.	.	H	α-helix	trans	-61.4	-46	178.1	-66.9	179.3	0	0	0	111.7	I16 T17 P18 L23 R24 T25 L30 I33 L36 L38	I16-L21 HydrophobicContact CG2-CD1 4.03Å; I16-L21 HydrophobicContact CG2-CD2 3.7Å; I16-L21 HydrophobicContact CG2-CG 3.78Å; T17-L21 PolarHBondContact O-N 2.85Å; P18-L21 PolarHBondContact O-N 3.38Å; L21-L23 VanDerWaalsContact C-N 3.34Å; L21-L23 PolarHBondContact O-N 3.07Å; L21-R24 PolarHBondContact O-N 2.96Å; L21-R24 VanDerWaalsContact O-N 3.15Å; L21-T25 WeakPolarHBondContact O-CB 3.42Å; L21-T25 PolarHBondContact O-N 3.46Å; L21-T25 PolarHBondContact O-OG1 3.47Å; L21-L30 HydrophobicContact CB-CD2 4.34Å; L21-L30 HydrophobicContact CD1-CD2 3.67Å; L21-I33 HydrophobicContact CB-CD1 4.38Å; L21-L36 HydrophobicContact CD2-CD1 4.09Å; L21-L36 HydrophobicContact CD2-CD2 3.58Å; L21-L36 HydrophobicContact CD2-CG 4.49Å; L21-L38 HydrophobicContact CD2-CD1 4.41Å
22	K	87.3	Confident	83.7	Confident	108 Å²	108	75.7 Å²	75.7	47%	0.47	42%	0.418	S	S	.	.	H	α-helix	trans	-60.4	-42.3	176.1	-175.4	174.6	-178.8	177.7	0	112.3	P18 L20 R24 G26	P18-K22 WeakPolarHBondContact O-CB 3.39Å; P18-K22 PolarHBondContact O-N 3.49Å; L20-K22 PolarHBondContact O-N 3.39Å; K22-R24 VanDerWaalsContact C-N 3.25Å; K22-R24 PolarHBondContact O-N 3.41Å; K22-G26 WeakPolarHBondContact O-CA 3.31Å; K22-G26 PolarHBondContact O-N 3.36Å
23	L	87.3	Confident	85.6	Confident	147 Å²	147	72.6 Å²	72.6	77%	0.77	39%	0.385	S	S	*	.	H	α-helix	trans	-62.5	-33.4	177.4	-175.2	69.7	0	0	0	112.2	Q19 L20 L21	Q19-L23 WeakPolarHBondContact O-CB 3.4Å; Q19-L23 PolarHBondContact O-N 2.94Å; L20-L23 PolarHBondContact O-N 3.33Å; L21-L23 VanDerWaalsContact C-N 3.34Å; L21-L23 PolarHBondContact O-N 3.07Å
24	R	87.6	Confident	86.7	Confident	120 Å²	120	75 Å²	75	45%	0.453	39%	0.389	S	S	.	.	H	α-helix	trans	-90.9	-31.3	-174.1	-62.3	-64.4	-92	-121.6	-0.5	114.1	L20 L21 K22 L38	L20-R24 HydrophobicContact CD2-CG 4.25Å; L20-R24 WeakPolarHBondContact O-CG 3.5Å; L20-R24 PolarHBondContact O-N 3.2Å; L20-R24 VanDerWaalsContact O-N 3.1Å; L21-R24 PolarHBondContact O-N 2.96Å; L21-R24 VanDerWaalsContact O-N 3.15Å; K22-R24 VanDerWaalsContact C-N 3.25Å; K22-R24 PolarHBondContact O-N 3.41Å; R24-L38 HydrophobicContact CB-CD2 4.46Å; R24-L38 HydrophobicContact CG-CD2 4.01Å
25	T	86.2	Confident	87	Confident	39 Å²	39	74.6 Å²	74.6	24%	0.239	39%	0.386	C	S	.	.	H	α-helix	trans	-102.9	-27.3	-175.8	60.1	0	0	0	0	112.6	L21 E27 I33 L36	L21-T25 WeakPolarHBondContact O-CB 3.42Å; L21-T25 PolarHBondContact O-N 3.46Å; L21-T25 PolarHBondContact O-OG1 3.47Å; T25-E27 PolarHBondContact O-N 2.86Å; T25-E27 PolarHBondContact OG1-N 2.94Å; T25-I33 HydrophobicContact CG2-CD1 4.04Å; T25-I33 HydrophobicContact CG2-CG1 4.14Å; T25-I33 HydrophobicContact CG2-CG2 3.85Å; T25-L36 HydrophobicContact CG2-CD1 3.72Å
26	G	81.3	Confident	87.1	Confident	47 Å²	47	70.2 Å²	70.2	49%	0.485	37%	0.366	S	S	.	.			trans	72.8	-3.1	-167.6	0	0	0	0	0	113.6	K22 F28	K22-G26 WeakPolarHBondContact O-CA 3.31Å; K22-G26 PolarHBondContact O-N 3.36Å; G26-F28 WeakPolarHBondContact O-CE2 3.43Å
27	E	80.8	Confident	87.3	Confident	89 Å²	89	76 Å²	76	42%	0.416	39%	0.391	S	S	.	.			trans	-82.5	145.1	-178.5	-67.1	-64.1	147.2	0	0	111.1	T25 S32 I33	T25-E27 PolarHBondContact O-N 2.86Å; T25-E27 PolarHBondContact OG1-N 2.94Å; E27-S32 PolarHBondContact OE2-OG 2.94Å; E27-I33 HydrophobicContact CB-CG1 4.02Å; E27-I33 HydrophobicContact CG-CG1 4.35Å
28	F	75.8	Confident	87.5	Confident	171 Å²	171	73.8 Å²	73.8	75%	0.75	38%	0.377	S	S	*	.	S	Bend	trans	-100.5	-20.6	179.5	-62.1	-98	0	0	0	112.3	G26	G26-F28 WeakPolarHBondContact O-CE2 3.43Å
29	S	84.3	Confident	87.8	Confident	57 Å²	57	76.9 Å²	76.9	40%	0.399	38%	0.38	S	S	.	.			trans	-106	134.9	173.6	-173.5	0	0	0	0	109.6	E31 S32	S29-E31 PolarHBondContact O-N 2.94Å; S29-E31 PolarHBondContact OG-N 3.33Å; S29-S32 PolarHBondContact O-N 3.37Å; S29-S32 PolarHBondContact O-OG 3.45Å
30	L	83.4	Confident	88.2	Confident	34 Å²	34	74.5 Å²	74.5	18%	0.178	38%	0.378	C	S	.	.	G	3₁₀ helix	trans	-70.6	-26.7	176.3	-60.3	-178.7	0	0	0	111.7	L21 S32 I33 E51 C52	L21-L30 HydrophobicContact CB-CD2 4.34Å; L21-L30 HydrophobicContact CD1-CD2 3.67Å; L30-S32 VanDerWaalsContact C-N 3.3Å; L30-S32 PolarHBondContact O-N 2.86Å; L30-I33 HydrophobicContact CD2-CD1 3.95Å; L30-I33 PolarHBondContact O-N 3.4Å; L30-E51 HydrophobicContact CD1-CB 3.65Å; L30-E51 VanDerWaalsContact CD1-OE2 3.24Å; L30-E51 WeakPolarHBondContact CD1-OE2 3.48Å; L30-C52 WeakPolarHBondContact O-CA 3.38Å
31	E	82.9	Confident	88.4	Confident	135 Å²	135	75 Å²	75	63%	0.631	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-70.8	-23.1	-179.9	-61.9	-179.7	176.3	0	0	113.1	S29 I33	S29-E31 PolarHBondContact O-N 2.94Å; S29-E31 PolarHBondContact OG-N 3.33Å; E31-I33 VanDerWaalsContact C-N 3.33Å
32	S	87.4	Confident	88.6	Confident	49 Å²	49	76.6 Å²	76.6	34%	0.343	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-82.9	-9.1	177.9	60	0	0	0	0	113.5	E27 S29 L30 L34	E27-S32 PolarHBondContact OE2-OG 2.94Å; S29-S32 PolarHBondContact O-N 3.37Å; S29-S32 PolarHBondContact O-OG 3.45Å; L30-S32 VanDerWaalsContact C-N 3.3Å; L30-S32 PolarHBondContact O-N 2.86Å; S32-L34 PolarHBondContact O-N 3.48Å; S32-L34 VanDerWaalsContact O-N 3.11Å
33	I	91.3	Very high	88.9	Confident	4 Å²	4	71.5 Å²	71.5	2%	0.021	38%	0.375	C	S	.	.			trans	-77.5	102.1	-177.7	-56.2	172.6	0	0	0	109.3	L21 T25 E27 L30 E31 L36 G54 L55	L21-I33 HydrophobicContact CB-CD1 4.38Å; T25-I33 HydrophobicContact CG2-CD1 4.04Å; T25-I33 HydrophobicContact CG2-CG1 4.14Å; T25-I33 HydrophobicContact CG2-CG2 3.85Å; E27-I33 HydrophobicContact CB-CG1 4.02Å; E27-I33 HydrophobicContact CG-CG1 4.35Å; L30-I33 HydrophobicContact CD2-CD1 3.95Å; L30-I33 PolarHBondContact O-N 3.4Å; E31-I33 VanDerWaalsContact C-N 3.33Å; I33-L36 HydrophobicContact CG2-CB 4.25Å; I33-G54 CarbonylContact O-C 3.57Å; I33-L55 HydrophobicContact CG2-CD1 3.81Å; I33-L55 VanDerWaalsContact O-CA 3.27Å; I33-L55 WeakPolarHBondContact O-CA 3.29Å; I33-L55 WeakPolarHBondContact O-CD1 3.36Å; I33-L55 PolarHBondContact O-N 2.9Å
34	L	92.5	Very high	89.2	Confident	88 Å²	88	65.9 Å²	65.9	46%	0.461	35%	0.35	S	S	.	.			trans	-90	-33.8	176.3	-56.4	-179.9	0	0	0	112.9	S32 G54 E56 W57	S32-L34 PolarHBondContact O-N 3.48Å; S32-L34 VanDerWaalsContact O-N 3.11Å; L34-G54 WeakPolarHBondContact CD2-O 3.18Å; L34-E56 PolarHBondContact O-N 2.97Å; L34-W57 PolarHBondContact O-N 2.9Å
35	L	93.3	Very high	89.6	Confident	94 Å²	94	62.6 Å²	62.6	49%	0.492	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	128.2	-174.9	-176.6	156	0	0	0	110.6	K37 W57	L35-K37 HydrophobicContact CD2-CD 4.23Å; L35-K37 HydrophobicContact CD2-CG 4.1Å; L35-W57 WeakPolarHBondContact CA-O 3.37Å; L35-W57 HydrophobicContact CB-CB 4.38Å; L35-W57 HydrophobicContact CD1-CB 4.38Å; L35-W57 HydrophobicContact CD1-CD2 4.26Å; L35-W57 HydrophobicContact CD1-CE3 4.26Å; L35-W57 HydrophobicContact CD1-CG 4.33Å; L35-W57 HydrophobicContact CD2-CE3 4.12Å; L35-W57 HydrophobicContact CD2-CZ3 4.45Å; L35-W57 HydrophobicContact CG-CB 4.13Å; L35-W57 HydrophobicContact CG-CD2 4.12Å; L35-W57 HydrophobicContact CG-CE3 3.72Å; L35-W57 HydrophobicContact CG-CG 4.32Å; L35-W57 HydrophobicContact CG-CZ3 4.5Å
36	L	94.8	Very high	89.9	Confident	3 Å²	3	60.8 Å²	60.8	2%	0.016	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	127.1	-179.2	-173.2	61.5	0	0	0	112.6	L21 T25 I33 L38 L49 L55 W57 L58 D59	L21-L36 HydrophobicContact CD2-CD1 4.09Å; L21-L36 HydrophobicContact CD2-CD2 3.58Å; L21-L36 HydrophobicContact CD2-CG 4.49Å; T25-L36 HydrophobicContact CG2-CD1 3.72Å; I33-L36 HydrophobicContact CG2-CB 4.25Å; L36-L38 HydrophobicContact CD1-CD1 4.29Å; L36-L38 HydrophobicContact CD1-CD2 4.17Å; L36-L38 HydrophobicContact CD1-CG 4.03Å; L36-L38 HydrophobicContact CD2-CD1 3.7Å; L36-L38 HydrophobicContact CD2-CG 4.2Å; L36-L38 HydrophobicContact CG-CD1 3.93Å; L36-L38 HydrophobicContact CG-CG 3.84Å; L36-L49 HydrophobicContact CD2-CD1 3.48Å; L36-L49 VanDerWaalsContact CD2-CD1 3.48Å; L36-L55 HydrophobicContact CB-CD1 3.67Å; L36-W57 PolarHBondContact N-O 2.96Å; L36-L58 HydrophobicContact CB-CD1 4.06Å; L36-L58 HydrophobicContact CD2-CD1 4.1Å; L36-L58 HydrophobicContact CG-CD1 4.22Å; L36-L58 WeakPolarHBondContact O-CA 3.48Å; L36-D59 PolarHBondContact O-N 2.99Å
37	K	94.3	Very high	90.5	Very high	123 Å²	123	59.7 Å²	59.7	54%	0.535	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	104.6	179.2	-74.9	174.1	179.3	174.7	0	110.9	L35 W57 D59	L35-K37 HydrophobicContact CD2-CD 4.23Å; L35-K37 HydrophobicContact CD2-CG 4.1Å; K37-W57 HydrophobicContact CB-CZ3 4.48Å; K37-W57 HydrophobicContact CD-CH2 4.23Å; K37-W57 HydrophobicContact CD-CZ3 4.1Å; K37-W57 VanDerWaalsContact CE-CH2 3.46Å; K37-W57 HydrophobicContact CG-CE3 4.27Å; K37-W57 HydrophobicContact CG-CH2 3.76Å; K37-W57 HydrophobicContact CG-CZ3 3.27Å; K37-D59 HydrophobicContact CG-CB 4.48Å
38	L	94.6	Very high	91	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.305	C	S	.	.			trans	-125.3	46.2	-177.5	-63.9	179.9	0	0	0	111.6	I16 L20 L21 R24 L36 L41 L43 D59 L60 N63	I16-L38 HydrophobicContact CD1-CD1 3.64Å; I16-L38 HydrophobicContact CG1-CD1 4.12Å; L20-L38 HydrophobicContact CD2-CD1 4.28Å; L20-L38 HydrophobicContact CD2-CD2 3.67Å; L21-L38 HydrophobicContact CD2-CD1 4.41Å; R24-L38 HydrophobicContact CB-CD2 4.46Å; R24-L38 HydrophobicContact CG-CD2 4.01Å; L36-L38 HydrophobicContact CD1-CD1 4.29Å; L36-L38 HydrophobicContact CD1-CD2 4.17Å; L36-L38 HydrophobicContact CD1-CG 4.03Å; L36-L38 HydrophobicContact CD2-CD1 3.7Å; L36-L38 HydrophobicContact CD2-CG 4.2Å; L36-L38 HydrophobicContact CG-CD1 3.93Å; L36-L38 HydrophobicContact CG-CG 3.84Å; L38-L41 HydrophobicContact CB-CD1 4.07Å; L38-L41 HydrophobicContact CD2-CD1 3.77Å; L38-L43 HydrophobicContact CB-CD1 3.94Å; L38-L43 HydrophobicContact CD1-CD1 4.21Å; L38-D59 CarbonylContact C-O 3.51Å; L38-D59 WeakPolarHBondContact CA-O 3.47Å; L38-D59 PolarHBondContact N-O 3.42Å; L38-L60 HydrophobicContact CB-CD2 4.07Å; L38-L60 HydrophobicContact CD1-CD2 4.29Å; L38-N63 PolarHBondContact O-ND2 3.31Å
39	R	94.8	Very high	91.9	Very high	134 Å²	134	48.1 Å²	48.1	51%	0.506	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	142.3	179.7	176.9	-178	-60.8	-147.8	0.2	112.4	L41 D59 S61	R39-L41 VanDerWaalsContact C-N 3.32Å; R39-L41 PolarHBondContact O-N 2.71Å; R39-D59 IonicContact CZ-OD2 3.28Å; R39-D59 IonicContact NE-OD2 2.76Å; R39-D59 PolarHBondContact NE-OD2 3.12Å; R39-D59 IonicContact NH2-OD2 2.64Å; R39-D59 PolarHBondContact NH2-OD2 3.47Å; R39-S61 CarbonylContact C-O 3.55Å; R39-S61 VanDerWaalsContact CA-O 3.22Å; R39-S61 WeakPolarHBondContact CA-O 3.32Å; R39-S61 WeakPolarHBondContact CG-O 3.34Å; R39-S61 PolarHBondContact NE-OG 2.94Å
40	C	94.3	Very high	92.3	Very high	89 Å²	89	46.1 Å²	46.1	60%	0.601	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	41.4	169.5	-63.3	0	0	0	0	114.7	S61 G62	C40-S61 PolarHBondContact N-O 2.92Å; C40-G62 VanDerWaalsContact CA-O 3.28Å; C40-G62 WeakPolarHBondContact CA-O 3.34Å
41	L	93.3	Very high	92.8	Very high	42 Å²	42	49.9 Å²	49.9	22%	0.22	27%	0.274	C	S	.	.	S	Bend	trans	-102.7	-1.1	178.8	-65.2	-176.9	0	0	0	113.2	L14 L38 R39 L43 N63	L14-L41 WeakPolarHBondContact CD1-O 3.4Å; L38-L41 HydrophobicContact CB-CD1 4.07Å; L38-L41 HydrophobicContact CD2-CD1 3.77Å; R39-L41 VanDerWaalsContact C-N 3.32Å; R39-L41 PolarHBondContact O-N 2.71Å; L41-L43 VanDerWaalsContact C-N 3.26Å; L41-L43 HydrophobicContact CB-CD1 4.29Å; L41-L43 HydrophobicContact CB-CG 3.93Å; L41-L43 HydrophobicContact CD1-CD1 4.38Å; L41-L43 PolarHBondContact O-N 3.5Å; L41-N63 PolarHBondContact N-OD1 3.1Å
42	G	92.6	Very high	93.3	Very high	36 Å²	36	43.4 Å²	43.4	37%	0.371	24%	0.244	S	C	.	.			trans	66.5	30.1	-175.5	0	0	0	0	0	112.5	L14 A44 N63	L14-G42 PolarHBondContact N-O 3.26Å; G42-A44 PolarHBondContact O-N 2.94Å; G42-N63 PolarHBondContact N-OD1 2.92Å
43	L	94.1	Very high	93.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	130.3	178.7	-65.4	167.5	0	0	0	110.3	L14 I16 L38 L41 L60 N63 A64 L65	L14-L43 HydrophobicContact CB-CD2 3.91Å; L14-L43 CarbonylContact O-C 3.34Å; L14-L43 WeakPolarHBondContact O-CA 3.48Å; L14-L43 WeakPolarHBondContact O-CD2 3.49Å; I16-L43 HydrophobicContact CD1-CD1 4.13Å; I16-L43 HydrophobicContact CG1-CD1 3.88Å; I16-L43 HydrophobicContact CG1-CD2 3.93Å; I16-L43 HydrophobicContact CG1-CG 4.49Å; L38-L43 HydrophobicContact CB-CD1 3.94Å; L38-L43 HydrophobicContact CD1-CD1 4.21Å; L41-L43 VanDerWaalsContact C-N 3.26Å; L41-L43 HydrophobicContact CB-CD1 4.29Å; L41-L43 HydrophobicContact CB-CG 3.93Å; L41-L43 HydrophobicContact CD1-CD1 4.38Å; L41-L43 PolarHBondContact O-N 3.5Å; L43-L60 HydrophobicContact CD1-CD2 4.28Å; L43-N63 HydrophobicContact CB-CB 4.06Å; L43-N63 PolarHBondContact N-OD1 3.04Å; L43-N63 VanDerWaalsContact N-OD1 3.07Å; L43-N63 WeakPolarHBondContact O-CB 3.39Å; L43-A64 CarbonylContact O-C 3.51Å; L43-A64 VanDerWaalsContact O-C 3.3Å; L43-A64 WeakPolarHBondContact O-CA 3.44Å; L43-A64 PolarHBondContact O-N 3.26Å; L43-L65 HydrophobicContact CB-CD2 4.28Å; L43-L65 PolarHBondContact O-N 3.44Å
44	A	94.6	Very high	93.7	Very high	29 Å²	29	45.9 Å²	45.9	24%	0.24	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	-20.3	171.1	0	0	0	0	0	112.4	L14 G42	L14-A44 PolarHBondContact O-N 2.88Å; G42-A44 PolarHBondContact O-N 2.94Å
45	D	94.3	Very high	93.9	Very high	52 Å²	52	41.7 Å²	41.7	28%	0.278	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	133.2	-178.7	-177.5	2.7	0	0	0	111.1	L14 Q15 I16 G47	L14-D45 PolarHBondContact O-N 2.91Å; Q15-D45 WeakPolarHBondContact CA-O 3.37Å; Q15-D45 HydrophobicContact CB-CB 4.16Å; Q15-D45 VanDerWaalsContact CD-OD2 3.31Å; Q15-D45 HydrophobicContact CG-CB 3.87Å; Q15-D45 PolarHBondContact NE2-OD2 3.45Å; I16-D45 PolarHBondContact N-O 3.34Å; I16-D45 VanDerWaalsContact N-O 3.07Å; D45-G47 VanDerWaalsContact C-N 3.35Å; D45-G47 PolarHBondContact OD1-N 3.21Å
46	L	94.2	Very high	94	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.234	C	C	.	.			trans	-81.7	-10.1	179.1	-63.9	-179.2	0	0	0	113.5	I16 C48 L49 L60 L65 L68 P70 L71	I16-L46 WeakPolarHBondContact CB-O 3.5Å; I16-L46 HydrophobicContact CD1-CB 4.48Å; I16-L46 HydrophobicContact CD1-CD2 3.78Å; L46-C48 PolarHBondContact O-N 3.04Å; L46-L49 HydrophobicContact CB-CB 4.32Å; L46-L49 HydrophobicContact CB-CD2 4.35Å; L46-L49 HydrophobicContact CD1-CD2 4.45Å; L46-L49 HydrophobicContact CD2-CD2 3.93Å; L46-L49 HydrophobicContact CG-CD2 4.48Å; L46-L49 WeakPolarHBondContact O-CB 3.48Å; L46-L49 PolarHBondContact O-N 3.37Å; L46-L60 HydrophobicContact CD1-CD1 4.47Å; L46-L60 HydrophobicContact CD2-CD1 3.64Å; L46-L60 HydrophobicContact CD2-CD2 3.89Å; L46-L60 HydrophobicContact CD2-CG 4.42Å; L46-L65 HydrophobicContact CD2-CD1 3.81Å; L46-L65 HydrophobicContact CD2-CD2 3.67Å; L46-L65 HydrophobicContact CD2-CG 4.41Å; L46-L65 HydrophobicContact CG-CD2 3.97Å; L46-L68 HydrophobicContact CD1-CD2 4.14Å; L46-P70 HydrophobicContact CB-CB 3.92Å; L46-P70 HydrophobicContact CB-CG 3.71Å; L46-L71 HydrophobicContact CD1-CD1 4.4Å; L46-L71 HydrophobicContact CD1-CD2 3.99Å; L46-L71 HydrophobicContact CD1-CG 3.83Å
47	G	93.1	Very high	94.1	Very high	24 Å²	24	45.4 Å²	45.4	25%	0.247	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	46.4	-125.1	169.2	0	0	0	0	0	113.9	D45 L49	D45-G47 VanDerWaalsContact C-N 3.35Å; D45-G47 PolarHBondContact OD1-N 3.21Å; G47-L49 PolarHBondContact O-N 3.45Å
48	C	92.3	Very high	94.3	Very high	17 Å²	17	39.5 Å²	39.5	12%	0.115	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-77.7	8.3	-177.8	64.9	0	0	0	0	115	I16 P18 L46 G50 E51	I16-C48 PolarHBondContact O-N 3.07Å; P18-C48 VanDerWaalsContact CD-SG 3.54Å; L46-C48 PolarHBondContact O-N 3.04Å; C48-G50 PolarHBondContact O-N 3.33Å; C48-G50 VanDerWaalsContact O-N 3.12Å; C48-E51 WeakPolarHBondContact O-CB 3.45Å; C48-E51 PolarHBondContact O-N 3.47Å
49	L	94.1	Very high	94.5	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-59	-29.1	-177.5	-174.1	64.9	0	0	0	112.9	I16 L36 L46 G47 E51 C52 L55 L58 L60 L71 L74	I16-L49 HydrophobicContact CD1-CB 4.08Å; I16-L49 HydrophobicContact CD1-CD1 4.39Å; I16-L49 HydrophobicContact CD1-CD2 3.86Å; I16-L49 HydrophobicContact CD1-CG 4.35Å; I16-L49 HydrophobicContact CG2-CB 4.47Å; L36-L49 HydrophobicContact CD2-CD1 3.48Å; L36-L49 VanDerWaalsContact CD2-CD1 3.48Å; L46-L49 HydrophobicContact CB-CB 4.32Å; L46-L49 HydrophobicContact CB-CD2 4.35Å; L46-L49 HydrophobicContact CD1-CD2 4.45Å; L46-L49 HydrophobicContact CD2-CD2 3.93Å; L46-L49 HydrophobicContact CG-CD2 4.48Å; L46-L49 WeakPolarHBondContact O-CB 3.48Å; L46-L49 PolarHBondContact O-N 3.37Å; G47-L49 PolarHBondContact O-N 3.45Å; L49-E51 PolarHBondContact O-N 2.97Å; L49-E51 VanDerWaalsContact O-N 3.16Å; L49-C52 WeakPolarHBondContact O-CB 3.28Å; L49-C52 PolarHBondContact O-N 2.99Å; L49-C52 VanDerWaalsContact O-N 3.09Å; L49-L55 HydrophobicContact CD1-CD2 4.24Å; L49-L58 HydrophobicContact CD2-CD1 4.46Å; L49-L58 HydrophobicContact CD2-CD2 3.82Å; L49-L60 HydrophobicContact CD2-CD1 4.27Å; L49-L71 HydrophobicContact CD2-CD2 3.58Å; L49-L71 HydrophobicContact CG-CD2 4.32Å; L49-L74 HydrophobicContact CG-CD1 4.44Å
50	G	92.1	Very high	94.6	Very high	15 Å²	15	33.5 Å²	33.5	16%	0.155	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-65.6	-12.1	177	0	0	0	0	0	115	C48 L53 P70 S73	C48-G50 PolarHBondContact O-N 3.33Å; C48-G50 VanDerWaalsContact O-N 3.12Å; G50-L53 WeakPolarHBondContact O-CD2 3.12Å; G50-P70 WeakPolarHBondContact CA-O 3.32Å; G50-S73 WeakPolarHBondContact CA-OG 3.38Å; G50-S73 PolarHBondContact O-OG 3.32Å
51	E	93.8	Very high	94.8	Very high	113 Å²	113	29.5 Å²	29.5	53%	0.528	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-84.3	-11.8	174.9	-61.6	171.8	-152.6	0	0	112.4	L30 C48 L49 L53	L30-E51 HydrophobicContact CD1-CB 3.65Å; L30-E51 VanDerWaalsContact CD1-OE2 3.24Å; L30-E51 WeakPolarHBondContact CD1-OE2 3.48Å; C48-E51 WeakPolarHBondContact O-CB 3.45Å; C48-E51 PolarHBondContact O-N 3.47Å; L49-E51 PolarHBondContact O-N 2.97Å; L49-E51 VanDerWaalsContact O-N 3.16Å; E51-L53 PolarHBondContact O-N 2.98Å
52	C	94.1	Very high	95	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.17	C	C	.	.			trans	-80.5	61.6	179	-58.2	0	0	0	0	111.2	L30 L49 G54 L55 L74	L30-C52 WeakPolarHBondContact O-CA 3.38Å; L49-C52 WeakPolarHBondContact O-CB 3.28Å; L49-C52 PolarHBondContact O-N 2.99Å; L49-C52 VanDerWaalsContact O-N 3.09Å; C52-G54 PolarHBondContact O-N 3.21Å; C52-G54 VanDerWaalsContact O-N 3.09Å; C52-L55 HydrophobicContact CB-CB 4.23Å; C52-L55 WeakPolarHBondContact O-CB 3.37Å; C52-L55 PolarHBondContact O-N 3.38Å; C52-L74 VanDerWaalsContact O-CD2 3.28Å; C52-L74 WeakPolarHBondContact O-CD2 3.45Å
53	L	94.3	Very high	95.2	Very high	88 Å²	88	27.2 Å²	27.2	46%	0.461	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-22.1	-168.1	-59.3	179.2	0	0	0	114.8	G50 E51 L55	G50-L53 WeakPolarHBondContact O-CD2 3.12Å; E51-L53 PolarHBondContact O-N 2.98Å; L53-L55 VanDerWaalsContact C-N 3.32Å
54	G	93	Very high	95.4	Very high	17 Å²	17	28.7 Å²	28.7	18%	0.175	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-0.5	175.6	0	0	0	0	0	114.7	I33 L34 C52 E56	I33-G54 CarbonylContact O-C 3.57Å; L34-G54 WeakPolarHBondContact CD2-O 3.18Å; C52-G54 PolarHBondContact O-N 3.21Å; C52-G54 VanDerWaalsContact O-N 3.09Å; G54-E56 PolarHBondContact O-N 3.45Å
55	L	96.2	Very high	95.5	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.156	C	C	.	.			trans	-68.5	120.9	-171.5	-165.8	74.7	0	0	0	112.2	I33 L36 L49 C52 L53 L58 L74 Q76 L77	I33-L55 HydrophobicContact CG2-CD1 3.81Å; I33-L55 VanDerWaalsContact O-CA 3.27Å; I33-L55 WeakPolarHBondContact O-CA 3.29Å; I33-L55 WeakPolarHBondContact O-CD1 3.36Å; I33-L55 PolarHBondContact O-N 2.9Å; L36-L55 HydrophobicContact CB-CD1 3.67Å; L49-L55 HydrophobicContact CD1-CD2 4.24Å; C52-L55 HydrophobicContact CB-CB 4.23Å; C52-L55 WeakPolarHBondContact O-CB 3.37Å; C52-L55 PolarHBondContact O-N 3.38Å; L53-L55 VanDerWaalsContact C-N 3.32Å; L55-L58 HydrophobicContact CD2-CB 3.86Å; L55-L58 HydrophobicContact CD2-CD1 4.07Å; L55-L58 HydrophobicContact CD2-CD2 3.81Å; L55-L58 HydrophobicContact CD2-CG 4.12Å; L55-L74 HydrophobicContact CD2-CD1 3.9Å; L55-Q76 CarbonylContact O-C 3.3Å; L55-Q76 VanDerWaalsContact O-C 3.3Å; L55-L77 HydrophobicContact CD2-CD1 4.28Å; L55-L77 HydrophobicContact CG-CD1 4.31Å; L55-L77 VanDerWaalsContact O-CA 3.24Å; L55-L77 WeakPolarHBondContact O-CA 3.48Å; L55-L77 PolarHBondContact O-N 3.01Å; L55-L77 VanDerWaalsContact O-N 3.16Å
56	E	95.3	Very high	95.7	Very high	99 Å²	99	28 Å²	28	46%	0.463	16%	0.162	S	C	.	.			trans	-105.4	-33.3	179.3	-66.2	-178.6	-167.9	0	0	112.3	L34 G54 Q76 A78 V79	L34-E56 PolarHBondContact O-N 2.97Å; G54-E56 PolarHBondContact O-N 3.45Å; E56-Q76 HydrophobicContact CG-CB 4.46Å; E56-A78 PolarHBondContact O-N 3.1Å; E56-V79 PolarHBondContact O-N 3.08Å
57	W	97.6	Very high	95.7	Very high	75 Å²	75	32.3 Å²	32.3	28%	0.284	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	123.6	-175.6	-167.1	103.2	0	0	0	111.1	L34 L35 L36 K37 D59 V79	L34-W57 PolarHBondContact O-N 2.9Å; L35-W57 WeakPolarHBondContact CA-O 3.37Å; L35-W57 HydrophobicContact CB-CB 4.38Å; L35-W57 HydrophobicContact CD1-CB 4.38Å; L35-W57 HydrophobicContact CD1-CD2 4.26Å; L35-W57 HydrophobicContact CD1-CE3 4.26Å; L35-W57 HydrophobicContact CD1-CG 4.33Å; L35-W57 HydrophobicContact CD2-CE3 4.12Å; L35-W57 HydrophobicContact CD2-CZ3 4.45Å; L35-W57 HydrophobicContact CG-CB 4.13Å; L35-W57 HydrophobicContact CG-CD2 4.12Å; L35-W57 HydrophobicContact CG-CE3 3.72Å; L35-W57 HydrophobicContact CG-CG 4.32Å; L35-W57 HydrophobicContact CG-CZ3 4.5Å; L36-W57 PolarHBondContact N-O 2.96Å; K37-W57 HydrophobicContact CB-CZ3 4.48Å; K37-W57 HydrophobicContact CD-CH2 4.23Å; K37-W57 HydrophobicContact CD-CZ3 4.1Å; K37-W57 VanDerWaalsContact CE-CH2 3.46Å; K37-W57 HydrophobicContact CG-CE3 4.27Å; K37-W57 HydrophobicContact CG-CH2 3.76Å; K37-W57 HydrophobicContact CG-CZ3 3.27Å; W57-D59 HydrophobicContact CE3-CB 4.41Å; W57-D59 HydrophobicContact CH2-CB 3.35Å; W57-D59 HydrophobicContact CZ2-CB 4.37Å; W57-D59 HydrophobicContact CZ3-CB 3.35Å; W57-V79 VanDerWaalsContact CD1-CB 3.47Å; W57-V79 HydrophobicContact CG-CB 4.17Å; W57-V79 HydrophobicContact CG-CG1 4.48Å
58	L	98.1	Very high	95.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	125.1	-176.3	179.2	55.7	0	0	0	112.2	L36 L49 L55 L60 L71 L77 V79 L80 N81	L36-L58 HydrophobicContact CB-CD1 4.06Å; L36-L58 HydrophobicContact CD2-CD1 4.1Å; L36-L58 HydrophobicContact CG-CD1 4.22Å; L36-L58 WeakPolarHBondContact O-CA 3.48Å; L49-L58 HydrophobicContact CD2-CD1 4.46Å; L49-L58 HydrophobicContact CD2-CD2 3.82Å; L55-L58 HydrophobicContact CD2-CB 3.86Å; L55-L58 HydrophobicContact CD2-CD1 4.07Å; L55-L58 HydrophobicContact CD2-CD2 3.81Å; L55-L58 HydrophobicContact CD2-CG 4.12Å; L58-L60 HydrophobicContact CD1-CD1 4.25Å; L58-L60 HydrophobicContact CD1-CD2 4.13Å; L58-L60 HydrophobicContact CD1-CG 3.79Å; L58-L60 HydrophobicContact CD2-CD1 3.69Å; L58-L60 HydrophobicContact CD2-CG 4.15Å; L58-L60 HydrophobicContact CG-CD1 3.96Å; L58-L60 HydrophobicContact CG-CG 3.86Å; L58-L71 HydrophobicContact CD2-CD2 3.64Å; L58-L77 HydrophobicContact CB-CD1 3.74Å; L58-V79 PolarHBondContact N-O 2.91Å; L58-L80 HydrophobicContact CB-CD1 3.99Å; L58-L80 HydrophobicContact CD2-CD1 3.79Å; L58-L80 HydrophobicContact CG-CD1 3.86Å; L58-L80 WeakPolarHBondContact O-CA 3.38Å; L58-N81 PolarHBondContact O-N 3.1Å
59	D	98	Very high	96.1	Very high	7 Å²	7	32.3 Å²	32.3	4%	0.037	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	109.9	170.2	-174.2	3.5	0	0	0	111.2	L36 K37 L38 R39 W57 S61 N81	L36-D59 PolarHBondContact O-N 2.99Å; K37-D59 HydrophobicContact CG-CB 4.48Å; L38-D59 CarbonylContact C-O 3.51Å; L38-D59 WeakPolarHBondContact CA-O 3.47Å; L38-D59 PolarHBondContact N-O 3.42Å; R39-D59 IonicContact CZ-OD2 3.28Å; R39-D59 IonicContact NE-OD2 2.76Å; R39-D59 PolarHBondContact NE-OD2 3.12Å; R39-D59 IonicContact NH2-OD2 2.64Å; R39-D59 PolarHBondContact NH2-OD2 3.47Å; W57-D59 HydrophobicContact CE3-CB 4.41Å; W57-D59 HydrophobicContact CH2-CB 3.35Å; W57-D59 HydrophobicContact CZ2-CB 4.37Å; W57-D59 HydrophobicContact CZ3-CB 3.35Å; D59-S61 WeakPolarHBondContact OD1-CB 3.45Å; D59-S61 PolarHBondContact OD1-N 3.44Å; D59-S61 PolarHBondContact OD1-OG 2.79Å; D59-N81 HydrophobicContact CB-CB 4.33Å; D59-N81 PolarHBondContact OD1-ND2 2.76Å; D59-N81 VanDerWaalsContact OD1-ND2 3.13Å
60	L	98	Very high	96.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.195	C	C	.	.			trans	-112.7	20.7	176.5	-68.6	168	0	0	0	111.6	I16 L38 L43 L46 L49 L58 N63 L65 N81 V82 N85	I16-L60 HydrophobicContact CD1-CD2 4.2Å; L38-L60 HydrophobicContact CB-CD2 4.07Å; L38-L60 HydrophobicContact CD1-CD2 4.29Å; L43-L60 HydrophobicContact CD1-CD2 4.28Å; L46-L60 HydrophobicContact CD1-CD1 4.47Å; L46-L60 HydrophobicContact CD2-CD1 3.64Å; L46-L60 HydrophobicContact CD2-CD2 3.89Å; L46-L60 HydrophobicContact CD2-CG 4.42Å; L49-L60 HydrophobicContact CD2-CD1 4.27Å; L58-L60 HydrophobicContact CD1-CD1 4.25Å; L58-L60 HydrophobicContact CD1-CD2 4.13Å; L58-L60 HydrophobicContact CD1-CG 3.79Å; L58-L60 HydrophobicContact CD2-CD1 3.69Å; L58-L60 HydrophobicContact CD2-CG 4.15Å; L58-L60 HydrophobicContact CG-CD1 3.96Å; L58-L60 HydrophobicContact CG-CG 3.86Å; L60-N63 VanDerWaalsContact C-ND2 3.33Å; L60-N63 PolarHBondContact O-ND2 3.01Å; L60-L65 HydrophobicContact CB-CD1 3.94Å; L60-L65 HydrophobicContact CD1-CD1 3.99Å; L60-L65 HydrophobicContact CD2-CD1 4.48Å; L60-L65 HydrophobicContact CG-CD1 4.38Å; L60-N81 CarbonylContact C-O 3.59Å; L60-N81 WeakPolarHBondContact CA-O 3.5Å; L60-N81 PolarHBondContact N-O 3.27Å; L60-V82 HydrophobicContact CB-CG1 4.26Å; L60-V82 HydrophobicContact CD1-CG1 4.27Å; L60-N85 PolarHBondContact O-ND2 2.68Å
61	S	98.1	Very high	96.4	Very high	5 Å²	5	33.1 Å²	33.1	4%	0.035	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	148.2	-175.7	55.4	0	0	0	0	113.9	R39 C40 D59 N81 S83	R39-S61 CarbonylContact C-O 3.55Å; R39-S61 VanDerWaalsContact CA-O 3.22Å; R39-S61 WeakPolarHBondContact CA-O 3.32Å; R39-S61 WeakPolarHBondContact CG-O 3.34Å; R39-S61 PolarHBondContact NE-OG 2.94Å; C40-S61 PolarHBondContact N-O 2.92Å; D59-S61 WeakPolarHBondContact OD1-CB 3.45Å; D59-S61 PolarHBondContact OD1-N 3.44Å; D59-S61 PolarHBondContact OD1-OG 2.79Å; S61-N81 PolarHBondContact N-O 2.82Å; S61-N81 PolarHBondContact OG-ND2 3.02Å; S61-S83 CarbonylContact C-O 3.41Å; S61-S83 WeakPolarHBondContact CA-O 3.46Å; S61-S83 VanDerWaalsContact CB-O 3.31Å; S61-S83 WeakPolarHBondContact CB-O 3.28Å; S61-S83 VanDerWaalsContact CB-OG 3.24Å; S61-S83 WeakPolarHBondContact CB-OG 3.22Å
62	G	97.3	Very high	96.5	Very high	18 Å²	18	29.5 Å²	29.5	19%	0.186	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	33.8	176.1	0	0	0	0	0	114.1	C40 S83 N84	C40-G62 VanDerWaalsContact CA-O 3.28Å; C40-G62 WeakPolarHBondContact CA-O 3.34Å; G62-S83 PolarHBondContact N-O 3.32Å; G62-N84 CarbonylContact C-O 3.58Å; G62-N84 WeakPolarHBondContact CA-O 3.5Å; G62-N84 PolarHBondContact N-O 3.15Å
63	N	97.9	Very high	96.6	Very high	13 Å²	13	31.9 Å²	31.9	7%	0.07	19%	0.193	C	C	.	.	S	Bend	trans	-109.8	-169.6	175.5	-73.1	-56	0	0	0	110.4	L38 L41 G42 L43 L60 L65 N84 N85	L38-N63 PolarHBondContact O-ND2 3.31Å; L41-N63 PolarHBondContact N-OD1 3.1Å; G42-N63 PolarHBondContact N-OD1 2.92Å; L43-N63 HydrophobicContact CB-CB 4.06Å; L43-N63 PolarHBondContact N-OD1 3.04Å; L43-N63 VanDerWaalsContact N-OD1 3.07Å; L43-N63 WeakPolarHBondContact O-CB 3.39Å; L60-N63 VanDerWaalsContact C-ND2 3.33Å; L60-N63 PolarHBondContact O-ND2 3.01Å; N63-L65 HydrophobicContact CB-CD1 4.5Å; N63-L65 HydrophobicContact CB-CG 4.14Å; N63-N84 PolarHBondContact N-O 2.96Å; N63-N85 VanDerWaalsContact CA-OD1 3.3Å; N63-N85 WeakPolarHBondContact CA-OD1 3.37Å; N63-N85 WeakPolarHBondContact CB-OD1 3.35Å; N63-N85 PolarHBondContact N-OD1 3.15Å; N63-N85 PolarHBondContact O-OD1 2.82Å; N63-N85 VanDerWaalsContact O-OD1 3.13Å
64	A	97.1	Very high	96.7	Very high	30 Å²	30	27.7 Å²	27.7	25%	0.248	17%	0.171	C	C	.	.			trans	-114.1	32.2	-180	0	0	0	0	0	111.8	L43 N85	L43-A64 CarbonylContact O-C 3.51Å; L43-A64 VanDerWaalsContact O-C 3.3Å; L43-A64 WeakPolarHBondContact O-CA 3.44Å; L43-A64 PolarHBondContact O-N 3.26Å; A64-N85 PolarHBondContact N-OD1 3.24Å
65	L	97.5	Very high	96.8	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.19	C	C	.	.			trans	-70.9	131.5	-176	-59.1	171.7	0	0	0	111	L43 L46 L60 N63 N85 Q86 L87	L43-L65 HydrophobicContact CB-CD2 4.28Å; L43-L65 PolarHBondContact O-N 3.44Å; L46-L65 HydrophobicContact CD2-CD1 3.81Å; L46-L65 HydrophobicContact CD2-CD2 3.67Å; L46-L65 HydrophobicContact CD2-CG 4.41Å; L46-L65 HydrophobicContact CG-CD2 3.97Å; L60-L65 HydrophobicContact CB-CD1 3.94Å; L60-L65 HydrophobicContact CD1-CD1 3.99Å; L60-L65 HydrophobicContact CD2-CD1 4.48Å; L60-L65 HydrophobicContact CG-CD1 4.38Å; N63-L65 HydrophobicContact CB-CD1 4.5Å; N63-L65 HydrophobicContact CB-CG 4.14Å; L65-N85 HydrophobicContact CB-CB 4.29Å; L65-N85 WeakPolarHBondContact CB-OD1 3.48Å; L65-N85 WeakPolarHBondContact CG-OD1 3.31Å; L65-N85 PolarHBondContact N-OD1 3.17Å; L65-Q86 CarbonylContact O-C 3.53Å; L65-Q86 VanDerWaalsContact O-C 3.26Å; L65-Q86 WeakPolarHBondContact O-CA 3.47Å; L65-Q86 PolarHBondContact O-N 3.31Å; L65-L87 HydrophobicContact CB-CD2 4.23Å; L65-L87 PolarHBondContact O-N 3.48Å
66	T	96.9	Very high	96.8	Very high	66 Å²	66	38.7 Å²	38.7	41%	0.405	21%	0.212	S	C	.	.			trans	-107.4	-17.8	173.8	55.6	0	0	0	0	112.8	Q86	T66-Q86 HydrophobicContact CG2-CB 4.03Å
67	H	95.9	Very high	96.9	Very high	91 Å²	91	34 Å²	34	42%	0.421	19%	0.19	S	C	.	.			trans	-144.9	156	-177.2	51.8	-79.9	0	0	0	111.2
68	L	97.3	Very high	97	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.01	18%	0.183	C	C	.	.			trans	-118.3	19.4	-176.4	-62.6	-179.2	0	0	0	113	L46 L71 V82 L87 L90 P92 L93	L46-L68 HydrophobicContact CD1-CD2 4.14Å; L68-L71 HydrophobicContact CB-CD1 4.06Å; L68-L71 HydrophobicContact CB-CG 4.27Å; L68-L71 HydrophobicContact CD1-CD1 4.26Å; L68-L71 HydrophobicContact CD2-CD1 3.86Å; L68-L71 HydrophobicContact CG-CD1 4.28Å; L68-L71 WeakPolarHBondContact O-CB 3.44Å; L68-L71 PolarHBondContact O-N 3.28Å; L68-V82 HydrophobicContact CD2-CG1 4.07Å; L68-L87 HydrophobicContact CD1-CD1 3.9Å; L68-L87 HydrophobicContact CD1-CD2 4.48Å; L68-L87 HydrophobicContact CD2-CD1 4.02Å; L68-L87 HydrophobicContact CD2-CD2 3.87Å; L68-L87 HydrophobicContact CG-CD1 4.06Å; L68-L87 HydrophobicContact CG-CD2 3.81Å; L68-L90 HydrophobicContact CD1-CD2 3.89Å; L68-P92 HydrophobicContact CB-CB 4.04Å; L68-P92 HydrophobicContact CB-CG 4Å; L68-P92 WeakPolarHBondContact O-CB 3.39Å; L68-L93 HydrophobicContact CD1-CD1 4.09Å; L68-L93 HydrophobicContact CD1-CD2 4.11Å; L68-L93 HydrophobicContact CD1-CG 4.03Å
69	G	96.1	Very high	97	Very high	39 Å²	39	33.2 Å²	33.2	40%	0.402	20%	0.196	S	C	.	.	G	3₁₀ helix	trans	-45.2	-51.6	-169.7	0	0	0	0	0	114.7	L71 A72	G69-L71 PolarHBondContact O-N 3.06Å; G69-L71 VanDerWaalsContact O-N 3.11Å; G69-A72 WeakPolarHBondContact O-CB 3.5Å; G69-A72 PolarHBondContact O-N 2.94Å; G69-A72 VanDerWaalsContact O-N 3.12Å
70	P	95.7	Very high	97	Very high	32 Å²	32	33 Å²	33	21%	0.208	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-61.9	-16.7	178.7	-30.5	40.6	0	0	0	115.8	L46 G50 A72 S73	L46-P70 HydrophobicContact CB-CB 3.92Å; L46-P70 HydrophobicContact CB-CG 3.71Å; G50-P70 WeakPolarHBondContact CA-O 3.32Å; P70-A72 PolarHBondContact O-N 2.94Å; P70-S73 PolarHBondContact O-OG 3.48Å
71	L	97.2	Very high	97	Very high	0 Å²	0	34 Å²	34	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-73	-16.4	176.3	-56	-170.3	0	0	0	112.9	L46 L49 L58 L68 G69 S73 L74 L80 L93 C96	L46-L71 HydrophobicContact CD1-CD1 4.4Å; L46-L71 HydrophobicContact CD1-CD2 3.99Å; L46-L71 HydrophobicContact CD1-CG 3.83Å; L49-L71 HydrophobicContact CD2-CD2 3.58Å; L49-L71 HydrophobicContact CG-CD2 4.32Å; L58-L71 HydrophobicContact CD2-CD2 3.64Å; L68-L71 HydrophobicContact CB-CD1 4.06Å; L68-L71 HydrophobicContact CB-CG 4.27Å; L68-L71 HydrophobicContact CD1-CD1 4.26Å; L68-L71 HydrophobicContact CD2-CD1 3.86Å; L68-L71 HydrophobicContact CG-CD1 4.28Å; L68-L71 WeakPolarHBondContact O-CB 3.44Å; L68-L71 PolarHBondContact O-N 3.28Å; G69-L71 PolarHBondContact O-N 3.06Å; G69-L71 VanDerWaalsContact O-N 3.11Å; L71-S73 PolarHBondContact O-N 3.36Å; L71-S73 VanDerWaalsContact O-N 3.13Å; L71-L74 HydrophobicContact CD2-CD1 3.61Å; L71-L74 WeakPolarHBondContact O-CB 3.27Å; L71-L74 PolarHBondContact O-N 3.42Å; L71-L80 HydrophobicContact CD1-CD1 4.16Å; L71-L80 HydrophobicContact CD1-CD2 3.75Å; L71-L93 HydrophobicContact CB-CD2 4.17Å; L71-L93 HydrophobicContact CD1-CD2 3.92Å; L71-C96 PolarHBondContact O-SG 2.88Å
72	A	96.1	Very high	97.1	Very high	38 Å²	38	33.8 Å²	33.8	31%	0.314	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-63.1	-20.2	-177	0	0	0	0	0	114.2	G69 P70 P92 T95	G69-A72 WeakPolarHBondContact O-CB 3.5Å; G69-A72 PolarHBondContact O-N 2.94Å; G69-A72 VanDerWaalsContact O-N 3.12Å; P70-A72 PolarHBondContact O-N 2.94Å; A72-P92 WeakPolarHBondContact CA-O 3.46Å; A72-P92 HydrophobicContact CB-CB 4.24Å; A72-T95 WeakPolarHBondContact CA-OG1 3.43Å; A72-T95 WeakPolarHBondContact O-CB 3.47Å; A72-T95 PolarHBondContact O-OG1 3.37Å
73	S	95.7	Very high	97.1	Very high	49 Å²	49	33.4 Å²	33.4	34%	0.343	19%	0.193	S	C	.	.	G	3₁₀ helix	trans	-87.2	-12.9	175	52.8	0	0	0	0	113.7	G50 P70 L71 R75	G50-S73 WeakPolarHBondContact CA-OG 3.38Å; G50-S73 PolarHBondContact O-OG 3.32Å; P70-S73 PolarHBondContact O-OG 3.48Å; L71-S73 PolarHBondContact O-N 3.36Å; L71-S73 VanDerWaalsContact O-N 3.13Å; S73-R75 PolarHBondContact O-N 3.37Å
74	L	96.3	Very high	97.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.211	C	C	.	.			trans	-86.6	72	-170.4	-54.6	-173.3	0	0	0	111.9	L49 C52 L55 L71 Q76 L77	L49-L74 HydrophobicContact CG-CD1 4.44Å; C52-L74 VanDerWaalsContact O-CD2 3.28Å; C52-L74 WeakPolarHBondContact O-CD2 3.45Å; L55-L74 HydrophobicContact CD2-CD1 3.9Å; L71-L74 HydrophobicContact CD2-CD1 3.61Å; L71-L74 WeakPolarHBondContact O-CB 3.27Å; L71-L74 PolarHBondContact O-N 3.42Å; L74-Q76 VanDerWaalsContact C-N 3.28Å; L74-Q76 PolarHBondContact O-N 2.96Å; L74-L77 HydrophobicContact CB-CB 4.15Å; L74-L77 VanDerWaalsContact O-CB 3.28Å; L74-L77 WeakPolarHBondContact O-CB 3.48Å; L74-L77 PolarHBondContact O-N 3.47Å
75	R	95.4	Very high	97.2	Very high	149 Å²	149	35.9 Å²	35.9	56%	0.562	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-22.5	-176.7	-63	-169.7	179.1	-169.1	-1.3	114.2	S73 L77 N98	S73-R75 PolarHBondContact O-N 3.37Å; R75-L77 VanDerWaalsContact C-N 3.29Å; R75-N98 WeakPolarHBondContact O-CB 3.37Å; R75-N98 PolarHBondContact O-ND2 2.95Å
76	Q	95.9	Very high	97.2	Very high	99 Å²	99	40.6 Å²	40.6	46%	0.463	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-4.6	177.7	-59.9	-57.4	-20.2	0	0	113.3	L55 E56 L74 A78 N98	L55-Q76 CarbonylContact O-C 3.3Å; L55-Q76 VanDerWaalsContact O-C 3.3Å; E56-Q76 HydrophobicContact CG-CB 4.46Å; L74-Q76 VanDerWaalsContact C-N 3.28Å; L74-Q76 PolarHBondContact O-N 2.96Å; Q76-A78 PolarHBondContact O-N 2.99Å; Q76-A78 VanDerWaalsContact O-N 3.1Å; Q76-N98 PolarHBondContact OE1-ND2 3.3Å
77	L	98	Very high	97.3	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.204	C	C	.	.			trans	-66.1	114.5	-174.7	-168.8	68.1	0	0	0	111	L55 L58 L74 R75 L80 N98 L99	L55-L77 HydrophobicContact CD2-CD1 4.28Å; L55-L77 HydrophobicContact CG-CD1 4.31Å; L55-L77 VanDerWaalsContact O-CA 3.24Å; L55-L77 WeakPolarHBondContact O-CA 3.48Å; L55-L77 PolarHBondContact O-N 3.01Å; L55-L77 VanDerWaalsContact O-N 3.16Å; L58-L77 HydrophobicContact CB-CD1 3.74Å; L74-L77 HydrophobicContact CB-CB 4.15Å; L74-L77 VanDerWaalsContact O-CB 3.28Å; L74-L77 WeakPolarHBondContact O-CB 3.48Å; L74-L77 PolarHBondContact O-N 3.47Å; R75-L77 VanDerWaalsContact C-N 3.29Å; L77-L80 HydrophobicContact CD2-CB 4.08Å; L77-L80 HydrophobicContact CD2-CD1 4.25Å; L77-L80 HydrophobicContact CD2-CD2 4.12Å; L77-L80 HydrophobicContact CD2-CG 4.38Å; L77-N98 CarbonylContact O-C 3.56Å; L77-L99 HydrophobicContact CD2-CD1 4.33Å; L77-L99 HydrophobicContact CG-CD1 4.16Å; L77-L99 WeakPolarHBondContact O-CA 3.48Å; L77-L99 PolarHBondContact O-N 2.91Å; L77-L99 VanDerWaalsContact O-N 3.14Å
78	A	97.7	Very high	97.4	Very high	18 Å²	18	37 Å²	37	15%	0.149	21%	0.208	C	C	.	.			trans	-101.8	-34.5	-178.8	0	0	0	0	0	112.3	E56 Q76 N98 Q100 S101	E56-A78 PolarHBondContact O-N 3.1Å; Q76-A78 PolarHBondContact O-N 2.99Å; Q76-A78 VanDerWaalsContact O-N 3.1Å; A78-N98 WeakPolarHBondContact CA-O 3.43Å; A78-Q100 PolarHBondContact O-N 3.06Å; A78-S101 PolarHBondContact O-N 3.28Å; A78-S101 VanDerWaalsContact O-N 3.1Å
79	V	98.5	Very high	97.3	Very high	42 Å²	42	37.3 Å²	37.3	26%	0.255	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	122.4	-177.9	-176.5	0	0	0	0	110.4	E56 W57 L58	E56-V79 PolarHBondContact O-N 3.08Å; W57-V79 VanDerWaalsContact CD1-CB 3.47Å; W57-V79 HydrophobicContact CG-CB 4.17Å; W57-V79 HydrophobicContact CG-CG1 4.48Å; L58-V79 PolarHBondContact N-O 2.91Å
80	L	98.7	Very high	97.4	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.005	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	126.9	178.9	-179.6	57.9	0	0	0	111.3	L58 L71 L77 V82 L93 L99 S101 L102 N103	L58-L80 HydrophobicContact CB-CD1 3.99Å; L58-L80 HydrophobicContact CD2-CD1 3.79Å; L58-L80 HydrophobicContact CG-CD1 3.86Å; L58-L80 WeakPolarHBondContact O-CA 3.38Å; L71-L80 HydrophobicContact CD1-CD1 4.16Å; L71-L80 HydrophobicContact CD1-CD2 3.75Å; L77-L80 HydrophobicContact CD2-CB 4.08Å; L77-L80 HydrophobicContact CD2-CD1 4.25Å; L77-L80 HydrophobicContact CD2-CD2 4.12Å; L77-L80 HydrophobicContact CD2-CG 4.38Å; L80-V82 HydrophobicContact CD1-CG1 3.72Å; L80-V82 HydrophobicContact CD2-CG1 4.11Å; L80-V82 HydrophobicContact CG-CG1 3.88Å; L80-L93 HydrophobicContact CD2-CD1 3.93Å; L80-L93 HydrophobicContact CD2-CD2 3.53Å; L80-L93 HydrophobicContact CD2-CG 4.41Å; L80-L99 HydrophobicContact CB-CD1 3.82Å; L80-S101 PolarHBondContact N-O 2.79Å; L80-L102 HydrophobicContact CB-CD1 4.05Å; L80-L102 HydrophobicContact CD2-CD1 3.89Å; L80-L102 HydrophobicContact CG-CD1 3.96Å; L80-L102 WeakPolarHBondContact O-CA 3.41Å; L80-N103 PolarHBondContact O-N 3.28Å
81	N	98.6	Very high	97.5	Very high	22 Å²	22	39.3 Å²	39.3	12%	0.118	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	111.4	168	-173.9	14.7	0	0	0	110.7	L58 D59 L60 S61 S83 N103	L58-N81 PolarHBondContact O-N 3.1Å; D59-N81 HydrophobicContact CB-CB 4.33Å; D59-N81 PolarHBondContact OD1-ND2 2.76Å; D59-N81 VanDerWaalsContact OD1-ND2 3.13Å; L60-N81 CarbonylContact C-O 3.59Å; L60-N81 WeakPolarHBondContact CA-O 3.5Å; L60-N81 PolarHBondContact N-O 3.27Å; S61-N81 PolarHBondContact N-O 2.82Å; S61-N81 PolarHBondContact OG-ND2 3.02Å; N81-S83 VanDerWaalsContact OD1-CB 3.3Å; N81-S83 WeakPolarHBondContact OD1-CB 3.38Å; N81-S83 PolarHBondContact OD1-N 3.04Å; N81-S83 VanDerWaalsContact OD1-N 3.12Å; N81-S83 PolarHBondContact OD1-OG 3.01Å; N81-S83 VanDerWaalsContact OD1-OG 3.04Å; N81-N103 HydrophobicContact CB-CB 4.44Å; N81-N103 WeakPolarHBondContact OD1-CB 3.43Å; N81-N103 PolarHBondContact OD1-ND2 2.78Å
82	V	98.5	Very high	97.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.217	C	C	.	.			trans	-119.1	22.9	174.5	-67.3	0	0	0	0	111	L60 L68 L80 N85 L87 L102 N103 A104 N107	L60-V82 HydrophobicContact CB-CG1 4.26Å; L60-V82 HydrophobicContact CD1-CG1 4.27Å; L68-V82 HydrophobicContact CD2-CG1 4.07Å; L80-V82 HydrophobicContact CD1-CG1 3.72Å; L80-V82 HydrophobicContact CD2-CG1 4.11Å; L80-V82 HydrophobicContact CG-CG1 3.88Å; V82-N85 PolarHBondContact O-ND2 2.93Å; V82-L87 HydrophobicContact CB-CD1 3.9Å; V82-L87 HydrophobicContact CG2-CD1 3.74Å; V82-L102 HydrophobicContact CG2-CD1 4.19Å; V82-N103 CarbonylContact C-O 3.51Å; V82-N103 WeakPolarHBondContact CG2-O 3.37Å; V82-N103 PolarHBondContact N-O 3.02Å; V82-A104 HydrophobicContact CG2-CB 4.07Å; V82-N107 PolarHBondContact O-ND2 2.71Å
83	S	98.6	Very high	97.5	Very high	11 Å²	11	38.9 Å²	38.9	8%	0.077	20%	0.202	C	C	.	.			trans	-62.2	149.1	-179.2	70.3	0	0	0	0	112.3	S61 G62 N81 N85 N103 A105	S61-S83 CarbonylContact C-O 3.41Å; S61-S83 WeakPolarHBondContact CA-O 3.46Å; S61-S83 VanDerWaalsContact CB-O 3.31Å; S61-S83 WeakPolarHBondContact CB-O 3.28Å; S61-S83 VanDerWaalsContact CB-OG 3.24Å; S61-S83 WeakPolarHBondContact CB-OG 3.22Å; G62-S83 PolarHBondContact N-O 3.32Å; N81-S83 VanDerWaalsContact OD1-CB 3.3Å; N81-S83 WeakPolarHBondContact OD1-CB 3.38Å; N81-S83 PolarHBondContact OD1-N 3.04Å; N81-S83 VanDerWaalsContact OD1-N 3.12Å; N81-S83 PolarHBondContact OD1-OG 3.01Å; N81-S83 VanDerWaalsContact OD1-OG 3.04Å; S83-N85 PolarHBondContact O-ND2 3.08Å; S83-N103 PolarHBondContact N-O 3.17Å; S83-A105 CarbonylContact C-O 3.34Å; S83-A105 WeakPolarHBondContact CA-O 3.39Å; S83-A105 VanDerWaalsContact CB-O 3.3Å; S83-A105 WeakPolarHBondContact CB-O 3.22Å
84	N	98.3	Very high	97.6	Very high	84 Å²	84	38.8 Å²	38.8	45%	0.449	20%	0.204	S	C	.	.	S	Bend	trans	57.8	61.3	-179.9	-164.5	39.6	0	0	0	111.7	G62 N63 A105 G106 L136	G62-N84 CarbonylContact C-O 3.58Å; G62-N84 WeakPolarHBondContact CA-O 3.5Å; G62-N84 PolarHBondContact N-O 3.15Å; N63-N84 PolarHBondContact N-O 2.96Å; N84-A105 PolarHBondContact N-O 2.75Å; N84-G106 VanDerWaalsContact CA-O 3.23Å; N84-G106 WeakPolarHBondContact CA-O 3.35Å; N84-G106 PolarHBondContact N-O 3.25Å; N84-L136 HydrophobicContact CB-CD1 4Å; N84-L136 HydrophobicContact CB-CD2 3.87Å
85	N	98.6	Very high	97.5	Very high	10 Å²	10	41.3 Å²	41.3	5%	0.053	22%	0.22	C	C	.	.	S	Bend	trans	-134.5	-167.6	173.9	-83.2	-78.4	0	0	0	108.6	L60 N63 A64 L65 V82 S83 L87 G106 N107	L60-N85 PolarHBondContact O-ND2 2.68Å; N63-N85 VanDerWaalsContact CA-OD1 3.3Å; N63-N85 WeakPolarHBondContact CA-OD1 3.37Å; N63-N85 WeakPolarHBondContact CB-OD1 3.35Å; N63-N85 PolarHBondContact N-OD1 3.15Å; N63-N85 PolarHBondContact O-OD1 2.82Å; N63-N85 VanDerWaalsContact O-OD1 3.13Å; A64-N85 PolarHBondContact N-OD1 3.24Å; L65-N85 HydrophobicContact CB-CB 4.29Å; L65-N85 WeakPolarHBondContact CB-OD1 3.48Å; L65-N85 WeakPolarHBondContact CG-OD1 3.31Å; L65-N85 PolarHBondContact N-OD1 3.17Å; V82-N85 PolarHBondContact O-ND2 2.93Å; S83-N85 PolarHBondContact O-ND2 3.08Å; N85-L87 HydrophobicContact CB-CG 4.25Å; N85-G106 PolarHBondContact N-O 3.31Å; N85-N107 WeakPolarHBondContact CA-OD1 3.3Å; N85-N107 WeakPolarHBondContact CB-OD1 3.3Å; N85-N107 PolarHBondContact O-OD1 2.9Å
86	Q	97.9	Very high	97.6	Very high	99 Å²	99	34.2 Å²	34.2	46%	0.463	19%	0.193	S	C	.	.			trans	-118.2	32.9	-176.6	-59.3	178.4	37.1	0	0	111.9	L65 T66 T88 N107 L108	L65-Q86 CarbonylContact O-C 3.53Å; L65-Q86 VanDerWaalsContact O-C 3.26Å; L65-Q86 WeakPolarHBondContact O-CA 3.47Å; L65-Q86 PolarHBondContact O-N 3.31Å; T66-Q86 HydrophobicContact CG2-CB 4.03Å; Q86-T88 PolarHBondContact O-N 2.95Å; Q86-N107 PolarHBondContact N-OD1 3.35Å; Q86-L108 HydrophobicContact CB-CD1 4.14Å
87	L	98.3	Very high	97.5	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.195	C	C	.	.			trans	-73.6	129.1	-174.8	-58.9	172.1	0	0	0	111.6	L65 L68 V82 N85 L90 N107 L108	L65-L87 HydrophobicContact CB-CD2 4.23Å; L65-L87 PolarHBondContact O-N 3.48Å; L68-L87 HydrophobicContact CD1-CD1 3.9Å; L68-L87 HydrophobicContact CD1-CD2 4.48Å; L68-L87 HydrophobicContact CD2-CD1 4.02Å; L68-L87 HydrophobicContact CD2-CD2 3.87Å; L68-L87 HydrophobicContact CG-CD1 4.06Å; L68-L87 HydrophobicContact CG-CD2 3.81Å; V82-L87 HydrophobicContact CB-CD1 3.9Å; V82-L87 HydrophobicContact CG2-CD1 3.74Å; N85-L87 HydrophobicContact CB-CG 4.25Å; L87-L90 HydrophobicContact CD1-CD2 4.15Å; L87-N107 HydrophobicContact CB-CB 4.12Å; L87-N107 VanDerWaalsContact CB-OD1 3.29Å; L87-N107 WeakPolarHBondContact CB-OD1 3.08Å; L87-N107 VanDerWaalsContact CG-OD1 3.29Å; L87-N107 WeakPolarHBondContact CG-OD1 3.47Å; L87-N107 PolarHBondContact N-OD1 3.15Å; L87-L108 CarbonylContact O-C 3.26Å; L87-L108 VanDerWaalsContact O-CA 3.32Å; L87-L108 WeakPolarHBondContact O-CA 3.2Å; L87-L108 WeakPolarHBondContact O-CB 3.46Å; L87-L108 PolarHBondContact O-N 3.1Å
88	T	97.3	Very high	97.5	Very high	81 Å²	81	37.7 Å²	37.7	50%	0.497	21%	0.211	S	C	.	.	S	Bend	trans	-103.4	0.2	170.6	57.9	0	0	0	0	112.5	Q86 L108 Q114	Q86-T88 PolarHBondContact O-N 2.95Å; T88-L108 HydrophobicContact CG2-CB 3.86Å; T88-L108 HydrophobicContact CG2-CD1 4.37Å; T88-Q114 PolarHBondContact O-NE2 2.88Å
89	G	96.8	Very high	97.5	Very high	9 Å²	9	36.8 Å²	36.8	9%	0.093	20%	0.204	C	C	.	.			trans	-162.7	158.9	-176.4	0	0	0	0	0	111.2	E91	G89-E91 VanDerWaalsContact CA-OE2 3.29Å; G89-E91 WeakPolarHBondContact CA-OE2 3.41Å
90	L	97.8	Very high	97.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.212	C	C	.	.			trans	-129	14.2	-177.2	-62.2	177.7	0	0	0	111.9	L68 L87 P92 L93 L102 L109 L115 C117 L118	L68-L90 HydrophobicContact CD1-CD2 3.89Å; L87-L90 HydrophobicContact CD1-CD2 4.15Å; L90-P92 VanDerWaalsContact C-N 3.32Å; L90-L93 HydrophobicContact CB-CD1 4.24Å; L90-L93 HydrophobicContact CD2-CD1 4.12Å; L90-L93 WeakPolarHBondContact O-CB 3.48Å; L90-L93 PolarHBondContact O-N 3.44Å; L90-L102 HydrophobicContact CD1-CD2 4.17Å; L90-L109 HydrophobicContact CD1-CD1 3.92Å; L90-L109 HydrophobicContact CG-CD1 4.28Å; L90-L109 HydrophobicContact CG-CD2 4.2Å; L90-L115 HydrophobicContact CD1-CD2 3.97Å; L90-C117 PolarHBondContact O-SG 3Å; L90-L118 HydrophobicContact CD1-CD1 3.97Å; L90-L118 HydrophobicContact CD1-CG 4.5Å
91	E	96.8	Very high	97.5	Very high	113 Å²	113	40.6 Å²	40.6	53%	0.528	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-52.3	-40.1	-173.5	-63	75.5	-169.4	0	0	113.7	G89 L93 A94	G89-E91 VanDerWaalsContact CA-OE2 3.29Å; G89-E91 WeakPolarHBondContact CA-OE2 3.41Å; E91-L93 PolarHBondContact O-N 3.31Å; E91-L93 VanDerWaalsContact O-N 3.08Å; E91-A94 WeakPolarHBondContact O-CB 3.41Å; E91-A94 PolarHBondContact O-N 3.18Å; E91-A94 VanDerWaalsContact O-N 3.11Å
92	P	96.6	Very high	97.5	Very high	29 Å²	29	39.6 Å²	39.6	19%	0.188	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-60.8	-18.6	177.3	-26.6	38	0	0	0	114.7	L68 A72 L90 A94 T95	L68-P92 HydrophobicContact CB-CB 4.04Å; L68-P92 HydrophobicContact CB-CG 4Å; L68-P92 WeakPolarHBondContact O-CB 3.39Å; A72-P92 WeakPolarHBondContact CA-O 3.46Å; A72-P92 HydrophobicContact CB-CB 4.24Å; L90-P92 VanDerWaalsContact C-N 3.32Å; P92-A94 VanDerWaalsContact C-N 3.27Å; P92-A94 PolarHBondContact O-N 3.35Å; P92-T95 PolarHBondContact O-OG1 3.49Å
93	L	97.8	Very high	97.5	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-78.2	-9.8	178.8	-57.5	-175.4	0	0	0	113.4	L68 L71 L80 L90 E91 T95 C96 L99 L102 L118	L68-L93 HydrophobicContact CD1-CD1 4.09Å; L68-L93 HydrophobicContact CD1-CD2 4.11Å; L68-L93 HydrophobicContact CD1-CG 4.03Å; L71-L93 HydrophobicContact CB-CD2 4.17Å; L71-L93 HydrophobicContact CD1-CD2 3.92Å; L80-L93 HydrophobicContact CD2-CD1 3.93Å; L80-L93 HydrophobicContact CD2-CD2 3.53Å; L80-L93 HydrophobicContact CD2-CG 4.41Å; L90-L93 HydrophobicContact CB-CD1 4.24Å; L90-L93 HydrophobicContact CD2-CD1 4.12Å; L90-L93 WeakPolarHBondContact O-CB 3.48Å; L90-L93 PolarHBondContact O-N 3.44Å; E91-L93 PolarHBondContact O-N 3.31Å; E91-L93 VanDerWaalsContact O-N 3.08Å; L93-T95 PolarHBondContact O-N 3.43Å; L93-T95 VanDerWaalsContact O-N 3.08Å; L93-C96 WeakPolarHBondContact O-CB 3.28Å; L93-C96 PolarHBondContact O-N 3.2Å; L93-L99 HydrophobicContact CD1-CD2 4.47Å; L93-L102 HydrophobicContact CD1-CD1 4.03Å; L93-L102 HydrophobicContact CD1-CD2 3.82Å; L93-L118 HydrophobicContact CB-CD2 4.16Å; L93-L118 HydrophobicContact CD1-CD2 4.31Å
94	A	96.6	Very high	97.5	Very high	47 Å²	47	40.1 Å²	40.1	39%	0.388	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-58.6	-23.2	-178.9	0	0	0	0	0	113.6	E91 P92 C117	E91-A94 WeakPolarHBondContact O-CB 3.41Å; E91-A94 PolarHBondContact O-N 3.18Å; E91-A94 VanDerWaalsContact O-N 3.11Å; P92-A94 VanDerWaalsContact C-N 3.27Å; P92-A94 PolarHBondContact O-N 3.35Å; A94-C117 HydrophobicContact CB-CB 4.11Å
95	T	95.9	Very high	97.5	Very high	53 Å²	53	36.1 Å²	36.1	33%	0.325	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-95.9	-4.8	-179.1	54.9	0	0	0	0	113.5	A72 P92 L93 E97	A72-T95 WeakPolarHBondContact CA-OG1 3.43Å; A72-T95 WeakPolarHBondContact O-CB 3.47Å; A72-T95 PolarHBondContact O-OG1 3.37Å; P92-T95 PolarHBondContact O-OG1 3.49Å; L93-T95 PolarHBondContact O-N 3.43Å; L93-T95 VanDerWaalsContact O-N 3.08Å; T95-E97 VanDerWaalsContact C-N 3.26Å; T95-E97 PolarHBondContact O-N 3.46Å
96	C	96.9	Very high	97.4	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.201	C	C	.	.			trans	-82.6	66.5	178.3	-62.2	0	0	0	0	110.6	L71 L93 N98 L99 L121	L71-C96 PolarHBondContact O-SG 2.88Å; L93-C96 WeakPolarHBondContact O-CB 3.28Å; L93-C96 PolarHBondContact O-N 3.2Å; C96-N98 PolarHBondContact O-N 2.83Å; C96-N98 VanDerWaalsContact O-N 3.09Å; C96-L99 HydrophobicContact CB-CB 4.03Å; C96-L99 WeakPolarHBondContact O-CB 3.47Å; C96-L99 PolarHBondContact O-N 3.38Å; C96-L121 WeakPolarHBondContact O-CD2 3.3Å
97	E	94.6	Very high	97.5	Very high	109 Å²	109	31.7 Å²	31.7	51%	0.509	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-28.1	-172.1	-65.7	173.1	-173.3	0	0	114.2	T95 L99	T95-E97 VanDerWaalsContact C-N 3.26Å; T95-E97 PolarHBondContact O-N 3.46Å; E97-L99 VanDerWaalsContact C-N 3.35Å
98	N	96.4	Very high	97.5	Very high	63 Å²	63	36 Å²	36	34%	0.337	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	1.2	178.5	-69.2	-50	0	0	0	114.2	R75 Q76 L77 A78 C96 Q100	R75-N98 WeakPolarHBondContact O-CB 3.37Å; R75-N98 PolarHBondContact O-ND2 2.95Å; Q76-N98 PolarHBondContact OE1-ND2 3.3Å; L77-N98 CarbonylContact O-C 3.56Å; A78-N98 WeakPolarHBondContact CA-O 3.43Å; C96-N98 PolarHBondContact O-N 2.83Å; C96-N98 VanDerWaalsContact O-N 3.09Å; N98-Q100 PolarHBondContact O-N 3.43Å
99	L	98.3	Very high	97.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.179	C	C	.	.			trans	-67	117	-175.2	-167.7	70.6	0	0	0	110.8	L77 L80 L93 C96 E97 L102 L121 C123 L124	L77-L99 HydrophobicContact CD2-CD1 4.33Å; L77-L99 HydrophobicContact CG-CD1 4.16Å; L77-L99 WeakPolarHBondContact O-CA 3.48Å; L77-L99 PolarHBondContact O-N 2.91Å; L77-L99 VanDerWaalsContact O-N 3.14Å; L80-L99 HydrophobicContact CB-CD1 3.82Å; L93-L99 HydrophobicContact CD1-CD2 4.47Å; C96-L99 HydrophobicContact CB-CB 4.03Å; C96-L99 WeakPolarHBondContact O-CB 3.47Å; C96-L99 PolarHBondContact O-N 3.38Å; E97-L99 VanDerWaalsContact C-N 3.35Å; L99-L102 HydrophobicContact CD2-CB 4.29Å; L99-L121 HydrophobicContact CB-CD1 4.39Å; L99-L121 HydrophobicContact CD2-CD1 4.1Å; L99-C123 CarbonylContact O-C 3.52Å; L99-C123 VanDerWaalsContact O-C 3.3Å; L99-L124 HydrophobicContact CD2-CD1 4.31Å; L99-L124 HydrophobicContact CG-CD1 4.24Å; L99-L124 WeakPolarHBondContact O-CA 3.46Å; L99-L124 PolarHBondContact O-N 3.28Å
100	Q	97.9	Very high	97.5	Very high	90 Å²	90	34.2 Å²	34.2	42%	0.421	20%	0.196	S	C	.	.			trans	-104.1	-35.9	-177.9	-69.2	169.4	27.7	0	0	112.8	A78 N98 C123 E125 Y126	A78-Q100 PolarHBondContact O-N 3.06Å; N98-Q100 PolarHBondContact O-N 3.43Å; Q100-C123 WeakPolarHBondContact CA-O 3.12Å; Q100-C123 HydrophobicContact CG-CB 4.09Å; Q100-E125 PolarHBondContact O-N 3.37Å; Q100-Y126 PolarHBondContact O-N 3.36Å
101	S	98.4	Very high	97.4	Very high	32 Å²	32	37.7 Å²	37.7	22%	0.224	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	119.5	-175.9	173.4	0	0	0	0	111.5	A78 L80 Y126	A78-S101 PolarHBondContact O-N 3.28Å; A78-S101 VanDerWaalsContact O-N 3.1Å; L80-S101 PolarHBondContact N-O 2.79Å; S101-Y126 WeakPolarHBondContact CA-O 3.05Å
102	L	98.6	Very high	97.3	Very high	2 Å²	2	34.8 Å²	34.8	1%	0.01	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	123.5	175.8	177.8	58.8	0	0	0	111	L80 V82 L90 L93 L99 A104 L118 L124 Y126 L127 R128	L80-L102 HydrophobicContact CB-CD1 4.05Å; L80-L102 HydrophobicContact CD2-CD1 3.89Å; L80-L102 HydrophobicContact CG-CD1 3.96Å; L80-L102 WeakPolarHBondContact O-CA 3.41Å; V82-L102 HydrophobicContact CG2-CD1 4.19Å; L90-L102 HydrophobicContact CD1-CD2 4.17Å; L93-L102 HydrophobicContact CD1-CD1 4.03Å; L93-L102 HydrophobicContact CD1-CD2 3.82Å; L99-L102 HydrophobicContact CD2-CB 4.29Å; L102-A104 HydrophobicContact CG-CB 4.43Å; L102-L118 HydrophobicContact CD2-CD1 3.88Å; L102-L118 HydrophobicContact CD2-CD2 3.95Å; L102-L124 HydrophobicContact CB-CD1 4.16Å; L102-Y126 PolarHBondContact N-O 2.76Å; L102-L127 HydrophobicContact CB-CD1 4.05Å; L102-L127 HydrophobicContact CD2-CD1 3.87Å; L102-L127 HydrophobicContact CG-CD1 3.99Å; L102-L127 WeakPolarHBondContact O-CA 3.47Å; L102-R128 PolarHBondContact O-N 2.86Å
103	N	98.6	Very high	97.2	Very high	22 Å²	22	35.9 Å²	35.9	12%	0.118	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	110.2	165.1	-174.2	5.6	0	0	0	110.4	L80 N81 V82 S83 A105 R128	L80-N103 PolarHBondContact O-N 3.28Å; N81-N103 HydrophobicContact CB-CB 4.44Å; N81-N103 WeakPolarHBondContact OD1-CB 3.43Å; N81-N103 PolarHBondContact OD1-ND2 2.78Å; V82-N103 CarbonylContact C-O 3.51Å; V82-N103 WeakPolarHBondContact CG2-O 3.37Å; V82-N103 PolarHBondContact N-O 3.02Å; S83-N103 PolarHBondContact N-O 3.17Å; N103-A105 WeakPolarHBondContact OD1-CB 3.44Å; N103-A105 PolarHBondContact OD1-N 3.29Å; N103-A105 VanDerWaalsContact OD1-N 3.14Å; N103-R128 HydrophobicContact CB-CB 4.33Å; N103-R128 WeakPolarHBondContact OD1-CB 3.45Å
104	A	98.4	Very high	97.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	23%	0.233	C	C	.	.			trans	-119	20.5	176.8	0	0	0	0	0	112.2	V82 L102 N107 L109 R128 L129 N138	V82-A104 HydrophobicContact CG2-CB 4.07Å; L102-A104 HydrophobicContact CG-CB 4.43Å; A104-N107 PolarHBondContact O-ND2 3.19Å; A104-L109 HydrophobicContact CB-CD1 4.43Å; A104-R128 CarbonylContact C-O 3.55Å; A104-R128 PolarHBondContact N-O 3.46Å; A104-L129 HydrophobicContact CB-CD2 4.38Å; A104-N138 PolarHBondContact O-ND2 2.72Å
105	A	98.5	Very high	97.1	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	21%	0.214	C	C	.	.			trans	-61	140.3	179.8	0	0	0	0	0	112.6	S83 N84 N103 R128 L129 D131 L136	S83-A105 CarbonylContact C-O 3.34Å; S83-A105 WeakPolarHBondContact CA-O 3.39Å; S83-A105 VanDerWaalsContact CB-O 3.3Å; S83-A105 WeakPolarHBondContact CB-O 3.22Å; N84-A105 PolarHBondContact N-O 2.75Å; N103-A105 WeakPolarHBondContact OD1-CB 3.44Å; N103-A105 PolarHBondContact OD1-N 3.29Å; N103-A105 VanDerWaalsContact OD1-N 3.14Å; A105-R128 PolarHBondContact N-O 3.17Å; A105-L129 WeakPolarHBondContact CA-O 3.07Å; A105-D131 HydrophobicContact CB-CB 4.1Å; A105-L136 HydrophobicContact CB-CB 4.02Å
106	G	97.9	Very high	97.1	Very high	12 Å²	12	38.3 Å²	38.3	12%	0.124	22%	0.223	C	C	.	.	S	Bend	trans	69.8	48.3	179.1	0	0	0	0	0	112.8	N84 N85	N84-G106 VanDerWaalsContact CA-O 3.23Å; N84-G106 WeakPolarHBondContact CA-O 3.35Å; N84-G106 PolarHBondContact N-O 3.25Å; N85-G106 PolarHBondContact N-O 3.31Å
107	N	98.7	Very high	97	Very high	4 Å²	4	39.5 Å²	39.5	2%	0.021	23%	0.232	C	C	.	.	S	Bend	trans	-119.2	-167.5	168.7	-81	-76.6	0	0	0	109.1	V82 N85 Q86 L87 A104 N138 P139	V82-N107 PolarHBondContact O-ND2 2.71Å; N85-N107 WeakPolarHBondContact CA-OD1 3.3Å; N85-N107 WeakPolarHBondContact CB-OD1 3.3Å; N85-N107 PolarHBondContact O-OD1 2.9Å; Q86-N107 PolarHBondContact N-OD1 3.35Å; L87-N107 HydrophobicContact CB-CB 4.12Å; L87-N107 VanDerWaalsContact CB-OD1 3.29Å; L87-N107 WeakPolarHBondContact CB-OD1 3.08Å; L87-N107 VanDerWaalsContact CG-OD1 3.29Å; L87-N107 WeakPolarHBondContact CG-OD1 3.47Å; L87-N107 PolarHBondContact N-OD1 3.15Å; A104-N107 PolarHBondContact O-ND2 3.19Å; N107-N138 VanDerWaalsContact CA-OD1 3.29Å; N107-N138 WeakPolarHBondContact CA-OD1 3.24Å; N107-N138 WeakPolarHBondContact CB-OD1 3.33Å; N107-N138 PolarHBondContact N-OD1 2.92Å; N107-N138 PolarHBondContact O-OD1 2.96Å; N107-N138 VanDerWaalsContact O-OD1 3.04Å; N107-P139 WeakPolarHBondContact O-CD 3.29Å
108	L	98.2	Very high	97.1	Very high	89 Å²	89	34.4 Å²	34.4	47%	0.466	21%	0.208	S	C	.	.			trans	-108.4	30.5	-175.9	-58.1	175.9	0	0	0	112.5	Q86 L87 T88 A110 N138	Q86-L108 HydrophobicContact CB-CD1 4.14Å; L87-L108 CarbonylContact O-C 3.26Å; L87-L108 VanDerWaalsContact O-CA 3.32Å; L87-L108 WeakPolarHBondContact O-CA 3.2Å; L87-L108 WeakPolarHBondContact O-CB 3.46Å; L87-L108 PolarHBondContact O-N 3.1Å; T88-L108 HydrophobicContact CG2-CB 3.86Å; T88-L108 HydrophobicContact CG2-CD1 4.37Å; L108-A110 PolarHBondContact O-N 3.43Å; L108-N138 PolarHBondContact N-OD1 3.46Å
109	L	98.1	Very high	97	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	21%	0.209	C	C	.	.			trans	-74.5	115.4	176	-56.3	168.3	0	0	0	109.4	L90 A104 Q114 L115 L129 N138 P139 L140	L90-L109 HydrophobicContact CD1-CD1 3.92Å; L90-L109 HydrophobicContact CG-CD1 4.28Å; L90-L109 HydrophobicContact CG-CD2 4.2Å; A104-L109 HydrophobicContact CB-CD1 4.43Å; L109-Q114 HydrophobicContact CD2-CB 4.05Å; L109-L115 HydrophobicContact CD1-CD2 4.09Å; L109-L129 HydrophobicContact CD1-CD2 4.08Å; L109-N138 HydrophobicContact CB-CB 4.19Å; L109-N138 VanDerWaalsContact CB-OD1 3.29Å; L109-N138 WeakPolarHBondContact CB-OD1 3.32Å; L109-N138 WeakPolarHBondContact CG-OD1 3.15Å; L109-N138 PolarHBondContact N-OD1 3.03Å; L109-P139 WeakPolarHBondContact O-CD 3.44Å; L109-L140 HydrophobicContact CB-CD2 3.53Å; L109-L140 WeakPolarHBondContact O-CB 3.41Å; L109-L140 WeakPolarHBondContact O-CD2 3.48Å; L109-L140 PolarHBondContact O-N 3.24Å
110	A	97	Very high	96.7	Very high	54 Å²	54	36.6 Å²	36.6	45%	0.446	24%	0.241	S	C	.	.			trans	-104.3	-26.3	-171	0	0	0	0	0	114.2	L108 P139	L108-A110 PolarHBondContact O-N 3.43Å; A110-P139 HydrophobicContact CB-CB 4.25Å
111	T	95.9	Very high	96.6	Very high	73 Å²	73	33 Å²	33	45%	0.448	23%	0.225	S	C	.	.	S	Bend	trans	-131.9	149.9	-174.7	68.6	0	0	0	0	111.4	G113 Q114	T111-G113 PolarHBondContact O-N 3.3Å; T111-Q114 PolarHBondContact O-N 2.97Å; T111-Q114 PolarHBondContact O-OE1 2.79Å; T111-Q114 PolarHBondContact OG1-OE1 2.92Å
112	P	93.9	Very high	96.3	Very high	52 Å²	52	36.5 Å²	36.5	34%	0.338	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-58.6	-27.9	174.4	-24.9	34.6	0	0	0	113.7	Q114 L115 A149 L153	P112-Q114 PolarHBondContact O-N 3.29Å; P112-L115 WeakPolarHBondContact O-CB 3.47Å; P112-L115 PolarHBondContact O-N 3.39Å; P112-A149 HydrophobicContact CB-CB 4.22Å; P112-A149 HydrophobicContact CG-CB 3.92Å; P112-L153 WeakPolarHBondContact O-CD2 3.43Å
113	G	93.9	Very high	96.2	Very high	51 Å²	51	38.6 Å²	38.6	53%	0.526	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-60.4	-27.9	178.8	0	0	0	0	0	113.8	T111 L115 Q116	T111-G113 PolarHBondContact O-N 3.3Å; G113-L115 PolarHBondContact O-N 3.48Å; G113-Q116 WeakPolarHBondContact O-CB 3.14Å; G113-Q116 PolarHBondContact O-N 2.9Å; G113-Q116 VanDerWaalsContact O-N 3.11Å
114	Q	95.9	Very high	96.1	Very high	39 Å²	39	38 Å²	38	18%	0.182	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-70.1	-8.3	175.7	-68.2	161.7	-58.8	0	0	113.2	T88 L109 T111 P112	T88-Q114 PolarHBondContact O-NE2 2.88Å; L109-Q114 HydrophobicContact CD2-CB 4.05Å; T111-Q114 PolarHBondContact O-N 2.97Å; T111-Q114 PolarHBondContact O-OE1 2.79Å; T111-Q114 PolarHBondContact OG1-OE1 2.92Å; P112-Q114 PolarHBondContact O-N 3.29Å
115	L	96.6	Very high	96	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-98.6	-3.7	175.5	-53.7	175.2	0	0	0	112.1	L90 L109 P112 G113 C117 L118 L129 L140 V150 L153	L90-L115 HydrophobicContact CD1-CD2 3.97Å; L109-L115 HydrophobicContact CD1-CD2 4.09Å; P112-L115 WeakPolarHBondContact O-CB 3.47Å; P112-L115 PolarHBondContact O-N 3.39Å; G113-L115 PolarHBondContact O-N 3.48Å; L115-C117 PolarHBondContact O-N 3.31Å; L115-L118 HydrophobicContact CB-CD1 4.49Å; L115-L118 HydrophobicContact CD2-CD1 4.24Å; L115-L118 VanDerWaalsContact O-CB 3.3Å; L115-L118 WeakPolarHBondContact O-CB 3.27Å; L115-L118 PolarHBondContact O-N 3.16Å; L115-L129 HydrophobicContact CD1-CD1 3.66Å; L115-L129 HydrophobicContact CD2-CD1 4.38Å; L115-L129 HydrophobicContact CD2-CD2 3.89Å; L115-L140 HydrophobicContact CD1-CD2 4.38Å; L115-V150 HydrophobicContact CD1-CG2 3.84Å; L115-L153 HydrophobicContact CB-CD2 3.6Å
116	Q	95.9	Very high	96	Very high	112 Å²	112	44.9 Å²	44.9	52%	0.523	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-59.1	-32.7	-173.6	-175.4	65.8	58.7	0	0	112.8	G113 L118 A119	G113-Q116 WeakPolarHBondContact O-CB 3.14Å; G113-Q116 PolarHBondContact O-N 2.9Å; G113-Q116 VanDerWaalsContact O-N 3.11Å; Q116-L118 PolarHBondContact O-N 2.91Å; Q116-A119 WeakPolarHBondContact O-CB 3.18Å; Q116-A119 PolarHBondContact O-N 3.33Å; Q116-A119 VanDerWaalsContact O-N 3.11Å
117	C	95.5	Very high	96	Very high	25 Å²	25	44.3 Å²	44.3	17%	0.169	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-59.9	-26.6	175.7	58.6	0	0	0	0	113.2	L90 A94 L115 A119	L90-C117 PolarHBondContact O-SG 3Å; A94-C117 HydrophobicContact CB-CB 4.11Å; L115-C117 PolarHBondContact O-N 3.31Å; C117-A119 VanDerWaalsContact C-N 3.33Å
118	L	97.1	Very high	95.9	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.01	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-78.7	-18.2	179.7	-54	-180	0	0	0	112.4	L90 L93 L102 L115 Q116 G120 L121 L124 L127 L154	L90-L118 HydrophobicContact CD1-CD1 3.97Å; L90-L118 HydrophobicContact CD1-CG 4.5Å; L93-L118 HydrophobicContact CB-CD2 4.16Å; L93-L118 HydrophobicContact CD1-CD2 4.31Å; L102-L118 HydrophobicContact CD2-CD1 3.88Å; L102-L118 HydrophobicContact CD2-CD2 3.95Å; L115-L118 HydrophobicContact CB-CD1 4.49Å; L115-L118 HydrophobicContact CD2-CD1 4.24Å; L115-L118 VanDerWaalsContact O-CB 3.3Å; L115-L118 WeakPolarHBondContact O-CB 3.27Å; L115-L118 PolarHBondContact O-N 3.16Å; Q116-L118 PolarHBondContact O-N 2.91Å; L118-G120 PolarHBondContact O-N 3.02Å; L118-L121 HydrophobicContact CB-CD1 4.43Å; L118-L121 HydrophobicContact CD2-CD1 3.84Å; L118-L121 WeakPolarHBondContact O-CB 3.23Å; L118-L121 PolarHBondContact O-N 3.5Å; L118-L121 VanDerWaalsContact O-N 3.1Å; L118-L124 HydrophobicContact CB-CD2 4.02Å; L118-L124 HydrophobicContact CD1-CD2 4.41Å; L118-L127 HydrophobicContact CD1-CD1 4.23Å; L118-L127 HydrophobicContact CD1-CD2 4.38Å; L118-L154 HydrophobicContact CB-CD1 4.17Å; L118-L154 HydrophobicContact CB-CD2 3.96Å; L118-L154 HydrophobicContact CD1-CD1 4.39Å
119	A	94.5	Very high	95.9	Very high	45 Å²	45	45 Å²	45	37%	0.372	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-67.1	-22	-177.6	0	0	0	0	0	113.1	Q116 C117 L121 L153 L154	Q116-A119 WeakPolarHBondContact O-CB 3.18Å; Q116-A119 PolarHBondContact O-N 3.33Å; Q116-A119 VanDerWaalsContact O-N 3.11Å; C117-A119 VanDerWaalsContact C-N 3.33Å; A119-L121 VanDerWaalsContact C-N 3.31Å; A119-L153 HydrophobicContact CB-CD1 4.41Å; A119-L154 HydrophobicContact CB-CD2 3.78Å; A119-L154 VanDerWaalsContact N-CD2 3.35Å
120	G	90.6	Very high	95.9	Very high	64 Å²	64	49 Å²	49	66%	0.66	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-81.5	-4.4	174.7	0	0	0	0	0	114.6	L118 P122	L118-G120 PolarHBondContact O-N 3.02Å; G120-P122 WeakPolarHBondContact O-CD 3.31Å
121	L	96.1	Very high	95.8	Very high	15 Å²	15	48.3 Å²	48.3	8%	0.079	28%	0.281	C	S	.	.			trans	-87.4	112.8	-173.5	-60.3	-179	0	0	0	111.1	C96 L99 L118 A119 C123 L124	C96-L121 WeakPolarHBondContact O-CD2 3.3Å; L99-L121 HydrophobicContact CB-CD1 4.39Å; L99-L121 HydrophobicContact CD2-CD1 4.1Å; L118-L121 HydrophobicContact CB-CD1 4.43Å; L118-L121 HydrophobicContact CD2-CD1 3.84Å; L118-L121 WeakPolarHBondContact O-CB 3.23Å; L118-L121 PolarHBondContact O-N 3.5Å; L118-L121 VanDerWaalsContact O-N 3.1Å; A119-L121 VanDerWaalsContact C-N 3.31Å; L121-C123 VanDerWaalsContact C-N 3.34Å; L121-C123 PolarHBondContact O-N 2.99Å; L121-L124 HydrophobicContact CB-CB 3.98Å; L121-L124 HydrophobicContact CD1-CD2 4.43Å
122	P	93.5	Very high	95.6	Very high	105 Å²	105	49 Å²	49	68%	0.682	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-26.5	-171.5	29.2	-35.4	0	0	0	113.3	G120	G120-P122 WeakPolarHBondContact O-CD 3.31Å
123	C	95.5	Very high	95.5	Very high	46 Å²	46	54.5 Å²	54.5	31%	0.311	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-0	-172.6	-65	0	0	0	0	113.6	L99 Q100 L121 E125	L99-C123 CarbonylContact O-C 3.52Å; L99-C123 VanDerWaalsContact O-C 3.3Å; Q100-C123 WeakPolarHBondContact CA-O 3.12Å; Q100-C123 HydrophobicContact CG-CB 4.09Å; L121-C123 VanDerWaalsContact C-N 3.34Å; L121-C123 PolarHBondContact O-N 2.99Å; C123-E125 PolarHBondContact O-N 2.86Å
124	L	97.4	Very high	95.4	Very high	11 Å²	11	54.6 Å²	54.6	6%	0.058	31%	0.308	C	S	.	.			trans	-73.6	112.5	-173.3	-171.1	70.3	0	0	0	111.1	L99 L102 L118 L121 L157	L99-L124 HydrophobicContact CD2-CD1 4.31Å; L99-L124 HydrophobicContact CG-CD1 4.24Å; L99-L124 WeakPolarHBondContact O-CA 3.46Å; L99-L124 PolarHBondContact O-N 3.28Å; L102-L124 HydrophobicContact CB-CD1 4.16Å; L118-L124 HydrophobicContact CB-CD2 4.02Å; L118-L124 HydrophobicContact CD1-CD2 4.41Å; L121-L124 HydrophobicContact CB-CB 3.98Å; L121-L124 HydrophobicContact CD1-CD2 4.43Å; L124-L157 HydrophobicContact CD2-CD2 4.12Å; L124-L157 HydrophobicContact CG-CD2 3.93Å
125	E	95.9	Very high	95.4	Very high	53 Å²	53	63.5 Å²	63.5	25%	0.248	34%	0.34	C	S	.	.			trans	-113.9	-30.2	-175.1	-69.1	-175.5	177.5	0	0	113	Q100 C123 K158 V159	Q100-E125 PolarHBondContact O-N 3.37Å; C123-E125 PolarHBondContact O-N 2.86Å; E125-K158 HydrophobicContact CB-CB 4.48Å; E125-K158 HydrophobicContact CB-CD 4.21Å; E125-K158 HydrophobicContact CB-CG 4.26Å; E125-K158 HydrophobicContact CG-CD 4.07Å; E125-K158 HydrophobicContact CG-CG 4.34Å; E125-K158 PolarHBondContact O-N 3.35Å; E125-K158 WeakPolarHBondContact OE1-CE 3.29Å; E125-K158 IonicContact OE1-NZ 3.38Å; E125-K158 PolarHBondContact OE1-NZ 2.93Å; E125-K158 WeakPolarHBondContact OE2-CD 3.37Å; E125-K158 WeakPolarHBondContact OE2-CE 3.29Å; E125-K158 IonicContact OE2-NZ 2.99Å; E125-K158 PolarHBondContact OE2-NZ 3.47Å; E125-V159 PolarHBondContact O-N 2.95Å; E125-V159 VanDerWaalsContact O-N 3.09Å
126	Y	97.2	Very high	95.4	Very high	90 Å²	90	65 Å²	65	35%	0.353	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	120.6	-173.9	-56.1	-97.4	0	0	0	110.1	Q100 S101 L102 V159	Q100-Y126 PolarHBondContact O-N 3.36Å; S101-Y126 WeakPolarHBondContact CA-O 3.05Å; L102-Y126 PolarHBondContact N-O 2.76Å; Y126-V159 HydrophobicContact CD1-CB 3.6Å; Y126-V159 HydrophobicContact CD1-CG1 4.29Å; Y126-V159 HydrophobicContact CD1-CG2 3.62Å; Y126-V159 HydrophobicContact CE1-CB 4.07Å; Y126-V159 HydrophobicContact CE1-CG2 3.52Å; Y126-V159 HydrophobicContact CG-CB 4.47Å
127	L	98.1	Very high	95.5	Very high	1 Å²	1	62.4 Å²	62.4	1%	0.005	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	126.3	175.3	-178.6	60.9	0	0	0	110.4	L102 L118 L129 V150 L154 L157 V159 I160 D161	L102-L127 HydrophobicContact CB-CD1 4.05Å; L102-L127 HydrophobicContact CD2-CD1 3.87Å; L102-L127 HydrophobicContact CG-CD1 3.99Å; L102-L127 WeakPolarHBondContact O-CA 3.47Å; L118-L127 HydrophobicContact CD1-CD1 4.23Å; L118-L127 HydrophobicContact CD1-CD2 4.38Å; L127-L129 HydrophobicContact CD1-CD2 4.1Å; L127-L129 HydrophobicContact CD1-CG 4.33Å; L127-L129 HydrophobicContact CD2-CD1 4.02Å; L127-L129 HydrophobicContact CD2-CD2 4.45Å; L127-L129 HydrophobicContact CD2-CG 4.17Å; L127-L129 HydrophobicContact CG-CD1 4.39Å; L127-L129 HydrophobicContact CG-CD2 4.32Å; L127-L129 HydrophobicContact CG-CG 4.01Å; L127-V150 HydrophobicContact CD2-CG1 4.12Å; L127-L154 HydrophobicContact CD2-CD1 3.67Å; L127-L157 HydrophobicContact CB-CD1 3.91Å; L127-L157 HydrophobicContact CB-CD2 3.86Å; L127-L157 HydrophobicContact CD2-CD1 3.92Å; L127-V159 PolarHBondContact N-O 2.97Å; L127-I160 CarbonylContact O-C 3.3Å; L127-I160 WeakPolarHBondContact O-CA 3.36Å; L127-D161 PolarHBondContact O-N 2.96Å
128	R	98.1	Very high	95.6	Very high	108 Å²	108	61.4 Å²	61.4	41%	0.408	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	121.5	168	-70.2	-166.2	176	104.8	-3.9	110.4	L102 N103 A104 A105	L102-R128 PolarHBondContact O-N 2.86Å; N103-R128 HydrophobicContact CB-CB 4.33Å; N103-R128 WeakPolarHBondContact OD1-CB 3.45Å; A104-R128 CarbonylContact C-O 3.55Å; A104-R128 PolarHBondContact N-O 3.46Å; A105-R128 PolarHBondContact N-O 3.17Å
129	L	98	Very high	95.6	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	36%	0.355	C	S	.	.	S	Bend	trans	-113.9	-17.1	174.6	-61.6	171.7	0	0	0	111.6	A104 A105 L109 L115 L127 N138 L140 V150 D161	A104-L129 HydrophobicContact CB-CD2 4.38Å; A105-L129 WeakPolarHBondContact CA-O 3.07Å; L109-L129 HydrophobicContact CD1-CD2 4.08Å; L115-L129 HydrophobicContact CD1-CD1 3.66Å; L115-L129 HydrophobicContact CD2-CD1 4.38Å; L115-L129 HydrophobicContact CD2-CD2 3.89Å; L127-L129 HydrophobicContact CD1-CD2 4.1Å; L127-L129 HydrophobicContact CD1-CG 4.33Å; L127-L129 HydrophobicContact CD2-CD1 4.02Å; L127-L129 HydrophobicContact CD2-CD2 4.45Å; L127-L129 HydrophobicContact CD2-CG 4.17Å; L127-L129 HydrophobicContact CG-CD1 4.39Å; L127-L129 HydrophobicContact CG-CD2 4.32Å; L127-L129 HydrophobicContact CG-CG 4.01Å; L129-N138 PolarHBondContact O-N 3Å; L129-N138 PolarHBondContact O-ND2 2.88Å; L129-L140 HydrophobicContact CD1-CD1 4.03Å; L129-L140 HydrophobicContact CD1-CD2 4.41Å; L129-V150 HydrophobicContact CD1-CG2 3.88Å; L129-D161 PolarHBondContact N-OD1 3.49Å
130	R	96.9	Very high	95.7	Very high	83 Å²	83	62.6 Å²	62.6	31%	0.313	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	151.2	168.5	62	-179.8	-55.1	-179.7	3.6	111.2	L136 C141 Y146 D161	R130-L136 CarbonylContact C-O 3.59Å; R130-L136 WeakPolarHBondContact CA-O 3.27Å; R130-C141 HydrophobicContact CB-CB 4.32Å; R130-Y146 WeakPolarHBondContact CD-OH 3.31Å; R130-D161 HydrophobicContact CG-CB 3.82Å; R130-D161 WeakPolarHBondContact CG-OD2 3.33Å; R130-D161 PolarHBondContact N-OD1 3.42Å
131	D	95.8	Very high	96	Very high	39 Å²	39	59.9 Å²	59.9	21%	0.209	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	100.9	171.5	-174.2	-23.1	0	0	0	108.4	A105 L133 A134 R135 L136	A105-D131 HydrophobicContact CB-CB 4.1Å; D131-L133 VanDerWaalsContact C-N 3.27Å; D131-L133 PolarHBondContact O-N 3.41Å; D131-L133 WeakPolarHBondContact OD1-CA 3.34Å; D131-L133 WeakPolarHBondContact OD1-CB 3.33Å; D131-L133 PolarHBondContact OD1-N 3.2Å; D131-A134 HydrophobicContact CB-CB 4.11Å; D131-A134 PolarHBondContact O-N 2.64Å; D131-A134 PolarHBondContact OD1-N 2.8Å; D131-R135 PolarHBondContact O-N 2.76Å; D131-L136 CarbonylContact C-O 3.3Å; D131-L136 HydrophobicContact CB-CB 4.27Å; D131-L136 PolarHBondContact N-O 3.43Å; D131-L136 PolarHBondContact O-N 3.13Å
132	P	91.6	Very high	95.9	Very high	88 Å²	88	63.3 Å²	63.3	57%	0.571	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-31.5	178.1	-22.7	33.8	0	0	0	113.7	R135	P132-R135 PolarHBondContact O-N 3.27Å
133	L	91.9	Very high	95.9	Very high	168 Å²	168	60.7 Å²	60.7	88%	0.88	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-43.3	-177.8	-61.2	175.5	0	0	0	110.6	D131 R135	D131-L133 VanDerWaalsContact C-N 3.27Å; D131-L133 PolarHBondContact O-N 3.41Å; D131-L133 WeakPolarHBondContact OD1-CA 3.34Å; D131-L133 WeakPolarHBondContact OD1-CB 3.33Å; D131-L133 PolarHBondContact OD1-N 3.2Å; L133-R135 PolarHBondContact O-N 2.86Å
134	A	91.2	Very high	95.6	Very high	52 Å²	52	64.8 Å²	64.8	43%	0.43	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-1.5	174.9	0	0	0	0	0	113.3	D131 L136	D131-A134 HydrophobicContact CB-CB 4.11Å; D131-A134 PolarHBondContact O-N 2.64Å; D131-A134 PolarHBondContact OD1-N 2.8Å; A134-L136 HydrophobicContact CB-CB 4.48Å; A134-L136 HydrophobicContact CB-CD1 3.84Å; A134-L136 HydrophobicContact CB-CG 3.79Å; A134-L136 PolarHBondContact O-N 2.88Å
135	R	95.6	Very high	95.4	Very high	227 Å²	227	67.6 Å²	67.6	86%	0.857	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	55	33.4	-173.1	-58.7	173.9	60.5	-170.1	-1.4	113	D131 P132 L133	D131-R135 PolarHBondContact O-N 2.76Å; P132-R135 PolarHBondContact O-N 3.27Å; L133-R135 PolarHBondContact O-N 2.86Å
136	L	97.1	Very high	95.3	Very high	30 Å²	30	65.6 Å²	65.6	16%	0.157	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	130.3	178.9	-62	179.2	0	0	0	109.6	N84 A105 R130 D131 A134	N84-L136 HydrophobicContact CB-CD1 4Å; N84-L136 HydrophobicContact CB-CD2 3.87Å; A105-L136 HydrophobicContact CB-CB 4.02Å; R130-L136 CarbonylContact C-O 3.59Å; R130-L136 WeakPolarHBondContact CA-O 3.27Å; D131-L136 CarbonylContact C-O 3.3Å; D131-L136 HydrophobicContact CB-CB 4.27Å; D131-L136 PolarHBondContact N-O 3.43Å; D131-L136 PolarHBondContact O-N 3.13Å; A134-L136 HydrophobicContact CB-CB 4.48Å; A134-L136 HydrophobicContact CB-CD1 3.84Å; A134-L136 HydrophobicContact CB-CG 3.79Å; A134-L136 PolarHBondContact O-N 2.88Å
137	S	97	Very high	95.1	Very high	59 Å²	59	62 Å²	62	41%	0.413	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	144	177	-170.6	0	0	0	0	110.3
138	N	98.3	Very high	94.8	Very high	3 Å²	3	64.7 Å²	64.7	2%	0.016	37%	0.369	C	S	.	.			trans	-85.9	151.7	166.5	-79.5	-85.8	0	0	0	110.4	A104 N107 L108 L109 L129 L140 C141	A104-N138 PolarHBondContact O-ND2 2.72Å; N107-N138 VanDerWaalsContact CA-OD1 3.29Å; N107-N138 WeakPolarHBondContact CA-OD1 3.24Å; N107-N138 WeakPolarHBondContact CB-OD1 3.33Å; N107-N138 PolarHBondContact N-OD1 2.92Å; N107-N138 PolarHBondContact O-OD1 2.96Å; N107-N138 VanDerWaalsContact O-OD1 3.04Å; L108-N138 PolarHBondContact N-OD1 3.46Å; L109-N138 HydrophobicContact CB-CB 4.19Å; L109-N138 VanDerWaalsContact CB-OD1 3.29Å; L109-N138 WeakPolarHBondContact CB-OD1 3.32Å; L109-N138 WeakPolarHBondContact CG-OD1 3.15Å; L109-N138 PolarHBondContact N-OD1 3.03Å; L129-N138 PolarHBondContact O-N 3Å; L129-N138 PolarHBondContact O-ND2 2.88Å; N138-L140 HydrophobicContact CB-CD2 4.09Å; N138-L140 HydrophobicContact CB-CG 4.08Å; N138-L140 PolarHBondContact O-N 2.92Å; N138-C141 WeakPolarHBondContact O-CB 3.18Å; N138-C141 PolarHBondContact O-N 2.89Å
139	P	97.9	Very high	94.6	Very high	66 Å²	66	60.8 Å²	60.8	43%	0.429	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-55.5	-34.5	175.2	-22.9	27.9	0	0	0	113.8	N107 L109 A110 C141 A142	N107-P139 WeakPolarHBondContact O-CD 3.29Å; L109-P139 WeakPolarHBondContact O-CD 3.44Å; A110-P139 HydrophobicContact CB-CB 4.25Å; P139-C141 PolarHBondContact O-N 3.5Å; P139-A142 VanDerWaalsContact O-CB 3.29Å; P139-A142 WeakPolarHBondContact O-CB 3.45Å; P139-A142 PolarHBondContact O-N 3.05Å; P139-A142 VanDerWaalsContact O-N 3.1Å
140	L	96.6	Very high	94.5	Very high	6 Å²	6	60.8 Å²	60.8	3%	0.031	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-58.4	-30.4	176.2	76	94.6	0	0	0	112.9	L109 L115 L129 N138 A142 S143 Y146	L109-L140 HydrophobicContact CB-CD2 3.53Å; L109-L140 WeakPolarHBondContact O-CB 3.41Å; L109-L140 WeakPolarHBondContact O-CD2 3.48Å; L109-L140 PolarHBondContact O-N 3.24Å; L115-L140 HydrophobicContact CD1-CD2 4.38Å; L129-L140 HydrophobicContact CD1-CD1 4.03Å; L129-L140 HydrophobicContact CD1-CD2 4.41Å; N138-L140 HydrophobicContact CB-CD2 4.09Å; N138-L140 HydrophobicContact CB-CG 4.08Å; N138-L140 PolarHBondContact O-N 2.92Å; L140-A142 PolarHBondContact O-N 2.78Å; L140-S143 PolarHBondContact O-N 3.14Å; L140-Y146 HydrophobicContact CD1-CD2 3.81Å; L140-Y146 HydrophobicContact CD1-CG 4.27Å; L140-Y146 WeakPolarHBondContact O-CB 3.47Å
141	C	95.8	Very high	94.3	Very high	8 Å²	8	61 Å²	61	5%	0.054	36%	0.361	C	S	.	.	G	3₁₀ helix	trans	-73.6	-9.1	-178.1	-59.7	0	0	0	0	113.2	R130 N138 P139 S143	R130-C141 HydrophobicContact CB-CB 4.32Å; N138-C141 WeakPolarHBondContact O-CB 3.18Å; N138-C141 PolarHBondContact O-N 2.89Å; P139-C141 PolarHBondContact O-N 3.5Å; C141-S143 VanDerWaalsContact C-N 3.31Å
142	A	94.9	Very high	94.2	Very high	87 Å²	87	67.2 Å²	67.2	72%	0.719	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-71.8	-27.2	174	0	0	0	0	0	112.3	P139 L140	P139-A142 VanDerWaalsContact O-CB 3.29Å; P139-A142 WeakPolarHBondContact O-CB 3.45Å; P139-A142 PolarHBondContact O-N 3.05Å; P139-A142 VanDerWaalsContact O-N 3.1Å; L140-A142 PolarHBondContact O-N 2.78Å
143	S	93.4	Very high	94.4	Very high	50 Å²	50	64.6 Å²	64.6	35%	0.35	37%	0.37	S	S	.	.	S	Bend	trans	-72.8	131	176.9	177.8	0	0	0	0	110.8	L140 C141 S145 Y146	L140-S143 PolarHBondContact O-N 3.14Å; C141-S143 VanDerWaalsContact C-N 3.31Å; S143-S145 PolarHBondContact O-N 3.3Å; S143-S145 PolarHBondContact OG-N 2.91Å; S143-S145 PolarHBondContact OG-OG 3Å; S143-Y146 WeakPolarHBondContact O-CB 3.34Å; S143-Y146 VanDerWaalsContact O-CD1 3.23Å; S143-Y146 WeakPolarHBondContact O-CD1 3.41Å; S143-Y146 PolarHBondContact O-N 2.83Å; S143-Y146 VanDerWaalsContact O-N 3.12Å
144	P	89.6	Confident	94.6	Very high	132 Å²	132	57.1 Å²	57.1	86%	0.857	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-24.2	177.3	26.5	-34.5	0	0	0	113
145	S	92	Very high	94.5	Very high	69 Å²	69	59.2 Å²	59.2	48%	0.483	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-3.5	179	61.5	0	0	0	0	114	S143 R147 A148 A149	S143-S145 PolarHBondContact O-N 3.3Å; S143-S145 PolarHBondContact OG-N 2.91Å; S143-S145 PolarHBondContact OG-OG 3Å; S145-R147 PolarHBondContact O-N 3.04Å; S145-R147 VanDerWaalsContact O-N 3.16Å; S145-A148 WeakPolarHBondContact O-CB 3.49Å; S145-A148 PolarHBondContact O-N 3.27Å; S145-A149 PolarHBondContact O-N 2.97Å
146	Y	94.3	Very high	94.2	Very high	12 Å²	12	51 Å²	51	5%	0.047	33%	0.326	C	S	.	.	H	α-helix	trans	-55.5	-42.1	-173.1	91.3	-88.6	0	0	0	112.1	R130 L140 S143 A148 A149 V150 D161	R130-Y146 WeakPolarHBondContact CD-OH 3.31Å; L140-Y146 HydrophobicContact CD1-CD2 3.81Å; L140-Y146 HydrophobicContact CD1-CG 4.27Å; L140-Y146 WeakPolarHBondContact O-CB 3.47Å; S143-Y146 WeakPolarHBondContact O-CB 3.34Å; S143-Y146 VanDerWaalsContact O-CD1 3.23Å; S143-Y146 WeakPolarHBondContact O-CD1 3.41Å; S143-Y146 PolarHBondContact O-N 2.83Å; S143-Y146 VanDerWaalsContact O-N 3.12Å; Y146-A148 VanDerWaalsContact C-N 3.32Å; Y146-A148 PolarHBondContact O-N 3.13Å; Y146-A149 PolarHBondContact O-N 3.42Å; Y146-V150 HydrophobicContact CD2-CG2 4.34Å; Y146-V150 VanDerWaalsContact O-CG2 3.26Å; Y146-V150 WeakPolarHBondContact O-CG2 3.28Å; Y146-V150 PolarHBondContact O-N 2.95Å; Y146-D161 VanDerWaalsContact CE2-OD2 3.29Å; Y146-D161 WeakPolarHBondContact CE2-OD2 3.18Å; Y146-D161 PolarHBondContact OH-OD2 3.46Å
147	R	92.6	Very high	94.1	Very high	13 Å²	13	49.7 Å²	49.7	5%	0.049	32%	0.319	C	S	.	.	H	α-helix	trans	-68	-35.2	-177.2	-171.5	176.3	170.4	84.4	-7	111.7	S145 R151 I160 E163	S145-R147 PolarHBondContact O-N 3.04Å; S145-R147 VanDerWaalsContact O-N 3.16Å; R147-R151 VanDerWaalsContact O-CG 3.25Å; R147-R151 WeakPolarHBondContact O-CG 3.29Å; R147-R151 PolarHBondContact O-N 3.12Å; R147-R151 VanDerWaalsContact O-N 3.16Å; R147-I160 PolarHBondContact NH1-O 2.87Å; R147-E163 IonicContact CZ-OE2 3.09Å; R147-E163 IonicContact NE-OE2 3.58Å; R147-E163 IonicContact NH1-OE2 3.54Å; R147-E163 VanDerWaalsContact NH2-CB 3.32Å; R147-E163 IonicContact NH2-OE2 2.86Å; R147-E163 PolarHBondContact NH2-OE2 2.81Å
148	A	92.2	Very high	93.9	Very high	59 Å²	59	50.6 Å²	50.6	49%	0.488	32%	0.315	S	S	.	.	H	α-helix	trans	-67.4	-46.3	173.7	0	0	0	0	0	110.6	S145 Y146 V150 R151 E152	S145-A148 WeakPolarHBondContact O-CB 3.49Å; S145-A148 PolarHBondContact O-N 3.27Å; Y146-A148 VanDerWaalsContact C-N 3.32Å; Y146-A148 PolarHBondContact O-N 3.13Å; A148-V150 PolarHBondContact O-N 2.87Å; A148-R151 WeakPolarHBondContact O-CB 3.24Å; A148-R151 PolarHBondContact O-N 3.27Å; A148-R151 VanDerWaalsContact O-N 3.15Å; A148-E152 PolarHBondContact O-N 3.47Å
149	A	94.6	Very high	93.7	Very high	25 Å²	25	51.2 Å²	51.2	21%	0.207	32%	0.319	C	S	.	.	H	α-helix	trans	-60.7	-41.3	177.2	0	0	0	0	0	112.7	P112 S145 Y146 R151 E152 L153	P112-A149 HydrophobicContact CB-CB 4.22Å; P112-A149 HydrophobicContact CG-CB 3.92Å; S145-A149 PolarHBondContact O-N 2.97Å; Y146-A149 PolarHBondContact O-N 3.42Å; A149-R151 VanDerWaalsContact C-N 3.34Å; A149-R151 PolarHBondContact O-N 2.85Å; A149-E152 PolarHBondContact O-N 2.78Å; A149-L153 VanDerWaalsContact O-CB 3.29Å; A149-L153 WeakPolarHBondContact O-CB 3.44Å; A149-L153 PolarHBondContact O-N 2.57Å
150	V	95.6	Very high	93.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-64.6	-38.6	176.1	174.5	0	0	0	0	111.3	L115 L127 L129 Y146 A148 L153 L154 L157 I160	L115-V150 HydrophobicContact CD1-CG2 3.84Å; L127-V150 HydrophobicContact CD2-CG1 4.12Å; L129-V150 HydrophobicContact CD1-CG2 3.88Å; Y146-V150 HydrophobicContact CD2-CG2 4.34Å; Y146-V150 VanDerWaalsContact O-CG2 3.26Å; Y146-V150 WeakPolarHBondContact O-CG2 3.28Å; Y146-V150 PolarHBondContact O-N 2.95Å; A148-V150 PolarHBondContact O-N 2.87Å; V150-L153 PolarHBondContact O-N 2.94Å; V150-L154 HydrophobicContact CG1-CD1 4.37Å; V150-L154 WeakPolarHBondContact O-CB 3.46Å; V150-L154 PolarHBondContact O-N 2.9Å; V150-L157 HydrophobicContact CG1-CD1 3.98Å; V150-I160 HydrophobicContact CB-CD1 4.48Å; V150-I160 HydrophobicContact CG1-CD1 3.85Å
151	R	93	Very high	93.5	Very high	87 Å²	87	48.8 Å²	48.8	33%	0.328	30%	0.302	S	S	.	.	H	α-helix	trans	-67.9	-38.7	176.8	-74.1	169.6	178.9	161.5	-10	112.5	R147 A148 A149 L154 P155 I160	R147-R151 VanDerWaalsContact O-CG 3.25Å; R147-R151 WeakPolarHBondContact O-CG 3.29Å; R147-R151 PolarHBondContact O-N 3.12Å; R147-R151 VanDerWaalsContact O-N 3.16Å; A148-R151 WeakPolarHBondContact O-CB 3.24Å; A148-R151 PolarHBondContact O-N 3.27Å; A148-R151 VanDerWaalsContact O-N 3.15Å; A149-R151 VanDerWaalsContact C-N 3.34Å; A149-R151 PolarHBondContact O-N 2.85Å; R151-L154 CarbonylContact O-C 3.57Å; R151-P155 WeakPolarHBondContact O-CA 3.17Å; R151-I160 HydrophobicContact CG-CD1 3.71Å
152	E	93.7	Very high	93.2	Very high	170 Å²	170	50.6 Å²	50.6	79%	0.794	32%	0.322	S	S	*	.	H	α-helix	trans	-65.3	-43.4	175.5	-173.9	-177.5	173.7	0	0	110.9	A148 A149	A148-E152 PolarHBondContact O-N 3.47Å; A149-E152 PolarHBondContact O-N 2.78Å
153	L	95.6	Very high	93	Very high	33 Å²	33	49.3 Å²	49.3	17%	0.173	30%	0.302	C	S	.	.	H	α-helix	trans	-71.4	-38.4	-179.6	-176.1	63.9	0	0	0	113.1	P112 L115 A119 A149 V150 P155	P112-L153 WeakPolarHBondContact O-CD2 3.43Å; L115-L153 HydrophobicContact CB-CD2 3.6Å; A119-L153 HydrophobicContact CB-CD1 4.41Å; A149-L153 VanDerWaalsContact O-CB 3.29Å; A149-L153 WeakPolarHBondContact O-CB 3.44Å; A149-L153 PolarHBondContact O-N 2.57Å; V150-L153 PolarHBondContact O-N 2.94Å; L153-P155 WeakPolarHBondContact O-CD 3.28Å
154	L	94.9	Very high	92.7	Very high	11 Å²	11	51.8 Å²	51.8	6%	0.058	30%	0.303	C	S	.	.			trans	-128.3	71.7	-172.1	-54.4	175.4	0	0	0	110.4	L118 A119 L127 V150 R151 G156 L157	L118-L154 HydrophobicContact CB-CD1 4.17Å; L118-L154 HydrophobicContact CB-CD2 3.96Å; L118-L154 HydrophobicContact CD1-CD1 4.39Å; A119-L154 HydrophobicContact CB-CD2 3.78Å; A119-L154 VanDerWaalsContact N-CD2 3.35Å; L127-L154 HydrophobicContact CD2-CD1 3.67Å; V150-L154 HydrophobicContact CG1-CD1 4.37Å; V150-L154 WeakPolarHBondContact O-CB 3.46Å; V150-L154 PolarHBondContact O-N 2.9Å; R151-L154 CarbonylContact O-C 3.57Å; L154-G156 PolarHBondContact O-N 3.18Å; L154-L157 HydrophobicContact CB-CD1 3.54Å; L154-L157 HydrophobicContact CB-CG 3.83Å; L154-L157 HydrophobicContact CD1-CD1 3.81Å; L154-L157 HydrophobicContact CG-CD1 4.32Å; L154-L157 PolarHBondContact O-N 3.11Å
155	P	90.5	Very high	92.5	Very high	97 Å²	97	46.7 Å²	46.7	63%	0.63	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-18.5	-173.4	27.2	-35.8	0	0	0	114	R151 L153 L157 I166	R151-P155 WeakPolarHBondContact O-CA 3.17Å; L153-P155 WeakPolarHBondContact O-CD 3.28Å; P155-L157 VanDerWaalsContact C-N 3.33Å; P155-L157 PolarHBondContact O-N 3.33Å; P155-I166 VanDerWaalsContact O-CD1 3.31Å; P155-I166 WeakPolarHBondContact O-CD1 3.47Å
156	G	89.4	Confident	92	Very high	54 Å²	54	47.5 Å²	47.5	56%	0.557	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-9.4	179.7	0	0	0	0	0	115.2	L154 K158	L154-G156 PolarHBondContact O-N 3.18Å; G156-K158 PolarHBondContact O-N 3.29Å
157	L	94.3	Very high	90.9	Very high	3 Å²	3	49 Å²	49	2%	0.016	29%	0.287	C	S	.	.			trans	-65.5	132.5	-176.5	-71.1	175.1	0	0	0	111.6	L124 L127 V150 L154 P155 I160 V165 I166	L124-L157 HydrophobicContact CD2-CD2 4.12Å; L124-L157 HydrophobicContact CG-CD2 3.93Å; L127-L157 HydrophobicContact CB-CD1 3.91Å; L127-L157 HydrophobicContact CB-CD2 3.86Å; L127-L157 HydrophobicContact CD2-CD1 3.92Å; V150-L157 HydrophobicContact CG1-CD1 3.98Å; L154-L157 HydrophobicContact CB-CD1 3.54Å; L154-L157 HydrophobicContact CB-CG 3.83Å; L154-L157 HydrophobicContact CD1-CD1 3.81Å; L154-L157 HydrophobicContact CG-CD1 4.32Å; L154-L157 PolarHBondContact O-N 3.11Å; P155-L157 VanDerWaalsContact C-N 3.33Å; P155-L157 PolarHBondContact O-N 3.33Å; L157-I160 HydrophobicContact CB-CG1 4.2Å; L157-I160 HydrophobicContact CD1-CD1 4.1Å; L157-I160 HydrophobicContact CD1-CG1 3.91Å; L157-V165 WeakPolarHBondContact O-CG2 3.44Å; L157-I166 VanDerWaalsContact O-CD1 3.27Å; L157-I166 WeakPolarHBondContact O-CD1 3.42Å
158	K	93.3	Very high	89.4	Confident	78 Å²	78	60.4 Å²	60.4	34%	0.339	33%	0.33	S	S	.	.	S	Bend	trans	-88.6	-33.1	173.8	-62.9	-176.1	-171.6	164.5	0	111.9	E125 G156 R164 V165	E125-K158 HydrophobicContact CB-CB 4.48Å; E125-K158 HydrophobicContact CB-CD 4.21Å; E125-K158 HydrophobicContact CB-CG 4.26Å; E125-K158 HydrophobicContact CG-CD 4.07Å; E125-K158 HydrophobicContact CG-CG 4.34Å; E125-K158 PolarHBondContact O-N 3.35Å; E125-K158 WeakPolarHBondContact OE1-CE 3.29Å; E125-K158 IonicContact OE1-NZ 3.38Å; E125-K158 PolarHBondContact OE1-NZ 2.93Å; E125-K158 WeakPolarHBondContact OE2-CD 3.37Å; E125-K158 WeakPolarHBondContact OE2-CE 3.29Å; E125-K158 IonicContact OE2-NZ 2.99Å; E125-K158 PolarHBondContact OE2-NZ 3.47Å; G156-K158 PolarHBondContact O-N 3.29Å; K158-R164 WeakPolarHBondContact O-CA 3.4Å; K158-V165 VanDerWaalsContact C-CG2 3.47Å; K158-V165 VanDerWaalsContact O-CG2 3.3Å; K158-V165 WeakPolarHBondContact O-CG2 3.13Å; K158-V165 PolarHBondContact O-N 3.5Å
159	V	94	Very high	88	Confident	16 Å²	16	59.4 Å²	59.4	10%	0.097	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	130.6	-176.3	-179.3	0	0	0	0	110.4	E125 Y126 L127 E163	E125-V159 PolarHBondContact O-N 2.95Å; E125-V159 VanDerWaalsContact O-N 3.09Å; Y126-V159 HydrophobicContact CD1-CB 3.6Å; Y126-V159 HydrophobicContact CD1-CG1 4.29Å; Y126-V159 HydrophobicContact CD1-CG2 3.62Å; Y126-V159 HydrophobicContact CE1-CB 4.07Å; Y126-V159 HydrophobicContact CE1-CG2 3.52Å; Y126-V159 HydrophobicContact CG-CB 4.47Å; L127-V159 PolarHBondContact N-O 2.97Å; V159-E163 WeakPolarHBondContact CA-O 3.07Å
160	I	95.6	Very high	86.8	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	122.4	174.1	-58.2	177.2	0	0	0	108.3	L127 R147 V150 R151 L157 G162 E163 V165	L127-I160 CarbonylContact O-C 3.3Å; L127-I160 WeakPolarHBondContact O-CA 3.36Å; R147-I160 PolarHBondContact NH1-O 2.87Å; V150-I160 HydrophobicContact CB-CD1 4.48Å; V150-I160 HydrophobicContact CG1-CD1 3.85Å; R151-I160 HydrophobicContact CG-CD1 3.71Å; L157-I160 HydrophobicContact CB-CG1 4.2Å; L157-I160 HydrophobicContact CD1-CD1 4.1Å; L157-I160 HydrophobicContact CD1-CG1 3.91Å; I160-G162 PolarHBondContact O-N 3.36Å; I160-E163 PolarHBondContact N-O 3.07Å; I160-E163 WeakPolarHBondContact O-CB 3.3Å; I160-E163 PolarHBondContact O-N 3.45Å; I160-V165 HydrophobicContact CB-CG1 4.22Å; I160-V165 HydrophobicContact CD1-CG1 3.97Å; I160-V165 HydrophobicContact CD1-CG2 4.32Å; I160-V165 HydrophobicContact CG1-CG1 4.05Å; I160-V165 HydrophobicContact CG1-CG2 4.14Å
161	D	95.2	Very high	85.7	Confident	20 Å²	20	66.6 Å²	66.6	11%	0.107	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	30.8	178.2	-56.3	-42.3	0	0	0	113.9	L127 L129 R130 Y146 E163	L127-D161 PolarHBondContact O-N 2.96Å; L129-D161 PolarHBondContact N-OD1 3.49Å; R130-D161 HydrophobicContact CG-CB 3.82Å; R130-D161 WeakPolarHBondContact CG-OD2 3.33Å; R130-D161 PolarHBondContact N-OD1 3.42Å; Y146-D161 VanDerWaalsContact CE2-OD2 3.29Å; Y146-D161 WeakPolarHBondContact CE2-OD2 3.18Å; Y146-D161 PolarHBondContact OH-OD2 3.46Å; D161-E163 VanDerWaalsContact C-N 3.27Å; D161-E163 PolarHBondContact O-N 2.95Å
162	G	89.5	Confident	84.7	Confident	46 Å²	46	69 Å²	69	47%	0.474	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.6	-6.4	-175.6	0	0	0	0	0	114.6	I160	I160-G162 PolarHBondContact O-N 3.36Å
163	E	89.1	Confident	83.5	Confident	60 Å²	60	67.7 Å²	67.7	28%	0.28	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	126.8	174.2	-65.8	179.3	-155.8	0	0	111.1	R147 V159 I160 D161 V165 R177	R147-E163 IonicContact CZ-OE2 3.09Å; R147-E163 IonicContact NE-OE2 3.58Å; R147-E163 IonicContact NH1-OE2 3.54Å; R147-E163 VanDerWaalsContact NH2-CB 3.32Å; R147-E163 IonicContact NH2-OE2 2.86Å; R147-E163 PolarHBondContact NH2-OE2 2.81Å; V159-E163 WeakPolarHBondContact CA-O 3.07Å; I160-E163 PolarHBondContact N-O 3.07Å; I160-E163 WeakPolarHBondContact O-CB 3.3Å; I160-E163 PolarHBondContact O-N 3.45Å; D161-E163 VanDerWaalsContact C-N 3.27Å; D161-E163 PolarHBondContact O-N 2.95Å; E163-V165 PolarHBondContact O-N 3.39Å; E163-R177 IonicContact OE1-CZ 3.87Å; E163-R177 IonicContact OE1-NH1 2.88Å; E163-R177 PolarHBondContact OE1-NH1 3.06Å; E163-R177 IonicContact OE2-CZ 3.91Å; E163-R177 IonicContact OE2-NH1 2.72Å; E163-R177 PolarHBondContact OE2-NH1 2.91Å
164	R	87.4	Confident	82.6	Confident	103 Å²	103	69.2 Å²	69.2	39%	0.389	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	128.9	173.4	-174.9	175.8	-68.8	-80.1	-0.6	110.4	K158 I166	K158-R164 WeakPolarHBondContact O-CA 3.4Å; R164-I166 VanDerWaalsContact CG-O 3.28Å; R164-I166 WeakPolarHBondContact CG-O 3.36Å
165	V	86.6	Confident	81.7	Confident	24 Å²	24	73.7 Å²	73.7	15%	0.145	39%	0.389	C	S	.	.			trans	-107.1	-26.3	179.8	-72.4	0	0	0	0	113.4	L157 K158 I160 E163	L157-V165 WeakPolarHBondContact O-CG2 3.44Å; K158-V165 VanDerWaalsContact C-CG2 3.47Å; K158-V165 VanDerWaalsContact O-CG2 3.3Å; K158-V165 WeakPolarHBondContact O-CG2 3.13Å; K158-V165 PolarHBondContact O-N 3.5Å; I160-V165 HydrophobicContact CB-CG1 4.22Å; I160-V165 HydrophobicContact CD1-CG1 3.97Å; I160-V165 HydrophobicContact CD1-CG2 4.32Å; I160-V165 HydrophobicContact CG1-CG1 4.05Å; I160-V165 HydrophobicContact CG1-CG2 4.14Å; E163-V165 PolarHBondContact O-N 3.39Å
166	I	80.1	Confident	81.1	Confident	86 Å²	86	71.3 Å²	71.3	44%	0.441	37%	0.374	S	S	.	.	S	Bend	trans	-131.1	146.8	-178.7	-56.5	175.9	0	0	0	110.1	P155 L157 R164	P155-I166 VanDerWaalsContact O-CD1 3.31Å; P155-I166 WeakPolarHBondContact O-CD1 3.47Å; L157-I166 VanDerWaalsContact O-CD1 3.27Å; L157-I166 WeakPolarHBondContact O-CD1 3.42Å; R164-I166 VanDerWaalsContact CG-O 3.28Å; R164-I166 WeakPolarHBondContact CG-O 3.36Å
167	G	71.9	Confident	80.4	Confident	44 Å²	44	72.9 Å²	72.9	45%	0.454	36%	0.363	S	S	.	.	S	Bend	trans	99.3	178.8	174.7	0	0	0	0	0	114.5	G169 S170	G167-G169 PolarHBondContact O-N 2.97Å; G167-S170 PolarHBondContact O-N 3.27Å; G167-S170 VanDerWaalsContact O-N 3.16Å; G167-S170 PolarHBondContact O-OG 3.21Å
168	R	60.2	Low	79.8	Confident	252 Å²	252	76.2 Å²	76.2	95%	0.951	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	123.7	-179.3	-66.3	-174.2	-174.8	-175.1	2	110.2
169	G	62.8	Low	79.1	Confident	38 Å²	38	77.6 Å²	77.6	39%	0.392	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.8	-13.1	-179.7	0	0	0	0	0	115.8	G167 E171 F172 Y173	G167-G169 PolarHBondContact O-N 2.97Å; G169-E171 VanDerWaalsContact C-N 3.33Å; G169-E171 PolarHBondContact O-N 3.44Å; G169-F172 PolarHBondContact O-N 3.49Å; G169-Y173 WeakPolarHBondContact O-CD2 3.4Å; G169-Y173 PolarHBondContact O-N 2.81Å
170	S	71.3	Confident	78.4	Confident	21 Å²	21	81.5 Å²	81.5	15%	0.147	41%	0.412	C	S	.	.	H	α-helix	trans	-65.4	-36.7	174.4	59.6	0	0	0	0	112.3	G167 F172 Y173 Q174	G167-S170 PolarHBondContact O-N 3.27Å; G167-S170 VanDerWaalsContact O-N 3.16Å; G167-S170 PolarHBondContact O-OG 3.21Å; S170-F172 VanDerWaalsContact C-N 3.35Å; S170-F172 PolarHBondContact O-N 2.74Å; S170-Y173 PolarHBondContact O-N 3Å; S170-Q174 WeakPolarHBondContact O-CB 3.38Å; S170-Q174 PolarHBondContact O-N 3.05Å
171	E	71.7	Confident	77.5	Confident	156 Å²	156	84.8 Å²	84.8	73%	0.729	43%	0.434	S	S	*	.	H	α-helix	trans	-60.5	-42.7	175.2	-65.4	178.8	164.9	0	0	111.9	G169 Q174 L175	G169-E171 VanDerWaalsContact C-N 3.33Å; G169-E171 PolarHBondContact O-N 3.44Å; E171-Q174 PolarHBondContact O-N 2.97Å; E171-L175 WeakPolarHBondContact O-CB 3.24Å; E171-L175 VanDerWaalsContact O-CG 3.31Å; E171-L175 WeakPolarHBondContact O-CG 3.19Å; E171-L175 PolarHBondContact O-N 3.2Å
172	F	72.5	Confident	76.6	Confident	138 Å²	138	88.5 Å²	88.5	61%	0.605	46%	0.462	S	S	*	.	H	α-helix	trans	-64.3	-45.6	177.2	-178.7	-99.5	0	0	0	111.7	G169 S170 Q174 L175 C176	G169-F172 PolarHBondContact O-N 3.49Å; S170-F172 VanDerWaalsContact C-N 3.35Å; S170-F172 PolarHBondContact O-N 2.74Å; F172-Q174 VanDerWaalsContact C-N 3.31Å; F172-Q174 PolarHBondContact O-N 3.05Å; F172-L175 PolarHBondContact O-N 3.09Å; F172-C176 PolarHBondContact O-N 2.75Å; F172-C176 PolarHBondContact O-SG 2.81Å
173	Y	68.8	Low	75.8	Confident	142 Å²	142	92.7 Å²	92.7	56%	0.557	47%	0.473	S	S	*	.	H	α-helix	trans	-61.9	-39.4	174.9	-88.6	-76.2	0	0	0	112.4	G169 S170 C176 R177	G169-Y173 WeakPolarHBondContact O-CD2 3.4Å; G169-Y173 PolarHBondContact O-N 2.81Å; S170-Y173 PolarHBondContact O-N 3Å; Y173-C176 PolarHBondContact O-N 2.91Å; Y173-R177 WeakPolarHBondContact O-CB 3.47Å; Y173-R177 PolarHBondContact O-N 3.18Å
174	Q	76.1	Confident	74.7	Confident	64 Å²	64	98.9 Å²	98.9	30%	0.299	49%	0.494	S	S	.	.	H	α-helix	trans	-65	-44	176.8	-169.6	63.4	46	0	0	110.9	S170 E171 F172 C176 R177 D178	S170-Q174 WeakPolarHBondContact O-CB 3.38Å; S170-Q174 PolarHBondContact O-N 3.05Å; E171-Q174 PolarHBondContact O-N 2.97Å; F172-Q174 VanDerWaalsContact C-N 3.31Å; F172-Q174 PolarHBondContact O-N 3.05Å; Q174-C176 PolarHBondContact O-N 2.91Å; Q174-R177 WeakPolarHBondContact O-CB 3.25Å; Q174-R177 PolarHBondContact O-N 2.94Å; Q174-D178 PolarHBondContact NE2-OD1 2.82Å; Q174-D178 WeakPolarHBondContact O-CB 3.5Å; Q174-D178 PolarHBondContact O-N 2.77Å
175	L	76	Confident	73.2	Confident	106 Å²	106	99.9 Å²	99.9	56%	0.555	51%	0.514	S	S	*	.	H	α-helix	trans	-58.4	-47	173.9	-75.9	165	0	0	0	112.3	E171 F172 R177 D178 L179	E171-L175 WeakPolarHBondContact O-CB 3.24Å; E171-L175 VanDerWaalsContact O-CG 3.31Å; E171-L175 WeakPolarHBondContact O-CG 3.19Å; E171-L175 PolarHBondContact O-N 3.2Å; F172-L175 PolarHBondContact O-N 3.09Å; L175-R177 VanDerWaalsContact C-N 3.28Å; L175-R177 PolarHBondContact O-N 2.93Å; L175-D178 PolarHBondContact O-N 2.59Å; L175-L179 WeakPolarHBondContact O-CB 3.42Å; L175-L179 WeakPolarHBondContact O-CG 3.22Å; L175-L179 PolarHBondContact O-N 2.94Å
176	C	78.3	Confident	71.5	Confident	46 Å²	46	103.1 Å²	103.1	31%	0.311	54%	0.537	S	S	.	.	H	α-helix	trans	-59.4	-41	176	-68.4	0	0	0	0	111.7	F172 Y173 Q174 L179 D180	F172-C176 PolarHBondContact O-N 2.75Å; F172-C176 PolarHBondContact O-SG 2.81Å; Y173-C176 PolarHBondContact O-N 2.91Å; Q174-C176 PolarHBondContact O-N 2.91Å; C176-L179 WeakPolarHBondContact O-CB 3.4Å; C176-L179 PolarHBondContact O-N 2.89Å; C176-D180 WeakPolarHBondContact O-CB 3.23Å; C176-D180 PolarHBondContact O-N 3.1Å
177	R	74.8	Confident	70	Confident	88 Å²	88	105.3 Å²	105.3	33%	0.332	56%	0.56	S	S	.	*	H	α-helix	trans	-67.2	-41.6	177.9	-175	-179.1	-179.6	136.6	7.4	112.3	E163 Y173 Q174 L175 L179 D180 S181	E163-R177 IonicContact OE1-CZ 3.87Å; E163-R177 IonicContact OE1-NH1 2.88Å; E163-R177 PolarHBondContact OE1-NH1 3.06Å; E163-R177 IonicContact OE2-CZ 3.91Å; E163-R177 IonicContact OE2-NH1 2.72Å; E163-R177 PolarHBondContact OE2-NH1 2.91Å; Y173-R177 WeakPolarHBondContact O-CB 3.47Å; Y173-R177 PolarHBondContact O-N 3.18Å; Q174-R177 WeakPolarHBondContact O-CB 3.25Å; Q174-R177 PolarHBondContact O-N 2.94Å; L175-R177 VanDerWaalsContact C-N 3.28Å; L175-R177 PolarHBondContact O-N 2.93Å; R177-L179 VanDerWaalsContact C-N 3.32Å; R177-D180 PolarHBondContact O-N 2.91Å; R177-S181 WeakPolarHBondContact O-CB 3.41Å; R177-S181 PolarHBondContact O-N 2.92Å; R177-S181 PolarHBondContact O-OG 3.14Å
178	D	80.6	Confident	68.9	Low	73 Å²	73	106.8 Å²	106.8	39%	0.39	56%	0.564	S	S	.	*	H	α-helix	trans	-65.3	-40.7	178.5	-65.2	-13.5	0	0	0	109.8	Q174 L175 S181 S182	Q174-D178 PolarHBondContact NE2-OD1 2.82Å; Q174-D178 WeakPolarHBondContact O-CB 3.5Å; Q174-D178 PolarHBondContact O-N 2.77Å; L175-D178 PolarHBondContact O-N 2.59Å; D178-S181 PolarHBondContact O-N 3.1Å; D178-S181 PolarHBondContact O-OG 3.33Å; D178-S182 WeakPolarHBondContact O-CB 3.26Å; D178-S182 PolarHBondContact O-N 3.26Å; D178-S182 PolarHBondContact O-OG 3.33Å
179	L	78.1	Confident	68.2	Low	107 Å²	107	101.4 Å²	101.4	56%	0.56	56%	0.561	S	S	*	*	H	α-helix	trans	-59.6	-52.6	170.8	-74.9	166.8	0	0	0	111.6	L175 C176 R177 S181 S182 L183	L175-L179 WeakPolarHBondContact O-CB 3.42Å; L175-L179 WeakPolarHBondContact O-CG 3.22Å; L175-L179 PolarHBondContact O-N 2.94Å; C176-L179 WeakPolarHBondContact O-CB 3.4Å; C176-L179 PolarHBondContact O-N 2.89Å; R177-L179 VanDerWaalsContact C-N 3.32Å; L179-S181 VanDerWaalsContact C-N 3.26Å; L179-S181 PolarHBondContact O-N 3.27Å; L179-S182 CarbonylContact O-C 3.44Å; L179-S182 WeakPolarHBondContact O-CA 3.18Å; L179-S182 WeakPolarHBondContact O-CB 3.39Å; L179-S182 PolarHBondContact O-N 3.16Å; L179-L183 VanDerWaalsContact O-CG 3.27Å; L179-L183 WeakPolarHBondContact O-CG 3.17Å; L179-L183 PolarHBondContact O-N 2.92Å
180	D	80.6	Confident	67.6	Low	98 Å²	98	101.9 Å²	101.9	52%	0.524	57%	0.566	S	S	.	*	H	α-helix	trans	-57.5	-39.7	177.7	-83.3	-11.4	0	0	0	112.2	C176 R177 S182 L183 R184	C176-D180 WeakPolarHBondContact O-CB 3.23Å; C176-D180 PolarHBondContact O-N 3.1Å; R177-D180 PolarHBondContact O-N 2.91Å; D180-S182 VanDerWaalsContact C-N 3.3Å; D180-S182 PolarHBondContact O-N 2.82Å; D180-L183 PolarHBondContact O-N 2.97Å; D180-R184 WeakPolarHBondContact O-CG 3.29Å; D180-R184 PolarHBondContact O-N 2.83Å
181	S	75.4	Confident	66.5	Low	68 Å²	68	107 Å²	107	48%	0.476	60%	0.599	S	S	.	*	H	α-helix	trans	-67.1	-33.6	177.1	75.4	0	0	0	0	112.5	R177 D178 L179	R177-S181 WeakPolarHBondContact O-CB 3.41Å; R177-S181 PolarHBondContact O-N 2.92Å; R177-S181 PolarHBondContact O-OG 3.14Å; D178-S181 PolarHBondContact O-N 3.1Å; D178-S181 PolarHBondContact O-OG 3.33Å; L179-S181 VanDerWaalsContact C-N 3.26Å; L179-S181 PolarHBondContact O-N 3.27Å
182	S	76.3	Confident	65.3	Low	99 Å²	99	111.1 Å²	111.1	69%	0.692	61%	0.608	S	S	*	*	H	α-helix	trans	-74	-28.5	176	-56.2	0	0	0	0	112.3	D178 L179 D180	D178-S182 WeakPolarHBondContact O-CB 3.26Å; D178-S182 PolarHBondContact O-N 3.26Å; D178-S182 PolarHBondContact O-OG 3.33Å; L179-S182 CarbonylContact O-C 3.44Å; L179-S182 WeakPolarHBondContact O-CA 3.18Å; L179-S182 WeakPolarHBondContact O-CB 3.39Å; L179-S182 PolarHBondContact O-N 3.16Å; D180-S182 VanDerWaalsContact C-N 3.3Å; D180-S182 PolarHBondContact O-N 2.82Å
183	L	74.1	Confident	64.2	Low	134 Å²	134	109.1 Å²	109.1	70%	0.702	62%	0.617	S	S	*	*	H	α-helix	trans	-82.2	-13.7	177.9	-68.6	169.8	0	0	0	113.2	L179 D180 P185	L179-L183 VanDerWaalsContact O-CG 3.27Å; L179-L183 WeakPolarHBondContact O-CG 3.17Å; L179-L183 PolarHBondContact O-N 2.92Å; D180-L183 PolarHBondContact O-N 2.97Å; L183-P185 WeakPolarHBondContact O-CD 3.47Å
184	R	66.1	Low	63.6	Low	189 Å²	189	108.7 Å²	108.7	71%	0.713	63%	0.629	S	S	*	*	S	Bend	trans	-71.1	123.5	174.9	-75.8	175.7	-169.1	-154.3	1.3	109.5	D180 S186	D180-R184 WeakPolarHBondContact O-CG 3.29Å; D180-R184 PolarHBondContact O-N 2.83Å; R184-S186 PolarHBondContact O-N 2.97Å
185	P	55.4	Low	62.6	Low	125 Å²	125	114.2 Å²	114.2	81%	0.812	66%	0.655	S	S	*	*	P	Polyproline II helix	trans	-60.7	129.1	176.9	22.9	-30.2	0	0	0	109.3	L183 S187	L183-P185 WeakPolarHBondContact O-CD 3.47Å; P185-S187 PolarHBondContact O-N 2.83Å
186	S	49.9	Very low	61.5	Low	92 Å²	92	114 Å²	114	64%	0.643	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-57.1	134.7	175.1	52.4	0	0	0	0	109.4	R184 S188	R184-S186 PolarHBondContact O-N 2.97Å; S186-S188 PolarHBondContact O-N 2.98Å
187	S	49.2	Very low	60.6	Low	131 Å²	131	120.3 Å²	120.3	92%	0.916	69%	0.693	S	S	*	*	S	Bend	trans	-73.3	49.3	172.5	58.5	0	0	0	0	111	P185	P185-S187 PolarHBondContact O-N 2.83Å
188	S	49	Very low	60	Low	76 Å²	76	120.9 Å²	120.9	53%	0.531	71%	0.708	S	S	.	*	S	Bend	trans	-109.3	138.4	171.4	-46.3	0	0	0	0	106.5	S186 G190	S186-S188 PolarHBondContact O-N 2.98Å; S188-G190 PolarHBondContact O-N 2.92Å
189	P	46.3	Very low	59.5	Low	139 Å²	139	128 Å²	128	90%	0.903	73%	0.73	S	S	*	*			trans	-72.4	74.7	168.3	31.6	-30.3	0	0	0	107.7
190	G	49.8	Very low	59	Low	47 Å²	47	123.9 Å²	123.9	49%	0.485	71%	0.709	S	S	.	*			trans	-63.8	160.1	162.5	0	0	0	0	0	109.4	S188 R192	S188-G190 PolarHBondContact O-N 2.92Å; G190-R192 PolarHBondContact O-N 3.09Å; G190-R192 VanDerWaalsContact O-N 3.13Å
191	P	46.8	Very low	58.7	Low	130 Å²	130	126.6 Å²	126.6	84%	0.844	72%	0.718	S	S	*	*	S	Bend	trans	-52.1	128	-178.8	24.9	-32.3	0	0	0	107.7	A193	P191-A193 PolarHBondContact O-N 3.26Å
192	R	48.1	Very low	58.2	Low	242 Å²	242	129 Å²	129	91%	0.913	73%	0.733	S	S	*	*			trans	-33.7	113.2	-177.1	-76.1	178.6	171.7	171.4	-3.1	108.6	G190 T194	G190-R192 PolarHBondContact O-N 3.09Å; G190-R192 VanDerWaalsContact O-N 3.13Å; R192-T194 PolarHBondContact O-N 3.21Å
193	A	49.3	Very low	57.6	Low	96 Å²	96	126 Å²	126	79%	0.793	72%	0.717	S	S	*	*			trans	-50.1	109.6	172.4	0	0	0	0	0	106	P191 E195	P191-A193 PolarHBondContact O-N 3.26Å; A193-E195 PolarHBondContact O-N 3.01Å
194	T	55.3	Low	57.3	Low	133 Å²	133	126.6 Å²	126.6	82%	0.816	71%	0.711	S	S	*	*			trans	-49.3	125.5	168.2	23.9	0	0	0	0	105.8	R192 A196	R192-T194 PolarHBondContact O-N 3.21Å; T194-A196 PolarHBondContact O-N 3.41Å
195	E	56	Low	57	Low	179 Å²	179	127 Å²	127	84%	0.836	71%	0.713	S	S	*	*			trans	-37	128.6	179.9	-73.2	174.4	145.5	0	0	109.6	A193 Q197	A193-E195 PolarHBondContact O-N 3.01Å; E195-Q197 PolarHBondContact O-N 3.03Å
196	A	52.9	Low	57.3	Low	102 Å²	102	128 Å²	128	84%	0.843	71%	0.706	S	S	*	*			trans	-54.1	106.4	177.6	0	0	0	0	0	107.7	T194	T194-A196 PolarHBondContact O-N 3.41Å
197	Q	58.9	Low	57.5	Low	179 Å²	179	129 Å²	129	84%	0.836	71%	0.713	S	S	*	*			trans	-68.9	135.4	174.4	-68.1	-158.1	-20.6	0	0	107.3	E195 W199	E195-Q197 PolarHBondContact O-N 3.03Å; Q197-W199 PolarHBondContact O-N 3.44Å; Q197-W199 VanDerWaalsContact O-N 3.15Å
198	P	62.2	Low	57.4	Low	99 Å²	99	133.9 Å²	133.9	64%	0.643	71%	0.712	S	S	*	*			trans	-56.7	126.8	174.6	24.2	-31.4	0	0	0	107.7	V200	P198-V200 PolarHBondContact O-N 3.43Å
199	W	68.7	Low	57.4	Low	223 Å²	223	136 Å²	136	85%	0.845	72%	0.724	S	S	*	*	S	Bend	trans	-65.5	-1.1	176.5	68.5	-84.9	0	0	0	112.8	Q197	Q197-W199 PolarHBondContact O-N 3.44Å; Q197-W199 VanDerWaalsContact O-N 3.15Å
200	V	68.8	Low	57.7	Low	20 Å²	20	134.7 Å²	134.7	12%	0.121	72%	0.718	C	S	.	*	S	Bend	trans	-127.4	123.5	-176.8	-179.1	0	0	0	0	107.6	P198 Y204	P198-V200 PolarHBondContact O-N 3.43Å; V200-Y204 HydrophobicContact CG1-CD1 3.55Å; V200-Y204 HydrophobicContact CG1-CD2 4.36Å; V200-Y204 HydrophobicContact CG1-CG 3.44Å; V200-Y204 VanDerWaalsContact CG1-CG 3.44Å
201	E	73.3	Confident	57.6	Low	155 Å²	155	144 Å²	144	72%	0.724	74%	0.738	S	S	*	*			trans	-59.4	142.3	173.1	-67.7	-63.4	154	0	0	110.8	G203 Y204	E201-G203 PolarHBondContact O-N 3.13Å; E201-G203 VanDerWaalsContact O-N 3.15Å; E201-Y204 WeakPolarHBondContact O-CB 3.44Å; E201-Y204 PolarHBondContact O-N 3.37Å; E201-Y204 VanDerWaalsContact O-N 3.08Å
202	P	65.9	Low	57.9	Low	120 Å²	120	141.5 Å²	141.5	78%	0.779	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.6	122.9	169.6	-21	31.5	0	0	0	109.9
203	G	63.9	Low	58.3	Low	34 Å²	34	132.2 Å²	132.2	35%	0.351	70%	0.696	S	S	.	*	T	Hydrogen-bonded Turn	trans	101.4	-5.9	-177.9	0	0	0	0	0	115.9	E201 W205 E206	E201-G203 PolarHBondContact O-N 3.13Å; E201-G203 VanDerWaalsContact O-N 3.15Å; G203-W205 PolarHBondContact O-N 3.09Å; G203-E206 WeakPolarHBondContact O-CB 3.48Å; G203-E206 PolarHBondContact O-N 3.16Å
204	Y	67.2	Low	59.1	Low	147 Å²	147	131.9 Å²	131.9	58%	0.576	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-32.5	175.7	-178.3	-94.5	0	0	0	113.5	V200 E201	V200-Y204 HydrophobicContact CG1-CD1 3.55Å; V200-Y204 HydrophobicContact CG1-CD2 4.36Å; V200-Y204 HydrophobicContact CG1-CG 3.44Å; V200-Y204 VanDerWaalsContact CG1-CG 3.44Å; E201-Y204 WeakPolarHBondContact O-CB 3.44Å; E201-Y204 PolarHBondContact O-N 3.37Å; E201-Y204 VanDerWaalsContact O-N 3.08Å
205	W	60.8	Low	59.7	Low	199 Å²	199	131.5 Å²	131.5	75%	0.754	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	0.5	176	-56.9	112.2	0	0	0	113.2	G203 S207	G203-W205 PolarHBondContact O-N 3.09Å; W205-S207 PolarHBondContact O-N 2.8Å
206	E	61.4	Low	60.3	Low	146 Å²	146	129 Å²	129	68%	0.682	67%	0.671	S	S	*	*	S	Bend	trans	-71	122.8	171.4	-71.8	177.8	-168	0	0	107.8	G203 W208	G203-E206 WeakPolarHBondContact O-CB 3.48Å; G203-E206 PolarHBondContact O-N 3.16Å; E206-W208 PolarHBondContact O-N 3.07Å; E206-W208 VanDerWaalsContact O-N 3.17Å
207	S	52.7	Low	61.3	Low	112 Å²	112	130 Å²	130	78%	0.783	66%	0.659	S	S	*	*			trans	-55.4	125.6	172.4	50.3	0	0	0	0	107.9	W205	W205-S207 PolarHBondContact O-N 2.8Å
208	W	49	Very low	62.2	Low	233 Å²	233	124.8 Å²	124.8	88%	0.883	63%	0.634	S	S	*	*			trans	-45.2	139.5	179.4	-70.9	29.4	0	0	0	109.9	E206 S210	E206-W208 PolarHBondContact O-N 3.07Å; E206-W208 VanDerWaalsContact O-N 3.17Å; W208-S210 PolarHBondContact O-N 2.96Å
209	P	48.3	Very low	62.8	Low	122 Å²	122	122.5 Å²	122.5	79%	0.792	62%	0.623	S	S	*	*	S	Bend	trans	-54.5	123.6	-178.5	21.9	-30.8	0	0	0	108.3	R211	P209-R211 PolarHBondContact O-N 3.22Å
210	S	52	Low	63	Low	110 Å²	110	115.6 Å²	115.6	77%	0.769	61%	0.609	S	S	*	*			trans	-38.1	103.2	-171	-48.1	0	0	0	0	111.7	W208 S212	W208-S210 PolarHBondContact O-N 2.96Å; S210-S212 PolarHBondContact O-N 3.29Å
211	R	48.9	Very low	63.6	Low	242 Å²	242	121 Å²	121	91%	0.913	63%	0.627	S	S	*	*			trans	-73.2	86.4	144.5	-73.8	-167.2	-176.1	-150.7	2.5	104.5	P209 S213	P209-R211 PolarHBondContact O-N 3.22Å; R211-S213 PolarHBondContact O-N 3.48Å
212	S	51.6	Low	64.2	Low	79 Å²	79	118.6 Å²	118.6	55%	0.552	62%	0.615	S	S	*	*			trans	-46.8	95.2	164.5	27.8	0	0	0	0	107.2	S210 S214 E217	S210-S212 PolarHBondContact O-N 3.29Å; S212-S214 PolarHBondContact O-N 3.45Å; S212-S214 VanDerWaalsContact O-N 3.1Å; S212-E217 WeakPolarHBondContact CB-OE1 3.33Å
213	S	57.8	Low	65.1	Low	47 Å²	47	119.3 Å²	119.3	33%	0.329	61%	0.606	S	S	.	*			trans	-70.2	108.7	173.7	178.9	0	0	0	0	104.4	R211 I215 L216 E217	R211-S213 PolarHBondContact O-N 3.48Å; S213-I215 PolarHBondContact O-N 3.04Å; S213-L216 PolarHBondContact O-N 2.89Å; S213-E217 PolarHBondContact O-N 3.01Å
214	S	64.9	Low	66.1	Low	88 Å²	88	123.7 Å²	123.7	62%	0.615	62%	0.618	S	S	*	*	H	α-helix	trans	-50	-24.5	176.3	61.1	0	0	0	0	111.9	S212 E218	S212-S214 PolarHBondContact O-N 3.45Å; S212-S214 VanDerWaalsContact O-N 3.1Å; S214-E218 WeakPolarHBondContact O-CB 3.46Å; S214-E218 PolarHBondContact O-N 3.38Å
215	I	69.2	Low	67.2	Low	126 Å²	126	121.1 Å²	121.1	65%	0.646	61%	0.614	S	S	*	*	H	α-helix	trans	-68.9	-40.2	176.1	-58.5	162.8	0	0	0	111.9	S213 A219	S213-I215 PolarHBondContact O-N 3.04Å; I215-A219 WeakPolarHBondContact O-CB 3.2Å; I215-A219 PolarHBondContact O-N 3.44Å
216	L	67.1	Low	68.5	Low	126 Å²	126	115.3 Å²	115.3	66%	0.66	60%	0.601	S	S	*	*	H	α-helix	trans	-73.5	-39.4	178.1	-84.6	163.4	0	0	0	111.6	S213 C220	S213-L216 PolarHBondContact O-N 2.89Å; L216-C220 WeakPolarHBondContact O-CB 3.4Å; L216-C220 PolarHBondContact O-N 3.04Å
217	E	73.6	Confident	69.8	Low	124 Å²	124	111.6 Å²	111.6	58%	0.579	59%	0.585	S	S	*	*	H	α-helix	trans	-65.7	-43.5	174.6	-75.1	177.6	-177.1	0	0	111.4	S212 S213 C220 R221	S212-E217 WeakPolarHBondContact CB-OE1 3.33Å; S213-E217 PolarHBondContact O-N 3.01Å; E217-C220 PolarHBondContact O-N 2.84Å; E217-R221 PolarHBondContact O-N 3.16Å
218	E	78.5	Confident	71.5	Confident	69 Å²	69	110.7 Å²	110.7	32%	0.322	57%	0.569	S	S	.	*	H	α-helix	trans	-66.6	-39.3	177.3	-172	60.7	-151.8	0	0	111.9	S214 R221 Q222	S214-E218 WeakPolarHBondContact O-CB 3.46Å; S214-E218 PolarHBondContact O-N 3.38Å; E218-R221 VanDerWaalsContact CD-NH2 3.29Å; E218-R221 PolarHBondContact O-N 3.36Å; E218-R221 IonicContact OE1-CZ 3.57Å; E218-R221 IonicContact OE1-NE 2.79Å; E218-R221 IonicContact OE1-NH2 3.48Å; E218-R221 PolarHBondContact OE1-NH2 3.43Å; E218-R221 IonicContact OE2-CZ 3.44Å; E218-R221 IonicContact OE2-NE 2.79Å; E218-R221 PolarHBondContact OE2-NE 3.5Å; E218-R221 IonicContact OE2-NH2 3.58Å; E218-R221 PolarHBondContact OE2-NH2 3.16Å; E218-Q222 WeakPolarHBondContact O-CB 3.29Å; E218-Q222 VanDerWaalsContact O-CG 3.28Å; E218-Q222 WeakPolarHBondContact O-CG 3.42Å; E218-Q222 PolarHBondContact O-N 3.48Å; E218-Q222 PolarHBondContact OE1-NE2 3.22Å; E218-Q222 VanDerWaalsContact OE1-NE2 3.12Å
219	A	74.1	Confident	73.6	Confident	50 Å²	50	105.7 Å²	105.7	41%	0.413	56%	0.555	S	S	.	*	H	α-helix	trans	-64.8	-41	175.3	0	0	0	0	0	112.2	I215 F223	I215-A219 WeakPolarHBondContact O-CB 3.2Å; I215-A219 PolarHBondContact O-N 3.44Å; A219-F223 WeakPolarHBondContact O-CB 3.21Å; A219-F223 PolarHBondContact O-N 3.18Å
220	C	72.9	Confident	75.5	Confident	79 Å²	79	103.3 Å²	103.3	53%	0.534	54%	0.54	S	S	.	.	H	α-helix	trans	-63.8	-40.9	174.3	-96.3	0	0	0	0	112	L216 E217 F223 Q224	L216-C220 WeakPolarHBondContact O-CB 3.4Å; L216-C220 PolarHBondContact O-N 3.04Å; E217-C220 PolarHBondContact O-N 2.84Å; C220-F223 PolarHBondContact O-N 3.39Å; C220-Q224 WeakPolarHBondContact O-CG 3.44Å; C220-Q224 PolarHBondContact O-N 3.09Å; C220-Q224 VanDerWaalsContact O-N 3.08Å
221	R	82.9	Confident	77.1	Confident	133 Å²	133	105 Å²	105	50%	0.502	53%	0.53	S	S	.	.	H	α-helix	trans	-63.5	-49.8	176.9	-171	177.9	71.1	160.7	2.5	111.4	E217 E218 F223 Q224 D225	E217-R221 PolarHBondContact O-N 3.16Å; E218-R221 VanDerWaalsContact CD-NH2 3.29Å; E218-R221 PolarHBondContact O-N 3.36Å; E218-R221 IonicContact OE1-CZ 3.57Å; E218-R221 IonicContact OE1-NE 2.79Å; E218-R221 IonicContact OE1-NH2 3.48Å; E218-R221 PolarHBondContact OE1-NH2 3.43Å; E218-R221 IonicContact OE2-CZ 3.44Å; E218-R221 IonicContact OE2-NE 2.79Å; E218-R221 PolarHBondContact OE2-NE 3.5Å; E218-R221 IonicContact OE2-NH2 3.58Å; E218-R221 PolarHBondContact OE2-NH2 3.16Å; R221-F223 VanDerWaalsContact C-N 3.27Å; R221-F223 PolarHBondContact O-N 3.48Å; R221-Q224 PolarHBondContact O-N 3.15Å; R221-Q224 VanDerWaalsContact O-N 3.1Å; R221-D225 PolarHBondContact O-N 2.85Å
222	Q	84.6	Confident	79.2	Confident	104 Å²	104	97 Å²	97	49%	0.486	51%	0.505	S	S	.	.	H	α-helix	trans	-60	-38.3	178.9	-72.6	173.6	4.3	0	0	112.2	E218 D225 T226	E218-Q222 WeakPolarHBondContact O-CB 3.29Å; E218-Q222 VanDerWaalsContact O-CG 3.28Å; E218-Q222 WeakPolarHBondContact O-CG 3.42Å; E218-Q222 PolarHBondContact O-N 3.48Å; E218-Q222 PolarHBondContact OE1-NE2 3.22Å; E218-Q222 VanDerWaalsContact OE1-NE2 3.12Å; Q222-D225 PolarHBondContact O-N 3.2Å; Q222-T226 PolarHBondContact O-N 3.42Å; Q222-T226 PolarHBondContact O-OG1 3.12Å
223	F	85.7	Confident	81.1	Confident	135 Å²	135	98 Å²	98	59%	0.592	50%	0.504	S	S	*	.	H	α-helix	trans	-65	-41.5	175.8	-174.7	-104.2	0	0	0	112.4	A219 C220 R221 T226 L227	A219-F223 WeakPolarHBondContact O-CB 3.21Å; A219-F223 PolarHBondContact O-N 3.18Å; C220-F223 PolarHBondContact O-N 3.39Å; R221-F223 VanDerWaalsContact C-N 3.27Å; R221-F223 PolarHBondContact O-N 3.48Å; F223-T226 PolarHBondContact O-N 3.32Å; F223-L227 HydrophobicContact CD1-CD1 3.93Å; F223-L227 HydrophobicContact CE1-CD1 3.47Å; F223-L227 VanDerWaalsContact CE1-CD1 3.47Å; F223-L227 HydrophobicContact CE1-CG 4.17Å; F223-L227 HydrophobicContact CZ-CD1 4.01Å; F223-L227 HydrophobicContact CZ-CG 4.32Å; F223-L227 WeakPolarHBondContact O-CG 3.33Å; F223-L227 PolarHBondContact O-N 3.1Å
224	Q	85	Confident	82.6	Confident	126 Å²	126	101.8 Å²	101.8	59%	0.589	52%	0.516	S	S	*	.	H	α-helix	trans	-66.2	-41.6	176.4	-73.1	173.6	4.7	0	0	112.2	C220 R221 T226 L227 Q228	C220-Q224 WeakPolarHBondContact O-CG 3.44Å; C220-Q224 PolarHBondContact O-N 3.09Å; C220-Q224 VanDerWaalsContact O-N 3.08Å; R221-Q224 PolarHBondContact O-N 3.15Å; R221-Q224 VanDerWaalsContact O-N 3.1Å; Q224-T226 VanDerWaalsContact C-N 3.31Å; Q224-T226 PolarHBondContact O-N 3.02Å; Q224-L227 PolarHBondContact O-N 2.85Å; Q224-Q228 PolarHBondContact O-N 3.49Å
225	D	90.9	Very high	83.9	Confident	94 Å²	94	106 Å²	106	50%	0.503	52%	0.519	S	S	.	.	H	α-helix	trans	-62	-41.4	176.6	-66.7	-22.1	0	0	0	111	R221 Q222 L227 Q228 E229	R221-D225 PolarHBondContact O-N 2.85Å; Q222-D225 PolarHBondContact O-N 3.2Å; D225-L227 PolarHBondContact O-N 3.17Å; D225-Q228 PolarHBondContact O-N 3.03Å; D225-E229 PolarHBondContact O-N 3.49Å
226	T	88.1	Confident	85	Confident	77 Å²	77	106 Å²	106	47%	0.472	52%	0.516	S	S	.	.	H	α-helix	trans	-65.7	-38.3	177.7	-46.2	0	0	0	0	111.9	Q222 F223 Q224 Q228 E229 C230	Q222-T226 PolarHBondContact O-N 3.42Å; Q222-T226 PolarHBondContact O-OG1 3.12Å; F223-T226 PolarHBondContact O-N 3.32Å; Q224-T226 VanDerWaalsContact C-N 3.31Å; Q224-T226 PolarHBondContact O-N 3.02Å; T226-Q228 VanDerWaalsContact C-N 3.34Å; T226-E229 PolarHBondContact O-N 3.05Å; T226-C230 PolarHBondContact O-N 3.04Å; T226-C230 PolarHBondContact O-SG 3.27Å; T226-C230 VanDerWaalsContact O-SG 3.36Å
227	L	88.6	Confident	86	Confident	67 Å²	67	102.2 Å²	102.2	35%	0.351	50%	0.503	S	S	.	.	H	α-helix	trans	-65	-39.7	175.5	-78.3	175	0	0	0	112	F223 Q224 D225 C230 W231	F223-L227 HydrophobicContact CD1-CD1 3.93Å; F223-L227 HydrophobicContact CE1-CD1 3.47Å; F223-L227 VanDerWaalsContact CE1-CD1 3.47Å; F223-L227 HydrophobicContact CE1-CG 4.17Å; F223-L227 HydrophobicContact CZ-CD1 4.01Å; F223-L227 HydrophobicContact CZ-CG 4.32Å; F223-L227 WeakPolarHBondContact O-CG 3.33Å; F223-L227 PolarHBondContact O-N 3.1Å; Q224-L227 PolarHBondContact O-N 2.85Å; D225-L227 PolarHBondContact O-N 3.17Å; L227-C230 PolarHBondContact O-N 3.47Å; L227-W231 PolarHBondContact O-N 2.98Å; L227-W231 VanDerWaalsContact O-N 3.1Å
228	Q	88.3	Confident	86.8	Confident	94 Å²	94	99.4 Å²	99.4	44%	0.439	50%	0.497	S	S	.	.	H	α-helix	trans	-64.6	-42.8	177.5	-170.8	61.2	39.1	0	0	111.3	Q224 D225 T226 C230 W231 D232	Q224-Q228 PolarHBondContact O-N 3.49Å; D225-Q228 PolarHBondContact O-N 3.03Å; T226-Q228 VanDerWaalsContact C-N 3.34Å; Q228-C230 VanDerWaalsContact C-N 3.34Å; Q228-C230 PolarHBondContact O-N 3.13Å; Q228-W231 PolarHBondContact O-N 3.25Å; Q228-D232 PolarHBondContact O-N 2.89Å
229	E	92.3	Very high	87.4	Confident	128 Å²	128	100.3 Å²	100.3	60%	0.598	50%	0.504	S	S	*	.	H	α-helix	trans	-62.7	-39.9	176.6	-166.3	173.7	-160.6	0	0	112	D225 T226 W231 D232 L233	D225-E229 PolarHBondContact O-N 3.49Å; T226-E229 PolarHBondContact O-N 3.05Å; E229-W231 PolarHBondContact O-N 3.36Å; E229-D232 PolarHBondContact O-N 3Å; E229-L233 WeakPolarHBondContact O-CB 3.32Å; E229-L233 WeakPolarHBondContact O-CG 3.34Å; E229-L233 PolarHBondContact O-N 3.03Å
230	C	87.9	Confident	88.2	Confident	71 Å²	71	101.1 Å²	101.1	48%	0.48	51%	0.507	S	S	.	.	H	α-helix	trans	-60.5	-42.8	173.7	-75.5	0	0	0	0	112.5	T226 L227 Q228 L233 E234	T226-C230 PolarHBondContact O-N 3.04Å; T226-C230 PolarHBondContact O-SG 3.27Å; T226-C230 VanDerWaalsContact O-SG 3.36Å; L227-C230 PolarHBondContact O-N 3.47Å; Q228-C230 VanDerWaalsContact C-N 3.34Å; Q228-C230 PolarHBondContact O-N 3.13Å; C230-L233 PolarHBondContact O-N 3.41Å; C230-E234 WeakPolarHBondContact O-CB 3.46Å; C230-E234 PolarHBondContact O-N 2.88Å
231	W	87	Confident	88.9	Confident	147 Å²	147	102.5 Å²	102.5	56%	0.557	51%	0.508	S	S	*	.	H	α-helix	trans	-67.5	-38	177.4	-70.8	-30.9	0	0	0	112.7	L227 Q228 E229 E234 R235	L227-W231 PolarHBondContact O-N 2.98Å; L227-W231 VanDerWaalsContact O-N 3.1Å; Q228-W231 PolarHBondContact O-N 3.25Å; E229-W231 PolarHBondContact O-N 3.36Å; W231-E234 PolarHBondContact O-N 2.86Å; W231-R235 WeakPolarHBondContact O-CB 3.47Å; W231-R235 PolarHBondContact O-N 2.68Å
232	D	92.4	Very high	89	Confident	73 Å²	73	98.6 Å²	98.6	39%	0.39	51%	0.505	S	S	.	.	H	α-helix	trans	-67.1	-38.8	177.1	-70.7	-25.3	0	0	0	111.2	Q228 E229 R235 Q236	Q228-D232 PolarHBondContact O-N 2.89Å; E229-D232 PolarHBondContact O-N 3Å; D232-R235 PolarHBondContact O-N 2.85Å; D232-Q236 WeakPolarHBondContact O-CG 3.48Å; D232-Q236 PolarHBondContact O-N 3.01Å
233	L	90.8	Very high	89.1	Confident	99 Å²	99	100 Å²	100	52%	0.518	51%	0.511	S	S	.	.	H	α-helix	trans	-64.7	-42.7	173.1	-75.1	171.4	0	0	0	112.4	E229 C230 R235 Q236 A237	E229-L233 WeakPolarHBondContact O-CB 3.32Å; E229-L233 WeakPolarHBondContact O-CG 3.34Å; E229-L233 PolarHBondContact O-N 3.03Å; C230-L233 PolarHBondContact O-N 3.41Å; L233-R235 VanDerWaalsContact C-N 3.27Å; L233-R235 PolarHBondContact O-N 3.5Å; L233-Q236 PolarHBondContact O-N 3.12Å; L233-A237 WeakPolarHBondContact O-CB 3.47Å; L233-A237 PolarHBondContact O-N 3.4Å
234	E	89.6	Confident	89	Confident	128 Å²	128	95.9 Å²	95.9	60%	0.598	50%	0.502	S	S	*	.	H	α-helix	trans	-61.2	-39.4	176	-175.8	175.1	-163.9	0	0	111.4	C230 W231 S238	C230-E234 WeakPolarHBondContact O-CB 3.46Å; C230-E234 PolarHBondContact O-N 2.88Å; W231-E234 PolarHBondContact O-N 2.86Å; E234-S238 WeakPolarHBondContact O-CB 3.1Å; E234-S238 PolarHBondContact O-N 3.11Å; E234-S238 PolarHBondContact O-OG 3.18Å
235	R	91.9	Very high	88.9	Confident	175 Å²	175	96.3 Å²	96.3	66%	0.66	50%	0.504	S	S	*	.	H	α-helix	trans	-66	-47.2	175.8	-163.2	179.4	-150.7	167.1	7.3	111.9	W231 D232 L233 A237 S238 D239	W231-R235 WeakPolarHBondContact O-CB 3.47Å; W231-R235 PolarHBondContact O-N 2.68Å; D232-R235 PolarHBondContact O-N 2.85Å; L233-R235 VanDerWaalsContact C-N 3.27Å; L233-R235 PolarHBondContact O-N 3.5Å; R235-A237 VanDerWaalsContact C-N 3.33Å; R235-A237 PolarHBondContact O-N 2.98Å; R235-S238 WeakPolarHBondContact O-CB 3.18Å; R235-S238 PolarHBondContact O-N 3.38Å; R235-D239 PolarHBondContact O-N 2.97Å
236	Q	92.1	Very high	88.3	Confident	126 Å²	126	98.6 Å²	98.6	59%	0.589	51%	0.511	S	S	*	.	H	α-helix	trans	-62	-41	176.9	-74.7	178.3	2.7	0	0	112.2	D232 L233 S238 D239 S240	D232-Q236 WeakPolarHBondContact O-CG 3.48Å; D232-Q236 PolarHBondContact O-N 3.01Å; L233-Q236 PolarHBondContact O-N 3.12Å; Q236-S238 VanDerWaalsContact C-N 3.34Å; Q236-D239 PolarHBondContact O-N 2.84Å; Q236-S240 WeakPolarHBondContact O-CB 3.36Å; Q236-S240 PolarHBondContact O-N 3.45Å; Q236-S240 PolarHBondContact O-OG 2.73Å
237	A	88.9	Confident	87.8	Confident	47 Å²	47	97.6 Å²	97.6	39%	0.388	51%	0.511	S	S	.	.	H	α-helix	trans	-61.8	-45.2	175.3	0	0	0	0	0	110.7	L233 R235 D239 S240 L241	L233-A237 WeakPolarHBondContact O-CB 3.47Å; L233-A237 PolarHBondContact O-N 3.4Å; R235-A237 VanDerWaalsContact C-N 3.33Å; R235-A237 PolarHBondContact O-N 2.98Å; A237-D239 PolarHBondContact O-N 3.41Å; A237-S240 PolarHBondContact O-N 2.86Å; A237-S240 PolarHBondContact O-OG 2.94Å; A237-L241 WeakPolarHBondContact O-CG 3.29Å; A237-L241 PolarHBondContact O-N 2.95Å
238	S	90.7	Very high	87	Confident	65 Å²	65	100.8 Å²	100.8	46%	0.455	53%	0.528	S	S	.	.	H	α-helix	trans	-62	-43.4	177.1	-63.9	0	0	0	0	112.4	E234 R235 Q236 S240 L241 A242	E234-S238 WeakPolarHBondContact O-CB 3.1Å; E234-S238 PolarHBondContact O-N 3.11Å; E234-S238 PolarHBondContact O-OG 3.18Å; R235-S238 WeakPolarHBondContact O-CB 3.18Å; R235-S238 PolarHBondContact O-N 3.38Å; Q236-S238 VanDerWaalsContact C-N 3.34Å; S238-S240 VanDerWaalsContact C-N 3.34Å; S238-S240 PolarHBondContact O-N 3.11Å; S238-L241 PolarHBondContact O-N 3.27Å; S238-A242 WeakPolarHBondContact O-CB 3.37Å; S238-A242 PolarHBondContact O-N 2.95Å
239	D	91.4	Very high	86	Confident	89 Å²	89	100.9 Å²	100.9	48%	0.476	54%	0.539	S	S	.	.	H	α-helix	trans	-65.1	-38.9	176.5	-70.2	-20.3	0	0	0	111.5	R235 Q236 A237 A242 Q243	R235-D239 PolarHBondContact O-N 2.97Å; Q236-D239 PolarHBondContact O-N 2.84Å; A237-D239 PolarHBondContact O-N 3.41Å; D239-A242 PolarHBondContact O-N 3.21Å; D239-Q243 VanDerWaalsContact O-CG 3.31Å; D239-Q243 WeakPolarHBondContact O-CG 3.33Å; D239-Q243 PolarHBondContact O-N 2.98Å
240	S	90.1	Very high	84.5	Confident	66 Å²	66	99.6 Å²	99.6	46%	0.462	54%	0.544	S	S	.	.	H	α-helix	trans	-66.2	-38.7	176.5	77	0	0	0	0	112.5	Q236 A237 S238 Q243 A244	Q236-S240 WeakPolarHBondContact O-CB 3.36Å; Q236-S240 PolarHBondContact O-N 3.45Å; Q236-S240 PolarHBondContact O-OG 2.73Å; A237-S240 PolarHBondContact O-N 2.86Å; A237-S240 PolarHBondContact O-OG 2.94Å; S238-S240 VanDerWaalsContact C-N 3.34Å; S238-S240 PolarHBondContact O-N 3.11Å; S240-Q243 PolarHBondContact O-N 3.1Å; S240-A244 WeakPolarHBondContact O-CB 3.33Å; S240-A244 PolarHBondContact O-N 3.23Å
241	L	87.5	Confident	83.1	Confident	109 Å²	109	99.7 Å²	99.7	57%	0.571	55%	0.55	S	S	*	.	H	α-helix	trans	-65.1	-45.6	174.2	-75.2	170.2	0	0	0	110.7	A237 S238 Q243 A244 E245	A237-L241 WeakPolarHBondContact O-CG 3.29Å; A237-L241 PolarHBondContact O-N 2.95Å; S238-L241 PolarHBondContact O-N 3.27Å; L241-Q243 VanDerWaalsContact C-N 3.33Å; L241-Q243 PolarHBondContact O-N 3.26Å; L241-A244 PolarHBondContact O-N 3.18Å; L241-E245 WeakPolarHBondContact O-CB 3.34Å; L241-E245 WeakPolarHBondContact O-CG 3.3Å; L241-E245 PolarHBondContact O-N 3.22Å
242	A	86	Confident	81.5	Confident	51 Å²	51	94.8 Å²	94.8	42%	0.421	55%	0.545	S	S	.	.	H	α-helix	trans	-61.1	-40.9	177	0	0	0	0	0	112.2	S238 D239 E245 Q246	S238-A242 WeakPolarHBondContact O-CB 3.37Å; S238-A242 PolarHBondContact O-N 2.95Å; D239-A242 PolarHBondContact O-N 3.21Å; A242-E245 PolarHBondContact O-N 3.46Å; A242-Q246 WeakPolarHBondContact O-CB 3.37Å; A242-Q246 PolarHBondContact O-N 3.18Å
243	Q	86.7	Confident	79.7	Confident	134 Å²	134	97.3 Å²	97.3	63%	0.626	57%	0.566	S	S	*	*	H	α-helix	trans	-65.1	-41.5	174.7	-73.8	176.1	16.8	0	0	112.2	D239 S240 L241 Q246 A247	D239-Q243 VanDerWaalsContact O-CG 3.31Å; D239-Q243 WeakPolarHBondContact O-CG 3.33Å; D239-Q243 PolarHBondContact O-N 2.98Å; S240-Q243 PolarHBondContact O-N 3.1Å; L241-Q243 VanDerWaalsContact C-N 3.33Å; L241-Q243 PolarHBondContact O-N 3.26Å; Q243-Q246 PolarHBondContact O-N 3.21Å; Q243-A247 WeakPolarHBondContact O-CB 3.35Å; Q243-A247 PolarHBondContact O-N 3.37Å
244	A	82.8	Confident	78	Confident	48 Å²	48	99.8 Å²	99.8	40%	0.397	59%	0.585	S	S	.	*	H	α-helix	trans	-64.4	-42.2	176.3	0	0	0	0	0	111.8	S240 L241 A247 L248	S240-A244 WeakPolarHBondContact O-CB 3.33Å; S240-A244 PolarHBondContact O-N 3.23Å; L241-A244 PolarHBondContact O-N 3.18Å; A244-A247 PolarHBondContact O-N 3.2Å; A244-L248 WeakPolarHBondContact O-CB 3.44Å; A244-L248 WeakPolarHBondContact O-CD1 3.34Å; A244-L248 VanDerWaalsContact O-CG 3.29Å; A244-L248 WeakPolarHBondContact O-CG 3.29Å; A244-L248 PolarHBondContact O-N 3.11Å
245	E	82.1	Confident	76	Confident	135 Å²	135	98.1 Å²	98.1	63%	0.631	59%	0.588	S	S	*	*	H	α-helix	trans	-62.9	-40.9	174.3	-74.8	-178.9	170.5	0	0	111.9	L241 A242 L248 S249	L241-E245 WeakPolarHBondContact O-CB 3.34Å; L241-E245 WeakPolarHBondContact O-CG 3.3Å; L241-E245 PolarHBondContact O-N 3.22Å; A242-E245 PolarHBondContact O-N 3.46Å; E245-L248 PolarHBondContact O-N 3.08Å; E245-S249 VanDerWaalsContact O-CB 3.32Å; E245-S249 WeakPolarHBondContact O-CB 3.22Å; E245-S249 PolarHBondContact O-N 2.65Å
246	Q	80	Confident	73.7	Confident	141 Å²	141	95 Å²	95	66%	0.659	59%	0.593	S	S	*	*	H	α-helix	trans	-67.8	-38.7	176.8	-165.4	175.9	7	0	0	112.1	A242 Q243 S249 S250	A242-Q246 WeakPolarHBondContact O-CB 3.37Å; A242-Q246 PolarHBondContact O-N 3.18Å; Q243-Q246 PolarHBondContact O-N 3.21Å; Q246-S249 PolarHBondContact O-N 3.35Å; Q246-S250 WeakPolarHBondContact O-CB 3.2Å; Q246-S250 PolarHBondContact O-N 3.32Å; Q246-S250 PolarHBondContact O-OG 3.12Å
247	A	77.8	Confident	71.5	Confident	57 Å²	57	97.9 Å²	97.9	47%	0.471	60%	0.604	S	S	.	*	H	α-helix	trans	-63.1	-44.3	173.3	0	0	0	0	0	111.4	Q243 A244 S249 S250 A251	Q243-A247 WeakPolarHBondContact O-CB 3.35Å; Q243-A247 PolarHBondContact O-N 3.37Å; A244-A247 PolarHBondContact O-N 3.2Å; A247-S249 VanDerWaalsContact C-N 3.34Å; A247-S249 PolarHBondContact O-N 2.64Å; A247-S250 PolarHBondContact O-N 2.95Å; A247-S250 PolarHBondContact O-OG 3.4Å; A247-A251 PolarHBondContact O-N 3.11Å
248	L	70.3	Confident	69.2	Low	133 Å²	133	100.8 Å²	100.8	70%	0.696	62%	0.616	S	S	*	*	H	α-helix	trans	-64.4	-34.9	174.7	-73.8	164.1	0	0	0	112.6	A244 E245	A244-L248 WeakPolarHBondContact O-CB 3.44Å; A244-L248 WeakPolarHBondContact O-CD1 3.34Å; A244-L248 VanDerWaalsContact O-CG 3.29Å; A244-L248 WeakPolarHBondContact O-CG 3.29Å; A244-L248 PolarHBondContact O-N 3.11Å; E245-L248 PolarHBondContact O-N 3.08Å
249	S	67.4	Low	66.8	Low	97 Å²	97	110.5 Å²	110.5	68%	0.678	65%	0.651	S	S	*	*	H	α-helix	trans	-74.9	-32.7	176.6	-173.2	0	0	0	0	112.9	E245 Q246 A247 A251	E245-S249 VanDerWaalsContact O-CB 3.32Å; E245-S249 WeakPolarHBondContact O-CB 3.22Å; E245-S249 PolarHBondContact O-N 2.65Å; Q246-S249 PolarHBondContact O-N 3.35Å; A247-S249 VanDerWaalsContact C-N 3.34Å; A247-S249 PolarHBondContact O-N 2.64Å; S249-A251 VanDerWaalsContact C-N 3.33Å
250	S	60.8	Low	65.5	Low	100 Å²	100	111.6 Å²	111.6	70%	0.699	66%	0.659	S	S	*	*	H	α-helix	trans	-74.4	-22.8	173.7	73.3	0	0	0	0	113.4	Q246 A247 G252	Q246-S250 WeakPolarHBondContact O-CB 3.2Å; Q246-S250 PolarHBondContact O-N 3.32Å; Q246-S250 PolarHBondContact O-OG 3.12Å; A247-S250 PolarHBondContact O-N 2.95Å; A247-S250 PolarHBondContact O-OG 3.4Å; S250-G252 PolarHBondContact O-N 3.08Å
251	A	59.7	Low	64.2	Low	73 Å²	73	114 Å²	114	60%	0.603	67%	0.67	S	S	*	*	S	Bend	trans	-78.1	63.9	163.7	0	0	0	0	0	109.8	A247 S249	A247-A251 PolarHBondContact O-N 3.11Å; S249-A251 VanDerWaalsContact C-N 3.33Å
252	G	53.2	Low	63	Low	44 Å²	44	114.3 Å²	114.3	45%	0.454	68%	0.675	S	S	.	*			trans	-57.4	160.4	169.4	0	0	0	0	0	111.5	S250 T254	S250-G252 PolarHBondContact O-N 3.08Å; G252-T254 PolarHBondContact O-N 3.31Å
253	P	53.6	Low	61.6	Low	127 Å²	127	118 Å²	118	83%	0.825	69%	0.69	S	S	*	*			trans	-57.4	118.4	-174.4	25.1	-32.8	0	0	0	109.6	S255	P253-S255 PolarHBondContact O-N 3.3Å
254	T	55.4	Low	60	Low	151 Å²	151	117 Å²	117	93%	0.926	69%	0.694	S	S	*	*			trans	-60.7	90.9	159.7	49	0	0	0	0	107.2	G252	G252-T254 PolarHBondContact O-N 3.31Å
255	S	48.6	Very low	58.5	Low	93 Å²	93	121.6 Å²	121.6	65%	0.65	71%	0.714	S	S	*	*			trans	-118.4	94	169.9	-172	0	0	0	0	109.2	P253	P253-S255 PolarHBondContact O-N 3.3Å
256	S	43	Very low	56.8	Low	110 Å²	110	120.6 Å²	120.6	77%	0.769	72%	0.72	S	S	*	*			trans	-169.8	110.2	130.1	51.9	0	0	0	0	107.7
257	F	45.3	Very low	55.1	Low	186 Å²	186	119.1 Å²	119.1	82%	0.816	73%	0.725	S	S	*	*				61.1	117.6	78.5	-95.7	-90.2	0	0	0	114.7
258	V	40.3	Very low	53.2	Low	107 Å²	107	124.3 Å²	124.3	65%	0.648	75%	0.746	S	S	*	*			trans	63.1	132.5	150	-128.2	0	0	0	0	116.7
259	F	40.4	Very low	51.6	Low	270 Å²	270	123.5 Å²	123.5	100%	1.184	75%	0.75	S	S	*	*			cis	-141.3	0	28.8	-98.1	-92.2	0	0	0	111

Retrieved 259 of 259 residues in 41.4 ms (Link to these results)

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