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Orphans transcription factor

Functions as a response regulator involved in His-to-Asp phosphorelay signal transduction system. Phosphorylation of the Asp residue in the receiver domain activates the ability of the protein to promote the transcription of target genes. Type-A response regulators seem to act as negative regulators of the cytokinin signaling.

AlphaFold DB (K7U7V4), UniProt , Accession A0A060D2U6, Species MAIZE (Zea mays, Maize), Gene Orphan259, Length 159 aa.

						>A0A060D2U6_MAIZE|A0A060D2U6|Orphan259
MAAAATATPSVAPEAGDRKAVAPPVDAVDLDLELELEEKHVLAVDDSSVDRAVIAKILRSSKYRVTTVDSATRALELLALGLVPDVNMIITDYWMPGMTGYELLKHVKESSALRAIPVVIMSSENVPTRISRCLEEGAEDFLLKPVRPADVSRLCSRIR
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	48.5	Very low	51.8	Low	248 Å²	248	127.3 Å²	127.3	100%	1.222	86%	0.86	S	S	*	*				0	119.2	0	-96.8	-173.8	160.7	0	0	107.3
2	A	48.3	Very low	52.1	Low	115 Å²	115	123.8 Å²	123.8	95%	0.95	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-77.3	133.8	-162.6	0	0	0	0	0	112.8
3	A	57.5	Low	51.8	Low	103 Å²	103	124.2 Å²	124.2	85%	0.851	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-102.6	156.8	179.8	0	0	0	0	0	111.4
4	A	47.5	Very low	51.8	Low	96 Å²	96	129 Å²	129	79%	0.793	85%	0.85	S	S	*	*	P	Polyproline II helix	trans	-84.8	157.4	-175.1	0	0	0	0	0	114.5
5	A	47.6	Very low	51.9	Low	84 Å²	84	127 Å²	127	69%	0.694	85%	0.848	S	S	*	*			trans	52	128.2	145.4	0	0	0	0	0	120.9
6	T	50.9	Low	51.4	Low	141 Å²	141	124.2 Å²	124.2	87%	0.865	85%	0.848	S	S	*	*				169.5	136.1	102.4	34.8	0	0	0	0	114
7	A	51.2	Low	51.5	Low	89 Å²	89	124.1 Å²	124.1	74%	0.736	84%	0.836	S	S	*	*			trans	21.9	135.8	149.5	0	0	0	0	0	123.6
8	T	60.1	Low	51.6	Low	140 Å²	140	129.4 Å²	129.4	86%	0.859	84%	0.836	S	S	*	*				-176.3	147.9	108.2	24.9	0	0	0	0	112
9	P	46.2	Very low	51.3	Low	125 Å²	125	133 Å²	133	81%	0.812	84%	0.837	S	S	*	*			trans	-102.3	160.6	-178.9	38.4	-30.6	0	0	0	113.2
10	S	61.4	Low	51.2	Low	116 Å²	116	131.1 Å²	131.1	81%	0.811	83%	0.834	S	S	*	*			trans	-157.5	107.2	162.8	-167	0	0	0	0	113.4
11	V	50.5	Low	50.9	Low	143 Å²	143	130.8 Å²	130.8	87%	0.867	83%	0.831	S	S	*	*			trans	37.1	127.9	137.1	-168	0	0	0	0	121.5
12	A	55.6	Low	51.1	Low	85 Å²	85	123.4 Å²	123.4	70%	0.702	81%	0.809	S	S	*	*			trans	-83.3	176.6	171.8	0	0	0	0	0	113.7
13	P	48.7	Very low	51.5	Low	129 Å²	129	123.1 Å²	123.1	84%	0.838	80%	0.797	S	S	*	*				-148.7	179.1	96	36.1	-15.9	0	0	0	116.8
14	E	51.6	Low	51.4	Low	192 Å²	192	124.1 Å²	124.1	90%	0.897	80%	0.795	S	S	*	*			trans	-67.5	158.3	-167.2	-61.9	169.1	96.3	0	0	118
15	A	52.7	Low	51.8	Low	99 Å²	99	126.2 Å²	126.2	82%	0.818	80%	0.798	S	S	*	*				163.2	121.8	106.3	0	0	0	0	0	114.1
16	G	44.8	Very low	51.9	Low	82 Å²	82	129.5 Å²	129.5	85%	0.845	80%	0.804	S	S	*	*			trans	51.7	153.2	143	0	0	0	0	0	121.6
17	D	52.5	Low	52	Low	123 Å²	123	127.4 Å²	127.4	66%	0.658	80%	0.8	S	S	*	*			cis	-166.9	152.7	4.4	-161.3	4.9	0	0	0	108.2
18	R	52.9	Low	52.1	Low	219 Å²	219	128.5 Å²	128.5	83%	0.826	80%	0.798	S	S	*	*			trans	67.2	107.8	160	-41.8	-167.1	-175.8	176.4	2.6	121.3
19	K	46.4	Very low	51.5	Low	198 Å²	198	129.2 Å²	129.2	86%	0.861	80%	0.796	S	S	*	*			trans	-96.6	115.2	157.8	-167.3	179.1	-175.9	-177.4	0	109.3
20	A	48.5	Very low	51.7	Low	94 Å²	94	129.5 Å²	129.5	78%	0.777	79%	0.79	S	S	*	*			trans	-94.6	125.7	167.2	0	0	0	0	0	109.3
21	V	46.5	Very low	51.1	Low	126 Å²	126	131.1 Å²	131.1	76%	0.764	79%	0.79	S	S	*	*			trans	-149.1	114.4	158.1	174.1	0	0	0	0	107.9
22	A	51.2	Low	51.1	Low	92 Å²	92	130.8 Å²	130.8	76%	0.76	78%	0.783	S	S	*	*			trans	-120.5	136.2	152.2	0	0	0	0	0	107
23	P	57.3	Low	50.7	Low	109 Å²	109	135.1 Å²	135.1	71%	0.708	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-73.8	157.3	178.7	31.1	-32.8	0	0	0	111.3
24	P	54.7	Low	50.9	Low	124 Å²	124	135.2 Å²	135.2	81%	0.805	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-74	137.8	-179.4	32.3	-32.1	0	0	0	110.1
25	V	56.3	Low	51	Low	141 Å²	141	134.5 Å²	134.5	86%	0.855	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-83.1	133.3	173.5	-72.1	0	0	0	0	109.8
26	D	49.9	Very low	51.3	Low	153 Å²	153	137.6 Å²	137.6	82%	0.818	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-56.7	130.9	179.8	-64.2	-56.8	0	0	0	112	V28	D26-V28 PolarHBondContact O-N 3.2Å
27	A	52.8	Low	52.6	Low	96 Å²	96	141.6 Å²	141.6	79%	0.793	78%	0.777	S	S	*	*			trans	-71.3	106.3	169.6	0	0	0	0	0	108.7
28	V	52.8	Low	54.2	Low	113 Å²	113	141.8 Å²	141.8	69%	0.685	77%	0.774	S	S	*	*			trans	-84.7	113.5	161.9	-75.1	0	0	0	0	107.5	D26 L30	D26-V28 PolarHBondContact O-N 3.2Å; V28-L30 VanDerWaalsContact C-N 3.31Å; V28-L30 HydrophobicContact CB-CD1 4.17Å; V28-L30 HydrophobicContact CG2-CD1 3.66Å; V28-L30 PolarHBondContact O-N 2.92Å
29	D	47.9	Very low	56	Low	154 Å²	154	134.3 Å²	134.3	82%	0.824	75%	0.747	S	S	*	*			trans	-61.7	94.7	166.1	-71.2	-51.3	0	0	0	107.8	D31	D29-D31 PolarHBondContact O-N 3.31Å
30	L	50	Low	58.4	Low	131 Å²	131	125 Å²	125	69%	0.686	71%	0.706	S	S	*	*			trans	-78.7	103	165.1	-99.4	79.1	0	0	0	106.6	V28 L32	V28-L30 VanDerWaalsContact C-N 3.31Å; V28-L30 HydrophobicContact CB-CD1 4.17Å; V28-L30 HydrophobicContact CG2-CD1 3.66Å; V28-L30 PolarHBondContact O-N 2.92Å; L30-L32 VanDerWaalsContact C-N 3.27Å; L30-L32 PolarHBondContact O-N 2.85Å
31	D	49.8	Very low	60.7	Low	150 Å²	150	120.5 Å²	120.5	80%	0.802	67%	0.669	S	S	*	*			trans	-52.5	97	157.8	-69.9	-47.9	0	0	0	107.8	D29 E33	D29-D31 PolarHBondContact O-N 3.31Å; D31-E33 PolarHBondContact O-N 2.83Å
32	L	50.8	Low	63.1	Low	137 Å²	137	114.5 Å²	114.5	72%	0.717	63%	0.633	S	S	*	*			trans	-69.4	80.9	166.7	-85.3	107.8	0	0	0	107.4	L30 L34	L30-L32 VanDerWaalsContact C-N 3.27Å; L30-L32 PolarHBondContact O-N 2.85Å; L32-L34 HydrophobicContact CB-CG 4.39Å; L32-L34 HydrophobicContact CD2-CD2 3.72Å; L32-L34 HydrophobicContact CD2-CG 4.38Å; L32-L34 PolarHBondContact O-N 2.86Å
33	E	46.3	Very low	65.4	Low	176 Å²	176	110.1 Å²	110.1	82%	0.822	60%	0.597	S	S	*	*			trans	-61.3	86.6	144.1	-73.9	169	143.5	0	0	105.4	D31 E35	D31-E33 PolarHBondContact O-N 2.83Å; E33-E35 PolarHBondContact O-N 2.75Å
34	L	53.7	Low	67.3	Low	130 Å²	130	104.9 Å²	104.9	68%	0.681	56%	0.563	S	S	*	*			trans	-58.5	91.4	162.7	-68.7	171.2	0	0	0	105.2	L32 L36	L32-L34 HydrophobicContact CB-CG 4.39Å; L32-L34 HydrophobicContact CD2-CD2 3.72Å; L32-L34 HydrophobicContact CD2-CG 4.38Å; L32-L34 PolarHBondContact O-N 2.86Å; L34-L36 VanDerWaalsContact C-N 3.25Å; L34-L36 PolarHBondContact O-N 2.81Å
35	E	53.1	Low	69.4	Low	178 Å²	178	99 Å²	99	83%	0.832	53%	0.525	S	S	*	.			trans	-51.1	103.2	160.1	-71	-168.2	149.2	0	0	104.5	E33 E37	E33-E35 PolarHBondContact O-N 2.75Å; E35-E37 PolarHBondContact O-N 2.73Å
36	L	59.7	Low	71.4	Confident	164 Å²	164	95.6 Å²	95.6	86%	0.859	50%	0.501	S	S	*	.			trans	-61.5	96.3	177.2	-74.9	168	0	0	0	105.7	L34 E38	L34-L36 VanDerWaalsContact C-N 3.25Å; L34-L36 PolarHBondContact O-N 2.81Å; L36-E38 PolarHBondContact O-N 3.12Å; L36-E38 VanDerWaalsContact O-N 3.12Å
37	E	71.4	Confident	73.7	Confident	166 Å²	166	90.1 Å²	90.1	78%	0.776	48%	0.475	S	S	*	.			trans	-51.3	123.5	-178.7	-77.8	-178.9	169.7	0	0	108.3	E35 K39	E35-E37 PolarHBondContact O-N 2.73Å; E37-K39 PolarHBondContact O-N 2.73Å
38	E	85.7	Confident	75.8	Confident	127 Å²	127	89.3 Å²	89.3	59%	0.593	46%	0.464	S	S	*	.			trans	-57.7	111.3	178.8	-71.1	-169.9	162.9	0	0	108.8	L36 H40 R64	L36-E38 PolarHBondContact O-N 3.12Å; L36-E38 VanDerWaalsContact O-N 3.12Å; E38-H40 PolarHBondContact O-N 2.95Å; E38-R64 HydrophobicContact CB-CB 4.33Å
39	K	92.2	Very high	78	Confident	62 Å²	62	88.6 Å²	88.6	27%	0.27	46%	0.459	S	S	.	.			trans	-58.8	132.4	-178.9	-63.9	-63.5	-172.8	174.9	0	109.9	E37 Y63 R64 N87 I158 R159	E37-K39 PolarHBondContact O-N 2.73Å; K39-Y63 HydrophobicContact CB-CD1 3.76Å; K39-Y63 HydrophobicContact CB-CE1 3.89Å; K39-Y63 WeakPolarHBondContact O-CA 3.45Å; K39-Y63 WeakPolarHBondContact O-CD1 3.12Å; K39-R64 PolarHBondContact O-N 2.73Å; K39-N87 WeakPolarHBondContact CA-OD1 3.33Å; K39-N87 HydrophobicContact CB-CB 4.45Å; K39-N87 HydrophobicContact CD-CB 4.24Å; K39-I158 HydrophobicContact CB-CG2 3.85Å; K39-I158 HydrophobicContact CD-CG2 3.74Å; K39-I158 HydrophobicContact CG-CG2 3.67Å; K39-R159 PolarHBondContact NZ-O 3.33Å; K39-R159 PolarHBondContact NZ-OXT 3.15Å
40	H	95.5	Very high	80.3	Confident	1 Å²	1	83.8 Å²	83.8	1%	0.005	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	124.8	-176.2	-172.7	-167.3	0	0	0	111.5	E38 R64 T66 V83 P84 D85 N87 M88	E38-H40 PolarHBondContact O-N 2.95Å; H40-R64 CarbonylContact C-O 3.37Å; H40-R64 WeakPolarHBondContact CA-O 3.3Å; H40-R64 HydrophobicContact CB-CB 4.47Å; H40-R64 PolarHBondContact CD2-O 3.15Å; H40-R64 VanDerWaalsContact ND1-CZ 3.28Å; H40-R64 PolarHBondContact ND1-NH2 3.24Å; H40-T66 PolarHBondContact CE1-OG1 2.94Å; H40-T66 WeakPolarHBondContact NE2-CB 3.12Å; H40-T66 PolarHBondContact NE2-OG1 3.15Å; H40-V83 WeakPolarHBondContact CE1-CG1 3.44Å; H40-P84 PolarHBondContact ND1-O 3.4Å; H40-D85 VanDerWaalsContact CB-O 3.3Å; H40-D85 WeakPolarHBondContact CB-O 3.46Å; H40-N87 PolarHBondContact N-OD1 3.26Å; H40-N87 PolarHBondContact O-N 2.99Å; H40-M88 PolarHBondContact O-N 2.97Å
41	V	96.6	Very high	82.6	Confident	0 Å²	0	79.9 Å²	79.9	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	129.1	175.3	-175.9	0	0	0	0	110.2	L58 Y63 R64 V65 T66 M88 I90 I158	V41-L58 HydrophobicContact CB-CD1 4.21Å; V41-L58 HydrophobicContact CG1-CD1 3.74Å; V41-L58 HydrophobicContact CG1-CD2 4.27Å; V41-L58 HydrophobicContact CG2-CD2 4.3Å; V41-Y63 HydrophobicContact CG2-CD1 3.77Å; V41-Y63 HydrophobicContact CG2-CD2 4.5Å; V41-Y63 HydrophobicContact CG2-CE1 4.46Å; V41-Y63 HydrophobicContact CG2-CG 3.81Å; V41-R64 PolarHBondContact N-O 2.91Å; V41-V65 WeakPolarHBondContact O-CA 3.46Å; V41-T66 PolarHBondContact O-N 3.36Å; V41-T66 VanDerWaalsContact O-N 3.07Å; V41-M88 WeakPolarHBondContact CA-O 3.44Å; V41-M88 HydrophobicContact CG1-CB 4.5Å; V41-M88 HydrophobicContact CG2-CB 4.3Å; V41-I90 HydrophobicContact CG1-CB 4.39Å; V41-I90 HydrophobicContact CG1-CG2 3.68Å; V41-I158 HydrophobicContact CG2-CD1 4.49Å
42	L	98.2	Very high	84.8	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	108.7	168.8	-175.8	63.5	0	0	0	109	V44 T66 V68 A74 L78 V83 V86 M88 I89 I90	L42-V44 HydrophobicContact CD2-CG2 4.36Å; L42-V44 HydrophobicContact CG-CG2 4.02Å; L42-T66 WeakPolarHBondContact CA-O 3.45Å; L42-T66 HydrophobicContact CD1-CG2 3.88Å; L42-V68 HydrophobicContact CD1-CG2 3.58Å; L42-A74 HydrophobicContact CD2-CB 4.12Å; L42-L78 HydrophobicContact CD2-CD1 4.02Å; L42-L78 HydrophobicContact CD2-CD2 4.14Å; L42-L78 HydrophobicContact CD2-CG 4.02Å; L42-V83 HydrophobicContact CD1-CG1 4.41Å; L42-V86 HydrophobicContact CB-CG1 3.86Å; L42-V86 HydrophobicContact CB-CG2 4.35Å; L42-M88 PolarHBondContact N-O 3Å; L42-I89 HydrophobicContact CB-CG1 4.25Å; L42-I89 HydrophobicContact CD2-CG1 4.31Å; L42-I89 WeakPolarHBondContact O-CA 3.47Å; L42-I90 PolarHBondContact O-N 3.44Å
43	A	98.2	Very high	87	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	117.8	178.8	0	0	0	0	0	111	I54 L58 V65 T66 T67 V68 I90	A43-I54 HydrophobicContact CB-CG2 4.11Å; A43-L58 HydrophobicContact CB-CD1 4.33Å; A43-V65 HydrophobicContact CB-CG1 4.03Å; A43-T66 PolarHBondContact N-O 3.02Å; A43-T67 HydrophobicContact CB-CG2 4.35Å; A43-T67 CarbonylContact O-C 3.58Å; A43-T67 VanDerWaalsContact O-CA 3.3Å; A43-T67 WeakPolarHBondContact O-CA 3.36Å; A43-V68 PolarHBondContact O-N 2.63Å; A43-I90 CarbonylContact C-O 3.58Å; A43-I90 WeakPolarHBondContact CA-O 3.38Å; A43-I90 HydrophobicContact CB-CG2 3.85Å
44	V	98.7	Very high	89.4	Confident	0 Å²	0	64 Å²	64	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	117.5	-173.9	-166.3	0	0	0	0	109.8	L42 V68 S70 A74 I89 I90 T91 D92 M95 L103	L42-V44 HydrophobicContact CD2-CG2 4.36Å; L42-V44 HydrophobicContact CG-CG2 4.02Å; V44-V68 WeakPolarHBondContact CA-O 3.43Å; V44-S70 VanDerWaalsContact CG1-C 3.49Å; V44-S70 WeakPolarHBondContact CG1-O 3.29Å; V44-A74 HydrophobicContact CG1-CB 4.08Å; V44-A74 HydrophobicContact CG2-CB 3.68Å; V44-I89 HydrophobicContact CG2-CG2 4.29Å; V44-I90 PolarHBondContact N-O 3.43Å; V44-T91 CarbonylContact O-C 3.39Å; V44-T91 WeakPolarHBondContact O-CA 3.49Å; V44-D92 PolarHBondContact O-N 3.38Å; V44-M95 HydrophobicContact CG1-CE 3.93Å; V44-M95 HydrophobicContact CG1-SD 3.74Å; V44-L103 HydrophobicContact CB-CD2 4.49Å; V44-L103 HydrophobicContact CG1-CD2 4.42Å; V44-L103 HydrophobicContact CG2-CD2 4.3Å
45	D	98.4	Very high	91.5	Very high	1 Å²	1	57.9 Å²	57.9	1%	0.005	31%	0.31	C	S	.	.			trans	-161.8	133.4	-178.5	-165.6	-53.6	0	0	0	108	S47 D50 R51 V68 D69 D92 K144	D45-S47 VanDerWaalsContact OD1-CB 3.3Å; D45-S47 WeakPolarHBondContact OD1-CB 3.38Å; D45-S47 PolarHBondContact OD1-N 3.32Å; D45-D50 VanDerWaalsContact OD2-CB 3.28Å; D45-D50 WeakPolarHBondContact OD2-CB 3.19Å; D45-R51 HydrophobicContact CB-CB 4.04Å; D45-R51 HydrophobicContact CB-CG 4.48Å; D45-R51 WeakPolarHBondContact O-CD 3.38Å; D45-R51 PolarHBondContact O-NH1 2.95Å; D45-V68 PolarHBondContact N-O 3.01Å; D45-V68 VanDerWaalsContact N-O 3.13Å; D45-D69 WeakPolarHBondContact O-CA 3.32Å; D45-D92 HydrophobicContact CB-CB 4.3Å; D45-K144 IonicContact OD1-NZ 2.78Å; D45-K144 WeakPolarHBondContact OD2-CE 3.41Å; D45-K144 IonicContact OD2-NZ 2.83Å; D45-K144 PolarHBondContact OD2-NZ 3.12Å
46	D	98.2	Very high	93.6	Very high	68 Å²	68	57.1 Å²	57.1	36%	0.364	30%	0.304	S	S	.	.	S	Bend	trans	-75.4	-31.1	-179.3	69.6	-49.2	0	0	0	111.9	S48 R51 D69 M95 P96	D46-S48 PolarHBondContact O-N 3.15Å; D46-R51 PolarHBondContact O-NH1 2.83Å; D46-D69 VanDerWaalsContact CA-O 3.28Å; D46-D69 WeakPolarHBondContact CA-O 3.4Å; D46-M95 HydrophobicContact CB-CB 4.43Å; D46-M95 HydrophobicContact CB-CG 4.15Å; D46-P96 VanDerWaalsContact OD2-CD 3.26Å; D46-P96 WeakPolarHBondContact OD2-CD 3.48Å
47	S	98	Very high	95.3	Very high	38 Å²	38	50 Å²	50	27%	0.266	27%	0.267	S	S	.	.			trans	-70.5	115	175	174	0	0	0	0	110.8	D45 V49 D50 R51	D45-S47 VanDerWaalsContact OD1-CB 3.3Å; D45-S47 WeakPolarHBondContact OD1-CB 3.38Å; D45-S47 PolarHBondContact OD1-N 3.32Å; S47-V49 PolarHBondContact O-N 2.99Å; S47-D50 PolarHBondContact O-N 3.42Å; S47-D50 PolarHBondContact OG-N 3.17Å; S47-R51 WeakPolarHBondContact O-CB 3.38Å; S47-R51 PolarHBondContact O-N 2.98Å
48	S	97.5	Very high	96.5	Very high	80 Å²	80	42.2 Å²	42.2	56%	0.559	23%	0.23	S	C	*	.	H	α-helix	trans	-60	-30	177.1	59.9	0	0	0	0	113	D46 A52	D46-S48 PolarHBondContact O-N 3.15Å; S48-A52 VanDerWaalsContact O-CB 3.29Å; S48-A52 WeakPolarHBondContact O-CB 3.3Å; S48-A52 PolarHBondContact O-N 3.15Å; S48-A52 VanDerWaalsContact O-N 3.09Å
49	V	97.2	Very high	96.9	Very high	97 Å²	97	42.4 Å²	42.4	59%	0.588	23%	0.226	S	C	*	.	H	α-helix	trans	-71	-52.2	177.3	177.8	0	0	0	0	110.4	S47 R51 A52 V53	S47-V49 PolarHBondContact O-N 2.99Å; V49-R51 VanDerWaalsContact C-N 3.34Å; V49-R51 PolarHBondContact O-N 3.4Å; V49-A52 PolarHBondContact O-N 3.07Å; V49-V53 WeakPolarHBondContact O-CG2 3.47Å; V49-V53 PolarHBondContact O-N 3.45Å
50	D	96.8	Very high	97	Very high	53 Å²	53	43.2 Å²	43.2	28%	0.283	24%	0.239	S	C	.	.	H	α-helix	trans	-65.1	-41.5	-178.9	-69.1	-14.1	0	0	0	110.7	D45 S47 A52 V53 I54 K144	D45-D50 VanDerWaalsContact OD2-CB 3.28Å; D45-D50 WeakPolarHBondContact OD2-CB 3.19Å; S47-D50 PolarHBondContact O-N 3.42Å; S47-D50 PolarHBondContact OG-N 3.17Å; D50-A52 VanDerWaalsContact C-N 3.3Å; D50-A52 PolarHBondContact O-N 3.36Å; D50-V53 PolarHBondContact O-N 3.07Å; D50-V53 VanDerWaalsContact O-N 3.15Å; D50-I54 WeakPolarHBondContact O-CG2 3.21Å; D50-I54 PolarHBondContact O-N 3.32Å; D50-K144 IonicContact OD2-NZ 3.71Å; D50-K144 PolarHBondContact OD2-NZ 3.05Å
51	R	97.9	Very high	96.8	Very high	49 Å²	49	45 Å²	45	19%	0.185	25%	0.252	C	S	.	.	H	α-helix	trans	-56.1	-42.7	173	-165.7	163.3	64.5	-112	6.6	112.2	D45 D46 S47 V49 I54 A55 T67 V68	D45-R51 HydrophobicContact CB-CB 4.04Å; D45-R51 HydrophobicContact CB-CG 4.48Å; D45-R51 WeakPolarHBondContact O-CD 3.38Å; D45-R51 PolarHBondContact O-NH1 2.95Å; D46-R51 PolarHBondContact O-NH1 2.83Å; S47-R51 WeakPolarHBondContact O-CB 3.38Å; S47-R51 PolarHBondContact O-N 2.98Å; V49-R51 VanDerWaalsContact C-N 3.34Å; V49-R51 PolarHBondContact O-N 3.4Å; R51-I54 WeakPolarHBondContact O-CG2 3.37Å; R51-A55 WeakPolarHBondContact O-CB 3.44Å; R51-A55 PolarHBondContact O-N 2.83Å; R51-A55 VanDerWaalsContact O-N 3.1Å; R51-T67 HydrophobicContact CG-CG2 4.07Å; R51-V68 WeakPolarHBondContact CD-O 3.36Å
52	A	97.6	Very high	96.5	Very high	61 Å²	61	52.8 Å²	52.8	50%	0.504	29%	0.286	S	S	.	.	H	α-helix	trans	-69.4	-40	176.9	0	0	0	0	0	112.4	S48 V49 D50 K56	S48-A52 VanDerWaalsContact O-CB 3.29Å; S48-A52 WeakPolarHBondContact O-CB 3.3Å; S48-A52 PolarHBondContact O-N 3.15Å; S48-A52 VanDerWaalsContact O-N 3.09Å; V49-A52 PolarHBondContact O-N 3.07Å; D50-A52 VanDerWaalsContact C-N 3.3Å; D50-A52 PolarHBondContact O-N 3.36Å; A52-K56 WeakPolarHBondContact O-CB 3.42Å; A52-K56 PolarHBondContact O-N 3.15Å
53	V	96.5	Very high	96.3	Very high	65 Å²	65	53.7 Å²	53.7	39%	0.394	29%	0.289	S	S	.	.	H	α-helix	trans	-62.4	-52.9	177.2	170	0	0	0	0	110.5	V49 D50 A55 K56 I57	V49-V53 WeakPolarHBondContact O-CG2 3.47Å; V49-V53 PolarHBondContact O-N 3.45Å; D50-V53 PolarHBondContact O-N 3.07Å; D50-V53 VanDerWaalsContact O-N 3.15Å; V53-A55 VanDerWaalsContact C-N 3.34Å; V53-A55 PolarHBondContact O-N 2.78Å; V53-K56 PolarHBondContact O-N 3.11Å; V53-I57 HydrophobicContact CG1-CD1 3.9Å; V53-I57 WeakPolarHBondContact O-CG1 3.24Å; V53-I57 PolarHBondContact O-N 2.85Å
54	I	97	Very high	96.2	Very high	4 Å²	4	58.2 Å²	58.2	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-64.5	-40.3	-178.4	-169	57.8	0	0	0	111.5	A43 D50 R51 K56 I57 L58 I90 M121 V146 V151	A43-I54 HydrophobicContact CB-CG2 4.11Å; D50-I54 WeakPolarHBondContact O-CG2 3.21Å; D50-I54 PolarHBondContact O-N 3.32Å; R51-I54 WeakPolarHBondContact O-CG2 3.37Å; I54-K56 VanDerWaalsContact C-N 3.32Å; I54-K56 PolarHBondContact O-N 3.28Å; I54-I57 PolarHBondContact O-N 2.74Å; I54-L58 HydrophobicContact CD1-CD1 4.44Å; I54-L58 HydrophobicContact CD1-CG 4.32Å; I54-L58 HydrophobicContact CG1-CD1 3.91Å; I54-L58 HydrophobicContact CG1-CG 4.29Å; I54-L58 WeakPolarHBondContact O-CB 3.25Å; I54-L58 WeakPolarHBondContact O-CG 3.3Å; I54-L58 PolarHBondContact O-N 2.98Å; I54-I90 HydrophobicContact CD1-CD1 3.87Å; I54-I90 HydrophobicContact CG1-CD1 4.04Å; I54-I90 HydrophobicContact CG1-CG2 4.34Å; I54-M121 HydrophobicContact CB-SD 4.32Å; I54-M121 HydrophobicContact CD1-SD 4.05Å; I54-M121 HydrophobicContact CG1-CE 4.43Å; I54-M121 HydrophobicContact CG1-SD 3.84Å; I54-M121 HydrophobicContact CG2-CE 4.46Å; I54-V146 HydrophobicContact CD1-CB 4.12Å; I54-V146 HydrophobicContact CD1-CG1 3.73Å; I54-V146 HydrophobicContact CD1-CG2 4.49Å; I54-V151 HydrophobicContact CD1-CG2 4.22Å
55	A	97.4	Very high	96.1	Very high	1 Å²	1	59 Å²	59	1%	0.008	31%	0.311	C	S	.	.	H	α-helix	trans	-63	-38.7	176.8	0	0	0	0	0	112.2	R51 V53 R59 V65 T67	R51-A55 WeakPolarHBondContact O-CB 3.44Å; R51-A55 PolarHBondContact O-N 2.83Å; R51-A55 VanDerWaalsContact O-N 3.1Å; V53-A55 VanDerWaalsContact C-N 3.34Å; V53-A55 PolarHBondContact O-N 2.78Å; A55-R59 VanDerWaalsContact O-CB 3.32Å; A55-R59 WeakPolarHBondContact O-CB 3.46Å; A55-R59 WeakPolarHBondContact O-CG 3.32Å; A55-R59 PolarHBondContact O-N 3.26Å; A55-V65 HydrophobicContact CB-CG1 4.12Å; A55-T67 HydrophobicContact CB-CG2 3.68Å
56	K	97.2	Very high	96.1	Very high	162 Å²	162	61 Å²	61	70%	0.704	32%	0.323	S	S	*	.	H	α-helix	trans	-64.1	-44.7	175	-177.3	177.6	179.7	178.3	0	111.5	A52 V53 I54 S60	A52-K56 WeakPolarHBondContact O-CB 3.42Å; A52-K56 PolarHBondContact O-N 3.15Å; V53-K56 PolarHBondContact O-N 3.11Å; I54-K56 VanDerWaalsContact C-N 3.32Å; I54-K56 PolarHBondContact O-N 3.28Å; K56-S60 WeakPolarHBondContact O-CB 3.46Å; K56-S60 PolarHBondContact O-N 3.24Å
57	I	95.8	Very high	96.1	Very high	16 Å²	16	60.5 Å²	60.5	8%	0.082	32%	0.323	C	S	.	.	H	α-helix	trans	-62.5	-51	178.8	-64.9	168.5	0	0	0	110.2	V53 I54 R59 S60 S61 V146 P148 V151	V53-I57 HydrophobicContact CG1-CD1 3.9Å; V53-I57 WeakPolarHBondContact O-CG1 3.24Å; V53-I57 PolarHBondContact O-N 2.85Å; I54-I57 PolarHBondContact O-N 2.74Å; I57-R59 PolarHBondContact O-N 3.37Å; I57-S60 PolarHBondContact O-N 2.95Å; I57-S60 VanDerWaalsContact O-N 3.15Å; I57-S60 PolarHBondContact O-OG 3.06Å; I57-S61 PolarHBondContact O-N 3.46Å; I57-S61 VanDerWaalsContact O-N 3.12Å; I57-S61 PolarHBondContact O-OG 3.13Å; I57-V146 WeakPolarHBondContact CD1-O 3.34Å; I57-P148 HydrophobicContact CG1-CG 4.38Å; I57-P148 HydrophobicContact CG2-CB 4.26Å; I57-P148 HydrophobicContact CG2-CG 4.24Å; I57-V151 HydrophobicContact CG2-CB 3.96Å; I57-V151 HydrophobicContact CG2-CG1 4.48Å; I57-V151 HydrophobicContact CG2-CG2 3.6Å
58	L	95.4	Very high	96.1	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-59.7	-45	179.3	-71.7	167.1	0	0	0	112.7	V41 A43 I54 S60 S61 K62 Y63 V65 I90 V151	V41-L58 HydrophobicContact CB-CD1 4.21Å; V41-L58 HydrophobicContact CG1-CD1 3.74Å; V41-L58 HydrophobicContact CG1-CD2 4.27Å; V41-L58 HydrophobicContact CG2-CD2 4.3Å; A43-L58 HydrophobicContact CB-CD1 4.33Å; I54-L58 HydrophobicContact CD1-CD1 4.44Å; I54-L58 HydrophobicContact CD1-CG 4.32Å; I54-L58 HydrophobicContact CG1-CD1 3.91Å; I54-L58 HydrophobicContact CG1-CG 4.29Å; I54-L58 WeakPolarHBondContact O-CB 3.25Å; I54-L58 WeakPolarHBondContact O-CG 3.3Å; I54-L58 PolarHBondContact O-N 2.98Å; L58-S60 VanDerWaalsContact C-N 3.3Å; L58-S60 PolarHBondContact O-N 3Å; L58-S61 CarbonylContact O-C 3.58Å; L58-S61 WeakPolarHBondContact O-CA 3.37Å; L58-S61 WeakPolarHBondContact O-CB 3.33Å; L58-S61 PolarHBondContact O-N 3.32Å; L58-K62 PolarHBondContact O-N 3.49Å; L58-Y63 HydrophobicContact CB-CD2 4.28Å; L58-Y63 HydrophobicContact CD2-CD2 3.77Å; L58-Y63 HydrophobicContact CD2-CE2 4.26Å; L58-Y63 HydrophobicContact CD2-CG 4.44Å; L58-Y63 WeakPolarHBondContact O-CD2 3.37Å; L58-Y63 PolarHBondContact O-N 3.38Å; L58-Y63 VanDerWaalsContact O-N 3.17Å; L58-V65 HydrophobicContact CB-CG2 3.47Å; L58-V65 VanDerWaalsContact CB-CG2 3.47Å; L58-V65 HydrophobicContact CD1-CG1 4.16Å; L58-V65 HydrophobicContact CD1-CG2 4.17Å; L58-V65 HydrophobicContact CG-CG2 4.48Å; L58-I90 HydrophobicContact CD1-CG2 4.01Å; L58-V151 HydrophobicContact CD2-CG1 3.86Å; L58-V151 HydrophobicContact CD2-CG2 4.2Å
59	R	95.2	Very high	96.1	Very high	131 Å²	131	59.3 Å²	59.3	49%	0.494	31%	0.308	S	S	.	.	H	α-helix	trans	-63	-36.7	176.3	-72.3	173.5	-173.1	136	4.3	112.1	A55 I57 S61 K62 V65	A55-R59 VanDerWaalsContact O-CB 3.32Å; A55-R59 WeakPolarHBondContact O-CB 3.46Å; A55-R59 WeakPolarHBondContact O-CG 3.32Å; A55-R59 PolarHBondContact O-N 3.26Å; I57-R59 PolarHBondContact O-N 3.37Å; R59-S61 PolarHBondContact O-N 3.34Å; R59-K62 PolarHBondContact O-N 3.28Å; R59-K62 VanDerWaalsContact O-N 3.07Å; R59-V65 HydrophobicContact CG-CB 4.18Å; R59-V65 HydrophobicContact CG-CG2 3.75Å; R59-V65 PolarHBondContact NH2-O 3.5Å
60	S	93.7	Very high	96.1	Very high	80 Å²	80	56.1 Å²	56.1	56%	0.559	29%	0.29	S	S	*	.	H	α-helix	trans	-64.5	-26.4	173.8	74.5	0	0	0	0	112.8	K56 I57 L58 K62	K56-S60 WeakPolarHBondContact O-CB 3.46Å; K56-S60 PolarHBondContact O-N 3.24Å; I57-S60 PolarHBondContact O-N 2.95Å; I57-S60 VanDerWaalsContact O-N 3.15Å; I57-S60 PolarHBondContact O-OG 3.06Å; L58-S60 VanDerWaalsContact C-N 3.3Å; L58-S60 PolarHBondContact O-N 3Å; S60-K62 VanDerWaalsContact C-N 3.31Å
61	S	91	Very high	96.2	Very high	39 Å²	39	53.7 Å²	53.7	27%	0.273	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	16.5	173	-61.1	0	0	0	0	114	I57 L58 R59 Y63	I57-S61 PolarHBondContact O-N 3.46Å; I57-S61 VanDerWaalsContact O-N 3.12Å; I57-S61 PolarHBondContact O-OG 3.13Å; L58-S61 CarbonylContact O-C 3.58Å; L58-S61 WeakPolarHBondContact O-CA 3.37Å; L58-S61 WeakPolarHBondContact O-CB 3.33Å; L58-S61 PolarHBondContact O-N 3.32Å; R59-S61 PolarHBondContact O-N 3.34Å; S61-Y63 VanDerWaalsContact C-N 3.3Å; S61-Y63 PolarHBondContact O-N 2.93Å
62	K	90.9	Very high	96.2	Very high	162 Å²	162	54.4 Å²	54.4	70%	0.704	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	24.3	175.8	-52.6	-62	-172.3	171.8	0	115.4	L58 R59 S60	L58-K62 PolarHBondContact O-N 3.49Å; R59-K62 PolarHBondContact O-N 3.28Å; R59-K62 VanDerWaalsContact O-N 3.07Å; S60-K62 VanDerWaalsContact C-N 3.31Å
63	Y	93.6	Very high	96.2	Very high	20 Å²	20	56.6 Å²	56.6	8%	0.078	28%	0.282	C	S	.	.			trans	-84.1	140.4	167.5	-64.2	-67.8	0	0	0	111.1	K39 V41 L58 S61 V151 C155 I158	K39-Y63 HydrophobicContact CB-CD1 3.76Å; K39-Y63 HydrophobicContact CB-CE1 3.89Å; K39-Y63 WeakPolarHBondContact O-CA 3.45Å; K39-Y63 WeakPolarHBondContact O-CD1 3.12Å; V41-Y63 HydrophobicContact CG2-CD1 3.77Å; V41-Y63 HydrophobicContact CG2-CD2 4.5Å; V41-Y63 HydrophobicContact CG2-CE1 4.46Å; V41-Y63 HydrophobicContact CG2-CG 3.81Å; L58-Y63 HydrophobicContact CB-CD2 4.28Å; L58-Y63 HydrophobicContact CD2-CD2 3.77Å; L58-Y63 HydrophobicContact CD2-CE2 4.26Å; L58-Y63 HydrophobicContact CD2-CG 4.44Å; L58-Y63 WeakPolarHBondContact O-CD2 3.37Å; L58-Y63 PolarHBondContact O-N 3.38Å; L58-Y63 VanDerWaalsContact O-N 3.17Å; S61-Y63 VanDerWaalsContact C-N 3.3Å; S61-Y63 PolarHBondContact O-N 2.93Å; Y63-V151 HydrophobicContact CD2-CG1 4.39Å; Y63-V151 HydrophobicContact CE2-CG1 3.88Å; Y63-C155 WeakPolarHBondContact OH-CA 3.19Å; Y63-C155 PolarHBondContact OH-SG 2.93Å; Y63-I158 HydrophobicContact CD1-CD1 4.17Å; Y63-I158 HydrophobicContact CE1-CD1 3.3Å; Y63-I158 WeakPolarHBondContact OH-CD1 3.44Å
64	R	95.3	Very high	96.3	Very high	95 Å²	95	53.5 Å²	53.5	36%	0.358	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	134.2	157.2	-178.2	173.1	69.2	127.9	-7.9	107.4	E38 K39 H40 V41 P84	E38-R64 HydrophobicContact CB-CB 4.33Å; K39-R64 PolarHBondContact O-N 2.73Å; H40-R64 CarbonylContact C-O 3.37Å; H40-R64 WeakPolarHBondContact CA-O 3.3Å; H40-R64 HydrophobicContact CB-CB 4.47Å; H40-R64 PolarHBondContact CD2-O 3.15Å; H40-R64 VanDerWaalsContact ND1-CZ 3.28Å; H40-R64 PolarHBondContact ND1-NH2 3.24Å; V41-R64 PolarHBondContact N-O 2.91Å; R64-P84 PolarHBondContact NH2-O 2.78Å; R64-P84 VanDerWaalsContact NH2-O 3.15Å
65	V	96.8	Very high	96.4	Very high	15 Å²	15	54.7 Å²	54.7	9%	0.091	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	118	-174.8	-172.2	0	0	0	0	111.9	V41 A43 A55 L58 R59 T67	V41-V65 WeakPolarHBondContact O-CA 3.46Å; A43-V65 HydrophobicContact CB-CG1 4.03Å; A55-V65 HydrophobicContact CB-CG1 4.12Å; L58-V65 HydrophobicContact CB-CG2 3.47Å; L58-V65 VanDerWaalsContact CB-CG2 3.47Å; L58-V65 HydrophobicContact CD1-CG1 4.16Å; L58-V65 HydrophobicContact CD1-CG2 4.17Å; L58-V65 HydrophobicContact CG-CG2 4.48Å; R59-V65 HydrophobicContact CG-CB 4.18Å; R59-V65 HydrophobicContact CG-CG2 3.75Å; R59-V65 PolarHBondContact NH2-O 3.5Å; V65-T67 HydrophobicContact CG1-CG2 4.12Å
66	T	98.2	Very high	96.3	Very high	44 Å²	44	58.7 Å²	58.7	27%	0.27	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	132	164.3	-64.2	0	0	0	0	108.9	H40 V41 L42 A43 V83	H40-T66 PolarHBondContact CE1-OG1 2.94Å; H40-T66 WeakPolarHBondContact NE2-CB 3.12Å; H40-T66 PolarHBondContact NE2-OG1 3.15Å; V41-T66 PolarHBondContact O-N 3.36Å; V41-T66 VanDerWaalsContact O-N 3.07Å; L42-T66 WeakPolarHBondContact CA-O 3.45Å; L42-T66 HydrophobicContact CD1-CG2 3.88Å; A43-T66 PolarHBondContact N-O 3.02Å; T66-V83 HydrophobicContact CG2-CG1 4.14Å; T66-V83 HydrophobicContact CG2-CG2 4.14Å
67	T	98.3	Very high	96.3	Very high	58 Å²	58	52 Å²	52	36%	0.356	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	138.7	-179	57.4	0	0	0	0	111	A43 R51 A55 V65	A43-T67 HydrophobicContact CB-CG2 4.35Å; A43-T67 CarbonylContact O-C 3.58Å; A43-T67 VanDerWaalsContact O-CA 3.3Å; A43-T67 WeakPolarHBondContact O-CA 3.36Å; R51-T67 HydrophobicContact CG-CG2 4.07Å; A55-T67 HydrophobicContact CB-CG2 3.68Å; V65-T67 HydrophobicContact CG1-CG2 4.12Å
68	V	98.2	Very high	96.4	Very high	8 Å²	8	52.1 Å²	52.1	5%	0.048	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	150.2	178.3	-171.6	0	0	0	0	109.3	L42 A43 V44 D45 R51 R73 A74 L77	L42-V68 HydrophobicContact CD1-CG2 3.58Å; A43-V68 PolarHBondContact O-N 2.63Å; V44-V68 WeakPolarHBondContact CA-O 3.43Å; D45-V68 PolarHBondContact N-O 3.01Å; D45-V68 VanDerWaalsContact N-O 3.13Å; R51-V68 WeakPolarHBondContact CD-O 3.36Å; V68-R73 HydrophobicContact CG1-CB 3.51Å; V68-R73 HydrophobicContact CG1-CG 3.49Å; V68-R73 VanDerWaalsContact CG1-CG 3.49Å; V68-A74 HydrophobicContact CG1-CB 4.45Å; V68-L77 HydrophobicContact CG1-CD1 4.29Å; V68-L77 HydrophobicContact CG2-CD1 3.52Å
69	D	98.1	Very high	96.3	Very high	85 Å²	85	56 Å²	56	46%	0.455	29%	0.293	S	S	.	.	S	Bend	trans	-97.2	-0.2	-172	61.6	2.9	0	0	0	114.8	D45 D46	D45-D69 WeakPolarHBondContact O-CA 3.32Å; D46-D69 VanDerWaalsContact CA-O 3.28Å; D46-D69 WeakPolarHBondContact CA-O 3.4Å
70	S	98.3	Very high	96.3	Very high	30 Å²	30	55.5 Å²	55.5	21%	0.21	30%	0.3	C	S	.	.			trans	-160.8	152.6	-177.6	57.4	0	0	0	0	112.2	V44 R73 A74	V44-S70 VanDerWaalsContact CG1-C 3.49Å; V44-S70 WeakPolarHBondContact CG1-O 3.29Å; S70-R73 PolarHBondContact O-N 3.4Å; S70-R73 VanDerWaalsContact OG-CB 3.24Å; S70-R73 WeakPolarHBondContact OG-CB 3.43Å; S70-R73 PolarHBondContact OG-N 3.21Å; S70-A74 PolarHBondContact O-N 2.9Å
71	A	98.3	Very high	96.2	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.008	30%	0.298	C	S	.	.	H	α-helix	trans	-62.4	-40.6	174.9	0	0	0	0	0	112.9	R73 A74 L75 M95 M98 L103	A71-R73 VanDerWaalsContact C-N 3.35Å; A71-R73 PolarHBondContact O-N 2.99Å; A71-A74 WeakPolarHBondContact O-CB 3.3Å; A71-A74 PolarHBondContact O-N 2.9Å; A71-L75 PolarHBondContact O-N 3.09Å; A71-M95 HydrophobicContact CB-CE 3.61Å; A71-M98 HydrophobicContact CB-CB 3.88Å; A71-M98 HydrophobicContact CB-CG 3.7Å; A71-M98 HydrophobicContact CB-SD 3.61Å; A71-L103 HydrophobicContact CB-CB 3.84Å; A71-L103 HydrophobicContact CB-CD1 4.38Å; A71-L103 HydrophobicContact CB-CD2 4.12Å; A71-L103 HydrophobicContact CB-CG 4.34Å
72	T	98.1	Very high	96.4	Very high	65 Å²	65	57.2 Å²	57.2	40%	0.399	31%	0.311	S	S	.	.	H	α-helix	trans	-57.5	-48.3	176.9	-53.9	0	0	0	0	111.2	A74 L75 E76	T72-A74 VanDerWaalsContact C-N 3.32Å; T72-A74 PolarHBondContact O-N 2.87Å; T72-L75 PolarHBondContact O-N 2.86Å; T72-E76 WeakPolarHBondContact O-CG 3.44Å; T72-E76 PolarHBondContact O-N 3.21Å
73	R	97.9	Very high	96.4	Very high	107 Å²	107	50.2 Å²	50.2	40%	0.404	28%	0.282	S	S	.	.	H	α-helix	trans	-67.5	-34.7	179.6	-173.2	60.2	176.4	167.6	2	112	V68 S70 A71 E76 L77	V68-R73 HydrophobicContact CG1-CB 3.51Å; V68-R73 HydrophobicContact CG1-CG 3.49Å; V68-R73 VanDerWaalsContact CG1-CG 3.49Å; S70-R73 PolarHBondContact O-N 3.4Å; S70-R73 VanDerWaalsContact OG-CB 3.24Å; S70-R73 WeakPolarHBondContact OG-CB 3.43Å; S70-R73 PolarHBondContact OG-N 3.21Å; A71-R73 VanDerWaalsContact C-N 3.35Å; A71-R73 PolarHBondContact O-N 2.99Å; R73-E76 VanDerWaalsContact CD-OE2 3.3Å; R73-E76 WeakPolarHBondContact CD-OE2 3.16Å; R73-E76 IonicContact CZ-OE2 3.78Å; R73-E76 IonicContact NE-OE2 3.99Å; R73-E76 IonicContact NH1-OE2 2.78Å; R73-E76 PolarHBondContact NH1-OE2 2.87Å; R73-E76 PolarHBondContact O-N 3.43Å; R73-L77 HydrophobicContact CG-CD1 4.23Å; R73-L77 HydrophobicContact CG-CG 4.47Å; R73-L77 WeakPolarHBondContact O-CB 3.47Å; R73-L77 VanDerWaalsContact O-CG 3.24Å; R73-L77 WeakPolarHBondContact O-CG 3.45Å; R73-L77 PolarHBondContact O-N 3.1Å
74	A	98.2	Very high	96.2	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.3	-45.9	174.1	0	0	0	0	0	111.5	L42 V44 V68 S70 A71 T72 L77 L78 L103	L42-A74 HydrophobicContact CD2-CB 4.12Å; V44-A74 HydrophobicContact CG1-CB 4.08Å; V44-A74 HydrophobicContact CG2-CB 3.68Å; V68-A74 HydrophobicContact CG1-CB 4.45Å; S70-A74 PolarHBondContact O-N 2.9Å; A71-A74 WeakPolarHBondContact O-CB 3.3Å; A71-A74 PolarHBondContact O-N 2.9Å; T72-A74 VanDerWaalsContact C-N 3.32Å; T72-A74 PolarHBondContact O-N 2.87Å; A74-L77 PolarHBondContact O-N 2.96Å; A74-L78 WeakPolarHBondContact O-CB 3.25Å; A74-L78 VanDerWaalsContact O-CG 3.25Å; A74-L78 WeakPolarHBondContact O-CG 3.47Å; A74-L78 PolarHBondContact O-N 3.49Å; A74-L103 HydrophobicContact CB-CD1 4.47Å; A74-L103 HydrophobicContact CB-CD2 4.4Å
75	L	97.6	Very high	96	Very high	29 Å²	29	53.6 Å²	53.6	15%	0.152	31%	0.312	C	S	.	.	H	α-helix	trans	-63.3	-42.9	175.9	-72.9	173.9	0	0	0	112.5	A71 T72 L77 L78 A79 M98 L103 H106 V107	A71-L75 PolarHBondContact O-N 3.09Å; T72-L75 PolarHBondContact O-N 2.86Å; L75-L77 PolarHBondContact O-N 3.44Å; L75-L78 PolarHBondContact O-N 3.21Å; L75-A79 WeakPolarHBondContact O-CB 3.38Å; L75-A79 PolarHBondContact O-N 2.84Å; L75-M98 HydrophobicContact CD1-CE 3.98Å; L75-M98 HydrophobicContact CD1-SD 3.72Å; L75-L103 HydrophobicContact CD1-CD1 4.17Å; L75-L103 HydrophobicContact CD2-CD1 3.62Å; L75-L103 HydrophobicContact CG-CD1 3.54Å; L75-H106 HydrophobicContact CD1-CB 3.81Å; L75-H106 HydrophobicContact CD2-CB 3.81Å; L75-H106 HydrophobicContact CG-CB 4.47Å; L75-V107 HydrophobicContact CD2-CG2 4.42Å
76	E	97.1	Very high	96	Very high	84 Å²	84	53.6 Å²	53.6	39%	0.393	31%	0.312	S	S	.	.	H	α-helix	trans	-58.1	-47.9	175.7	-73.9	174.2	-175.8	0	0	111.8	T72 R73 L78 A79 L80	T72-E76 WeakPolarHBondContact O-CG 3.44Å; T72-E76 PolarHBondContact O-N 3.21Å; R73-E76 VanDerWaalsContact CD-OE2 3.3Å; R73-E76 WeakPolarHBondContact CD-OE2 3.16Å; R73-E76 IonicContact CZ-OE2 3.78Å; R73-E76 IonicContact NE-OE2 3.99Å; R73-E76 IonicContact NH1-OE2 2.78Å; R73-E76 PolarHBondContact NH1-OE2 2.87Å; R73-E76 PolarHBondContact O-N 3.43Å; E76-L78 PolarHBondContact O-N 3.06Å; E76-A79 PolarHBondContact O-N 3.03Å; E76-L80 VanDerWaalsContact O-CB 3.3Å; E76-L80 WeakPolarHBondContact O-CB 3.3Å; E76-L80 VanDerWaalsContact O-CG 3.25Å; E76-L80 WeakPolarHBondContact O-CG 3.24Å; E76-L80 PolarHBondContact O-N 3.48Å
77	L	97	Very high	95.8	Very high	22 Å²	22	53.5 Å²	53.5	12%	0.115	31%	0.31	C	S	.	.	H	α-helix	trans	-63.7	-40.4	-179.6	-73.7	174.8	0	0	0	112.3	V68 R73 A74 L75 G81 L82 V83	V68-L77 HydrophobicContact CG1-CD1 4.29Å; V68-L77 HydrophobicContact CG2-CD1 3.52Å; R73-L77 HydrophobicContact CG-CD1 4.23Å; R73-L77 HydrophobicContact CG-CG 4.47Å; R73-L77 WeakPolarHBondContact O-CB 3.47Å; R73-L77 VanDerWaalsContact O-CG 3.24Å; R73-L77 WeakPolarHBondContact O-CG 3.45Å; R73-L77 PolarHBondContact O-N 3.1Å; A74-L77 PolarHBondContact O-N 2.96Å; L75-L77 PolarHBondContact O-N 3.44Å; L77-G81 PolarHBondContact O-N 3.21Å; L77-L82 HydrophobicContact CD2-CB 3.82Å; L77-L82 HydrophobicContact CD2-CD1 3.9Å; L77-L82 PolarHBondContact O-N 2.98Å; L77-V83 HydrophobicContact CB-CG2 3.79Å; L77-V83 HydrophobicContact CD1-CG2 4.09Å; L77-V83 HydrophobicContact CD2-CG2 4.28Å; L77-V83 HydrophobicContact CG-CG2 4.27Å
78	L	96.5	Very high	95.7	Very high	18 Å²	18	50.8 Å²	50.8	9%	0.094	29%	0.293	C	S	.	.	H	α-helix	trans	-67.6	-46.1	176	-71.3	167.6	0	0	0	111.6	L42 A74 L75 E76 L80 G81 V86 I89 L113 I116	L42-L78 HydrophobicContact CD2-CD1 4.02Å; L42-L78 HydrophobicContact CD2-CD2 4.14Å; L42-L78 HydrophobicContact CD2-CG 4.02Å; A74-L78 WeakPolarHBondContact O-CB 3.25Å; A74-L78 VanDerWaalsContact O-CG 3.25Å; A74-L78 WeakPolarHBondContact O-CG 3.47Å; A74-L78 PolarHBondContact O-N 3.49Å; L75-L78 PolarHBondContact O-N 3.21Å; E76-L78 PolarHBondContact O-N 3.06Å; L78-L80 PolarHBondContact O-N 3.44Å; L78-G81 PolarHBondContact O-N 3.41Å; L78-V86 HydrophobicContact CD2-CB 4.34Å; L78-V86 HydrophobicContact CD2-CG2 4.08Å; L78-I89 HydrophobicContact CD1-CD1 3.71Å; L78-L113 HydrophobicContact CB-CD1 4.12Å; L78-L113 HydrophobicContact CB-CD2 4.04Å; L78-L113 HydrophobicContact CD1-CD1 4.32Å; L78-L113 HydrophobicContact CD2-CD2 4.44Å; L78-I116 HydrophobicContact CD2-CD1 4.4Å
79	A	93.6	Very high	95.7	Very high	84 Å²	84	50.4 Å²	50.4	69%	0.694	29%	0.291	S	S	*	.	H	α-helix	trans	-67.1	-36.5	-178.4	0	0	0	0	0	112.7	L75 E76 G81	L75-A79 WeakPolarHBondContact O-CB 3.38Å; L75-A79 PolarHBondContact O-N 2.84Å; E76-A79 PolarHBondContact O-N 3.03Å; A79-G81 VanDerWaalsContact C-N 3.28Å
80	L	94.6	Very high	95.7	Very high	120 Å²	120	46.4 Å²	46.4	63%	0.628	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-2.5	177.3	-64.5	175	0	0	0	113.3	E76 L78 L82	E76-L80 VanDerWaalsContact O-CB 3.3Å; E76-L80 WeakPolarHBondContact O-CB 3.3Å; E76-L80 VanDerWaalsContact O-CG 3.25Å; E76-L80 WeakPolarHBondContact O-CG 3.24Å; E76-L80 PolarHBondContact O-N 3.48Å; L78-L80 PolarHBondContact O-N 3.44Å; L80-L82 HydrophobicContact CB-CD1 3.92Å; L80-L82 HydrophobicContact CB-CG 3.76Å; L80-L82 HydrophobicContact CD1-CD1 3.93Å; L80-L82 PolarHBondContact O-N 3.28Å
81	G	92.9	Very high	95.7	Very high	51 Å²	51	45 Å²	45	53%	0.526	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	21.3	-178.1	0	0	0	0	0	113.9	L77 L78 A79 V83	L77-G81 PolarHBondContact O-N 3.21Å; L78-G81 PolarHBondContact O-N 3.41Å; A79-G81 VanDerWaalsContact C-N 3.28Å; G81-V83 PolarHBondContact O-N 3.38Å
82	L	94.4	Very high	95.7	Very high	104 Å²	104	45.4 Å²	45.4	55%	0.545	26%	0.262	S	S	.	.	S	Bend	trans	-76.5	-11.2	-177.8	-64.8	176.5	0	0	0	112.8	L77 L80	L77-L82 HydrophobicContact CD2-CB 3.82Å; L77-L82 HydrophobicContact CD2-CD1 3.9Å; L77-L82 PolarHBondContact O-N 2.98Å; L80-L82 HydrophobicContact CB-CD1 3.92Å; L80-L82 HydrophobicContact CB-CG 3.76Å; L80-L82 HydrophobicContact CD1-CD1 3.93Å; L80-L82 PolarHBondContact O-N 3.28Å
83	V	92	Very high	95.7	Very high	15 Å²	15	44 Å²	44	9%	0.091	25%	0.249	C	C	.	.	S	Bend	trans	-129.1	83.5	177.2	-173.8	0	0	0	0	107.3	H40 L42 T66 L77 G81 V86	H40-V83 WeakPolarHBondContact CE1-CG1 3.44Å; L42-V83 HydrophobicContact CD1-CG1 4.41Å; T66-V83 HydrophobicContact CG2-CG1 4.14Å; T66-V83 HydrophobicContact CG2-CG2 4.14Å; L77-V83 HydrophobicContact CB-CG2 3.79Å; L77-V83 HydrophobicContact CD1-CG2 4.09Å; L77-V83 HydrophobicContact CD2-CG2 4.28Å; L77-V83 HydrophobicContact CG-CG2 4.27Å; G81-V83 PolarHBondContact O-N 3.38Å; V83-V86 HydrophobicContact CB-CG2 4.27Å; V83-V86 HydrophobicContact CG1-CG2 3.51Å; V83-V86 WeakPolarHBondContact O-CG2 3.22Å
84	P	89.2	Confident	95.7	Very high	70 Å²	70	45.2 Å²	45.2	46%	0.455	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	158.3	-177.2	30.4	-35.6	0	0	0	111.8	H40 R64 V86	H40-P84 PolarHBondContact ND1-O 3.4Å; R64-P84 PolarHBondContact NH2-O 2.78Å; R64-P84 VanDerWaalsContact NH2-O 3.15Å; P84-V86 VanDerWaalsContact C-N 3.29Å; P84-V86 PolarHBondContact O-N 3.01Å
85	D	91.7	Very high	95.7	Very high	115 Å²	115	45.6 Å²	45.6	62%	0.615	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	30.3	170.5	-41.3	-51.8	0	0	0	115	H40 N87	H40-D85 VanDerWaalsContact CB-O 3.3Å; H40-D85 WeakPolarHBondContact CB-O 3.46Å; D85-N87 PolarHBondContact O-N 3.42Å; D85-N87 VanDerWaalsContact O-N 3.11Å; D85-N87 PolarHBondContact O-OD1 3.48Å
86	V	95.4	Very high	95.6	Very high	15 Å²	15	49 Å²	49	9%	0.091	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	113	175.2	177.9	0	0	0	0	109.7	L42 L78 V83 P84 M88 I89 I116	L42-V86 HydrophobicContact CB-CG1 3.86Å; L42-V86 HydrophobicContact CB-CG2 4.35Å; L78-V86 HydrophobicContact CD2-CB 4.34Å; L78-V86 HydrophobicContact CD2-CG2 4.08Å; V83-V86 HydrophobicContact CB-CG2 4.27Å; V83-V86 HydrophobicContact CG1-CG2 3.51Å; V83-V86 WeakPolarHBondContact O-CG2 3.22Å; P84-V86 VanDerWaalsContact C-N 3.29Å; P84-V86 PolarHBondContact O-N 3.01Å; V86-M88 VanDerWaalsContact CG1-O 3.3Å; V86-M88 WeakPolarHBondContact CG1-O 3.27Å; V86-I89 HydrophobicContact CG1-CG1 4.09Å; V86-I116 HydrophobicContact CB-CD1 4.44Å; V86-I116 HydrophobicContact CG1-CG2 4.08Å
87	N	95.1	Very high	95.6	Very high	43 Å²	43	49 Å²	49	23%	0.23	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-14.8	179	-50.5	108.5	0	0	0	112.8	K39 H40 D85 P117 I158	K39-N87 WeakPolarHBondContact CA-OD1 3.33Å; K39-N87 HydrophobicContact CB-CB 4.45Å; K39-N87 HydrophobicContact CD-CB 4.24Å; H40-N87 PolarHBondContact N-OD1 3.26Å; H40-N87 PolarHBondContact O-N 2.99Å; D85-N87 PolarHBondContact O-N 3.42Å; D85-N87 VanDerWaalsContact O-N 3.11Å; D85-N87 PolarHBondContact O-OD1 3.48Å; N87-P117 WeakPolarHBondContact O-CD 3.43Å; N87-P117 WeakPolarHBondContact O-CG 3.3Å; N87-I158 HydrophobicContact CB-CG2 3.67Å
88	M	96.5	Very high	95.6	Very high	1 Å²	1	49.5 Å²	49.5	1%	0.005	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	144.6	175.8	177.4	178.1	-81.4	0	0	111	H40 V41 L42 V86 P117 V119 L154 I158	H40-M88 PolarHBondContact O-N 2.97Å; V41-M88 WeakPolarHBondContact CA-O 3.44Å; V41-M88 HydrophobicContact CG1-CB 4.5Å; V41-M88 HydrophobicContact CG2-CB 4.3Å; L42-M88 PolarHBondContact N-O 3Å; V86-M88 VanDerWaalsContact CG1-O 3.3Å; V86-M88 WeakPolarHBondContact CG1-O 3.27Å; M88-P117 WeakPolarHBondContact CA-O 3.38Å; M88-P117 HydrophobicContact CB-CG 4.11Å; M88-P117 HydrophobicContact CE-CB 4.46Å; M88-P117 HydrophobicContact CE-CG 4.28Å; M88-P117 HydrophobicContact CG-CG 4.37Å; M88-V119 HydrophobicContact CE-CG2 3.94Å; M88-V119 HydrophobicContact CG-CG2 4.45Å; M88-V119 HydrophobicContact SD-CG2 3.9Å; M88-L154 HydrophobicContact CE-CB 4.13Å; M88-L154 HydrophobicContact SD-CB 4.44Å; M88-L154 HydrophobicContact SD-CD1 4.11Å; M88-I158 HydrophobicContact CB-CD1 4.24Å; M88-I158 HydrophobicContact CB-CG1 4.22Å; M88-I158 HydrophobicContact CE-CD1 3.74Å; M88-I158 HydrophobicContact CE-CG1 3.32Å; M88-I158 HydrophobicContact SD-CD1 3.88Å; M88-I158 HydrophobicContact SD-CG1 4.11Å
89	I	97.8	Very high	95.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	132	165.7	-61.3	164.6	0	0	0	107.6	L42 V44 L78 V86 L103 V107 I116 P117 V118 V119	L42-I89 HydrophobicContact CB-CG1 4.25Å; L42-I89 HydrophobicContact CD2-CG1 4.31Å; L42-I89 WeakPolarHBondContact O-CA 3.47Å; V44-I89 HydrophobicContact CG2-CG2 4.29Å; L78-I89 HydrophobicContact CD1-CD1 3.71Å; V86-I89 HydrophobicContact CG1-CG1 4.09Å; I89-L103 HydrophobicContact CG2-CD2 4.34Å; I89-V107 HydrophobicContact CD1-CG1 4.28Å; I89-V107 HydrophobicContact CD1-CG2 3.75Å; I89-I116 HydrophobicContact CD1-CG2 4.08Å; I89-I116 HydrophobicContact CG1-CG2 3.9Å; I89-P117 PolarHBondContact N-O 3.24Å; I89-V118 HydrophobicContact CB-CG2 4.28Å; I89-V118 HydrophobicContact CD1-CG2 4.35Å; I89-V118 HydrophobicContact CG2-CG1 4.46Å; I89-V118 CarbonylContact O-C 3.56Å; I89-V118 WeakPolarHBondContact O-CA 3.44Å; I89-V119 PolarHBondContact O-N 3.12Å
90	I	97.9	Very high	95.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	123.3	167.6	-170.8	166.2	0	0	0	108.2	V41 L42 A43 V44 I54 L58 V119 M121 L142 L154	V41-I90 HydrophobicContact CG1-CB 4.39Å; V41-I90 HydrophobicContact CG1-CG2 3.68Å; L42-I90 PolarHBondContact O-N 3.44Å; A43-I90 CarbonylContact C-O 3.58Å; A43-I90 WeakPolarHBondContact CA-O 3.38Å; A43-I90 HydrophobicContact CB-CG2 3.85Å; V44-I90 PolarHBondContact N-O 3.43Å; I54-I90 HydrophobicContact CD1-CD1 3.87Å; I54-I90 HydrophobicContact CG1-CD1 4.04Å; I54-I90 HydrophobicContact CG1-CG2 4.34Å; L58-I90 HydrophobicContact CD1-CG2 4.01Å; I90-V119 CarbonylContact C-O 3.54Å; I90-V119 VanDerWaalsContact CA-O 3.31Å; I90-V119 WeakPolarHBondContact CA-O 3.49Å; I90-V119 HydrophobicContact CB-CB 4.41Å; I90-V119 HydrophobicContact CD1-CB 4.46Å; I90-V119 HydrophobicContact CD1-CG1 4.13Å; I90-V119 HydrophobicContact CG1-CB 4.09Å; I90-V119 HydrophobicContact CG1-CG1 4.11Å; I90-M121 HydrophobicContact CD1-CG 3.99Å; I90-M121 HydrophobicContact CD1-SD 3.71Å; I90-M121 HydrophobicContact CG1-CE 4.01Å; I90-M121 HydrophobicContact CG1-CG 3.75Å; I90-M121 HydrophobicContact CG1-SD 3.68Å; I90-L142 HydrophobicContact CD1-CD1 4.34Å; I90-L154 HydrophobicContact CD1-CD1 4.46Å
91	T	98.6	Very high	96.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	142.9	-170.3	-177.2	0	0	0	0	111.9	V44 M95 L103 V118 V119 I120 M121	V44-T91 CarbonylContact O-C 3.39Å; V44-T91 WeakPolarHBondContact O-CA 3.49Å; T91-M95 VanDerWaalsContact OG1-CE 3.22Å; T91-M95 WeakPolarHBondContact OG1-CE 3.22Å; T91-L103 HydrophobicContact CG2-CD2 4.16Å; T91-V118 HydrophobicContact CG2-CG1 4.2Å; T91-V119 PolarHBondContact N-O 3.13Å; T91-I120 HydrophobicContact CG2-CD1 3.4Å; T91-I120 CarbonylContact O-C 3.57Å; T91-I120 WeakPolarHBondContact O-CA 3.36Å; T91-M121 PolarHBondContact O-N 2.91Å
92	D	98.3	Very high	96.4	Very high	11 Å²	11	43.8 Å²	43.8	6%	0.059	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	147.3	163.5	-162.2	12.6	0	0	0	110.5	V44 D45 M95 G100 M121 K144	V44-D92 PolarHBondContact O-N 3.38Å; D45-D92 HydrophobicContact CB-CB 4.3Å; D92-M95 HydrophobicContact CB-CG 4.16Å; D92-G100 WeakPolarHBondContact O-CA 3.4Å; D92-G100 PolarHBondContact O-N 2.81Å; D92-M121 CarbonylContact C-O 3.53Å; D92-M121 VanDerWaalsContact OD1-O 3.05Å; D92-K144 VanDerWaalsContact OD1-CE 3.31Å; D92-K144 WeakPolarHBondContact OD1-CE 3.45Å; D92-K144 IonicContact OD1-NZ 3.74Å; D92-K144 PolarHBondContact OD1-NZ 2.81Å; D92-K144 IonicContact OD2-NZ 3.13Å; D92-K144 PolarHBondContact OD2-NZ 3.21Å
93	Y	98.4	Very high	96.6	Very high	35 Å²	35	38.9 Å²	38.9	14%	0.137	22%	0.22	C	C	.	.	S	Bend	trans	-73.4	-47.2	176.7	178.9	-86.2	0	0	0	110.6	T99 G100 I120 M121 R129 F141	Y93-T99 CarbonylContact O-C 3.46Å; Y93-T99 WeakPolarHBondContact O-CA 3.17Å; Y93-T99 VanDerWaalsContact O-CB 3.31Å; Y93-T99 WeakPolarHBondContact O-CB 3.07Å; Y93-G100 PolarHBondContact O-N 3.3Å; Y93-I120 HydrophobicContact CD2-CG2 4.05Å; Y93-I120 HydrophobicContact CG-CG2 4.45Å; Y93-M121 WeakPolarHBondContact CB-O 3.31Å; Y93-M121 PolarHBondContact N-O 2.93Å; Y93-R129 HydrophobicContact CD2-CG 3.85Å; Y93-R129 HydrophobicContact CE1-CG 4.3Å; Y93-R129 HydrophobicContact CE2-CG 3.29Å; Y93-R129 VanDerWaalsContact CZ-NE 3.26Å; Y93-F141 HydrophobicContact CD2-CE2 4.49Å
94	W	96.8	Very high	96.9	Very high	132 Å²	132	38.2 Å²	38.2	50%	0.5	22%	0.216	S	C	.	.			trans	-98.7	110.2	-177.5	-84	125.2	0	0	0	109.9	T99	W94-T99 HydrophobicContact CE3-CG2 3.95Å; W94-T99 HydrophobicContact CZ3-CG2 3.89Å
95	M	97.5	Very high	97.3	Very high	9 Å²	9	38.2 Å²	38.2	4%	0.044	21%	0.209	C	C	.	.			trans	-135	144.8	169.1	-67.5	-179.9	-71.3	0	0	108.8	V44 D46 A71 T91 D92 M98	V44-M95 HydrophobicContact CG1-CE 3.93Å; V44-M95 HydrophobicContact CG1-SD 3.74Å; D46-M95 HydrophobicContact CB-CB 4.43Å; D46-M95 HydrophobicContact CB-CG 4.15Å; A71-M95 HydrophobicContact CB-CE 3.61Å; T91-M95 VanDerWaalsContact OG1-CE 3.22Å; T91-M95 WeakPolarHBondContact OG1-CE 3.22Å; D92-M95 HydrophobicContact CB-CG 4.16Å; M95-M98 WeakPolarHBondContact CB-O 3.35Å
96	P	96.2	Very high	97.6	Very high	100 Å²	100	36.9 Å²	36.9	65%	0.649	20%	0.199	S	C	*	.	S	Bend	trans	-59.5	141	175.2	-24.4	33.9	0	0	0	112.6	D46 M98	D46-P96 VanDerWaalsContact OD2-CD 3.26Å; D46-P96 WeakPolarHBondContact OD2-CD 3.48Å; P96-M98 PolarHBondContact O-N 2.91Å
97	G	97	Very high	97.7	Very high	85 Å²	85	36.2 Å²	36.2	88%	0.876	19%	0.194	S	C	*	.	S	Bend	trans	82.4	-50.4	177.1	0	0	0	0	0	114.2
98	M	97.8	Very high	97.8	Very high	31 Å²	31	36.5 Å²	36.5	15%	0.153	19%	0.193	C	C	.	.	S	Bend	trans	-143.9	124.7	176.5	-179.3	-174.4	-61.7	0	0	110.4	A71 L75 M95 P96 E102	A71-M98 HydrophobicContact CB-CB 3.88Å; A71-M98 HydrophobicContact CB-CG 3.7Å; A71-M98 HydrophobicContact CB-SD 3.61Å; L75-M98 HydrophobicContact CD1-CE 3.98Å; L75-M98 HydrophobicContact CD1-SD 3.72Å; M95-M98 WeakPolarHBondContact CB-O 3.35Å; P96-M98 PolarHBondContact O-N 2.91Å; M98-E102 HydrophobicContact CG-CB 3.6Å; M98-E102 HydrophobicContact SD-CB 4.41Å
99	T	98	Very high	97.9	Very high	19 Å²	19	42.8 Å²	42.8	12%	0.117	22%	0.223	C	C	.	.			trans	-71.4	157.9	178.2	60.9	0	0	0	0	112	Y93 W94 Y101 E102 L103	Y93-T99 CarbonylContact O-C 3.46Å; Y93-T99 WeakPolarHBondContact O-CA 3.17Å; Y93-T99 VanDerWaalsContact O-CB 3.31Å; Y93-T99 WeakPolarHBondContact O-CB 3.07Å; W94-T99 HydrophobicContact CE3-CG2 3.95Å; W94-T99 HydrophobicContact CZ3-CG2 3.89Å; T99-Y101 PolarHBondContact O-N 3.46Å; T99-E102 WeakPolarHBondContact CB-OE2 3.32Å; T99-E102 PolarHBondContact N-OE2 2.93Å; T99-E102 PolarHBondContact O-N 2.82Å; T99-E102 VanDerWaalsContact O-N 3.12Å; T99-E102 VanDerWaalsContact OG1-CG 3.31Å; T99-E102 WeakPolarHBondContact OG1-CG 3.4Å; T99-E102 PolarHBondContact OG1-N 3.02Å; T99-E102 VanDerWaalsContact OG1-N 3.1Å; T99-E102 PolarHBondContact OG1-OE2 2.89Å; T99-L103 PolarHBondContact O-N 3.2Å
100	G	98.2	Very high	97.8	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-61.1	-26.8	170	0	0	0	0	0	113.3	D92 Y93 L104	D92-G100 WeakPolarHBondContact O-CA 3.4Å; D92-G100 PolarHBondContact O-N 2.81Å; Y93-G100 PolarHBondContact O-N 3.3Å; G100-L104 WeakPolarHBondContact O-CB 3.39Å; G100-L104 PolarHBondContact O-N 3.39Å
101	Y	98.4	Very high	97.6	Very high	53 Å²	53	49.3 Å²	49.3	21%	0.208	27%	0.268	C	S	.	.	H	α-helix	trans	-68.4	-43.9	171.9	178	-105.8	0	0	0	111.6	T99 L103 L104 K105 R132 E136	T99-Y101 PolarHBondContact O-N 3.46Å; Y101-L103 VanDerWaalsContact C-N 3.34Å; Y101-L103 PolarHBondContact O-N 3.17Å; Y101-L104 HydrophobicContact CD2-CD2 4.37Å; Y101-L104 WeakPolarHBondContact O-CB 3.07Å; Y101-L104 PolarHBondContact O-N 3.32Å; Y101-K105 HydrophobicContact CE1-CD 3.83Å; Y101-K105 HydrophobicContact CE1-CG 4.26Å; Y101-K105 WeakPolarHBondContact O-CG 3.31Å; Y101-K105 PolarHBondContact O-N 2.9Å; Y101-R132 HydrophobicContact CE2-CB 4.48Å; Y101-E136 HydrophobicContact CE2-CB 3.87Å; Y101-E136 HydrophobicContact CE2-CG 3.97Å; Y101-E136 PolarHBondContact OH-OE2 2.95Å
102	E	98.5	Very high	97.4	Very high	82 Å²	82	53.1 Å²	53.1	38%	0.383	30%	0.3	S	S	.	.	H	α-helix	trans	-63.6	-40.3	173.2	-72.5	163.9	126.8	0	0	111.5	M98 T99 L104 K105 H106	M98-E102 HydrophobicContact CG-CB 3.6Å; M98-E102 HydrophobicContact SD-CB 4.41Å; T99-E102 WeakPolarHBondContact CB-OE2 3.32Å; T99-E102 PolarHBondContact N-OE2 2.93Å; T99-E102 PolarHBondContact O-N 2.82Å; T99-E102 VanDerWaalsContact O-N 3.12Å; T99-E102 VanDerWaalsContact OG1-CG 3.31Å; T99-E102 WeakPolarHBondContact OG1-CG 3.4Å; T99-E102 PolarHBondContact OG1-N 3.02Å; T99-E102 VanDerWaalsContact OG1-N 3.1Å; T99-E102 PolarHBondContact OG1-OE2 2.89Å; E102-L104 VanDerWaalsContact C-N 3.33Å; E102-L104 PolarHBondContact O-N 3.29Å; E102-K105 PolarHBondContact O-N 2.71Å; E102-H106 PolarHBondContact O-N 3.36Å; E102-H106 PolarHBondContact O-ND1 2.84Å
103	L	98.6	Very high	97.3	Very high	1 Å²	1	53.7 Å²	53.7	1%	0.005	30%	0.303	C	S	.	.	H	α-helix	trans	-56.8	-47.1	172.4	177.6	58.7	0	0	0	111.6	V44 A71 A74 L75 I89 T91 T99 Y101 K105 H106 V107	V44-L103 HydrophobicContact CB-CD2 4.49Å; V44-L103 HydrophobicContact CG1-CD2 4.42Å; V44-L103 HydrophobicContact CG2-CD2 4.3Å; A71-L103 HydrophobicContact CB-CB 3.84Å; A71-L103 HydrophobicContact CB-CD1 4.38Å; A71-L103 HydrophobicContact CB-CD2 4.12Å; A71-L103 HydrophobicContact CB-CG 4.34Å; A74-L103 HydrophobicContact CB-CD1 4.47Å; A74-L103 HydrophobicContact CB-CD2 4.4Å; L75-L103 HydrophobicContact CD1-CD1 4.17Å; L75-L103 HydrophobicContact CD2-CD1 3.62Å; L75-L103 HydrophobicContact CG-CD1 3.54Å; I89-L103 HydrophobicContact CG2-CD2 4.34Å; T91-L103 HydrophobicContact CG2-CD2 4.16Å; T99-L103 PolarHBondContact O-N 3.2Å; Y101-L103 VanDerWaalsContact C-N 3.34Å; Y101-L103 PolarHBondContact O-N 3.17Å; L103-K105 VanDerWaalsContact C-N 3.35Å; L103-K105 PolarHBondContact O-N 2.81Å; L103-H106 PolarHBondContact O-N 2.94Å; L103-V107 HydrophobicContact CD1-CG2 4.2Å; L103-V107 WeakPolarHBondContact O-CG2 3.22Å; L103-V107 PolarHBondContact O-N 2.82Å
104	L	98.6	Very high	97.2	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-55.1	-49.2	175.5	169.6	68.5	0	0	0	111.1	G100 Y101 E102 H106 V107 K108 V118 I120 C133 E136 A138	G100-L104 WeakPolarHBondContact O-CB 3.39Å; G100-L104 PolarHBondContact O-N 3.39Å; Y101-L104 HydrophobicContact CD2-CD2 4.37Å; Y101-L104 WeakPolarHBondContact O-CB 3.07Å; Y101-L104 PolarHBondContact O-N 3.32Å; E102-L104 VanDerWaalsContact C-N 3.33Å; E102-L104 PolarHBondContact O-N 3.29Å; L104-H106 PolarHBondContact O-N 3.2Å; L104-V107 PolarHBondContact O-N 3.15Å; L104-K108 HydrophobicContact CD1-CD 4.4Å; L104-K108 HydrophobicContact CD1-CG 3.81Å; L104-K108 HydrophobicContact CG-CG 4.43Å; L104-K108 WeakPolarHBondContact O-CG 3.34Å; L104-K108 PolarHBondContact O-N 3.32Å; L104-V118 HydrophobicContact CB-CG1 4.31Å; L104-V118 HydrophobicContact CD1-CB 3.66Å; L104-V118 HydrophobicContact CD1-CG1 3.85Å; L104-V118 HydrophobicContact CD1-CG2 4.02Å; L104-I120 HydrophobicContact CB-CD1 4.34Å; L104-C133 HydrophobicContact CD2-CB 4.4Å; L104-C133 WeakPolarHBondContact CD2-O 3.2Å; L104-E136 HydrophobicContact CD2-CB 3.8Å; L104-E136 HydrophobicContact CD2-CG 3.97Å; L104-E136 HydrophobicContact CG-CB 4.38Å; L104-E136 HydrophobicContact CG-CG 4.06Å; L104-A138 HydrophobicContact CD1-CB 4.28Å; L104-A138 HydrophobicContact CD2-CB 3.85Å
105	K	98.3	Very high	97	Very high	71 Å²	71	57.6 Å²	57.6	31%	0.309	34%	0.337	S	S	.	.	H	α-helix	trans	-55.8	-50.9	177.3	-65.8	-160.8	75.7	175.3	0	111.8	Y101 E102 L103 V107 K108 E109 E136	Y101-K105 HydrophobicContact CE1-CD 3.83Å; Y101-K105 HydrophobicContact CE1-CG 4.26Å; Y101-K105 WeakPolarHBondContact O-CG 3.31Å; Y101-K105 PolarHBondContact O-N 2.9Å; E102-K105 PolarHBondContact O-N 2.71Å; L103-K105 VanDerWaalsContact C-N 3.35Å; L103-K105 PolarHBondContact O-N 2.81Å; K105-V107 VanDerWaalsContact C-N 3.3Å; K105-V107 PolarHBondContact O-N 2.93Å; K105-K108 PolarHBondContact O-N 3.21Å; K105-K108 VanDerWaalsContact O-N 3.15Å; K105-E109 WeakPolarHBondContact O-CB 3.28Å; K105-E109 VanDerWaalsContact O-CG 3.31Å; K105-E109 WeakPolarHBondContact O-CG 3.3Å; K105-E109 PolarHBondContact O-N 2.94Å; K105-E136 WeakPolarHBondContact CE-OE1 3.26Å; K105-E136 HydrophobicContact CG-CG 3.78Å
106	H	98	Very high	96.9	Very high	87 Å²	87	58.3 Å²	58.3	40%	0.403	34%	0.341	S	S	.	.	H	α-helix	trans	-59.2	-40.5	179.4	-72.8	88.7	0	0	0	112.4	L75 E102 L103 L104 S110	L75-H106 HydrophobicContact CD1-CB 3.81Å; L75-H106 HydrophobicContact CD2-CB 3.81Å; L75-H106 HydrophobicContact CG-CB 4.47Å; E102-H106 PolarHBondContact O-N 3.36Å; E102-H106 PolarHBondContact O-ND1 2.84Å; L103-H106 PolarHBondContact O-N 2.94Å; L104-H106 PolarHBondContact O-N 3.2Å; H106-S110 VanDerWaalsContact O-CB 3.3Å; H106-S110 WeakPolarHBondContact O-CB 3.21Å; H106-S110 PolarHBondContact O-N 3.13Å; H106-S110 VanDerWaalsContact O-N 3.15Å
107	V	97.6	Very high	97	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-64.7	-44.4	176.8	170.4	0	0	0	0	110.9	L75 I89 L103 L104 K105 S110 L113 R114 V118	L75-V107 HydrophobicContact CD2-CG2 4.42Å; I89-V107 HydrophobicContact CD1-CG1 4.28Å; I89-V107 HydrophobicContact CD1-CG2 3.75Å; L103-V107 HydrophobicContact CD1-CG2 4.2Å; L103-V107 WeakPolarHBondContact O-CG2 3.22Å; L103-V107 PolarHBondContact O-N 2.82Å; L104-V107 PolarHBondContact O-N 3.15Å; K105-V107 VanDerWaalsContact C-N 3.3Å; K105-V107 PolarHBondContact O-N 2.93Å; V107-S110 PolarHBondContact O-N 3.48Å; V107-L113 HydrophobicContact CG1-CB 4.02Å; V107-L113 WeakPolarHBondContact CG1-O 3.49Å; V107-L113 CarbonylContact O-C 3.52Å; V107-R114 WeakPolarHBondContact O-CA 3.39Å; V107-R114 PolarHBondContact O-N 3.05Å; V107-V118 HydrophobicContact CB-CG2 4.18Å; V107-V118 HydrophobicContact CG1-CG2 3.68Å
108	K	97.5	Very high	97	Very high	49 Å²	49	50.4 Å²	50.4	21%	0.213	27%	0.274	C	S	.	.	H	α-helix	trans	-75.9	-30.1	-177.1	-62.2	-47.6	-175	-177.9	0	113.8	L104 K105 R114 I116 G137	L104-K108 HydrophobicContact CD1-CD 4.4Å; L104-K108 HydrophobicContact CD1-CG 3.81Å; L104-K108 HydrophobicContact CG-CG 4.43Å; L104-K108 WeakPolarHBondContact O-CG 3.34Å; L104-K108 PolarHBondContact O-N 3.32Å; K105-K108 PolarHBondContact O-N 3.21Å; K105-K108 VanDerWaalsContact O-N 3.15Å; K108-R114 PolarHBondContact NZ-O 2.97Å; K108-R114 WeakPolarHBondContact O-CB 3.23Å; K108-I116 PolarHBondContact NZ-O 3.41Å; K108-G137 WeakPolarHBondContact CE-O 3.2Å
109	E	97.1	Very high	97	Very high	134 Å²	134	48.9 Å²	48.9	63%	0.626	27%	0.267	S	S	*	.	H	α-helix	trans	-75.2	-26	174.1	-70.4	172.9	-177.3	0	0	112.2	K105	K105-E109 WeakPolarHBondContact O-CB 3.28Å; K105-E109 VanDerWaalsContact O-CG 3.31Å; K105-E109 WeakPolarHBondContact O-CG 3.3Å; K105-E109 PolarHBondContact O-N 2.94Å
110	S	96.1	Very high	97	Very high	38 Å²	38	48 Å²	48	27%	0.266	26%	0.261	S	S	.	.			trans	-76.6	122.8	178.1	175.1	0	0	0	0	112.5	H106 V107 A112 L113 R114	H106-S110 VanDerWaalsContact O-CB 3.3Å; H106-S110 WeakPolarHBondContact O-CB 3.21Å; H106-S110 PolarHBondContact O-N 3.13Å; H106-S110 VanDerWaalsContact O-N 3.15Å; V107-S110 PolarHBondContact O-N 3.48Å; S110-A112 PolarHBondContact O-N 2.9Å; S110-A112 PolarHBondContact OG-N 3.26Å; S110-L113 PolarHBondContact O-N 3.17Å; S110-L113 PolarHBondContact OG-N 2.66Å; S110-R114 VanDerWaalsContact O-CB 3.23Å; S110-R114 WeakPolarHBondContact O-CB 3.42Å; S110-R114 WeakPolarHBondContact O-CG 3.28Å; S110-R114 PolarHBondContact O-N 3.43Å
111	S	94.7	Very high	97	Very high	98 Å²	98	48.1 Å²	48.1	69%	0.685	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-30.9	177.5	57.4	0	0	0	0	113.6
112	A	94.2	Very high	97	Very high	81 Å²	81	45.6 Å²	45.6	67%	0.669	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-30.6	179.8	0	0	0	0	0	113.1	S110	S110-A112 PolarHBondContact O-N 2.9Å; S110-A112 PolarHBondContact OG-N 3.26Å
113	L	95.7	Very high	96.8	Very high	23 Å²	23	45.8 Å²	45.8	12%	0.12	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.8	-19.8	-172.4	-53.2	177.6	0	0	0	113.5	L78 V107 S110 A115 I116	L78-L113 HydrophobicContact CB-CD1 4.12Å; L78-L113 HydrophobicContact CB-CD2 4.04Å; L78-L113 HydrophobicContact CD1-CD1 4.32Å; L78-L113 HydrophobicContact CD2-CD2 4.44Å; V107-L113 HydrophobicContact CG1-CB 4.02Å; V107-L113 WeakPolarHBondContact CG1-O 3.49Å; V107-L113 CarbonylContact O-C 3.52Å; S110-L113 PolarHBondContact O-N 3.17Å; S110-L113 PolarHBondContact OG-N 2.66Å; L113-A115 PolarHBondContact O-N 3.42Å; L113-I116 HydrophobicContact CD2-CD1 4.11Å; L113-I116 WeakPolarHBondContact O-CB 3.39Å; L113-I116 WeakPolarHBondContact O-CG1 3.39Å; L113-I116 PolarHBondContact O-N 3.15Å
114	R	95.4	Very high	96.7	Very high	157 Å²	157	49.8 Å²	49.8	59%	0.592	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-25.3	-172.2	66.3	-178.7	-176	-167.3	2	115.2	V107 K108 S110 I116	V107-R114 WeakPolarHBondContact O-CA 3.39Å; V107-R114 PolarHBondContact O-N 3.05Å; K108-R114 PolarHBondContact NZ-O 2.97Å; K108-R114 WeakPolarHBondContact O-CB 3.23Å; S110-R114 VanDerWaalsContact O-CB 3.23Å; S110-R114 WeakPolarHBondContact O-CB 3.42Å; S110-R114 WeakPolarHBondContact O-CG 3.28Å; S110-R114 PolarHBondContact O-N 3.43Å; R114-I116 VanDerWaalsContact C-N 3.29Å
115	A	94.3	Very high	96.5	Very high	92 Å²	92	55 Å²	55	76%	0.76	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-20	178.3	0	0	0	0	0	113.2	L113 P117	L113-A115 PolarHBondContact O-N 3.42Å; A115-P117 WeakPolarHBondContact O-CD 3.29Å
116	I	95.6	Very high	96.5	Very high	24 Å²	24	53.9 Å²	53.9	12%	0.123	31%	0.308	C	S	.	.	S	Bend	trans	-74.4	122.6	179.3	-53.9	173.9	0	0	0	108.3	L78 V86 I89 K108 L113 R114	L78-I116 HydrophobicContact CD2-CD1 4.4Å; V86-I116 HydrophobicContact CB-CD1 4.44Å; V86-I116 HydrophobicContact CG1-CG2 4.08Å; I89-I116 HydrophobicContact CD1-CG2 4.08Å; I89-I116 HydrophobicContact CG1-CG2 3.9Å; K108-I116 PolarHBondContact NZ-O 3.41Å; L113-I116 HydrophobicContact CD2-CD1 4.11Å; L113-I116 WeakPolarHBondContact O-CB 3.39Å; L113-I116 WeakPolarHBondContact O-CG1 3.39Å; L113-I116 PolarHBondContact O-N 3.15Å; R114-I116 VanDerWaalsContact C-N 3.29Å
117	P	96.6	Very high	96.4	Very high	18 Å²	18	54 Å²	54	12%	0.117	32%	0.317	C	S	.	.			trans	-65.7	139.5	173.2	26.5	-32.4	0	0	0	110.1	N87 M88 I89 A115 E139	N87-P117 WeakPolarHBondContact O-CD 3.43Å; N87-P117 WeakPolarHBondContact O-CG 3.3Å; M88-P117 WeakPolarHBondContact CA-O 3.38Å; M88-P117 HydrophobicContact CB-CG 4.11Å; M88-P117 HydrophobicContact CE-CB 4.46Å; M88-P117 HydrophobicContact CE-CG 4.28Å; M88-P117 HydrophobicContact CG-CG 4.37Å; I89-P117 PolarHBondContact N-O 3.24Å; A115-P117 WeakPolarHBondContact O-CD 3.29Å; P117-E139 HydrophobicContact CB-CB 3.88Å; P117-E139 HydrophobicContact CB-CG 3.94Å
118	V	98	Very high	96.4	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	121.7	-179.3	-178.5	0	0	0	0	108.3	I89 T91 L104 V107 I120 A138 E139	I89-V118 HydrophobicContact CB-CG2 4.28Å; I89-V118 HydrophobicContact CD1-CG2 4.35Å; I89-V118 HydrophobicContact CG2-CG1 4.46Å; I89-V118 CarbonylContact O-C 3.56Å; I89-V118 WeakPolarHBondContact O-CA 3.44Å; T91-V118 HydrophobicContact CG2-CG1 4.2Å; L104-V118 HydrophobicContact CB-CG1 4.31Å; L104-V118 HydrophobicContact CD1-CB 3.66Å; L104-V118 HydrophobicContact CD1-CG1 3.85Å; L104-V118 HydrophobicContact CD1-CG2 4.02Å; V107-V118 HydrophobicContact CB-CG2 4.18Å; V107-V118 HydrophobicContact CG1-CG2 3.68Å; V118-I120 HydrophobicContact CG1-CD1 4Å; V118-A138 CarbonylContact O-C 3.52Å; V118-A138 WeakPolarHBondContact O-CA 3.37Å; V118-E139 PolarHBondContact O-N 3.4Å
119	V	97.8	Very high	96.4	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	128	175.2	176.6	0	0	0	0	108.6	M88 I89 I90 T91 E139 D140 L142 L154	M88-V119 HydrophobicContact CE-CG2 3.94Å; M88-V119 HydrophobicContact CG-CG2 4.45Å; M88-V119 HydrophobicContact SD-CG2 3.9Å; I89-V119 PolarHBondContact O-N 3.12Å; I90-V119 CarbonylContact C-O 3.54Å; I90-V119 VanDerWaalsContact CA-O 3.31Å; I90-V119 WeakPolarHBondContact CA-O 3.49Å; I90-V119 HydrophobicContact CB-CB 4.41Å; I90-V119 HydrophobicContact CD1-CB 4.46Å; I90-V119 HydrophobicContact CD1-CG1 4.13Å; I90-V119 HydrophobicContact CG1-CB 4.09Å; I90-V119 HydrophobicContact CG1-CG1 4.11Å; T91-V119 PolarHBondContact N-O 3.13Å; V119-E139 HydrophobicContact CG2-CB 4.33Å; V119-D140 WeakPolarHBondContact CA-O 3.36Å; V119-D140 HydrophobicContact CG1-CB 4.17Å; V119-D140 HydrophobicContact CG2-CB 4.18Å; V119-L142 HydrophobicContact CG1-CD1 3.96Å; V119-L142 HydrophobicContact CG1-CG 3.91Å; V119-L154 HydrophobicContact CG1-CD1 4.32Å; V119-L154 HydrophobicContact CG1-CD2 4.41Å; V119-L154 HydrophobicContact CG2-CD1 4.2Å; V119-L154 HydrophobicContact CG2-CD2 3.86Å
120	I	98.3	Very high	96.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	138.5	178.2	-55.4	-58.8	0	0	0	109.6	T91 Y93 L104 V118 C133 A138 D140 F141 L142	T91-I120 HydrophobicContact CG2-CD1 3.4Å; T91-I120 CarbonylContact O-C 3.57Å; T91-I120 WeakPolarHBondContact O-CA 3.36Å; Y93-I120 HydrophobicContact CD2-CG2 4.05Å; Y93-I120 HydrophobicContact CG-CG2 4.45Å; L104-I120 HydrophobicContact CB-CD1 4.34Å; V118-I120 HydrophobicContact CG1-CD1 4Å; I120-C133 HydrophobicContact CG1-CB 4.16Å; I120-A138 HydrophobicContact CG1-CB 4.09Å; I120-D140 PolarHBondContact N-O 3.07Å; I120-F141 HydrophobicContact CB-CD2 3.68Å; I120-F141 HydrophobicContact CB-CE2 4Å; I120-F141 HydrophobicContact CB-CG 4.4Å; I120-F141 HydrophobicContact CG1-CD2 4.47Å; I120-F141 HydrophobicContact CG2-CD2 3.74Å; I120-F141 HydrophobicContact CG2-CE2 3.49Å; I120-F141 VanDerWaalsContact CG2-CE2 3.49Å; I120-F141 HydrophobicContact CG2-CZ 4.22Å; I120-F141 CarbonylContact O-C 3.52Å; I120-F141 WeakPolarHBondContact O-CA 3.34Å; I120-L142 PolarHBondContact O-N 2.87Å
121	M	98	Very high	96.5	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.01	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	144.3	169.4	-56.9	179.8	-65.3	0	0	109.2	I54 I90 T91 D92 Y93 L142 K144 V146	I54-M121 HydrophobicContact CB-SD 4.32Å; I54-M121 HydrophobicContact CD1-SD 4.05Å; I54-M121 HydrophobicContact CG1-CE 4.43Å; I54-M121 HydrophobicContact CG1-SD 3.84Å; I54-M121 HydrophobicContact CG2-CE 4.46Å; I90-M121 HydrophobicContact CD1-CG 3.99Å; I90-M121 HydrophobicContact CD1-SD 3.71Å; I90-M121 HydrophobicContact CG1-CE 4.01Å; I90-M121 HydrophobicContact CG1-CG 3.75Å; I90-M121 HydrophobicContact CG1-SD 3.68Å; T91-M121 PolarHBondContact O-N 2.91Å; D92-M121 CarbonylContact C-O 3.53Å; D92-M121 VanDerWaalsContact OD1-O 3.05Å; Y93-M121 WeakPolarHBondContact CB-O 3.31Å; Y93-M121 PolarHBondContact N-O 2.93Å; M121-L142 CarbonylContact C-O 3.59Å; M121-L142 VanDerWaalsContact CA-O 3.29Å; M121-L142 WeakPolarHBondContact CA-O 3.39Å; M121-K144 HydrophobicContact CB-CG 4.27Å; M121-V146 HydrophobicContact CG-CG2 4.02Å; M121-V146 HydrophobicContact SD-CG2 3.75Å
122	S	97.4	Very high	96.6	Very high	1 Å²	1	57 Å²	57	1%	0.007	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	139.6	176.5	172.3	0	0	0	0	111.2	E124 L142 L143 K144	S122-E124 PolarHBondContact OG-N 2.94Å; S122-E124 PolarHBondContact OG-O 2.86Å; S122-L142 PolarHBondContact N-O 3.44Å; S122-L143 CarbonylContact O-C 3.53Å; S122-L143 WeakPolarHBondContact O-CA 3.49Å; S122-K144 PolarHBondContact O-N 3.01Å
123	S	95.9	Very high	96.8	Very high	86 Å²	86	53.1 Å²	53.1	60%	0.601	29%	0.289	S	S	*	.	S	Bend	trans	-73.8	-17.6	169.9	-60.3	0	0	0	0	113	K144	S123-K144 WeakPolarHBondContact OG-CD 3.31Å
124	E	95.3	Very high	96.9	Very high	85 Å²	85	55.9 Å²	55.9	40%	0.397	30%	0.304	S	S	.	.	S	Bend	trans	-106.8	137.5	-178	-62.7	171.3	-164.2	0	0	111.4	S122 V126 R129 L143	S122-E124 PolarHBondContact OG-N 2.94Å; S122-E124 PolarHBondContact OG-O 2.86Å; E124-V126 HydrophobicContact CB-CG2 4.18Å; E124-R129 IonicContact OE2-CZ 3.7Å; E124-R129 IonicContact OE2-NH1 2.91Å; E124-R129 PolarHBondContact OE2-NH1 3.35Å; E124-R129 IonicContact OE2-NH2 2.93Å; E124-R129 PolarHBondContact OE2-NH2 2.83Å; E124-L143 WeakPolarHBondContact O-CD2 3.39Å
125	N	95.6	Very high	97	Very high	109 Å²	109	55.9 Å²	55.9	58%	0.583	31%	0.311	S	S	*	.			trans	-99.6	82	175.2	-172.9	7.8	0	0	0	110.8	I130 L143	N125-I130 WeakPolarHBondContact OD1-CD1 3.48Å; N125-L143 HydrophobicContact CB-CD1 3.78Å; N125-L143 HydrophobicContact CB-CD2 3.85Å
126	V	97	Very high	97.2	Very high	48 Å²	48	54.2 Å²	54.2	29%	0.291	29%	0.287	S	S	.	.			trans	-111.4	106.4	-179.9	-179.6	0	0	0	0	109.1	E124 T128 R129 I130	E124-V126 HydrophobicContact CB-CG2 4.18Å; V126-T128 VanDerWaalsContact C-N 3.31Å; V126-T128 WeakPolarHBondContact CG1-OG1 3.46Å; V126-T128 PolarHBondContact O-N 2.77Å; V126-R129 HydrophobicContact CB-CB 3.99Å; V126-R129 HydrophobicContact CG1-CB 4.13Å; V126-R129 WeakPolarHBondContact O-CB 3.34Å; V126-R129 PolarHBondContact O-N 3.03Å; V126-I130 WeakPolarHBondContact O-CG1 3.14Å; V126-I130 PolarHBondContact O-N 2.79Å; V126-I130 VanDerWaalsContact O-N 3.13Å
127	P	96.8	Very high	97.3	Very high	90 Å²	90	54.7 Å²	54.7	58%	0.584	30%	0.298	S	S	*	.	H	α-helix	trans	-54.5	-42.3	-173.5	-30.1	35.9	0	0	0	114.2	R129 I130 S131	P127-R129 VanDerWaalsContact C-N 3.27Å; P127-R129 PolarHBondContact O-N 2.77Å; P127-I130 PolarHBondContact O-N 2.75Å; P127-S131 PolarHBondContact O-N 2.95Å; P127-S131 PolarHBondContact O-OG 3.33Å
128	T	97.2	Very high	97.3	Very high	94 Å²	94	54.3 Å²	54.3	58%	0.577	30%	0.296	S	S	*	.	H	α-helix	trans	-63.9	-31.3	179.1	52.2	0	0	0	0	113	V126 R132	V126-T128 VanDerWaalsContact C-N 3.31Å; V126-T128 WeakPolarHBondContact CG1-OG1 3.46Å; V126-T128 PolarHBondContact O-N 2.77Å; T128-R132 WeakPolarHBondContact O-CB 3.42Å; T128-R132 WeakPolarHBondContact O-CG 3.37Å; T128-R132 PolarHBondContact O-N 3.26Å; T128-R132 VanDerWaalsContact O-N 3.11Å
129	R	96.9	Very high	97.3	Very high	27 Å²	27	57.8 Å²	57.8	10%	0.102	31%	0.313	C	S	.	.	H	α-helix	trans	-71.6	-45.4	174.8	179.2	-174.7	-66.3	159.4	9.2	111.2	Y93 E124 V126 P127 S131 R132 C133 F141	Y93-R129 HydrophobicContact CD2-CG 3.85Å; Y93-R129 HydrophobicContact CE1-CG 4.3Å; Y93-R129 HydrophobicContact CE2-CG 3.29Å; Y93-R129 VanDerWaalsContact CZ-NE 3.26Å; E124-R129 IonicContact OE2-CZ 3.7Å; E124-R129 IonicContact OE2-NH1 2.91Å; E124-R129 PolarHBondContact OE2-NH1 3.35Å; E124-R129 IonicContact OE2-NH2 2.93Å; E124-R129 PolarHBondContact OE2-NH2 2.83Å; V126-R129 HydrophobicContact CB-CB 3.99Å; V126-R129 HydrophobicContact CG1-CB 4.13Å; V126-R129 WeakPolarHBondContact O-CB 3.34Å; V126-R129 PolarHBondContact O-N 3.03Å; P127-R129 VanDerWaalsContact C-N 3.27Å; P127-R129 PolarHBondContact O-N 2.77Å; R129-S131 VanDerWaalsContact C-N 3.34Å; R129-R132 PolarHBondContact O-N 3.45Å; R129-C133 PolarHBondContact O-N 3.29Å; R129-C133 PolarHBondContact O-SG 2.85Å; R129-F141 HydrophobicContact CG-CE2 4.35Å; R129-F141 HydrophobicContact CG-CZ 4.48Å
130	I	97.5	Very high	97.2	Very high	38 Å²	38	59.3 Å²	59.3	20%	0.195	32%	0.321	C	S	.	.	H	α-helix	trans	-57.9	-51.5	178.1	-60.6	174.1	0	0	0	108.9	N125 V126 P127 R132 C133 L134 F141	N125-I130 WeakPolarHBondContact OD1-CD1 3.48Å; V126-I130 WeakPolarHBondContact O-CG1 3.14Å; V126-I130 PolarHBondContact O-N 2.79Å; V126-I130 VanDerWaalsContact O-N 3.13Å; P127-I130 PolarHBondContact O-N 2.75Å; I130-R132 PolarHBondContact O-N 2.78Å; I130-C133 PolarHBondContact O-N 3.21Å; I130-L134 HydrophobicContact CG2-CD1 3.98Å; I130-L134 WeakPolarHBondContact O-CG 3.31Å; I130-L134 PolarHBondContact O-N 3.41Å; I130-F141 HydrophobicContact CB-CG 4.4Å; I130-F141 HydrophobicContact CD1-CD1 4.2Å; I130-F141 HydrophobicContact CD1-CE1 4.19Å; I130-F141 HydrophobicContact CG1-CD1 3.72Å; I130-F141 HydrophobicContact CG1-CD2 4.3Å; I130-F141 HydrophobicContact CG1-CE1 3.64Å; I130-F141 HydrophobicContact CG1-CE2 4.23Å; I130-F141 HydrophobicContact CG1-CG 4.05Å; I130-F141 HydrophobicContact CG1-CZ 3.9Å; I130-F141 HydrophobicContact CG2-CB 4.02Å; I130-F141 HydrophobicContact CG2-CD1 4.35Å; I130-F141 HydrophobicContact CG2-CD2 4.48Å; I130-F141 HydrophobicContact CG2-CG 4.05Å
131	S	97.8	Very high	97.1	Very high	57 Å²	57	60.3 Å²	60.3	40%	0.399	33%	0.325	S	S	.	.	H	α-helix	trans	-55.9	-48.1	177	-61.6	0	0	0	0	112.2	P127 R129 C133 L134 E135	P127-S131 PolarHBondContact O-N 2.95Å; P127-S131 PolarHBondContact O-OG 3.33Å; R129-S131 VanDerWaalsContact C-N 3.34Å; S131-C133 VanDerWaalsContact C-N 3.34Å; S131-C133 PolarHBondContact O-N 2.82Å; S131-L134 PolarHBondContact O-N 2.94Å; S131-E135 WeakPolarHBondContact O-CB 3.41Å; S131-E135 VanDerWaalsContact O-CG 3.26Å; S131-E135 WeakPolarHBondContact O-CG 3.15Å; S131-E135 PolarHBondContact O-N 3.44Å
132	R	97.8	Very high	97	Very high	164 Å²	164	60.9 Å²	60.9	62%	0.619	33%	0.328	S	S	*	.	H	α-helix	trans	-59.4	-40.8	178.1	-77.4	174	-179	-166.7	0.5	113.4	Y101 T128 R129 I130 E136	Y101-R132 HydrophobicContact CE2-CB 4.48Å; T128-R132 WeakPolarHBondContact O-CB 3.42Å; T128-R132 WeakPolarHBondContact O-CG 3.37Å; T128-R132 PolarHBondContact O-N 3.26Å; T128-R132 VanDerWaalsContact O-N 3.11Å; R129-R132 PolarHBondContact O-N 3.45Å; I130-R132 PolarHBondContact O-N 2.78Å; R132-E136 WeakPolarHBondContact O-CB 3.36Å; R132-E136 PolarHBondContact O-N 3.12Å; R132-E136 VanDerWaalsContact O-N 3.09Å
133	C	98.2	Very high	97	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-66.2	-43.6	178.2	-63.8	0	0	0	0	111.2	L104 I120 R129 I130 S131 E136 G137 A138 F141	L104-C133 HydrophobicContact CD2-CB 4.4Å; L104-C133 WeakPolarHBondContact CD2-O 3.2Å; I120-C133 HydrophobicContact CG1-CB 4.16Å; R129-C133 PolarHBondContact O-N 3.29Å; R129-C133 PolarHBondContact O-SG 2.85Å; I130-C133 PolarHBondContact O-N 3.21Å; S131-C133 VanDerWaalsContact C-N 3.34Å; S131-C133 PolarHBondContact O-N 2.82Å; C133-E136 PolarHBondContact O-N 3.45Å; C133-G137 PolarHBondContact O-N 2.74Å; C133-A138 HydrophobicContact CB-CB 4.16Å; C133-A138 WeakPolarHBondContact O-CB 3.45Å; C133-A138 PolarHBondContact O-N 3.05Å; C133-F141 HydrophobicContact CB-CD2 3.95Å; C133-F141 HydrophobicContact CB-CE2 4.32Å
134	L	97.8	Very high	97	Very high	81 Å²	81	61.5 Å²	61.5	42%	0.424	32%	0.323	S	S	.	.	H	α-helix	trans	-66.9	-40.6	178.8	-64.2	174.1	0	0	0	111.7	I130 S131 E136 G137 A138	I130-L134 HydrophobicContact CG2-CD1 3.98Å; I130-L134 WeakPolarHBondContact O-CG 3.31Å; I130-L134 PolarHBondContact O-N 3.41Å; S131-L134 PolarHBondContact O-N 2.94Å; L134-E136 VanDerWaalsContact C-N 3.31Å; L134-E136 PolarHBondContact O-N 3.01Å; L134-G137 WeakPolarHBondContact O-CA 3.36Å; L134-G137 PolarHBondContact O-N 3.23Å; L134-A138 HydrophobicContact CD2-CB 4.45Å
135	E	98	Very high	97	Very high	158 Å²	158	62.8 Å²	62.8	74%	0.738	34%	0.338	S	S	*	.	H	α-helix	trans	-62.4	-36	175.5	-74.8	167.2	-169.9	0	0	112.6	S131 G137	S131-E135 WeakPolarHBondContact O-CB 3.41Å; S131-E135 VanDerWaalsContact O-CG 3.26Å; S131-E135 WeakPolarHBondContact O-CG 3.15Å; S131-E135 PolarHBondContact O-N 3.44Å; E135-G137 PolarHBondContact O-N 3.04Å
136	E	98	Very high	96.9	Very high	56 Å²	56	58.2 Å²	58.2	26%	0.262	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-10.5	174.1	-163.9	70.6	-135.7	0	0	112.8	Y101 L104 K105 R132 C133 L134	Y101-E136 HydrophobicContact CE2-CB 3.87Å; Y101-E136 HydrophobicContact CE2-CG 3.97Å; Y101-E136 PolarHBondContact OH-OE2 2.95Å; L104-E136 HydrophobicContact CD2-CB 3.8Å; L104-E136 HydrophobicContact CD2-CG 3.97Å; L104-E136 HydrophobicContact CG-CB 4.38Å; L104-E136 HydrophobicContact CG-CG 4.06Å; K105-E136 WeakPolarHBondContact CE-OE1 3.26Å; K105-E136 HydrophobicContact CG-CG 3.78Å; R132-E136 WeakPolarHBondContact O-CB 3.36Å; R132-E136 PolarHBondContact O-N 3.12Å; R132-E136 VanDerWaalsContact O-N 3.09Å; C133-E136 PolarHBondContact O-N 3.45Å; L134-E136 VanDerWaalsContact C-N 3.31Å; L134-E136 PolarHBondContact O-N 3.01Å
137	G	97.5	Very high	96.7	Very high	34 Å²	34	63 Å²	63	35%	0.351	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	102.9	21.7	176.3	0	0	0	0	0	114.9	K108 C133 L134 E135	K108-G137 WeakPolarHBondContact CE-O 3.2Å; C133-G137 PolarHBondContact O-N 2.74Å; L134-G137 WeakPolarHBondContact O-CA 3.36Å; L134-G137 PolarHBondContact O-N 3.23Å; E135-G137 PolarHBondContact O-N 3.04Å
138	A	97.6	Very high	96.5	Very high	10 Å²	10	62.4 Å²	62.4	8%	0.083	32%	0.324	C	S	.	.			trans	-59.4	137.2	164.5	0	0	0	0	0	110.1	L104 V118 I120 C133 L134	L104-A138 HydrophobicContact CD1-CB 4.28Å; L104-A138 HydrophobicContact CD2-CB 3.85Å; V118-A138 CarbonylContact O-C 3.52Å; V118-A138 WeakPolarHBondContact O-CA 3.37Å; I120-A138 HydrophobicContact CG1-CB 4.09Å; C133-A138 HydrophobicContact CB-CB 4.16Å; C133-A138 WeakPolarHBondContact O-CB 3.45Å; C133-A138 PolarHBondContact O-N 3.05Å; L134-A138 HydrophobicContact CD2-CB 4.45Å
139	E	96.4	Very high	96.3	Very high	74 Å²	74	60.3 Å²	60.3	35%	0.346	32%	0.316	S	S	.	.	S	Bend	trans	-73.1	-35.4	179.8	-179.2	61.8	-141.9	0	0	111.6	P117 V118 V119 R157	P117-E139 HydrophobicContact CB-CB 3.88Å; P117-E139 HydrophobicContact CB-CG 3.94Å; V118-E139 PolarHBondContact O-N 3.4Å; V119-E139 HydrophobicContact CG2-CB 4.33Å; E139-R157 HydrophobicContact CG-CB 3.97Å; E139-R157 HydrophobicContact CG-CG 4.24Å; E139-R157 WeakPolarHBondContact OE1-CD 3.44Å; E139-R157 WeakPolarHBondContact OE1-CG 3.45Å; E139-R157 IonicContact OE1-NE 3.3Å; E139-R157 PolarHBondContact OE1-NE 3.3Å
140	D	95.8	Very high	96.1	Very high	32 Å²	32	59.9 Å²	59.9	17%	0.171	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	167.5	175	-144.9	-28.3	0	0	0	110.7	V119 I120 L154 R157	V119-D140 WeakPolarHBondContact CA-O 3.36Å; V119-D140 HydrophobicContact CG1-CB 4.17Å; V119-D140 HydrophobicContact CG2-CB 4.18Å; I120-D140 PolarHBondContact N-O 3.07Å; D140-L154 HydrophobicContact CB-CD2 3.99Å; D140-R157 IonicContact OD2-CZ 3.1Å; D140-R157 IonicContact OD2-NH1 2.81Å; D140-R157 PolarHBondContact OD2-NH1 3.11Å; D140-R157 IonicContact OD2-NH2 2.7Å; D140-R157 PolarHBondContact OD2-NH2 3.21Å
141	F	96.7	Very high	95.7	Very high	21 Å²	21	58 Å²	58	9%	0.092	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	119.9	174.9	-166.5	-72.4	0	0	0	110.2	Y93 I120 R129 I130 C133 L143	Y93-F141 HydrophobicContact CD2-CE2 4.49Å; I120-F141 HydrophobicContact CB-CD2 3.68Å; I120-F141 HydrophobicContact CB-CE2 4Å; I120-F141 HydrophobicContact CB-CG 4.4Å; I120-F141 HydrophobicContact CG1-CD2 4.47Å; I120-F141 HydrophobicContact CG2-CD2 3.74Å; I120-F141 HydrophobicContact CG2-CE2 3.49Å; I120-F141 VanDerWaalsContact CG2-CE2 3.49Å; I120-F141 HydrophobicContact CG2-CZ 4.22Å; I120-F141 CarbonylContact O-C 3.52Å; I120-F141 WeakPolarHBondContact O-CA 3.34Å; R129-F141 HydrophobicContact CG-CE2 4.35Å; R129-F141 HydrophobicContact CG-CZ 4.48Å; I130-F141 HydrophobicContact CB-CG 4.4Å; I130-F141 HydrophobicContact CD1-CD1 4.2Å; I130-F141 HydrophobicContact CD1-CE1 4.19Å; I130-F141 HydrophobicContact CG1-CD1 3.72Å; I130-F141 HydrophobicContact CG1-CD2 4.3Å; I130-F141 HydrophobicContact CG1-CE1 3.64Å; I130-F141 HydrophobicContact CG1-CE2 4.23Å; I130-F141 HydrophobicContact CG1-CG 4.05Å; I130-F141 HydrophobicContact CG1-CZ 3.9Å; I130-F141 HydrophobicContact CG2-CB 4.02Å; I130-F141 HydrophobicContact CG2-CD1 4.35Å; I130-F141 HydrophobicContact CG2-CD2 4.48Å; I130-F141 HydrophobicContact CG2-CG 4.05Å; C133-F141 HydrophobicContact CB-CD2 3.95Å; C133-F141 HydrophobicContact CB-CE2 4.32Å; F141-L143 HydrophobicContact CE1-CD2 4.23Å
142	L	96.6	Very high	95.1	Very high	14 Å²	14	58.6 Å²	58.6	7%	0.073	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	138.8	-176.3	-56.3	-176.6	0	0	0	111.3	I90 V119 I120 M121 S122 V146 D150 L154	I90-L142 HydrophobicContact CD1-CD1 4.34Å; V119-L142 HydrophobicContact CG1-CD1 3.96Å; V119-L142 HydrophobicContact CG1-CG 3.91Å; I120-L142 PolarHBondContact O-N 2.87Å; M121-L142 CarbonylContact C-O 3.59Å; M121-L142 VanDerWaalsContact CA-O 3.29Å; M121-L142 WeakPolarHBondContact CA-O 3.39Å; S122-L142 PolarHBondContact N-O 3.44Å; L142-V146 HydrophobicContact CB-CG2 4.21Å; L142-V146 HydrophobicContact CD1-CG1 4.05Å; L142-V146 HydrophobicContact CD1-CG2 4.4Å; L142-D150 HydrophobicContact CD1-CB 4.21Å; L142-D150 HydrophobicContact CD2-CB 4.16Å; L142-L154 HydrophobicContact CD1-CD1 4.29Å
143	L	96.7	Very high	94.5	Very high	70 Å²	70	58.5 Å²	58.5	37%	0.366	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	135	169.9	-69	175.7	0	0	0	110.7	S122 E124 N125 F141 P145	S122-L143 CarbonylContact O-C 3.53Å; S122-L143 WeakPolarHBondContact O-CA 3.49Å; E124-L143 WeakPolarHBondContact O-CD2 3.39Å; N125-L143 HydrophobicContact CB-CD1 3.78Å; N125-L143 HydrophobicContact CB-CD2 3.85Å; F141-L143 HydrophobicContact CE1-CD2 4.23Å; L143-P145 CarbonylContact O-C 3.53Å
144	K	96.2	Very high	93.9	Very high	30 Å²	30	58.6 Å²	58.6	13%	0.13	31%	0.31	C	S	.	.	S	Bend	trans	-74.4	146.4	171.8	-66	179.4	174	-171.9	0	109.9	D45 D50 D92 M121 S122 S123 V146	D45-K144 IonicContact OD1-NZ 2.78Å; D45-K144 WeakPolarHBondContact OD2-CE 3.41Å; D45-K144 IonicContact OD2-NZ 2.83Å; D45-K144 PolarHBondContact OD2-NZ 3.12Å; D50-K144 IonicContact OD2-NZ 3.71Å; D50-K144 PolarHBondContact OD2-NZ 3.05Å; D92-K144 VanDerWaalsContact OD1-CE 3.31Å; D92-K144 WeakPolarHBondContact OD1-CE 3.45Å; D92-K144 IonicContact OD1-NZ 3.74Å; D92-K144 PolarHBondContact OD1-NZ 2.81Å; D92-K144 IonicContact OD2-NZ 3.13Å; D92-K144 PolarHBondContact OD2-NZ 3.21Å; M121-K144 HydrophobicContact CB-CG 4.27Å; S122-K144 PolarHBondContact O-N 3.01Å; S123-K144 WeakPolarHBondContact OG-CD 3.31Å; K144-V146 HydrophobicContact CG-CG2 4.49Å
145	P	94	Very high	92.7	Very high	111 Å²	111	57.8 Å²	57.8	72%	0.721	31%	0.311	S	S	*	.	S	Bend	cis	-74.5	130.1	-2.3	30.8	-34	0	0	0	111.6	L143	L143-P145 CarbonylContact O-C 3.53Å
146	V	94	Very high	91.5	Very high	14 Å²	14	55.3 Å²	55.3	9%	0.085	31%	0.311	C	S	.	.	P	Polyproline II helix	trans	-66.7	134.8	176.6	179.3	0	0	0	0	109.2	I54 I57 M121 L142 K144 D150 V151	I54-V146 HydrophobicContact CD1-CB 4.12Å; I54-V146 HydrophobicContact CD1-CG1 3.73Å; I54-V146 HydrophobicContact CD1-CG2 4.49Å; I57-V146 WeakPolarHBondContact CD1-O 3.34Å; M121-V146 HydrophobicContact CG-CG2 4.02Å; M121-V146 HydrophobicContact SD-CG2 3.75Å; L142-V146 HydrophobicContact CB-CG2 4.21Å; L142-V146 HydrophobicContact CD1-CG1 4.05Å; L142-V146 HydrophobicContact CD1-CG2 4.4Å; K144-V146 HydrophobicContact CG-CG2 4.49Å; V146-D150 HydrophobicContact CG1-CB 4.18Å; V146-V151 HydrophobicContact CG1-CG2 4.18Å
147	R	94	Very high	90.2	Very high	147 Å²	147	56.3 Å²	56.3	56%	0.555	31%	0.312	S	S	*	.			trans	-109.6	158.3	-179.5	-55.1	165	-61.8	177.4	4.4	110.3	A149 D150 V151	R147-A149 PolarHBondContact O-N 2.81Å; R147-A149 VanDerWaalsContact O-N 3.12Å; R147-D150 WeakPolarHBondContact CA-OD2 3.5Å; R147-D150 VanDerWaalsContact CB-OD2 3.27Å; R147-D150 WeakPolarHBondContact CB-OD2 3.31Å; R147-D150 IonicContact CZ-OD1 2.71Å; R147-D150 IonicContact CZ-OD2 3.21Å; R147-D150 PolarHBondContact N-OD2 3.4Å; R147-D150 IonicContact NE-OD1 3.88Å; R147-D150 IonicContact NE-OD2 3.15Å; R147-D150 PolarHBondContact NE-OD2 3.1Å; R147-D150 VanDerWaalsContact NE-OD2 3.13Å; R147-D150 IonicContact NH2-OD1 3.65Å; R147-D150 PolarHBondContact NH2-OD1 3.28Å; R147-D150 IonicContact NH2-OD2 2.71Å; R147-D150 WeakPolarHBondContact O-CB 3.49Å; R147-D150 PolarHBondContact O-N 2.99Å; R147-V151 PolarHBondContact O-N 3.09Å
148	P	92.8	Very high	88.8	Confident	78 Å²	78	55.7 Å²	55.7	51%	0.506	30%	0.301	S	S	.	.	H	α-helix	trans	-52.6	-34.6	173.8	-27.8	35.2	0	0	0	114.5	I57 D150 V151 S152	I57-P148 HydrophobicContact CG1-CG 4.38Å; I57-P148 HydrophobicContact CG2-CB 4.26Å; I57-P148 HydrophobicContact CG2-CG 4.24Å; P148-D150 PolarHBondContact O-N 3.5Å; P148-V151 PolarHBondContact O-N 2.76Å; P148-S152 PolarHBondContact O-N 3.18Å
149	A	92.8	Very high	86.9	Confident	50 Å²	50	67.8 Å²	67.8	41%	0.413	34%	0.344	S	S	.	.	H	α-helix	trans	-69.5	-18.2	177.6	0	0	0	0	0	114.3	R147 S152 R153	R147-A149 PolarHBondContact O-N 2.81Å; R147-A149 VanDerWaalsContact O-N 3.12Å; A149-S152 WeakPolarHBondContact CA-OG 3.38Å; A149-S152 PolarHBondContact O-OG 3.2Å; A149-R153 WeakPolarHBondContact O-CG 3.49Å; A149-R153 PolarHBondContact O-NE 2.98Å
150	D	92.4	Very high	86.4	Confident	18 Å²	18	67.5 Å²	67.5	10%	0.096	34%	0.344	C	S	.	.	H	α-helix	trans	-80.6	-43.2	174.9	-54	-46.6	0	0	0	108.9	L142 V146 R147 P148 S152 R153	L142-D150 HydrophobicContact CD1-CB 4.21Å; L142-D150 HydrophobicContact CD2-CB 4.16Å; V146-D150 HydrophobicContact CG1-CB 4.18Å; R147-D150 WeakPolarHBondContact CA-OD2 3.5Å; R147-D150 VanDerWaalsContact CB-OD2 3.27Å; R147-D150 WeakPolarHBondContact CB-OD2 3.31Å; R147-D150 IonicContact CZ-OD1 2.71Å; R147-D150 IonicContact CZ-OD2 3.21Å; R147-D150 PolarHBondContact N-OD2 3.4Å; R147-D150 IonicContact NE-OD1 3.88Å; R147-D150 IonicContact NE-OD2 3.15Å; R147-D150 PolarHBondContact NE-OD2 3.1Å; R147-D150 VanDerWaalsContact NE-OD2 3.13Å; R147-D150 IonicContact NH2-OD1 3.65Å; R147-D150 PolarHBondContact NH2-OD1 3.28Å; R147-D150 IonicContact NH2-OD2 2.71Å; R147-D150 WeakPolarHBondContact O-CB 3.49Å; R147-D150 PolarHBondContact O-N 2.99Å; P148-D150 PolarHBondContact O-N 3.5Å; D150-S152 PolarHBondContact O-N 2.94Å; D150-R153 WeakPolarHBondContact O-CB 3.34Å; D150-R153 PolarHBondContact O-N 2.78Å
151	V	89.1	Confident	86	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-65	-36	176	170.2	0	0	0	0	112.8	I54 I57 L58 Y63 V146 R147 P148 R153 L154	I54-V151 HydrophobicContact CD1-CG2 4.22Å; I57-V151 HydrophobicContact CG2-CB 3.96Å; I57-V151 HydrophobicContact CG2-CG1 4.48Å; I57-V151 HydrophobicContact CG2-CG2 3.6Å; L58-V151 HydrophobicContact CD2-CG1 3.86Å; L58-V151 HydrophobicContact CD2-CG2 4.2Å; Y63-V151 HydrophobicContact CD2-CG1 4.39Å; Y63-V151 HydrophobicContact CE2-CG1 3.88Å; V146-V151 HydrophobicContact CG1-CG2 4.18Å; R147-V151 PolarHBondContact O-N 3.09Å; P148-V151 PolarHBondContact O-N 2.76Å; V151-R153 PolarHBondContact O-N 3.22Å; V151-R153 VanDerWaalsContact O-N 3.13Å; V151-L154 WeakPolarHBondContact O-CB 3.26Å; V151-L154 PolarHBondContact O-N 3.31Å
152	S	84.7	Confident	85.4	Confident	69 Å²	69	72 Å²	72	48%	0.483	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-24.3	176.6	60.8	0	0	0	0	113.3	P148 A149 D150 L154	P148-S152 PolarHBondContact O-N 3.18Å; A149-S152 WeakPolarHBondContact CA-OG 3.38Å; A149-S152 PolarHBondContact O-OG 3.2Å; D150-S152 PolarHBondContact O-N 2.94Å; S152-L154 VanDerWaalsContact C-N 3.31Å
153	R	86.2	Confident	84.7	Confident	162 Å²	162	75.4 Å²	75.4	61%	0.611	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-13.1	176.3	-58.3	168	-172.9	-117.3	-0.8	112.7	A149 D150 V151 R157	A149-R153 WeakPolarHBondContact O-CG 3.49Å; A149-R153 PolarHBondContact O-NE 2.98Å; D150-R153 WeakPolarHBondContact O-CB 3.34Å; D150-R153 PolarHBondContact O-N 2.78Å; V151-R153 PolarHBondContact O-N 3.22Å; V151-R153 VanDerWaalsContact O-N 3.13Å; R153-R157 PolarHBondContact O-NH1 3.13Å
154	L	84.1	Confident	83.9	Confident	1 Å²	1	75.8 Å²	75.8	1%	0.005	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-19.7	175.9	-57.3	-179.3	0	0	0	111.8	M88 I90 V119 D140 L142 V151 S152 S156 R157 I158	M88-L154 HydrophobicContact CE-CB 4.13Å; M88-L154 HydrophobicContact SD-CB 4.44Å; M88-L154 HydrophobicContact SD-CD1 4.11Å; I90-L154 HydrophobicContact CD1-CD1 4.46Å; V119-L154 HydrophobicContact CG1-CD1 4.32Å; V119-L154 HydrophobicContact CG1-CD2 4.41Å; V119-L154 HydrophobicContact CG2-CD1 4.2Å; V119-L154 HydrophobicContact CG2-CD2 3.86Å; D140-L154 HydrophobicContact CB-CD2 3.99Å; L142-L154 HydrophobicContact CD1-CD1 4.29Å; V151-L154 WeakPolarHBondContact O-CB 3.26Å; V151-L154 PolarHBondContact O-N 3.31Å; S152-L154 VanDerWaalsContact C-N 3.31Å; L154-S156 PolarHBondContact O-N 3.23Å; L154-S156 VanDerWaalsContact O-N 3.15Å; L154-R157 WeakPolarHBondContact O-CB 3.21Å; L154-R157 PolarHBondContact O-N 3.36Å; L154-I158 PolarHBondContact O-N 2.7Å
155	C	73.3	Confident	83.1	Confident	65 Å²	65	78.8 Å²	78.8	44%	0.439	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-33	179.8	-65.6	0	0	0	0	113.4	Y63 R157	Y63-C155 WeakPolarHBondContact OH-CA 3.19Å; Y63-C155 PolarHBondContact OH-SG 2.93Å; C155-R157 PolarHBondContact O-N 2.71Å
156	S	73.6	Confident	82.4	Confident	106 Å²	106	76.5 Å²	76.5	74%	0.741	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-6.5	178.9	61	0	0	0	0	114.3	L154	L154-S156 PolarHBondContact O-N 3.23Å; L154-S156 VanDerWaalsContact O-N 3.15Å
157	R	69.4	Low	81.5	Confident	77 Å²	77	81.3 Å²	81.3	29%	0.291	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.6	-12.7	-171.4	-65.4	165.3	159.1	138.4	-23.7	113.3	E139 D140 R153 L154 C155	E139-R157 HydrophobicContact CG-CB 3.97Å; E139-R157 HydrophobicContact CG-CG 4.24Å; E139-R157 WeakPolarHBondContact OE1-CD 3.44Å; E139-R157 WeakPolarHBondContact OE1-CG 3.45Å; E139-R157 IonicContact OE1-NE 3.3Å; E139-R157 PolarHBondContact OE1-NE 3.3Å; D140-R157 IonicContact OD2-CZ 3.1Å; D140-R157 IonicContact OD2-NH1 2.81Å; D140-R157 PolarHBondContact OD2-NH1 3.11Å; D140-R157 IonicContact OD2-NH2 2.7Å; D140-R157 PolarHBondContact OD2-NH2 3.21Å; R153-R157 PolarHBondContact O-NH1 3.13Å; L154-R157 WeakPolarHBondContact O-CB 3.21Å; L154-R157 PolarHBondContact O-N 3.36Å; C155-R157 PolarHBondContact O-N 2.71Å
158	I	68	Low	80.4	Confident	20 Å²	20	75.8 Å²	75.8	10%	0.103	39%	0.39	C	S	.	.			trans	-88.2	111.3	176.6	-62.4	174.3	0	0	0	107.6	K39 V41 Y63 N87 M88 L154	K39-I158 HydrophobicContact CB-CG2 3.85Å; K39-I158 HydrophobicContact CD-CG2 3.74Å; K39-I158 HydrophobicContact CG-CG2 3.67Å; V41-I158 HydrophobicContact CG2-CD1 4.49Å; Y63-I158 HydrophobicContact CD1-CD1 4.17Å; Y63-I158 HydrophobicContact CE1-CD1 3.3Å; Y63-I158 WeakPolarHBondContact OH-CD1 3.44Å; N87-I158 HydrophobicContact CB-CG2 3.67Å; M88-I158 HydrophobicContact CB-CD1 4.24Å; M88-I158 HydrophobicContact CB-CG1 4.22Å; M88-I158 HydrophobicContact CE-CD1 3.74Å; M88-I158 HydrophobicContact CE-CG1 3.32Å; M88-I158 HydrophobicContact SD-CD1 3.88Å; M88-I158 HydrophobicContact SD-CG1 4.11Å; L154-I158 PolarHBondContact O-N 2.7Å
159	R	58.7	Low	79.3	Confident	264 Å²	264	75.6 Å²	75.6	100%	0.996	38%	0.38	S	S	*	.			trans	-78.8	0	175.6	-65	-176.9	-176.6	170.7	2.1	111.1	K39	K39-R159 PolarHBondContact NZ-O 3.33Å; K39-R159 PolarHBondContact NZ-OXT 3.15Å

Retrieved 159 of 159 residues in 38.3 ms (Link to these results)

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