A0A096N676_PAPAN Loading...

18S rRNA (pseudouridine(1248)-N1)-methyltransferase

AlphaFold DB (A0A096N4W5), UniProt , Accession A0A096N676, Species PAPAN (Papio anubis, Olive baboon), Gene EMG1, Length 244 aa.

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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	40.8	Very low	41.5	Very low	246 Å²	246	146.4 Å²	146.4	100%	1.212	87%	0.871	S	S	*	*				0	131.6	0	-70.9	-173.1	-157.1	0	0	107.9
2	A	41.7	Very low	41.4	Very low	111 Å²	111	150.1 Å²	150.1	92%	0.917	87%	0.872	S	S	*	*			trans	-70.2	151.1	-172.9	0	0	0	0	0	112.9
3	A	41.1	Very low	41.4	Very low	96 Å²	96	158.1 Å²	158.1	79%	0.793	88%	0.879	S	S	*	*			trans	-126.6	147.1	163.4	0	0	0	0	0	109.4
4	P	45	Very low	41.4	Very low	125 Å²	125	155.6 Å²	155.6	81%	0.812	88%	0.878	S	S	*	*			trans	-94.7	157.1	-146.7	35.3	-32.3	0	0	0	114.6	G6	P4-G6 PolarHBondContact O-N 2.87Å
5	S	48.9	Very low	40.9	Very low	126 Å²	126	149.3 Å²	149.3	88%	0.881	86%	0.861	S	S	*	*			trans	-68.6	106.9	172.3	37.2	0	0	0	0	111.9
6	G	39	Very low	40.8	Very low	76 Å²	76	145 Å²	145	78%	0.784	86%	0.859	S	S	*	*			trans	-100	101.8	168.4	0	0	0	0	0	110.7	P4 F8	P4-G6 PolarHBondContact O-N 2.87Å; G6-F8 PolarHBondContact O-N 2.72Å
7	G	37.4	Very low	40.7	Very low	75 Å²	75	147.6 Å²	147.6	77%	0.773	86%	0.861	S	S	*	*			trans	-64.8	124.9	177.8	0	0	0	0	0	112.6	K9	G7-K9 PolarHBondContact O-N 3.22Å
8	F	35.7	Very low	40.7	Very low	204 Å²	204	149.5 Å²	149.5	90%	0.895	86%	0.86	S	S	*	*			trans	-74.6	105.6	172.1	-151.9	-95.8	0	0	0	108.7	G6	G6-F8 PolarHBondContact O-N 2.72Å
9	K	45.7	Very low	40.9	Very low	190 Å²	190	146.7 Å²	146.7	83%	0.826	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-78.3	128.8	169.3	-80.2	-174.2	175.7	-177.9	0	109	G7 R11	G7-K9 PolarHBondContact O-N 3.22Å; K9-R11 PolarHBondContact O-N 2.85Å
10	P	39.3	Very low	41	Very low	118 Å²	118	147.8 Å²	147.8	77%	0.766	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-62.9	127.7	172.5	-15.9	28.7	0	0	0	109.6	E12	P10-E12 PolarHBondContact O-N 2.8Å
11	R	41.9	Very low	40.9	Very low	243 Å²	243	148.5 Å²	148.5	92%	0.917	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-63.6	119.7	165.8	-104.9	176.9	164.7	171.2	-4.9	108.1	K9 R13	K9-R11 PolarHBondContact O-N 2.85Å; R11-R13 PolarHBondContact O-N 3.36Å
12	E	40.7	Very low	41.1	Very low	191 Å²	191	148.3 Å²	148.3	89%	0.893	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-56.6	121.2	166.5	-72.8	176.5	153	0	0	109.1	P10 S14	P10-E12 PolarHBondContact O-N 2.8Å; E12-S14 VanDerWaalsContact C-N 3.31Å; E12-S14 PolarHBondContact O-N 3.46Å
13	R	41.3	Very low	41.2	Very low	254 Å²	254	149.2 Å²	149.2	96%	0.958	82%	0.824	S	S	*	*			trans	-74.2	90.3	167.7	-77.6	-174.3	-176.6	-176.3	1	107.9	R11	R11-R13 PolarHBondContact O-N 3.36Å
14	S	40.9	Very low	41.7	Very low	123 Å²	123	148.8 Å²	148.8	86%	0.86	82%	0.821	S	S	*	*			trans	-70.3	126.1	158.7	166.9	0	0	0	0	108.9	E12	E12-S14 VanDerWaalsContact C-N 3.31Å; E12-S14 PolarHBondContact O-N 3.46Å
15	G	34.3	Very low	42	Very low	61 Å²	61	149 Å²	149	63%	0.629	82%	0.82	S	S	*	*			trans	127.8	90.1	167.8	0	0	0	0	0	112	E17	G15-E17 PolarHBondContact O-N 2.86Å
16	G	39.6	Very low	42.3	Very low	81 Å²	81	148 Å²	148	84%	0.835	81%	0.81	S	S	*	*			trans	-61.9	102.4	165.4	0	0	0	0	0	109.6	Q18	G16-Q18 PolarHBondContact O-N 3.48Å; G16-Q18 VanDerWaalsContact O-N 3.17Å
17	E	38.1	Very low	43.1	Very low	190 Å²	190	150.2 Å²	150.2	89%	0.888	81%	0.811	S	S	*	*			trans	-70.8	103.2	158.5	-76	176	146.2	0	0	106.5	G15 A19	G15-E17 PolarHBondContact O-N 2.86Å; E17-A19 PolarHBondContact O-N 2.91Å
18	Q	41.3	Very low	44.2	Very low	181 Å²	181	156.3 Å²	156.3	85%	0.846	82%	0.816	S	S	*	*			trans	-54.2	110.4	162.1	-76.9	174.6	-5.1	0	0	106.8	G16 Q20	G16-Q18 PolarHBondContact O-N 3.48Å; G16-Q18 VanDerWaalsContact O-N 3.17Å; Q18-Q20 VanDerWaalsContact C-N 3.35Å; Q18-Q20 PolarHBondContact O-N 2.91Å
19	A	44.6	Very low	45.5	Very low	97 Å²	97	151.2 Å²	151.2	80%	0.802	79%	0.791	S	S	*	*			trans	-54.7	105.8	163.4	0	0	0	0	0	106.3	E17 E21	E17-A19 PolarHBondContact O-N 2.91Å; A19-E21 PolarHBondContact O-N 3.36Å
20	Q	43	Very low	46.3	Very low	167 Å²	167	144.8 Å²	144.8	78%	0.78	77%	0.769	S	S	*	*			trans	-59.7	110.7	174.1	-80.1	175.3	-20.1	0	0	106.9	Q18 W22	Q18-Q20 VanDerWaalsContact C-N 3.35Å; Q18-Q20 PolarHBondContact O-N 2.91Å; Q20-W22 VanDerWaalsContact O-CD1 3.26Å; Q20-W22 PolarHBondContact O-N 3.39Å
21	E	39.3	Very low	47.5	Very low	164 Å²	164	149.3 Å²	149.3	77%	0.766	77%	0.77	S	S	*	*			trans	-61.1	111.3	170.9	-121.9	170.2	-178.3	0	0	107.4	A19 D23	A19-E21 PolarHBondContact O-N 3.36Å; E21-D23 PolarHBondContact O-N 3.25Å
22	W	44.7	Very low	48.5	Very low	242 Å²	242	140.5 Å²	140.5	92%	0.917	74%	0.741	S	S	*	*			trans	-74.8	27.4	174.1	-79.4	36	0	0	0	112.1	Q20 A24	Q20-W22 VanDerWaalsContact O-CD1 3.26Å; Q20-W22 PolarHBondContact O-N 3.39Å; W22-A24 PolarHBondContact O-N 2.92Å
23	D	43.3	Very low	49.1	Very low	129 Å²	129	133.2 Å²	133.2	69%	0.69	72%	0.717	S	S	*	*			trans	-84.5	50.6	176.3	-76	-30.2	0	0	0	110.8	E21 V25	E21-D23 PolarHBondContact O-N 3.25Å; D23-V25 PolarHBondContact O-N 3.41Å
24	A	51.9	Low	49.1	Very low	88 Å²	88	123.9 Å²	123.9	73%	0.727	70%	0.695	S	S	*	*			trans	-67	105.9	165.2	0	0	0	0	0	107.8	W22 P26	W22-A24 PolarHBondContact O-N 2.92Å; A24-P26 WeakPolarHBondContact O-CD 3.36Å; A24-P26 VanDerWaalsContact O-N 3.11Å
25	V	50.7	Low	49.3	Very low	129 Å²	129	121.4 Å²	121.4	78%	0.782	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-52	119.8	172.3	177.3	0	0	0	0	107.9	D23	D23-V25 PolarHBondContact O-N 3.41Å
26	P	55	Low	49.9	Very low	105 Å²	105	123.3 Å²	123.3	68%	0.682	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-58.6	133.1	-178.5	20.4	-29.9	0	0	0	109	A24 K28	A24-P26 WeakPolarHBondContact O-CD 3.36Å; A24-P26 VanDerWaalsContact O-N 3.11Å; P26-K28 PolarHBondContact O-N 3.44Å
27	P	57.1	Low	50.2	Low	122 Å²	122	129.4 Å²	129.4	79%	0.792	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-55.3	135.2	-177.4	20.3	-31.2	0	0	0	110	R29	P27-R29 PolarHBondContact O-N 3.27Å; P27-R29 VanDerWaalsContact O-N 3.13Å
28	K	59.4	Low	50.8	Low	204 Å²	204	125 Å²	125	89%	0.887	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-56.7	121.7	178.6	-78.8	-176.8	178	175.4	0	108.7	P26	P26-K28 PolarHBondContact O-N 3.44Å
29	R	64.6	Low	51.7	Low	96 Å²	96	118.1 Å²	118.1	36%	0.362	65%	0.647	S	S	.	*	P	Polyproline II helix	trans	-57.1	127	178.5	-68.2	-173.6	-173.5	-166.8	1.5	109.4	P27 P122	P27-R29 PolarHBondContact O-N 3.27Å; P27-R29 VanDerWaalsContact O-N 3.13Å; R29-P122 PolarHBondContact NH1-O 2.92Å
30	P	62.1	Low	53.5	Low	56 Å²	56	115.3 Å²	115.3	36%	0.364	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-56.1	148.4	171.5	-19.4	30.8	0	0	0	109.8	R102	P30-R102 WeakPolarHBondContact CD-O 3.36Å
31	R	63.4	Low	55.8	Low	212 Å²	212	110 Å²	110	80%	0.8	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-63.4	151.7	164.4	-59.7	-176.6	177.4	-177.5	-0	108	G33 A34	R31-G33 PolarHBondContact O-N 3.06Å; R31-A34 HydrophobicContact CB-CB 3.82Å; R31-A34 WeakPolarHBondContact O-CB 3.48Å; R31-A34 PolarHBondContact O-N 3.01Å
32	L	63.5	Low	58.4	Low	58 Å²	58	104.6 Å²	104.6	30%	0.304	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-52.8	115.9	175.8	-164.9	88.3	0	0	0	109.4	A34 L106 Q107 P122	L32-A34 PolarHBondContact O-N 3.48Å; L32-L106 VanDerWaalsContact CD1-O 3.28Å; L32-L106 WeakPolarHBondContact CD1-O 3.17Å; L32-Q107 HydrophobicContact CD1-CB 4.21Å; L32-Q107 HydrophobicContact CD2-CB 4.46Å; L32-Q107 VanDerWaalsContact CD2-OE1 3.27Å; L32-P122 HydrophobicContact CD1-CG 3.66Å
33	G	54.3	Low	61	Low	38 Å²	38	93.1 Å²	93.1	39%	0.392	53%	0.529	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.3	8.8	-175.5	0	0	0	0	0	116.7	R31 G35	R31-G33 PolarHBondContact O-N 3.06Å; G33-G35 PolarHBondContact O-N 3.41Å
34	A	41.4	Very low	63.6	Low	59 Å²	59	87 Å²	87	49%	0.488	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	109.3	172.3	0	0	0	0	0	110.3	R31 L32	R31-A34 HydrophobicContact CB-CB 3.82Å; R31-A34 WeakPolarHBondContact O-CB 3.48Å; R31-A34 PolarHBondContact O-N 3.01Å; L32-A34 PolarHBondContact O-N 3.48Å
35	G	44.4	Very low	65.8	Low	70 Å²	70	82.8 Å²	82.8	72%	0.722	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	135.8	6	-173.4	0	0	0	0	0	114.4	G33 K37	G33-G35 PolarHBondContact O-N 3.41Å; G35-K37 PolarHBondContact O-N 3.24Å
36	N	45.7	Very low	68.1	Low	102 Å²	102	76.6 Å²	76.6	55%	0.545	43%	0.425	S	S	.	.			trans	-60.8	74.5	-179.9	-96.2	27.5	0	0	0	113.8	I38	N36-I38 WeakPolarHBondContact CA-O 3.42Å; N36-I38 PolarHBondContact OD1-O 2.9Å
37	K	47.6	Very low	70.2	Confident	209 Å²	209	71.6 Å²	71.6	91%	0.909	39%	0.392	S	S	*	.	S	Bend	trans	-91.2	-9.6	147.1	-70	-172.7	176.7	-177.1	0	111.3	G35	G35-K37 PolarHBondContact O-N 3.24Å
38	I	50	Low	72.2	Confident	96 Å²	96	66.9 Å²	66.9	49%	0.492	36%	0.359	S	S	.	.	S	Bend	trans	-125.4	143	178.5	-55.8	161.9	0	0	0	104.4	N36	N36-I38 WeakPolarHBondContact CA-O 3.42Å; N36-I38 PolarHBondContact OD1-O 2.9Å
39	G	59.5	Low	74	Confident	38 Å²	38	57.6 Å²	57.6	39%	0.392	32%	0.322	S	S	.	.			trans	-46.4	165.9	-175.1	0	0	0	0	0	114.4	R41 S193	G39-R41 PolarHBondContact O-N 2.94Å; G39-S193 CarbonylContact C-O 3.58Å
40	G	82.3	Confident	75.6	Confident	37 Å²	37	53 Å²	53	38%	0.381	31%	0.305	S	S	.	.			trans	-64.8	38.1	-171.9	0	0	0	0	0	116.9	R42	G40-R42 PolarHBondContact O-N 2.8Å
41	R	90.9	Very high	77.3	Confident	57 Å²	57	50.4 Å²	50.4	22%	0.215	29%	0.288	C	S	.	.			trans	-54.1	129.3	174.9	74.1	-177.9	-172.9	172.1	7.2	110.5	G39 L105 S193 W241	G39-R41 PolarHBondContact O-N 2.94Å; R41-L105 HydrophobicContact CG-CD2 4.38Å; R41-S193 WeakPolarHBondContact CB-O 3.38Å; R41-S193 PolarHBondContact N-O 3.08Å; R41-S193 VanDerWaalsContact N-O 3.17Å; R41-W241 HydrophobicContact CB-CH2 4.4Å; R41-W241 HydrophobicContact CB-CZ2 4.04Å; R41-W241 PolarHBondContact NH2-O 3.06Å
42	R	95.3	Very high	78.9	Confident	50 Å²	50	40.6 Å²	40.6	19%	0.189	25%	0.251	C	S	.	.			trans	-166.6	146.2	170.5	61.4	-173.4	-169.1	-166.6	6.2	108.2	G40 I44 L105 P195 I196 W241	G40-R42 PolarHBondContact O-N 2.8Å; R42-I44 HydrophobicContact CG-CG1 4.17Å; R42-L105 CarbonylContact C-O 3.57Å; R42-L105 VanDerWaalsContact CA-O 3.31Å; R42-L105 WeakPolarHBondContact CA-O 3.16Å; R42-L105 WeakPolarHBondContact CB-O 3.48Å; R42-P195 HydrophobicContact CG-CB 4.12Å; R42-P195 WeakPolarHBondContact O-CA 3.46Å; R42-I196 PolarHBondContact O-N 3.1Å; R42-I196 VanDerWaalsContact O-N 3.12Å; R42-W241 VanDerWaalsContact C-CH2 3.42Å
43	L	98.1	Very high	80.4	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	127.9	169.2	175.2	58.1	0	0	0	107.5	V45 L100 L105 L106 Q107 I196 F198 T234 F237 W241	L43-V45 HydrophobicContact CD1-CG2 4.22Å; L43-V45 HydrophobicContact CD2-CG2 4.01Å; L43-V45 HydrophobicContact CG-CG2 3.88Å; L43-L100 HydrophobicContact CB-CD2 3.9Å; L43-L100 HydrophobicContact CD2-CD2 3.69Å; L43-L100 HydrophobicContact CG-CD2 4.42Å; L43-L105 PolarHBondContact N-O 3.03Å; L43-L106 HydrophobicContact CB-CD1 4.12Å; L43-L106 HydrophobicContact CD2-CD1 4Å; L43-L106 HydrophobicContact CG-CD1 3.9Å; L43-L106 CarbonylContact O-C 3.6Å; L43-L106 WeakPolarHBondContact O-CA 3.44Å; L43-Q107 PolarHBondContact O-N 2.77Å; L43-I196 HydrophobicContact CD1-CG2 4.33Å; L43-F198 HydrophobicContact CD1-CB 4.3Å; L43-F198 HydrophobicContact CD1-CD2 3.74Å; L43-F198 HydrophobicContact CD1-CG 4.4Å; L43-T234 HydrophobicContact CD2-CG2 4.39Å; L43-F237 HydrophobicContact CB-CD1 3.99Å; L43-F237 HydrophobicContact CB-CE1 4.14Å; L43-F237 HydrophobicContact CB-CG 4.38Å; L43-F237 HydrophobicContact CD1-CD1 4.48Å; L43-F237 HydrophobicContact CD1-CD2 4.4Å; L43-F237 HydrophobicContact CD1-CE1 4.02Å; L43-F237 HydrophobicContact CD1-CE2 3.91Å; L43-F237 HydrophobicContact CD1-CZ 3.71Å; L43-F237 HydrophobicContact CD2-CB 4.45Å; L43-F237 HydrophobicContact CD2-CD1 4.4Å; L43-F237 HydrophobicContact CD2-CD2 3.94Å; L43-F237 HydrophobicContact CD2-CE2 4.25Å; L43-F237 HydrophobicContact CD2-CG 3.99Å; L43-F237 HydrophobicContact CG-CE1 4.5Å; L43-W241 HydrophobicContact CB-CH2 4.31Å; L43-W241 HydrophobicContact CB-CZ3 4.31Å
44	I	98.6	Very high	82.3	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	119.9	171	-58.1	166.7	0	0	0	107	R42 Q107 Y109 F167 P168 I196 V197 F198	R42-I44 HydrophobicContact CG-CG1 4.17Å; I44-Q107 CarbonylContact C-O 3.54Å; I44-Q107 VanDerWaalsContact CA-O 3.31Å; I44-Q107 WeakPolarHBondContact CA-O 3.49Å; I44-Q107 HydrophobicContact CG1-CB 4.18Å; I44-Y109 HydrophobicContact CG2-CD2 3.71Å; I44-Y109 HydrophobicContact CG2-CE2 3.74Å; I44-F167 HydrophobicContact CD1-CD1 4.31Å; I44-F167 HydrophobicContact CG2-CD1 4.26Å; I44-F167 HydrophobicContact CG2-CE1 4Å; I44-P168 HydrophobicContact CD1-CG 3.95Å; I44-I196 PolarHBondContact N-O 3.01Å; I44-V197 HydrophobicContact CB-CB 4.41Å; I44-V197 HydrophobicContact CB-CG2 3.73Å; I44-V197 HydrophobicContact CD1-CG2 3.91Å; I44-V197 HydrophobicContact CG1-CG2 4.39Å; I44-V197 HydrophobicContact CG2-CG2 3.92Å; I44-V197 CarbonylContact O-C 3.52Å; I44-V197 VanDerWaalsContact O-CA 3.26Å; I44-V197 WeakPolarHBondContact O-CA 3.5Å; I44-F198 PolarHBondContact O-N 3.33Å
45	V	98.8	Very high	84.9	Confident	0 Å²	0	37 Å²	37	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	124.7	174.6	179.9	0	0	0	0	109.5	L43 L47 L95 L106 Q107 V108 Y109 F198 V200	L43-V45 HydrophobicContact CD1-CG2 4.22Å; L43-V45 HydrophobicContact CD2-CG2 4.01Å; L43-V45 HydrophobicContact CG-CG2 3.88Å; V45-L47 HydrophobicContact CG1-CD2 4.22Å; V45-L95 HydrophobicContact CB-CD1 4.25Å; V45-L95 HydrophobicContact CB-CD2 4.13Å; V45-L95 HydrophobicContact CG1-CD1 3.9Å; V45-L95 HydrophobicContact CG1-CD2 4.16Å; V45-L95 HydrophobicContact CG2-CD2 3.84Å; V45-L106 HydrophobicContact CG2-CD1 3.94Å; V45-Q107 PolarHBondContact N-O 3.48Å; V45-V108 WeakPolarHBondContact O-CA 3.28Å; V45-Y109 PolarHBondContact O-N 2.96Å; V45-F198 WeakPolarHBondContact CA-O 3.19Å; V45-V200 HydrophobicContact CG1-CG2 4.22Å
46	V	98.9	Very high	87.2	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	114.1	170.4	-174.6	0	0	0	0	108.4	E48 Y109 H111 V163 F167 V197 F198 V199 V200	V46-E48 PolarHBondContact O-N 2.88Å; V46-Y109 WeakPolarHBondContact CA-O 3.41Å; V46-Y109 HydrophobicContact CG2-CD2 4.5Å; V46-H111 HydrophobicContact CG1-CB 4.38Å; V46-V163 HydrophobicContact CG2-CG2 4.14Å; V46-F167 HydrophobicContact CG2-CE1 4.04Å; V46-F167 HydrophobicContact CG2-CZ 3.87Å; V46-V197 HydrophobicContact CG2-CG1 4.01Å; V46-F198 PolarHBondContact N-O 2.84Å; V46-V199 HydrophobicContact CB-CG1 4.43Å; V46-V200 PolarHBondContact O-N 2.96Å
47	L	98.8	Very high	89.5	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	99.8	168.8	-64.7	-176.2	0	0	0	108.6	V45 L92 L95 Y109 I110 H111 V200 A202	V45-L47 HydrophobicContact CG1-CD2 4.22Å; L47-L92 HydrophobicContact CD1-CD2 3.97Å; L47-L92 HydrophobicContact CD1-CG 3.92Å; L47-L95 HydrophobicContact CD1-CD1 4.26Å; L47-L95 HydrophobicContact CD2-CD1 4.22Å; L47-L95 HydrophobicContact CG-CD1 4.3Å; L47-Y109 PolarHBondContact N-O 3.05Å; L47-I110 HydrophobicContact CB-CG2 4.34Å; L47-I110 HydrophobicContact CD1-CG1 4.43Å; L47-H111 PolarHBondContact O-N 3.23Å; L47-V200 CarbonylContact C-O 3.39Å; L47-V200 WeakPolarHBondContact CA-O 3.34Å; L47-V200 HydrophobicContact CD2-CB 4.26Å; L47-A202 HydrophobicContact CB-CB 3.97Å
48	E	98.7	Very high	91.5	Very high	22 Å²	22	30.3 Å²	30.3	10%	0.103	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	138.4	-170.9	-178.3	54.3	-127.8	0	0	112.3	V46 A50 H111 V199 V200 A202 V210	V46-E48 PolarHBondContact O-N 2.88Å; E48-A50 VanDerWaalsContact C-N 3.34Å; E48-A50 PolarHBondContact O-N 3.32Å; E48-H111 VanDerWaalsContact CD-ND1 3.3Å; E48-H111 IonicContact OE1-CE1 2.71Å; E48-H111 IonicContact OE1-CG 3.7Å; E48-H111 IonicContact OE1-ND1 2.83Å; E48-H111 PolarHBondContact OE1-ND1 3.44Å; E48-H111 IonicContact OE2-CG 3.38Å; E48-H111 IonicContact OE2-ND1 3.42Å; E48-H111 PolarHBondContact OE2-ND1 2.83Å; E48-H111 VanDerWaalsContact OE2-ND1 3.11Å; E48-V199 HydrophobicContact CB-CG1 3.59Å; E48-V199 HydrophobicContact CG-CG1 4.13Å; E48-V200 PolarHBondContact N-O 2.64Å; E48-A202 PolarHBondContact O-N 3.16Å; E48-V210 HydrophobicContact CG-CG1 3.82Å
49	G	97.8	Very high	93.5	Very high	10 Å²	10	35.6 Å²	35.6	10%	0.103	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	63.9	34	179.1	0	0	0	0	0	114.3	S51 H111 Q113	G49-S51 PolarHBondContact O-N 2.95Å; G49-H111 PolarHBondContact N-O 2.65Å; G49-Q113 VanDerWaalsContact O-CG 3.24Å; G49-Q113 WeakPolarHBondContact O-CG 2.94Å; G49-Q113 PolarHBondContact O-NE2 2.95Å
50	A	98.1	Very high	95.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	130.7	178.6	0	0	0	0	0	112	E48 L52 A88 I110 H111 T112 Q113 A202	E48-A50 VanDerWaalsContact C-N 3.34Å; E48-A50 PolarHBondContact O-N 3.32Å; A50-L52 VanDerWaalsContact C-N 3.27Å; A50-L52 HydrophobicContact CB-CD1 4.3Å; A50-L52 HydrophobicContact CB-CG 4.22Å; A50-L52 PolarHBondContact O-N 2.9Å; A50-A88 HydrophobicContact CB-CB 4.18Å; A50-I110 HydrophobicContact CB-CG2 3.45Å; A50-I110 VanDerWaalsContact CB-CG2 3.45Å; A50-H111 PolarHBondContact N-O 3.17Å; A50-T112 CarbonylContact O-C 3.53Å; A50-T112 WeakPolarHBondContact O-CA 3.37Å; A50-T112 WeakPolarHBondContact O-CB 3.19Å; A50-Q113 PolarHBondContact O-N 2.88Å; A50-A202 WeakPolarHBondContact CA-O 3.37Å; A50-A202 HydrophobicContact CB-CB 4.02Å
51	S	96.4	Very high	95.8	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.007	21%	0.213	C	C	.	.			trans	-78.5	71	175.3	174.8	0	0	0	0	111.5	G49 V83 R84 P85	G49-S51 PolarHBondContact O-N 2.95Å; S51-V83 WeakPolarHBondContact OG-CA 3.42Å; S51-R84 PolarHBondContact OG-N 2.82Å; S51-P85 WeakPolarHBondContact O-CA 3.22Å; S51-P85 WeakPolarHBondContact O-CB 2.92Å
52	L	97.1	Very high	96.1	Very high	5 Å²	5	41.7 Å²	41.7	3%	0.026	22%	0.217	C	C	.	.			trans	-119.8	101.3	177.2	-59.4	176.7	0	0	0	110.2	A50 L63 P85 A88 I110 T112 F133 M137	A50-L52 VanDerWaalsContact C-N 3.27Å; A50-L52 HydrophobicContact CB-CD1 4.3Å; A50-L52 HydrophobicContact CB-CG 4.22Å; A50-L52 PolarHBondContact O-N 2.9Å; L52-L63 HydrophobicContact CD2-CD2 3.93Å; L52-P85 HydrophobicContact CD2-CB 3.94Å; L52-A88 HydrophobicContact CD1-CB 4.44Å; L52-A88 HydrophobicContact CD2-CB 4.38Å; L52-A88 HydrophobicContact CG-CB 4.49Å; L52-I110 HydrophobicContact CD1-CD1 4.47Å; L52-I110 HydrophobicContact CD1-CG2 3.93Å; L52-T112 HydrophobicContact CB-CG2 3.92Å; L52-T112 HydrophobicContact CD1-CG2 4.45Å; L52-F133 HydrophobicContact CD2-CE1 4.02Å; L52-F133 HydrophobicContact CD2-CZ 4.05Å; L52-M137 HydrophobicContact CD1-SD 4.02Å; L52-M137 HydrophobicContact CD2-CG 4.25Å
53	E	95.1	Very high	96.1	Very high	12 Å²	12	39.6 Å²	39.6	6%	0.056	21%	0.21	C	C	.	.			trans	-147.1	151.3	178.3	68.1	-177.3	131.7	0	0	111.1	L63 L64 R78 K114	E53-L63 WeakPolarHBondContact O-CD1 3.08Å; E53-L64 HydrophobicContact CG-CB 3.53Å; E53-L64 HydrophobicContact CG-CD2 3.71Å; E53-L64 HydrophobicContact CG-CG 4.28Å; E53-L64 PolarHBondContact O-N 3.22Å; E53-L64 WeakPolarHBondContact OE1-CD2 3.32Å; E53-R78 IonicContact OE1-CZ 3.82Å; E53-R78 IonicContact OE1-NH1 3.14Å; E53-R78 PolarHBondContact OE1-NH1 3.27Å; E53-R78 IonicContact OE1-NH2 3.31Å; E53-R78 PolarHBondContact OE1-NH2 3.08Å; E53-R78 IonicContact OE2-CZ 3.63Å; E53-R78 IonicContact OE2-NH1 3.94Å; E53-R78 PolarHBondContact OE2-NH1 3.3Å; E53-K114 HydrophobicContact CB-CD 3.98Å; E53-K114 WeakPolarHBondContact OE2-CE 3.4Å; E53-K114 IonicContact OE2-NZ 2.64Å; E53-K114 PolarHBondContact OE2-NZ 2.87Å
54	T	95.7	Very high	95.9	Very high	45 Å²	45	40 Å²	40	28%	0.276	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	144.3	178.1	56.1	0	0	0	0	111.6	E62 V138 L141	T54-E62 CarbonylContact C-O 3.34Å; T54-E62 WeakPolarHBondContact CA-O 3.33Å; T54-V138 HydrophobicContact CG2-CB 4.34Å; T54-V138 HydrophobicContact CG2-CG1 4.28Å; T54-V138 HydrophobicContact CG2-CG2 4.1Å; T54-L141 HydrophobicContact CG2-CB 4.01Å; T54-L141 HydrophobicContact CG2-CD1 3.79Å
55	V	95.1	Very high	95.6	Very high	22 Å²	22	40.3 Å²	40.3	13%	0.133	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	145.6	170.8	63.8	0	0	0	0	109.7	V57 Y61 E62 L64 I72	V55-V57 HydrophobicContact CG1-CG2 4.12Å; V55-Y61 WeakPolarHBondContact O-CA 3.49Å; V55-E62 HydrophobicContact CG1-CB 4.44Å; V55-E62 PolarHBondContact N-O 2.96Å; V55-E62 PolarHBondContact O-N 2.92Å; V55-L64 HydrophobicContact CB-CB 4.41Å; V55-L64 HydrophobicContact CB-CD1 3.7Å; V55-L64 HydrophobicContact CG1-CB 4.25Å; V55-L64 HydrophobicContact CG1-CD1 3.63Å; V55-L64 HydrophobicContact CG2-CD1 4.02Å; V55-I72 HydrophobicContact CG2-CD1 4.39Å; V55-I72 HydrophobicContact CG2-CG2 4.17Å
56	K	94	Very high	95.2	Very high	128 Å²	128	41.3 Å²	41.3	56%	0.557	22%	0.22	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	120.7	174.4	-170.1	179.1	-179.2	-179.3	0	109.4	G58 Y61	K56-G58 WeakPolarHBondContact CE-O 3.33Å; K56-Y61 HydrophobicContact CB-CD1 4.17Å; K56-Y61 HydrophobicContact CB-CE1 3.94Å; K56-Y61 HydrophobicContact CD-CE1 4.39Å; K56-Y61 HydrophobicContact CG-CE1 4.18Å
57	V	92.5	Very high	94.7	Very high	48 Å²	48	47.7 Å²	47.7	29%	0.291	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	104.4	176.3	-175.8	0	0	0	0	107.8	V55 K59 T60 I72	V55-V57 HydrophobicContact CG1-CG2 4.12Å; V57-K59 PolarHBondContact O-N 3.12Å; V57-T60 PolarHBondContact N-O 2.96Å; V57-T60 PolarHBondContact O-N 3.44Å; V57-T60 PolarHBondContact O-OG1 2.82Å; V57-T60 VanDerWaalsContact O-OG1 3.08Å; V57-I72 HydrophobicContact CG2-CD1 4.14Å
58	G	91	Very high	94.4	Very high	66 Å²	66	53.3 Å²	53.3	68%	0.68	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	-110.6	-172.6	0	0	0	0	0	112.1	K56	K56-G58 WeakPolarHBondContact CE-O 3.33Å
59	K	91.9	Very high	94.1	Very high	206 Å²	206	52.6 Å²	52.6	90%	0.896	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	-8.2	179.7	-65.1	-175.5	-178.8	179	0	113.8	V57	V57-K59 PolarHBondContact O-N 3.12Å
60	T	94.3	Very high	93.8	Very high	80 Å²	80	58 Å²	58	49%	0.491	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	158.7	-176.1	49.7	0	0	0	0	111.5	V57	V57-T60 PolarHBondContact N-O 2.96Å; V57-T60 PolarHBondContact O-N 3.44Å; V57-T60 PolarHBondContact O-OG1 2.82Å; V57-T60 VanDerWaalsContact O-OG1 3.08Å
61	Y	95.1	Very high	93.5	Very high	116 Å²	116	62 Å²	62	46%	0.455	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	131.3	171.1	-71.3	-90	0	0	0	109.1	V55 K56 H142	V55-Y61 WeakPolarHBondContact O-CA 3.49Å; K56-Y61 HydrophobicContact CB-CD1 4.17Å; K56-Y61 HydrophobicContact CB-CE1 3.94Å; K56-Y61 HydrophobicContact CD-CE1 4.39Å; K56-Y61 HydrophobicContact CG-CE1 4.18Å; Y61-H142 AromaticContact CD1-CE1 3.56Å; Y61-H142 AromaticContact CD1-NE2 3.63Å; Y61-H142 AromaticContact CD2-CE1 3.5Å; Y61-H142 AromaticContact CE1-CE1 3.94Å; Y61-H142 AromaticContact CE2-CE1 3.87Å; Y61-H142 AromaticContact CG-CE1 3.32Å; Y61-H142 AromaticContact CG-NE2 3.69Å
62	E	96.3	Very high	93.3	Very high	65 Å²	65	64.6 Å²	64.6	30%	0.304	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	157.9	180	-64.1	-171.8	-152.5	0	0	109.8	T54 V55 H69	T54-E62 CarbonylContact C-O 3.34Å; T54-E62 WeakPolarHBondContact CA-O 3.33Å; V55-E62 HydrophobicContact CG1-CB 4.44Å; V55-E62 PolarHBondContact N-O 2.96Å; V55-E62 PolarHBondContact O-N 2.92Å; E62-H69 IonicContact OE2-CE1 3.3Å; E62-H69 IonicContact OE2-NE2 3.45Å; E62-H69 PolarHBondContact OE2-NE2 2.75Å
63	L	96.4	Very high	93	Very high	6 Å²	6	64.4 Å²	64.4	3%	0.031	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	128.4	170.6	-160.6	74.6	0	0	0	108.3	L52 E53 N65 H69 P85 F133 C134 M137 V138 L141	L52-L63 HydrophobicContact CD2-CD2 3.93Å; E53-L63 WeakPolarHBondContact O-CD1 3.08Å; L63-N65 PolarHBondContact O-N 3.17Å; L63-H69 PolarHBondContact O-CE1 2.92Å; L63-H69 PolarHBondContact O-ND1 2.87Å; L63-P85 HydrophobicContact CD2-CB 3.67Å; L63-P85 HydrophobicContact CD2-CG 4.35Å; L63-F133 HydrophobicContact CD2-CE1 4.47Å; L63-C134 HydrophobicContact CB-CB 3.93Å; L63-C134 HydrophobicContact CD2-CB 4.3Å; L63-M137 HydrophobicContact CD1-CB 3.79Å; L63-M137 HydrophobicContact CD2-CB 4.05Å; L63-M137 HydrophobicContact CD2-CG 4.36Å; L63-V138 HydrophobicContact CB-CG2 4.04Å; L63-V138 HydrophobicContact CD1-CG2 4.48Å; L63-V138 VanDerWaalsContact N-CG2 3.34Å; L63-L141 HydrophobicContact CD1-CD1 4.25Å
64	L	94.1	Very high	92.9	Very high	7 Å²	7	68.8 Å²	68.8	4%	0.037	36%	0.36	C	S	.	.			trans	-61.9	136.4	-179	-164.7	66.8	0	0	0	109.7	E53 V55 H69 L73 V83 P85	E53-L64 HydrophobicContact CG-CB 3.53Å; E53-L64 HydrophobicContact CG-CD2 3.71Å; E53-L64 HydrophobicContact CG-CG 4.28Å; E53-L64 PolarHBondContact O-N 3.22Å; E53-L64 WeakPolarHBondContact OE1-CD2 3.32Å; V55-L64 HydrophobicContact CB-CB 4.41Å; V55-L64 HydrophobicContact CB-CD1 3.7Å; V55-L64 HydrophobicContact CG1-CB 4.25Å; V55-L64 HydrophobicContact CG1-CD1 3.63Å; V55-L64 HydrophobicContact CG2-CD1 4.02Å; L64-H69 HydrophobicContact CD1-CB 3.61Å; L64-L73 HydrophobicContact CD1-CD2 3.93Å; L64-L73 HydrophobicContact CD1-CG 4.28Å; L64-L73 HydrophobicContact CD2-CD2 3.48Å; L64-L73 VanDerWaalsContact CD2-CD2 3.48Å; L64-L73 HydrophobicContact CG-CD2 3.89Å; L64-V83 HydrophobicContact CB-CG1 4.13Å; L64-V83 HydrophobicContact CD2-CG1 4.17Å; L64-V83 HydrophobicContact CD2-CG2 4.39Å; L64-V83 HydrophobicContact CG-CG1 3.83Å; L64-V83 WeakPolarHBondContact O-CG1 3.42Å; L64-P85 WeakPolarHBondContact O-CG 3.35Å
65	N	92.4	Very high	92.7	Very high	7 Å²	7	75.3 Å²	75.3	4%	0.037	38%	0.384	C	S	.	.			trans	-152.8	137.9	-169.1	-178.9	-15.5	0	0	0	108.9	L63 D67 H69 P85 F130	L63-N65 PolarHBondContact O-N 3.17Å; N65-D67 VanDerWaalsContact C-N 3.28Å; N65-D67 PolarHBondContact O-N 3.4Å; N65-D67 PolarHBondContact OD1-N 3.08Å; N65-H69 PolarHBondContact N-ND1 3.03Å; N65-H69 VanDerWaalsContact N-ND1 3.18Å; N65-H69 VanDerWaalsContact O-CB 3.31Å; N65-H69 WeakPolarHBondContact O-CB 3.47Å; N65-H69 PolarHBondContact O-N 3.44Å; N65-P85 HydrophobicContact CB-CG 4.43Å; N65-F130 WeakPolarHBondContact ND2-CE1 3.41Å
66	C	90.3	Very high	92.4	Very high	21 Å²	21	79.6 Å²	79.6	14%	0.142	41%	0.406	C	S	.	.	H	α-helix	trans	-53.8	-39.1	176	63	0	0	0	0	113.9	P80 V83	C66-P80 HydrophobicContact CB-CB 4.5Å; C66-P80 WeakPolarHBondContact CB-O 3.42Å; C66-V83 PolarHBondContact N-O 2.85Å
67	D	88.8	Confident	92.2	Very high	134 Å²	134	77 Å²	77	72%	0.717	42%	0.416	S	S	*	.	H	α-helix	trans	-78.9	-43.4	-171.9	-62.2	-29.2	0	0	0	112.5	N65	N65-D67 VanDerWaalsContact C-N 3.28Å; N65-D67 PolarHBondContact O-N 3.4Å; N65-D67 PolarHBondContact OD1-N 3.08Å
68	K	90.4	Very high	92.1	Very high	119 Å²	119	78.4 Å²	78.4	52%	0.517	42%	0.416	S	S	.	.	H	α-helix	trans	-86.1	-29.5	-175.8	-64.8	-175.3	-175.7	176.6	0	113	D131	K68-D131 IonicContact NZ-OD1 3.77Å; K68-D131 PolarHBondContact NZ-OD1 3.38Å
69	H	93.8	Very high	92.1	Very high	6 Å²	6	79.9 Å²	79.9	3%	0.028	41%	0.409	C	S	.	.	H	α-helix	trans	-117.5	17.5	-165.9	-52.8	112.1	0	0	0	114.3	E62 L63 L64 N65 S71 I72 L73	E62-H69 IonicContact OE2-CE1 3.3Å; E62-H69 IonicContact OE2-NE2 3.45Å; E62-H69 PolarHBondContact OE2-NE2 2.75Å; L63-H69 PolarHBondContact O-CE1 2.92Å; L63-H69 PolarHBondContact O-ND1 2.87Å; L64-H69 HydrophobicContact CD1-CB 3.61Å; N65-H69 PolarHBondContact N-ND1 3.03Å; N65-H69 VanDerWaalsContact N-ND1 3.18Å; N65-H69 VanDerWaalsContact O-CB 3.31Å; N65-H69 WeakPolarHBondContact O-CB 3.47Å; N65-H69 PolarHBondContact O-N 3.44Å; H69-S71 VanDerWaalsContact C-N 3.33Å; H69-S71 PolarHBondContact O-N 3.47Å; H69-I72 PolarHBondContact O-N 3.26Å; H69-L73 WeakPolarHBondContact O-CG 3.41Å; H69-L73 PolarHBondContact O-N 3.23Å
70	K	91.7	Very high	92	Very high	123 Å²	123	70.9 Å²	70.9	54%	0.535	37%	0.371	S	S	.	.	H	α-helix	trans	-48.8	-48	-177	-169	173.4	-177.6	175.4	0	113.8	I72 L73 L74 P80	K70-I72 VanDerWaalsContact C-N 3.33Å; K70-I72 PolarHBondContact O-N 3.21Å; K70-L73 PolarHBondContact O-N 3.33Å; K70-L74 HydrophobicContact CG-CD1 4.19Å; K70-L74 WeakPolarHBondContact O-CG 3.46Å; K70-L74 PolarHBondContact O-N 3.21Å; K70-P80 HydrophobicContact CG-CB 4.17Å; K70-P80 HydrophobicContact CG-CG 3.81Å
71	S	91.6	Very high	91.8	Very high	86 Å²	86	68.5 Å²	68.5	60%	0.601	36%	0.363	S	S	*	.	H	α-helix	trans	-66.3	-33.4	-179.3	-53.4	0	0	0	0	113.2	H69 K75	H69-S71 VanDerWaalsContact C-N 3.33Å; H69-S71 PolarHBondContact O-N 3.47Å; S71-K75 VanDerWaalsContact O-CG 3.26Å; S71-K75 WeakPolarHBondContact O-CG 3.2Å; S71-K75 PolarHBondContact O-N 3.38Å
72	I	91.9	Very high	91.6	Very high	54 Å²	54	65.6 Å²	65.6	28%	0.277	35%	0.353	S	S	.	.	H	α-helix	trans	-71.7	-39.8	177.1	-59.1	174.3	0	0	0	109.8	V55 V57 H69 K70 K75 N76	V55-I72 HydrophobicContact CG2-CD1 4.39Å; V55-I72 HydrophobicContact CG2-CG2 4.17Å; V57-I72 HydrophobicContact CG2-CD1 4.14Å; H69-I72 PolarHBondContact O-N 3.26Å; K70-I72 VanDerWaalsContact C-N 3.33Å; K70-I72 PolarHBondContact O-N 3.21Å; I72-K75 PolarHBondContact O-N 3.1Å; I72-N76 PolarHBondContact O-N 3.37Å; I72-N76 PolarHBondContact O-ND2 3.23Å; I72-N76 VanDerWaalsContact O-ND2 3.12Å
73	L	91.4	Very high	91.6	Very high	2 Å²	2	62.5 Å²	62.5	1%	0.01	34%	0.339	C	S	.	.	H	α-helix	trans	-61.5	-49.9	177.2	-68.5	168.5	0	0	0	111.4	L64 H69 K70 K75 N76 G77 R78 P80 V83	L64-L73 HydrophobicContact CD1-CD2 3.93Å; L64-L73 HydrophobicContact CD1-CG 4.28Å; L64-L73 HydrophobicContact CD2-CD2 3.48Å; L64-L73 VanDerWaalsContact CD2-CD2 3.48Å; L64-L73 HydrophobicContact CG-CD2 3.89Å; H69-L73 WeakPolarHBondContact O-CG 3.41Å; H69-L73 PolarHBondContact O-N 3.23Å; K70-L73 PolarHBondContact O-N 3.33Å; L73-K75 PolarHBondContact O-N 3.28Å; L73-N76 CarbonylContact O-C 3.55Å; L73-N76 PolarHBondContact O-N 3.08Å; L73-N76 VanDerWaalsContact O-N 3.08Å; L73-G77 PolarHBondContact O-N 2.95Å; L73-R78 CarbonylContact C-O 3.47Å; L73-R78 HydrophobicContact CD2-CB 4.25Å; L73-R78 PolarHBondContact O-N 3.07Å; L73-P80 HydrophobicContact CB-CG 4.14Å; L73-P80 HydrophobicContact CD1-CB 4.07Å; L73-P80 HydrophobicContact CD1-CG 4.47Å; L73-V83 HydrophobicContact CD1-CB 4.14Å; L73-V83 HydrophobicContact CD1-CG2 3.97Å; L73-V83 HydrophobicContact CD2-CG2 3.71Å
74	L	91.6	Very high	91.6	Very high	103 Å²	103	66.3 Å²	66.3	54%	0.539	35%	0.353	S	S	.	.	H	α-helix	trans	-61.5	-41.1	178.5	-68.7	172.2	0	0	0	112.4	K70 N76 G77 P80	K70-L74 HydrophobicContact CG-CD1 4.19Å; K70-L74 WeakPolarHBondContact O-CG 3.46Å; K70-L74 PolarHBondContact O-N 3.21Å; L74-N76 PolarHBondContact O-N 2.95Å; L74-G77 PolarHBondContact O-N 3.3Å; L74-P80 HydrophobicContact CD2-CG 4.12Å; L74-P80 HydrophobicContact CG-CG 4.16Å
75	K	91.6	Very high	91.7	Very high	182 Å²	182	66 Å²	66	79%	0.791	35%	0.351	S	S	*	.	H	α-helix	trans	-61.4	-31.2	175.6	-77.5	176.8	-177	-174.4	0	113.1	S71 I72 L73 G77	S71-K75 VanDerWaalsContact O-CG 3.26Å; S71-K75 WeakPolarHBondContact O-CG 3.2Å; S71-K75 PolarHBondContact O-N 3.38Å; I72-K75 PolarHBondContact O-N 3.1Å; L73-K75 PolarHBondContact O-N 3.28Å; K75-G77 VanDerWaalsContact C-N 3.31Å
76	N	89.4	Confident	92	Very high	112 Å²	112	66.9 Å²	66.9	60%	0.599	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	10.6	177.7	-66.8	-35.4	0	0	0	112.8	I72 L73 L74 R78	I72-N76 PolarHBondContact O-N 3.37Å; I72-N76 PolarHBondContact O-ND2 3.23Å; I72-N76 VanDerWaalsContact O-ND2 3.12Å; L73-N76 CarbonylContact O-C 3.55Å; L73-N76 PolarHBondContact O-N 3.08Å; L73-N76 VanDerWaalsContact O-N 3.08Å; L74-N76 PolarHBondContact O-N 2.95Å; N76-R78 PolarHBondContact O-N 3.11Å
77	G	90.3	Very high	92.4	Very high	74 Å²	74	67 Å²	67	76%	0.763	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	22.4	179.6	0	0	0	0	0	114.1	L73 L74 K75	L73-G77 PolarHBondContact O-N 2.95Å; L74-G77 PolarHBondContact O-N 3.3Å; K75-G77 VanDerWaalsContact C-N 3.31Å
78	R	90.1	Very high	92.8	Very high	77 Å²	77	60.6 Å²	60.6	29%	0.291	32%	0.321	S	S	.	.			trans	-103.2	139.1	-179.9	-65.2	-176.5	65	-163.4	-2.3	110.5	E53 L73 N76 P80	E53-R78 IonicContact OE1-CZ 3.82Å; E53-R78 IonicContact OE1-NH1 3.14Å; E53-R78 PolarHBondContact OE1-NH1 3.27Å; E53-R78 IonicContact OE1-NH2 3.31Å; E53-R78 PolarHBondContact OE1-NH2 3.08Å; E53-R78 IonicContact OE2-CZ 3.63Å; E53-R78 IonicContact OE2-NH1 3.94Å; E53-R78 PolarHBondContact OE2-NH1 3.3Å; L73-R78 CarbonylContact C-O 3.47Å; L73-R78 HydrophobicContact CD2-CB 4.25Å; L73-R78 PolarHBondContact O-N 3.07Å; N76-R78 PolarHBondContact O-N 3.11Å; R78-P80 VanDerWaalsContact O-CD 3.31Å; R78-P80 WeakPolarHBondContact O-CD 3.5Å
79	D	90.4	Very high	93.2	Very high	98 Å²	98	55.4 Å²	55.4	52%	0.524	30%	0.298	S	S	.	.			trans	-70.2	121.3	174.9	-172.3	-5.6	0	0	0	110.4	G81 E82	D79-G81 PolarHBondContact O-N 3.18Å; D79-G81 PolarHBondContact OD1-N 3.18Å; D79-E82 HydrophobicContact CB-CG 4.19Å; D79-E82 PolarHBondContact O-N 2.96Å
80	P	90.2	Very high	93.4	Very high	16 Å²	16	59.6 Å²	59.6	10%	0.104	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-56.8	-30.9	171.6	-23	34.2	0	0	0	113.9	C66 K70 L73 L74 R78 E82 V83	C66-P80 HydrophobicContact CB-CB 4.5Å; C66-P80 WeakPolarHBondContact CB-O 3.42Å; K70-P80 HydrophobicContact CG-CB 4.17Å; K70-P80 HydrophobicContact CG-CG 3.81Å; L73-P80 HydrophobicContact CB-CG 4.14Å; L73-P80 HydrophobicContact CD1-CB 4.07Å; L73-P80 HydrophobicContact CD1-CG 4.47Å; L74-P80 HydrophobicContact CD2-CG 4.12Å; L74-P80 HydrophobicContact CG-CG 4.16Å; R78-P80 VanDerWaalsContact O-CD 3.31Å; R78-P80 WeakPolarHBondContact O-CD 3.5Å; P80-E82 PolarHBondContact O-N 2.89Å; P80-V83 PolarHBondContact O-N 2.82Å
81	G	90.8	Very high	93.8	Very high	31 Å²	31	53.7 Å²	53.7	32%	0.32	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-61.2	-27.9	-179	0	0	0	0	0	114	D79 R84 A204	D79-G81 PolarHBondContact O-N 3.18Å; D79-G81 PolarHBondContact OD1-N 3.18Å; G81-R84 WeakPolarHBondContact O-CG 3.36Å; G81-A204 WeakPolarHBondContact O-CB 3.33Å
82	E	90.8	Very high	94.1	Very high	54 Å²	54	49.7 Å²	49.7	25%	0.252	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-80.1	-18.4	-178.9	-68.6	-58.7	146.3	0	0	113.7	D79 P80 R84 H205	D79-E82 HydrophobicContact CB-CG 4.19Å; D79-E82 PolarHBondContact O-N 2.96Å; P80-E82 PolarHBondContact O-N 2.89Å; E82-R84 PolarHBondContact O-N 3.07Å; E82-R84 VanDerWaalsContact O-N 3.15Å; E82-H205 WeakPolarHBondContact OE1-CB 3.43Å; E82-H205 IonicContact OE1-CD2 2.89Å; E82-H205 PolarHBondContact OE1-CD2 2.88Å; E82-H205 VanDerWaalsContact OE1-CD2 3.3Å; E82-H205 IonicContact OE1-CG 3.45Å
83	V	94.8	Very high	94.4	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.256	C	S	.	.			trans	-91.9	82.8	-173.2	-174.4	0	0	0	0	110.7	S51 L64 C66 L73 P80 P85	S51-V83 WeakPolarHBondContact OG-CA 3.42Å; L64-V83 HydrophobicContact CB-CG1 4.13Å; L64-V83 HydrophobicContact CD2-CG1 4.17Å; L64-V83 HydrophobicContact CD2-CG2 4.39Å; L64-V83 HydrophobicContact CG-CG1 3.83Å; L64-V83 WeakPolarHBondContact O-CG1 3.42Å; C66-V83 PolarHBondContact N-O 2.85Å; L73-V83 HydrophobicContact CD1-CB 4.14Å; L73-V83 HydrophobicContact CD1-CG2 3.97Å; L73-V83 HydrophobicContact CD2-CG2 3.71Å; P80-V83 PolarHBondContact O-N 2.82Å; V83-P85 VanDerWaalsContact C-CD 3.44Å; V83-P85 VanDerWaalsContact O-CD 3.32Å; V83-P85 WeakPolarHBondContact O-CD 3.3Å
84	R	96.4	Very high	94.8	Very high	87 Å²	87	51.8 Å²	51.8	33%	0.328	27%	0.274	S	S	.	.			trans	-123.2	68.5	-172	-66.5	-66	-59.2	-78.9	-3.7	113.3	S51 G81 E82 D86 I87 A204	S51-R84 PolarHBondContact OG-N 2.82Å; G81-R84 WeakPolarHBondContact O-CG 3.36Å; E82-R84 PolarHBondContact O-N 3.07Å; E82-R84 VanDerWaalsContact O-N 3.15Å; R84-D86 VanDerWaalsContact C-OD1 3.31Å; R84-D86 WeakPolarHBondContact CA-OD1 3.41Å; R84-D86 WeakPolarHBondContact CB-OD1 3.36Å; R84-D86 IonicContact CZ-OD1 3.11Å; R84-D86 IonicContact CZ-OD2 3.57Å; R84-D86 IonicContact NE-OD1 2.69Å; R84-D86 PolarHBondContact NE-OD1 2.71Å; R84-D86 IonicContact NE-OD2 2.75Å; R84-D86 PolarHBondContact NE-OD2 3.12Å; R84-D86 IonicContact NH2-OD1 2.78Å; R84-D86 IonicContact NH2-OD2 3.88Å; R84-D86 PolarHBondContact NH2-OD2 3.45Å; R84-D86 PolarHBondContact O-N 2.94Å; R84-I87 HydrophobicContact CB-CD1 3.57Å; R84-I87 HydrophobicContact CB-CG1 3.95Å; R84-I87 HydrophobicContact CG-CD1 4.31Å; R84-I87 PolarHBondContact O-N 2.97Å; R84-A204 HydrophobicContact CB-CB 4.19Å; R84-A204 HydrophobicContact CG-CB 3.73Å
85	P	97.4	Very high	95.1	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-59.9	-21.6	174.8	26.2	-37.9	0	0	0	113.9	S51 L52 L63 L64 N65 V83 I87 A88 H89 F130	S51-P85 WeakPolarHBondContact O-CA 3.22Å; S51-P85 WeakPolarHBondContact O-CB 2.92Å; L52-P85 HydrophobicContact CD2-CB 3.94Å; L63-P85 HydrophobicContact CD2-CB 3.67Å; L63-P85 HydrophobicContact CD2-CG 4.35Å; L64-P85 WeakPolarHBondContact O-CG 3.35Å; N65-P85 HydrophobicContact CB-CG 4.43Å; V83-P85 VanDerWaalsContact C-CD 3.44Å; V83-P85 VanDerWaalsContact O-CD 3.32Å; V83-P85 WeakPolarHBondContact O-CD 3.3Å; P85-I87 VanDerWaalsContact C-N 3.27Å; P85-I87 PolarHBondContact O-N 3.29Å; P85-A88 PolarHBondContact O-N 3.27Å; P85-H89 PolarHBondContact O-N 3Å; P85-H89 VanDerWaalsContact O-N 3.14Å; P85-F130 HydrophobicContact CB-CE2 4.35Å; P85-F130 HydrophobicContact CB-CZ 4.39Å; P85-F130 HydrophobicContact CG-CE2 4.2Å; P85-F130 HydrophobicContact CG-CZ 3.79Å
86	D	97.8	Very high	95.4	Very high	26 Å²	26	38.6 Å²	38.6	14%	0.139	21%	0.213	C	C	.	.	H	α-helix	trans	-63.9	-29.3	177.7	61.3	-64.5	0	0	0	112.9	R84 H89 Q90 F130	R84-D86 VanDerWaalsContact C-OD1 3.31Å; R84-D86 WeakPolarHBondContact CA-OD1 3.41Å; R84-D86 WeakPolarHBondContact CB-OD1 3.36Å; R84-D86 IonicContact CZ-OD1 3.11Å; R84-D86 IonicContact CZ-OD2 3.57Å; R84-D86 IonicContact NE-OD1 2.69Å; R84-D86 PolarHBondContact NE-OD1 2.71Å; R84-D86 IonicContact NE-OD2 2.75Å; R84-D86 PolarHBondContact NE-OD2 3.12Å; R84-D86 IonicContact NH2-OD1 2.78Å; R84-D86 IonicContact NH2-OD2 3.88Å; R84-D86 PolarHBondContact NH2-OD2 3.45Å; R84-D86 PolarHBondContact O-N 2.94Å; D86-H89 WeakPolarHBondContact O-CB 3.07Å; D86-H89 PolarHBondContact O-N 3.02Å; D86-Q90 WeakPolarHBondContact O-CG 3.4Å; D86-Q90 PolarHBondContact O-N 3.18Å; D86-F130 HydrophobicContact CB-CD2 4.27Å; D86-F130 HydrophobicContact CB-CE2 3.87Å; D86-F130 HydrophobicContact CB-CZ 4.41Å
87	I	98.3	Very high	95.8	Very high	23 Å²	23	36 Å²	36	12%	0.118	20%	0.199	C	C	.	.	H	α-helix	trans	-63.3	-47.7	176.9	-64.1	174.5	0	0	0	110.4	R84 P85 H89 S91 A202 F203 A204 A226	R84-I87 HydrophobicContact CB-CD1 3.57Å; R84-I87 HydrophobicContact CB-CG1 3.95Å; R84-I87 HydrophobicContact CG-CD1 4.31Å; R84-I87 PolarHBondContact O-N 2.97Å; P85-I87 VanDerWaalsContact C-N 3.27Å; P85-I87 PolarHBondContact O-N 3.29Å; I87-H89 VanDerWaalsContact C-N 3.34Å; I87-S91 WeakPolarHBondContact O-CB 3.35Å; I87-S91 PolarHBondContact O-N 3.18Å; I87-S91 PolarHBondContact O-OG 2.82Å; I87-A202 HydrophobicContact CG2-CB 4.47Å; I87-F203 WeakPolarHBondContact CD1-O 3.37Å; I87-A204 HydrophobicContact CD1-CB 4.45Å; I87-A226 HydrophobicContact CG2-CB 3.68Å
88	A	98.3	Very high	96.1	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.6	-41.2	175.9	0	0	0	0	0	111	A50 L52 P85 S91 L92	A50-A88 HydrophobicContact CB-CB 4.18Å; L52-A88 HydrophobicContact CD1-CB 4.44Å; L52-A88 HydrophobicContact CD2-CB 4.38Å; L52-A88 HydrophobicContact CG-CB 4.49Å; P85-A88 PolarHBondContact O-N 3.27Å; A88-S91 PolarHBondContact O-N 3.48Å; A88-L92 WeakPolarHBondContact O-CB 3.37Å; A88-L92 WeakPolarHBondContact O-CG 3.48Å; A88-L92 PolarHBondContact O-N 2.81Å
89	H	98.7	Very high	96.5	Very high	9 Å²	9	31.7 Å²	31.7	4%	0.042	17%	0.167	C	C	.	.	H	α-helix	trans	-57.1	-55.3	177.2	178.4	-135.5	0	0	0	112.1	P85 D86 I87 S91 L92 L93 P127 R128 F130 F133	P85-H89 PolarHBondContact O-N 3Å; P85-H89 VanDerWaalsContact O-N 3.14Å; D86-H89 WeakPolarHBondContact O-CB 3.07Å; D86-H89 PolarHBondContact O-N 3.02Å; I87-H89 VanDerWaalsContact C-N 3.34Å; H89-S91 VanDerWaalsContact C-N 3.33Å; H89-S91 PolarHBondContact O-N 3.44Å; H89-L92 PolarHBondContact O-N 3.5Å; H89-L93 WeakPolarHBondContact O-CG 3.26Å; H89-L93 PolarHBondContact O-N 3Å; H89-P127 PolarHBondContact NE2-O 3.35Å; H89-R128 PolarHBondContact CE1-O 3.02Å; H89-F130 HydrophobicContact CB-CD2 4.23Å; H89-F130 AromaticContact ND1-CD2 3.65Å; H89-F133 HydrophobicContact CB-CD1 3.68Å; H89-F133 HydrophobicContact CB-CD2 4.41Å; H89-F133 HydrophobicContact CB-CE1 3.67Å; H89-F133 HydrophobicContact CB-CE2 4.4Å; H89-F133 HydrophobicContact CB-CG 4.06Å; H89-F133 HydrophobicContact CB-CZ 4.04Å; H89-F133 AromaticContact CD2-CD1 3.92Å; H89-F133 AromaticContact CD2-CD2 3.55Å; H89-F133 AromaticContact CD2-CG 3.38Å; H89-F133 WeakPolarHBondContact CD2-CG 3.31Å; H89-F133 AromaticContact CG-CD1 3.83Å; H89-F133 AromaticContact CG-CG 3.78Å
90	Q	98.6	Very high	96.8	Very high	94 Å²	94	27 Å²	27	44%	0.439	14%	0.142	S	C	.	.	H	α-helix	trans	-63.1	-39.6	-179	-68.2	171.8	12.1	0	0	111.9	D86 L93 M94 A227	D86-Q90 WeakPolarHBondContact O-CG 3.4Å; D86-Q90 PolarHBondContact O-N 3.18Å; Q90-L93 WeakPolarHBondContact O-CB 3.28Å; Q90-L93 PolarHBondContact O-N 3.41Å; Q90-M94 PolarHBondContact O-N 3.01Å; Q90-M94 VanDerWaalsContact O-N 3.1Å; Q90-A227 HydrophobicContact CB-CB 3.95Å
91	S	98.8	Very high	97.2	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-63	-43.8	177.1	-55.9	0	0	0	0	111.6	I87 A88 H89 L93 M94 L95 A226 A227	I87-S91 WeakPolarHBondContact O-CB 3.35Å; I87-S91 PolarHBondContact O-N 3.18Å; I87-S91 PolarHBondContact O-OG 2.82Å; A88-S91 PolarHBondContact O-N 3.48Å; H89-S91 VanDerWaalsContact C-N 3.33Å; H89-S91 PolarHBondContact O-N 3.44Å; S91-L93 VanDerWaalsContact C-N 3.32Å; S91-L93 PolarHBondContact O-N 3.21Å; S91-M94 PolarHBondContact O-N 3.16Å; S91-L95 WeakPolarHBondContact O-CB 3.31Å; S91-L95 VanDerWaalsContact O-CG 3.3Å; S91-L95 WeakPolarHBondContact O-CG 3.48Å; S91-L95 PolarHBondContact O-N 3.37Å; S91-A226 WeakPolarHBondContact OG-CB 3.45Å; S91-A227 PolarHBondContact OG-N 3.19Å
92	L	98.6	Very high	97.3	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-63.2	-36.5	174	-72.2	168.1	0	0	0	112.4	L47 A88 H89 M94 L95 M96 V108 I110 V120 I126 F133	L47-L92 HydrophobicContact CD1-CD2 3.97Å; L47-L92 HydrophobicContact CD1-CG 3.92Å; A88-L92 WeakPolarHBondContact O-CB 3.37Å; A88-L92 WeakPolarHBondContact O-CG 3.48Å; A88-L92 PolarHBondContact O-N 2.81Å; H89-L92 PolarHBondContact O-N 3.5Å; L92-M94 VanDerWaalsContact C-N 3.35Å; L92-L95 PolarHBondContact O-N 3.04Å; L92-M96 VanDerWaalsContact O-CB 3.23Å; L92-M96 WeakPolarHBondContact O-CB 3.48Å; L92-M96 WeakPolarHBondContact O-CG 3.3Å; L92-M96 PolarHBondContact O-N 3.4Å; L92-V108 HydrophobicContact CD2-CG1 3.87Å; L92-I110 HydrophobicContact CD1-CD1 3.71Å; L92-I110 HydrophobicContact CD2-CD1 4.03Å; L92-I110 HydrophobicContact CD2-CG1 4.26Å; L92-I110 HydrophobicContact CG-CD1 4.37Å; L92-V120 HydrophobicContact CD2-CG2 4.27Å; L92-I126 HydrophobicContact CB-CD1 4.42Å; L92-I126 HydrophobicContact CB-CG1 4.15Å; L92-I126 HydrophobicContact CB-CG2 4.35Å; L92-I126 HydrophobicContact CD1-CD1 4.38Å; L92-F133 HydrophobicContact CD1-CE2 3.8Å; L92-F133 HydrophobicContact CD1-CZ 4.23Å
93	L	98.6	Very high	97.5	Very high	22 Å²	22	31 Å²	31	12%	0.115	15%	0.151	C	C	.	.	H	α-helix	trans	-61.4	-43.9	174.8	-67	-176.8	0	0	0	111.5	H89 Q90 S91 D97 I126	H89-L93 WeakPolarHBondContact O-CG 3.26Å; H89-L93 PolarHBondContact O-N 3Å; Q90-L93 WeakPolarHBondContact O-CB 3.28Å; Q90-L93 PolarHBondContact O-N 3.41Å; S91-L93 VanDerWaalsContact C-N 3.32Å; S91-L93 PolarHBondContact O-N 3.21Å; L93-D97 VanDerWaalsContact O-CB 3.24Å; L93-D97 WeakPolarHBondContact O-CB 3.35Å; L93-D97 VanDerWaalsContact O-CG 3.28Å; L93-D97 PolarHBondContact O-N 3.17Å; L93-I126 HydrophobicContact CD2-CB 3.9Å; L93-I126 HydrophobicContact CD2-CG2 3.65Å; L93-I126 HydrophobicContact CG-CG2 4.46Å
94	M	98.5	Very high	97.4	Very high	79 Å²	79	31.3 Å²	31.3	39%	0.389	15%	0.154	S	C	.	.	H	α-helix	trans	-65	-48.2	177.5	-63.4	-61.5	92.9	0	0	111.7	Q90 S91 L92 S98 A227 C230 A231	Q90-M94 PolarHBondContact O-N 3.01Å; Q90-M94 VanDerWaalsContact O-N 3.1Å; S91-M94 PolarHBondContact O-N 3.16Å; L92-M94 VanDerWaalsContact C-N 3.35Å; M94-S98 PolarHBondContact O-N 2.78Å; M94-A227 HydrophobicContact CG-CB 4.04Å; M94-C230 HydrophobicContact CB-CB 4.42Å; M94-A231 HydrophobicContact CB-CB 4.45Å; M94-A231 HydrophobicContact CG-CB 4.5Å; M94-A231 HydrophobicContact SD-CB 4.48Å
95	L	98.6	Very high	97.4	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.7	-50.3	-179.7	-71	171.5	0	0	0	111.9	V45 L47 S91 L92 D97 S98 N101 L106 V108 C230 T234	V45-L95 HydrophobicContact CB-CD1 4.25Å; V45-L95 HydrophobicContact CB-CD2 4.13Å; V45-L95 HydrophobicContact CG1-CD1 3.9Å; V45-L95 HydrophobicContact CG1-CD2 4.16Å; V45-L95 HydrophobicContact CG2-CD2 3.84Å; L47-L95 HydrophobicContact CD1-CD1 4.26Å; L47-L95 HydrophobicContact CD2-CD1 4.22Å; L47-L95 HydrophobicContact CG-CD1 4.3Å; S91-L95 WeakPolarHBondContact O-CB 3.31Å; S91-L95 VanDerWaalsContact O-CG 3.3Å; S91-L95 WeakPolarHBondContact O-CG 3.48Å; S91-L95 PolarHBondContact O-N 3.37Å; L92-L95 PolarHBondContact O-N 3.04Å; L95-D97 VanDerWaalsContact C-N 3.3Å; L95-D97 PolarHBondContact O-N 2.9Å; L95-S98 WeakPolarHBondContact O-CB 3.43Å; L95-S98 PolarHBondContact O-N 3.38Å; L95-S98 PolarHBondContact O-OG 3.13Å; L95-N101 WeakPolarHBondContact O-CB 3.38Å; L95-L106 HydrophobicContact CB-CD2 3.98Å; L95-L106 HydrophobicContact CD2-CD1 4.46Å; L95-L106 HydrophobicContact CD2-CD2 4.2Å; L95-L106 WeakPolarHBondContact O-CD2 3.37Å; L95-V108 HydrophobicContact CB-CG2 4.15Å; L95-V108 HydrophobicContact CD1-CG1 3.92Å; L95-V108 HydrophobicContact CD1-CG2 4.03Å; L95-C230 HydrophobicContact CD1-CB 4.45Å; L95-C230 HydrophobicContact CD2-CB 3.72Å; L95-C230 HydrophobicContact CG-CB 3.81Å; L95-T234 HydrophobicContact CD2-CG2 3.94Å
96	M	97.9	Very high	97.5	Very high	7 Å²	7	28.4 Å²	28.4	3%	0.034	15%	0.145	C	C	.	.	H	α-helix	trans	-75.9	-19.3	-171.8	-60.2	-58	-66.8	0	0	113.3	L92 N101 V108 V120 N121 P122 T124 I126	L92-M96 VanDerWaalsContact O-CB 3.23Å; L92-M96 WeakPolarHBondContact O-CB 3.48Å; L92-M96 WeakPolarHBondContact O-CG 3.3Å; L92-M96 PolarHBondContact O-N 3.4Å; M96-N101 PolarHBondContact O-ND2 2.99Å; M96-V108 HydrophobicContact SD-CG2 4.2Å; M96-V120 HydrophobicContact CE-CG1 3.92Å; M96-V120 HydrophobicContact SD-CG1 3.92Å; M96-N121 WeakPolarHBondContact CE-O 3.45Å; M96-P122 WeakPolarHBondContact CE-O 3.31Å; M96-T124 VanDerWaalsContact CE-O 3.3Å; M96-T124 WeakPolarHBondContact CE-O 3.48Å; M96-I126 HydrophobicContact CB-CG1 4.22Å; M96-I126 HydrophobicContact CG-CG1 3.74Å
97	D	96.9	Very high	97.5	Very high	58 Å²	58	27.5 Å²	27.5	31%	0.31	14%	0.14	S	C	.	.	H	α-helix	trans	-86	-22	175.2	-80.7	3.2	0	0	0	114.5	L93 L95 R128	L93-D97 VanDerWaalsContact O-CB 3.24Å; L93-D97 WeakPolarHBondContact O-CB 3.35Å; L93-D97 VanDerWaalsContact O-CG 3.28Å; L93-D97 PolarHBondContact O-N 3.17Å; L95-D97 VanDerWaalsContact C-N 3.3Å; L95-D97 PolarHBondContact O-N 2.9Å; D97-R128 VanDerWaalsContact CG-NH1 3.33Å; D97-R128 IonicContact OD1-CZ 3.78Å; D97-R128 IonicContact OD1-NH1 3.79Å; D97-R128 PolarHBondContact OD1-NH1 3.05Å; D97-R128 IonicContact OD1-NH2 2.71Å; D97-R128 PolarHBondContact OD1-NH2 3.19Å; D97-R128 IonicContact OD2-CZ 3.3Å; D97-R128 IonicContact OD2-NH1 2.81Å; D97-R128 PolarHBondContact OD2-NH1 3.4Å; D97-R128 IonicContact OD2-NH2 3.72Å; D97-R128 PolarHBondContact OD2-NH2 2.76Å
98	S	98	Very high	97.5	Very high	6 Å²	6	26.5 Å²	26.5	4%	0.042	14%	0.135	C	C	.	.	S	Bend	trans	-50.4	138.7	-176.4	65.9	0	0	0	0	112.2	M94 L95 L100 N101 R102 E238	M94-S98 PolarHBondContact O-N 2.78Å; L95-S98 WeakPolarHBondContact O-CB 3.43Å; L95-S98 PolarHBondContact O-N 3.38Å; L95-S98 PolarHBondContact O-OG 3.13Å; S98-L100 PolarHBondContact O-N 3.33Å; S98-N101 PolarHBondContact O-N 3.02Å; S98-N101 WeakPolarHBondContact OG-CB 3.36Å; S98-N101 PolarHBondContact OG-N 3.01Å; S98-N101 VanDerWaalsContact OG-N 3.11Å; S98-R102 PolarHBondContact O-N 3.37Å; S98-E238 WeakPolarHBondContact CB-OE1 3.4Å
99	P	97.9	Very high	97.5	Very high	54 Å²	54	26.9 Å²	26.9	35%	0.351	14%	0.136	S	C	.	.	H	α-helix	trans	-46.5	-38.5	164.7	-29.3	33.6	0	0	0	112.3	N101 R102 A103 E238 V243	P99-N101 VanDerWaalsContact C-N 3.33Å; P99-N101 PolarHBondContact O-N 3.25Å; P99-R102 PolarHBondContact O-N 2.83Å; P99-R102 VanDerWaalsContact O-N 3.08Å; P99-A103 WeakPolarHBondContact O-CB 3.48Å; P99-A103 PolarHBondContact O-N 3.31Å; P99-E238 HydrophobicContact CB-CG 4.24Å; P99-E238 WeakPolarHBondContact CD-OE1 3.28Å; P99-V243 HydrophobicContact CB-CG1 3.74Å
100	L	97.3	Very high	97.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-55.9	-43.4	176.9	-158.3	67.4	0	0	0	113.4	L43 S98 A103 G104 L105 T234 F237 E238 W241 V243	L43-L100 HydrophobicContact CB-CD2 3.9Å; L43-L100 HydrophobicContact CD2-CD2 3.69Å; L43-L100 HydrophobicContact CG-CD2 4.42Å; S98-L100 PolarHBondContact O-N 3.33Å; L100-A103 PolarHBondContact O-N 2.69Å; L100-G104 PolarHBondContact O-N 3.11Å; L100-L105 HydrophobicContact CD1-CB 3.88Å; L100-L105 HydrophobicContact CD1-CD1 4.27Å; L100-L105 HydrophobicContact CG-CB 4.1Å; L100-L105 PolarHBondContact O-N 2.92Å; L100-T234 HydrophobicContact CD2-CG2 4.24Å; L100-F237 HydrophobicContact CD1-CB 4.17Å; L100-F237 HydrophobicContact CD2-CB 3.73Å; L100-F237 HydrophobicContact CD2-CG 4.46Å; L100-E238 HydrophobicContact CB-CG 3.84Å; L100-E238 WeakPolarHBondContact CB-OE1 3.45Å; L100-E238 HydrophobicContact CD1-CG 4.1Å; L100-E238 PolarHBondContact N-OE1 2.88Å; L100-W241 HydrophobicContact CD1-CE3 3.77Å; L100-W241 HydrophobicContact CD1-CZ3 4.12Å; L100-V243 HydrophobicContact CD1-CG2 4.34Å
101	N	97.4	Very high	97.5	Very high	2 Å²	2	23.4 Å²	23.4	1%	0.011	12%	0.12	C	C	.	.	H	α-helix	trans	-67.4	-41.5	175.6	-175.3	47.6	0	0	0	111.9	L95 M96 S98 P99 A103 G104 L106 P122	L95-N101 WeakPolarHBondContact O-CB 3.38Å; M96-N101 PolarHBondContact O-ND2 2.99Å; S98-N101 PolarHBondContact O-N 3.02Å; S98-N101 WeakPolarHBondContact OG-CB 3.36Å; S98-N101 PolarHBondContact OG-N 3.01Å; S98-N101 VanDerWaalsContact OG-N 3.11Å; P99-N101 VanDerWaalsContact C-N 3.33Å; P99-N101 PolarHBondContact O-N 3.25Å; N101-A103 PolarHBondContact O-N 3.26Å; N101-G104 PolarHBondContact O-N 2.75Å; N101-L106 HydrophobicContact CB-CB 4.06Å; N101-L106 HydrophobicContact CB-CD2 3.84Å; N101-P122 PolarHBondContact ND2-O 3.38Å; N101-P122 VanDerWaalsContact ND2-O 3.16Å; N101-P122 WeakPolarHBondContact OD1-CB 3.46Å
102	R	93.8	Very high	97.5	Very high	148 Å²	148	23.5 Å²	23.5	56%	0.558	12%	0.121	S	C	*	.	H	α-helix	trans	-65.2	-31.2	178	-62.5	-175.2	-176.4	-156.3	1.8	112.2	P30 S98 P99 G104	P30-R102 WeakPolarHBondContact CD-O 3.36Å; S98-R102 PolarHBondContact O-N 3.37Å; P99-R102 PolarHBondContact O-N 2.83Å; P99-R102 VanDerWaalsContact O-N 3.08Å; R102-G104 PolarHBondContact O-N 2.92Å
103	A	94	Very high	97.4	Very high	36 Å²	36	27.4 Å²	27.4	30%	0.298	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-5.8	173.1	0	0	0	0	0	113.8	P99 L100 N101 L105 V243	P99-A103 WeakPolarHBondContact O-CB 3.48Å; P99-A103 PolarHBondContact O-N 3.31Å; L100-A103 PolarHBondContact O-N 2.69Å; N101-A103 PolarHBondContact O-N 3.26Å; A103-L105 VanDerWaalsContact C-N 3.34Å; A103-L105 HydrophobicContact CB-CD1 4.23Å; A103-L105 HydrophobicContact CB-CG 4.32Å; A103-V243 HydrophobicContact CB-CG1 3.99Å; A103-V243 HydrophobicContact CB-CG2 4.18Å
104	G	94.3	Very high	97.3	Very high	5 Å²	5	32.4 Å²	32.4	5%	0.052	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	19.5	180	0	0	0	0	0	114.3	L100 N101 R102	L100-G104 PolarHBondContact O-N 3.11Å; N101-G104 PolarHBondContact O-N 2.75Å; R102-G104 PolarHBondContact O-N 2.92Å
105	L	96.6	Very high	97.2	Very high	27 Å²	27	33.4 Å²	33.4	14%	0.141	17%	0.166	C	C	.	.			trans	-105.2	6.9	-176.4	-63.7	174.3	0	0	0	113.3	R41 R42 L43 L100 A103 W241 V243	R41-L105 HydrophobicContact CG-CD2 4.38Å; R42-L105 CarbonylContact C-O 3.57Å; R42-L105 VanDerWaalsContact CA-O 3.31Å; R42-L105 WeakPolarHBondContact CA-O 3.16Å; R42-L105 WeakPolarHBondContact CB-O 3.48Å; L43-L105 PolarHBondContact N-O 3.03Å; L100-L105 HydrophobicContact CD1-CB 3.88Å; L100-L105 HydrophobicContact CD1-CD1 4.27Å; L100-L105 HydrophobicContact CG-CB 4.1Å; L100-L105 PolarHBondContact O-N 2.92Å; A103-L105 VanDerWaalsContact C-N 3.34Å; A103-L105 HydrophobicContact CB-CD1 4.23Å; A103-L105 HydrophobicContact CB-CG 4.32Å; L105-W241 HydrophobicContact CB-CE3 4.18Å; L105-W241 HydrophobicContact CB-CZ3 4.06Å; L105-W241 HydrophobicContact CD1-CE3 3.93Å; L105-V243 HydrophobicContact CD1-CG2 3.82Å
106	L	98	Very high	97.2	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	134.1	177.2	-175.8	67.1	0	0	0	111.1	L32 L43 V45 L95 N101 V108 T234	L32-L106 VanDerWaalsContact CD1-O 3.28Å; L32-L106 WeakPolarHBondContact CD1-O 3.17Å; L43-L106 HydrophobicContact CB-CD1 4.12Å; L43-L106 HydrophobicContact CD2-CD1 4Å; L43-L106 HydrophobicContact CG-CD1 3.9Å; L43-L106 CarbonylContact O-C 3.6Å; L43-L106 WeakPolarHBondContact O-CA 3.44Å; V45-L106 HydrophobicContact CG2-CD1 3.94Å; L95-L106 HydrophobicContact CB-CD2 3.98Å; L95-L106 HydrophobicContact CD2-CD1 4.46Å; L95-L106 HydrophobicContact CD2-CD2 4.2Å; L95-L106 WeakPolarHBondContact O-CD2 3.37Å; N101-L106 HydrophobicContact CB-CB 4.06Å; N101-L106 HydrophobicContact CB-CD2 3.84Å; L106-V108 HydrophobicContact CD1-CG2 4.35Å; L106-V108 HydrophobicContact CD2-CG2 3.87Å; L106-V108 HydrophobicContact CG-CG2 3.89Å; L106-T234 HydrophobicContact CD2-CG2 4.47Å
107	Q	98	Very high	97.2	Very high	6 Å²	6	34.9 Å²	34.9	3%	0.028	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	136.6	165.6	-179.3	58.5	55.3	0	0	108.9	L32 L43 I44 V45 Y109 V120	L32-Q107 HydrophobicContact CD1-CB 4.21Å; L32-Q107 HydrophobicContact CD2-CB 4.46Å; L32-Q107 VanDerWaalsContact CD2-OE1 3.27Å; L43-Q107 PolarHBondContact O-N 2.77Å; I44-Q107 CarbonylContact C-O 3.54Å; I44-Q107 VanDerWaalsContact CA-O 3.31Å; I44-Q107 WeakPolarHBondContact CA-O 3.49Å; I44-Q107 HydrophobicContact CG1-CB 4.18Å; V45-Q107 PolarHBondContact N-O 3.48Å; Q107-Y109 HydrophobicContact CG-CD2 4.37Å; Q107-Y109 HydrophobicContact CG-CE2 3.64Å; Q107-V120 PolarHBondContact NE2-O 3.02Å
108	V	98.7	Very high	97.3	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.012	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	135	-178.2	-176.4	0	0	0	0	110.5	V45 L92 L95 M96 L106 V120	V45-V108 WeakPolarHBondContact O-CA 3.28Å; L92-V108 HydrophobicContact CD2-CG1 3.87Å; L95-V108 HydrophobicContact CB-CG2 4.15Å; L95-V108 HydrophobicContact CD1-CG1 3.92Å; L95-V108 HydrophobicContact CD1-CG2 4.03Å; M96-V108 HydrophobicContact SD-CG2 4.2Å; L106-V108 HydrophobicContact CD1-CG2 4.35Å; L106-V108 HydrophobicContact CD2-CG2 3.87Å; L106-V108 HydrophobicContact CG-CG2 3.89Å; V108-V120 HydrophobicContact CB-CB 4.15Å; V108-V120 HydrophobicContact CB-CG2 4.46Å; V108-V120 HydrophobicContact CG1-CG2 4.3Å; V108-V120 PolarHBondContact O-N 2.69Å; V108-V120 VanDerWaalsContact O-N 3.07Å
109	Y	98.8	Very high	97.4	Very high	9 Å²	9	34.8 Å²	34.8	4%	0.035	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	149.4	168	-63.2	-81.1	0	0	0	109.9	I44 V45 V46 L47 Q107 I118 E119 I159 V163 H166 F167	I44-Y109 HydrophobicContact CG2-CD2 3.71Å; I44-Y109 HydrophobicContact CG2-CE2 3.74Å; V45-Y109 PolarHBondContact O-N 2.96Å; V46-Y109 WeakPolarHBondContact CA-O 3.41Å; V46-Y109 HydrophobicContact CG2-CD2 4.5Å; L47-Y109 PolarHBondContact N-O 3.05Å; Q107-Y109 HydrophobicContact CG-CD2 4.37Å; Q107-Y109 HydrophobicContact CG-CE2 3.64Å; Y109-I118 CarbonylContact C-O 3.58Å; Y109-I118 VanDerWaalsContact CA-O 3.3Å; Y109-I118 WeakPolarHBondContact CA-O 3.44Å; Y109-E119 HydrophobicContact CD1-CB 4.15Å; Y109-E119 HydrophobicContact CD1-CG 4.35Å; Y109-E119 HydrophobicContact CE1-CB 3.95Å; Y109-E119 HydrophobicContact CE1-CG 3.79Å; Y109-I159 HydrophobicContact CD1-CD1 3.91Å; Y109-I159 HydrophobicContact CE1-CD1 3.68Å; Y109-V163 HydrophobicContact CD1-CG2 4.49Å; Y109-V163 HydrophobicContact CD2-CG2 4.34Å; Y109-V163 HydrophobicContact CG-CG2 4.09Å; Y109-H166 HydrophobicContact CE1-CB 4.28Å; Y109-F167 HydrophobicContact CD2-CE1 4.37Å; Y109-F167 HydrophobicContact CE2-CE1 4.4Å
110	I	98.8	Very high	97.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	122.5	171.8	-47.9	162.8	0	0	0	107.1	L47 A50 L52 L92 I118 V120	L47-I110 HydrophobicContact CB-CG2 4.34Å; L47-I110 HydrophobicContact CD1-CG1 4.43Å; A50-I110 HydrophobicContact CB-CG2 3.45Å; A50-I110 VanDerWaalsContact CB-CG2 3.45Å; L52-I110 HydrophobicContact CD1-CD1 4.47Å; L52-I110 HydrophobicContact CD1-CG2 3.93Å; L92-I110 HydrophobicContact CD1-CD1 3.71Å; L92-I110 HydrophobicContact CD2-CD1 4.03Å; L92-I110 HydrophobicContact CD2-CG1 4.26Å; L92-I110 HydrophobicContact CG-CD1 4.37Å; I110-I118 HydrophobicContact CB-CB 4.16Å; I110-I118 HydrophobicContact CD1-CG2 4.41Å; I110-I118 PolarHBondContact N-O 3.41Å; I110-I118 PolarHBondContact O-N 3.21Å; I110-V120 HydrophobicContact CD1-CG2 3.87Å; I110-V120 HydrophobicContact CG1-CG2 4.11Å
111	H	98.7	Very high	97.3	Very high	30 Å²	30	34 Å²	34	14%	0.139	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	116.5	172.1	-175.4	-122.7	0	0	0	108.3	V46 L47 E48 G49 A50 N115 L117	V46-H111 HydrophobicContact CG1-CB 4.38Å; L47-H111 PolarHBondContact O-N 3.23Å; E48-H111 VanDerWaalsContact CD-ND1 3.3Å; E48-H111 IonicContact OE1-CE1 2.71Å; E48-H111 IonicContact OE1-CG 3.7Å; E48-H111 IonicContact OE1-ND1 2.83Å; E48-H111 PolarHBondContact OE1-ND1 3.44Å; E48-H111 IonicContact OE2-CG 3.38Å; E48-H111 IonicContact OE2-ND1 3.42Å; E48-H111 PolarHBondContact OE2-ND1 2.83Å; E48-H111 VanDerWaalsContact OE2-ND1 3.11Å; G49-H111 PolarHBondContact N-O 2.65Å; A50-H111 PolarHBondContact N-O 3.17Å; H111-N115 PolarHBondContact NE2-OD1 3.32Å; H111-N115 VanDerWaalsContact NE2-OD1 3.08Å; H111-L117 HydrophobicContact CB-CD1 4.19Å
112	T	98.2	Very high	97.2	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.012	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	160.7	-174.7	75.2	0	0	0	0	112	A50 L52 K114 N115 V116 I118	A50-T112 CarbonylContact O-C 3.53Å; A50-T112 WeakPolarHBondContact O-CA 3.37Å; A50-T112 WeakPolarHBondContact O-CB 3.19Å; L52-T112 HydrophobicContact CB-CG2 3.92Å; L52-T112 HydrophobicContact CD1-CG2 4.45Å; T112-K114 PolarHBondContact O-N 2.88Å; T112-K114 VanDerWaalsContact O-N 3.07Å; T112-K114 PolarHBondContact OG1-N 2.84Å; T112-N115 PolarHBondContact O-N 2.83Å; T112-V116 HydrophobicContact CG2-CB 4.13Å; T112-V116 PolarHBondContact N-O 3.35Å; T112-V116 WeakPolarHBondContact OG1-CB 3.46Å; T112-V116 PolarHBondContact OG1-N 3.45Å; T112-V116 VanDerWaalsContact OG1-N 3.11Å; T112-I118 HydrophobicContact CG2-CD1 4.21Å
113	Q	96	Very high	97.2	Very high	83 Å²	83	32 Å²	32	39%	0.388	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-21.7	172	-63.2	-178.7	-12.9	0	0	113.3	G49 A50 N115	G49-Q113 VanDerWaalsContact O-CG 3.24Å; G49-Q113 WeakPolarHBondContact O-CG 2.94Å; G49-Q113 PolarHBondContact O-NE2 2.95Å; A50-Q113 PolarHBondContact O-N 2.88Å; Q113-N115 VanDerWaalsContact C-N 3.31Å
114	K	96.1	Very high	97.2	Very high	126 Å²	126	30.5 Å²	30.5	55%	0.548	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	21.8	175.6	-70.9	-164.8	165.1	172.9	0	113.3	E53 T112 V116	E53-K114 HydrophobicContact CB-CD 3.98Å; E53-K114 WeakPolarHBondContact OE2-CE 3.4Å; E53-K114 IonicContact OE2-NZ 2.64Å; E53-K114 PolarHBondContact OE2-NZ 2.87Å; T112-K114 PolarHBondContact O-N 2.88Å; T112-K114 VanDerWaalsContact O-N 3.07Å; T112-K114 PolarHBondContact OG1-N 2.84Å; K114-V116 PolarHBondContact O-N 3.44Å
115	N	97.5	Very high	97.2	Very high	100 Å²	100	38.8 Å²	38.8	54%	0.535	18%	0.181	S	C	.	.	S	Bend	trans	58	32.7	177.3	-165.8	26.3	0	0	0	113.1	H111 T112 Q113 N161	H111-N115 PolarHBondContact NE2-OD1 3.32Å; H111-N115 VanDerWaalsContact NE2-OD1 3.08Å; T112-N115 PolarHBondContact O-N 2.83Å; Q113-N115 VanDerWaalsContact C-N 3.31Å; N115-N161 PolarHBondContact O-ND2 2.89Å; N115-N161 PolarHBondContact OD1-ND2 2.78Å
116	V	98.4	Very high	97.3	Very high	38 Å²	38	37.8 Å²	37.8	23%	0.23	18%	0.176	C	C	.	.			trans	-96.5	123	172.5	-177.2	0	0	0	0	108	T112 K114 I118 L141 V158	T112-V116 HydrophobicContact CG2-CB 4.13Å; T112-V116 PolarHBondContact N-O 3.35Å; T112-V116 WeakPolarHBondContact OG1-CB 3.46Å; T112-V116 PolarHBondContact OG1-N 3.45Å; T112-V116 VanDerWaalsContact OG1-N 3.11Å; K114-V116 PolarHBondContact O-N 3.44Å; V116-I118 HydrophobicContact CG1-CG1 4.12Å; V116-L141 HydrophobicContact CG1-CD2 4.09Å; V116-V158 HydrophobicContact CG1-CG1 3.77Å; V116-V158 HydrophobicContact CG1-CG2 4.07Å
117	L	98.7	Very high	97.3	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	127	175.5	-175.7	63.8	0	0	0	110.8	H111 V158 I159 N161 V163	H111-L117 HydrophobicContact CB-CD1 4.19Å; L117-V158 CarbonylContact O-C 3.54Å; L117-V158 WeakPolarHBondContact O-CA 3.24Å; L117-I159 HydrophobicContact CB-CG1 4.16Å; L117-I159 HydrophobicContact CD2-CD1 3.59Å; L117-I159 HydrophobicContact CD2-CG1 3.72Å; L117-I159 HydrophobicContact CG-CD1 3.82Å; L117-I159 HydrophobicContact CG-CG1 3.63Å; L117-I159 PolarHBondContact O-N 2.82Å; L117-N161 WeakPolarHBondContact CB-OD1 3.24Å; L117-V163 HydrophobicContact CD1-CB 3.81Å; L117-V163 HydrophobicContact CD1-CG2 3.71Å; L117-V163 HydrophobicContact CD2-CB 3.74Å; L117-V163 HydrophobicContact CD2-CG2 4.02Å; L117-V163 HydrophobicContact CG-CB 4.45Å; L117-V163 HydrophobicContact CG-CG2 4.5Å
118	I	98.8	Very high	97.2	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	124.7	-176.1	-56.4	168.8	0	0	0	108.6	Y109 I110 T112 V116 L140 L156 K157 V158	Y109-I118 CarbonylContact C-O 3.58Å; Y109-I118 VanDerWaalsContact CA-O 3.3Å; Y109-I118 WeakPolarHBondContact CA-O 3.44Å; I110-I118 HydrophobicContact CB-CB 4.16Å; I110-I118 HydrophobicContact CD1-CG2 4.41Å; I110-I118 PolarHBondContact N-O 3.41Å; I110-I118 PolarHBondContact O-N 3.21Å; T112-I118 HydrophobicContact CG2-CD1 4.21Å; V116-I118 HydrophobicContact CG1-CG1 4.12Å; I118-L140 HydrophobicContact CD1-CD2 3.83Å; I118-L140 HydrophobicContact CG1-CD2 4.27Å; I118-L140 HydrophobicContact CG2-CD2 3.67Å; I118-L156 HydrophobicContact CG2-CD2 4.44Å; I118-K157 WeakPolarHBondContact CA-O 3.36Å; I118-V158 HydrophobicContact CG1-CG2 4.43Å
119	E	98.5	Very high	97.2	Very high	60 Å²	60	46.3 Å²	46.3	28%	0.28	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	129.2	168.3	-175.4	-176.7	-176.8	0	0	109.6	Y109 K157 I159	Y109-E119 HydrophobicContact CD1-CB 4.15Å; Y109-E119 HydrophobicContact CD1-CG 4.35Å; Y109-E119 HydrophobicContact CE1-CB 3.95Å; Y109-E119 HydrophobicContact CE1-CG 3.79Å; E119-K157 PolarHBondContact N-O 3.02Å; E119-K157 PolarHBondContact O-N 2.69Å; E119-K157 VanDerWaalsContact O-N 3.12Å; E119-I159 HydrophobicContact CB-CD1 4Å; E119-I159 HydrophobicContact CB-CG1 4.29Å; E119-I159 HydrophobicContact CB-CG2 4.09Å
120	V	98.3	Very high	97.1	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.006	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	120.6	175.7	-174.3	0	0	0	0	109.2	L92 M96 Q107 V108 I110 L156	L92-V120 HydrophobicContact CD2-CG2 4.27Å; M96-V120 HydrophobicContact CE-CG1 3.92Å; M96-V120 HydrophobicContact SD-CG1 3.92Å; Q107-V120 PolarHBondContact NE2-O 3.02Å; V108-V120 HydrophobicContact CB-CB 4.15Å; V108-V120 HydrophobicContact CB-CG2 4.46Å; V108-V120 HydrophobicContact CG1-CG2 4.3Å; V108-V120 PolarHBondContact O-N 2.69Å; V108-V120 VanDerWaalsContact O-N 3.07Å; I110-V120 HydrophobicContact CD1-CG2 3.87Å; I110-V120 HydrophobicContact CG1-CG2 4.11Å; V120-L156 HydrophobicContact CB-CD2 4.13Å; V120-L156 HydrophobicContact CG1-CD2 3.89Å; V120-L156 HydrophobicContact CG2-CD2 3.8Å
121	N	96.1	Very high	97	Very high	38 Å²	38	53.2 Å²	53.2	20%	0.203	25%	0.253	C	S	.	.			trans	-70.3	134.7	174.4	-170.2	-61.2	0	0	0	109.7	M96 Q123 T124 Q153 K154 L155	M96-N121 WeakPolarHBondContact CE-O 3.45Å; N121-Q123 PolarHBondContact O-N 3.4Å; N121-Q123 WeakPolarHBondContact OD1-CB 3.31Å; N121-Q123 PolarHBondContact OD1-N 3.42Å; N121-T124 WeakPolarHBondContact O-CB 3.38Å; N121-T124 PolarHBondContact O-N 3.25Å; N121-T124 PolarHBondContact O-OG1 3.19Å; N121-Q153 PolarHBondContact ND2-NE2 3.07Å; N121-Q153 PolarHBondContact OD1-NE2 3.2Å; N121-K154 PolarHBondContact ND2-O 2.82Å; N121-L155 WeakPolarHBondContact CB-O 3.5Å; N121-L155 PolarHBondContact N-O 2.83Å
122	P	95.2	Very high	96.9	Very high	20 Å²	20	58.5 Å²	58.5	13%	0.13	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-24.9	177.8	-29.5	35.7	0	0	0	115.2	R29 L32 M96 N101 T124	R29-P122 PolarHBondContact NH1-O 2.92Å; L32-P122 HydrophobicContact CD1-CG 3.66Å; M96-P122 WeakPolarHBondContact CE-O 3.31Å; N101-P122 PolarHBondContact ND2-O 3.38Å; N101-P122 VanDerWaalsContact ND2-O 3.16Å; N101-P122 WeakPolarHBondContact OD1-CB 3.46Å; P122-T124 VanDerWaalsContact C-N 3.31Å
123	Q	93.1	Very high	96.9	Very high	86 Å²	86	58.4 Å²	58.4	40%	0.402	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-7.3	177.9	-63.1	-174.5	-19.4	0	0	113.9	N121 R125 Q153 L155	N121-Q123 PolarHBondContact O-N 3.4Å; N121-Q123 WeakPolarHBondContact OD1-CB 3.31Å; N121-Q123 PolarHBondContact OD1-N 3.42Å; Q123-R125 PolarHBondContact O-N 3.14Å; Q123-Q153 VanDerWaalsContact OE1-CD 3.25Å; Q123-L155 HydrophobicContact CB-CD2 4.35Å
124	T	94.9	Very high	97	Very high	5 Å²	5	55.1 Å²	55.1	3%	0.031	26%	0.257	C	S	.	.			trans	-64.7	122.6	-179	-53	0	0	0	0	110.6	M96 N121 P122 I126 L155 L156	M96-T124 VanDerWaalsContact CE-O 3.3Å; M96-T124 WeakPolarHBondContact CE-O 3.48Å; N121-T124 WeakPolarHBondContact O-CB 3.38Å; N121-T124 PolarHBondContact O-N 3.25Å; N121-T124 PolarHBondContact O-OG1 3.19Å; P122-T124 VanDerWaalsContact C-N 3.31Å; T124-I126 HydrophobicContact CG2-CD1 3.85Å; T124-L155 HydrophobicContact CG2-CB 4.26Å; T124-L155 WeakPolarHBondContact OG1-CB 3.41Å; T124-L155 PolarHBondContact OG1-O 2.85Å; T124-L156 HydrophobicContact CG2-CD1 4.43Å; T124-L156 HydrophobicContact CG2-CD2 4.28Å; T124-L156 HydrophobicContact CG2-CG 4.13Å
125	R	94.7	Very high	97	Very high	180 Å²	180	51.1 Å²	51.1	68%	0.679	25%	0.252	S	S	*	.			trans	-91.1	103.5	169.5	-171.8	175.3	-174.4	-102.2	3.8	109.6	Q123	Q123-R125 PolarHBondContact O-N 3.14Å
126	I	97.4	Very high	97	Very high	5 Å²	5	47.7 Å²	47.7	3%	0.026	23%	0.233	C	C	.	.			trans	-67	129.3	178.5	-56.2	-65.7	0	0	0	109.5	L92 L93 M96 T124 R128 F133	L92-I126 HydrophobicContact CB-CD1 4.42Å; L92-I126 HydrophobicContact CB-CG1 4.15Å; L92-I126 HydrophobicContact CB-CG2 4.35Å; L92-I126 HydrophobicContact CD1-CD1 4.38Å; L93-I126 HydrophobicContact CD2-CB 3.9Å; L93-I126 HydrophobicContact CD2-CG2 3.65Å; L93-I126 HydrophobicContact CG-CG2 4.46Å; M96-I126 HydrophobicContact CB-CG1 4.22Å; M96-I126 HydrophobicContact CG-CG1 3.74Å; T124-I126 HydrophobicContact CG2-CD1 3.85Å; I126-R128 PolarHBondContact O-N 3.26Å; I126-F133 HydrophobicContact CG2-CD2 4.05Å
127	P	97.9	Very high	97	Very high	19 Å²	19	46 Å²	46	12%	0.123	22%	0.223	C	C	.	.			trans	-58	133.1	176.6	-24.5	33.8	0	0	0	111.5	H89 R132 F133 L136	H89-P127 PolarHBondContact NE2-O 3.35Å; P127-R132 HydrophobicContact CB-CB 3.63Å; P127-R132 HydrophobicContact CG-CB 4.28Å; P127-F133 HydrophobicContact CB-CB 4.49Å; P127-L136 HydrophobicContact CG-CD2 3.9Å
128	R	97.3	Very high	96.9	Very high	100 Å²	100	46.8 Å²	46.8	38%	0.377	23%	0.228	S	C	.	.	S	Bend	trans	-73.8	-32	180	-59	-52.3	-176.9	153.7	3.2	113.7	H89 D97 I126	H89-R128 PolarHBondContact CE1-O 3.02Å; D97-R128 VanDerWaalsContact CG-NH1 3.33Å; D97-R128 IonicContact OD1-CZ 3.78Å; D97-R128 IonicContact OD1-NH1 3.79Å; D97-R128 PolarHBondContact OD1-NH1 3.05Å; D97-R128 IonicContact OD1-NH2 2.71Å; D97-R128 PolarHBondContact OD1-NH2 3.19Å; D97-R128 IonicContact OD2-CZ 3.3Å; D97-R128 IonicContact OD2-NH1 2.81Å; D97-R128 PolarHBondContact OD2-NH1 3.4Å; D97-R128 IonicContact OD2-NH2 3.72Å; D97-R128 PolarHBondContact OD2-NH2 2.76Å; I126-R128 PolarHBondContact O-N 3.26Å
129	T	97.7	Very high	96.9	Very high	69 Å²	69	50.6 Å²	50.6	42%	0.423	25%	0.246	S	C	.	.	S	Bend	trans	-84.7	131.2	176.9	59.5	0	0	0	0	109.1	D131 R132 F133	T129-D131 PolarHBondContact O-N 3.4Å; T129-R132 PolarHBondContact O-N 3.42Å; T129-R132 WeakPolarHBondContact OG1-CB 3.38Å; T129-R132 WeakPolarHBondContact OG1-CG 3.4Å; T129-R132 PolarHBondContact OG1-NE 2.86Å; T129-F133 PolarHBondContact O-N 3.08Å
130	F	96.8	Very high	96.8	Very high	51 Å²	51	47.8 Å²	47.8	22%	0.224	23%	0.232	C	C	.	.	H	α-helix	trans	-60.8	-41.5	-174.1	175.8	-106.5	0	0	0	112.6	N65 P85 D86 H89 R132 F133 C134	N65-F130 WeakPolarHBondContact ND2-CE1 3.41Å; P85-F130 HydrophobicContact CB-CE2 4.35Å; P85-F130 HydrophobicContact CB-CZ 4.39Å; P85-F130 HydrophobicContact CG-CE2 4.2Å; P85-F130 HydrophobicContact CG-CZ 3.79Å; D86-F130 HydrophobicContact CB-CD2 4.27Å; D86-F130 HydrophobicContact CB-CE2 3.87Å; D86-F130 HydrophobicContact CB-CZ 4.41Å; H89-F130 HydrophobicContact CB-CD2 4.23Å; H89-F130 AromaticContact ND1-CD2 3.65Å; F130-R132 VanDerWaalsContact C-N 3.29Å; F130-R132 PolarHBondContact O-N 3.45Å; F130-F133 HydrophobicContact CD2-CD1 4.35Å; F130-F133 HydrophobicContact CE2-CD1 4.34Å; F130-F133 WeakPolarHBondContact O-CA 3.46Å; F130-F133 WeakPolarHBondContact O-CB 3.39Å; F130-F133 PolarHBondContact O-N 3.33Å; F130-C134 VanDerWaalsContact CE1-SG 3.56Å; F130-C134 WeakPolarHBondContact CZ-SG 3.36Å; F130-C134 PolarHBondContact O-N 3.22Å; F130-C134 PolarHBondContact O-SG 3.11Å; F130-C134 VanDerWaalsContact O-SG 3.37Å
131	D	96.5	Very high	96.8	Very high	102 Å²	102	49.3 Å²	49.3	55%	0.545	24%	0.24	S	C	.	.	H	α-helix	trans	-60.3	-35.9	177.5	-71.2	-45.8	0	0	0	113.3	K68 T129 C134 G135	K68-D131 IonicContact NZ-OD1 3.77Å; K68-D131 PolarHBondContact NZ-OD1 3.38Å; T129-D131 PolarHBondContact O-N 3.4Å; D131-C134 WeakPolarHBondContact O-CB 3.39Å; D131-C134 PolarHBondContact O-N 2.9Å; D131-G135 PolarHBondContact O-N 3.06Å; D131-G135 VanDerWaalsContact O-N 3.08Å
132	R	97.3	Very high	96.7	Very high	141 Å²	141	51.9 Å²	51.9	53%	0.532	25%	0.251	S	S	.	.	H	α-helix	trans	-71.2	-36.1	175.5	-73.2	-165.7	-64.2	167.1	-9	111.9	P127 T129 F130 C134 G135 L136	P127-R132 HydrophobicContact CB-CB 3.63Å; P127-R132 HydrophobicContact CG-CB 4.28Å; T129-R132 PolarHBondContact O-N 3.42Å; T129-R132 WeakPolarHBondContact OG1-CB 3.38Å; T129-R132 WeakPolarHBondContact OG1-CG 3.4Å; T129-R132 PolarHBondContact OG1-NE 2.86Å; F130-R132 VanDerWaalsContact C-N 3.29Å; F130-R132 PolarHBondContact O-N 3.45Å; R132-C134 VanDerWaalsContact C-N 3.34Å; R132-G135 PolarHBondContact O-N 2.88Å; R132-L136 WeakPolarHBondContact O-CB 3.17Å; R132-L136 PolarHBondContact O-N 2.65Å
133	F	98.1	Very high	96.8	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.6	-44.3	171.9	169	-96.9	0	0	0	110.8	L52 L63 H89 L92 I126 P127 T129 F130 G135 L136 M137	L52-F133 HydrophobicContact CD2-CE1 4.02Å; L52-F133 HydrophobicContact CD2-CZ 4.05Å; L63-F133 HydrophobicContact CD2-CE1 4.47Å; H89-F133 HydrophobicContact CB-CD1 3.68Å; H89-F133 HydrophobicContact CB-CD2 4.41Å; H89-F133 HydrophobicContact CB-CE1 3.67Å; H89-F133 HydrophobicContact CB-CE2 4.4Å; H89-F133 HydrophobicContact CB-CG 4.06Å; H89-F133 HydrophobicContact CB-CZ 4.04Å; H89-F133 AromaticContact CD2-CD1 3.92Å; H89-F133 AromaticContact CD2-CD2 3.55Å; H89-F133 AromaticContact CD2-CG 3.38Å; H89-F133 WeakPolarHBondContact CD2-CG 3.31Å; H89-F133 AromaticContact CG-CD1 3.83Å; H89-F133 AromaticContact CG-CG 3.78Å; L92-F133 HydrophobicContact CD1-CE2 3.8Å; L92-F133 HydrophobicContact CD1-CZ 4.23Å; I126-F133 HydrophobicContact CG2-CD2 4.05Å; P127-F133 HydrophobicContact CB-CB 4.49Å; T129-F133 PolarHBondContact O-N 3.08Å; F130-F133 HydrophobicContact CD2-CD1 4.35Å; F130-F133 HydrophobicContact CE2-CD1 4.34Å; F130-F133 WeakPolarHBondContact O-CA 3.46Å; F130-F133 WeakPolarHBondContact O-CB 3.39Å; F130-F133 PolarHBondContact O-N 3.33Å; F133-G135 PolarHBondContact O-N 3.38Å; F133-L136 WeakPolarHBondContact O-CB 3.21Å; F133-L136 PolarHBondContact O-N 3.37Å; F133-M137 HydrophobicContact CD1-CG 4.21Å; F133-M137 HydrophobicContact CD2-CE 4.23Å; F133-M137 HydrophobicContact CD2-CG 4.21Å; F133-M137 HydrophobicContact CE1-CG 3.72Å; F133-M137 HydrophobicContact CE2-CE 3.78Å; F133-M137 HydrophobicContact CE2-CG 3.72Å; F133-M137 HydrophobicContact CE2-SD 3.8Å; F133-M137 HydrophobicContact CG-CG 4.44Å; F133-M137 HydrophobicContact CZ-CE 4.39Å; F133-M137 HydrophobicContact CZ-CG 3.46Å; F133-M137 VanDerWaalsContact CZ-CG 3.46Å; F133-M137 HydrophobicContact CZ-SD 3.8Å; F133-M137 WeakPolarHBondContact O-CG 3.39Å; F133-M137 PolarHBondContact O-N 3.19Å
134	C	97.4	Very high	97	Very high	14 Å²	14	58.6 Å²	58.6	10%	0.095	28%	0.281	C	S	.	.	H	α-helix	trans	-57.4	-48.5	175.9	-68.3	0	0	0	0	112.1	L63 F130 D131 R132 L136 M137 V138	L63-C134 HydrophobicContact CB-CB 3.93Å; L63-C134 HydrophobicContact CD2-CB 4.3Å; F130-C134 VanDerWaalsContact CE1-SG 3.56Å; F130-C134 WeakPolarHBondContact CZ-SG 3.36Å; F130-C134 PolarHBondContact O-N 3.22Å; F130-C134 PolarHBondContact O-SG 3.11Å; F130-C134 VanDerWaalsContact O-SG 3.37Å; D131-C134 WeakPolarHBondContact O-CB 3.39Å; D131-C134 PolarHBondContact O-N 2.9Å; R132-C134 VanDerWaalsContact C-N 3.34Å; C134-L136 VanDerWaalsContact C-N 3.32Å; C134-L136 PolarHBondContact O-N 3.44Å; C134-M137 PolarHBondContact O-N 2.99Å; C134-V138 WeakPolarHBondContact O-CG2 3.32Å; C134-V138 PolarHBondContact O-N 3.5Å
135	G	97.1	Very high	97.1	Very high	42 Å²	42	59.4 Å²	59.4	43%	0.433	29%	0.287	S	S	.	.	H	α-helix	trans	-59.6	-40.5	175.9	0	0	0	0	0	113.2	D131 R132 F133 V138 Q139	D131-G135 PolarHBondContact O-N 3.06Å; D131-G135 VanDerWaalsContact O-N 3.08Å; R132-G135 PolarHBondContact O-N 2.88Å; F133-G135 PolarHBondContact O-N 3.38Å; G135-V138 PolarHBondContact O-N 3.28Å; G135-Q139 PolarHBondContact O-N 2.91Å
136	L	97.3	Very high	97.2	Very high	28 Å²	28	51.4 Å²	51.4	15%	0.147	26%	0.258	C	S	.	.	H	α-helix	trans	-62.6	-43.1	175.6	178.6	65.4	0	0	0	112.1	P127 R132 F133 C134 Q139 L140 V146 L156	P127-L136 HydrophobicContact CG-CD2 3.9Å; R132-L136 WeakPolarHBondContact O-CB 3.17Å; R132-L136 PolarHBondContact O-N 2.65Å; F133-L136 WeakPolarHBondContact O-CB 3.21Å; F133-L136 PolarHBondContact O-N 3.37Å; C134-L136 VanDerWaalsContact C-N 3.32Å; C134-L136 PolarHBondContact O-N 3.44Å; L136-Q139 PolarHBondContact O-N 3.42Å; L136-L140 WeakPolarHBondContact O-CB 3.36Å; L136-L140 PolarHBondContact O-N 2.64Å; L136-V146 HydrophobicContact CD1-CB 4.32Å; L136-V146 HydrophobicContact CD1-CG1 3.8Å; L136-V146 HydrophobicContact CD1-CG2 3.99Å; L136-L156 HydrophobicContact CD1-CD1 4.14Å; L136-L156 HydrophobicContact CD2-CD1 3.81Å; L136-L156 HydrophobicContact CG-CD1 3.91Å
137	M	98.1	Very high	97	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-68	-40	178.2	-67	-59.1	101.2	0	0	112	L52 L63 F133 C134 Q139 L140 L141 L156	L52-M137 HydrophobicContact CD1-SD 4.02Å; L52-M137 HydrophobicContact CD2-CG 4.25Å; L63-M137 HydrophobicContact CD1-CB 3.79Å; L63-M137 HydrophobicContact CD2-CB 4.05Å; L63-M137 HydrophobicContact CD2-CG 4.36Å; F133-M137 HydrophobicContact CD1-CG 4.21Å; F133-M137 HydrophobicContact CD2-CE 4.23Å; F133-M137 HydrophobicContact CD2-CG 4.21Å; F133-M137 HydrophobicContact CE1-CG 3.72Å; F133-M137 HydrophobicContact CE2-CE 3.78Å; F133-M137 HydrophobicContact CE2-CG 3.72Å; F133-M137 HydrophobicContact CE2-SD 3.8Å; F133-M137 HydrophobicContact CG-CG 4.44Å; F133-M137 HydrophobicContact CZ-CE 4.39Å; F133-M137 HydrophobicContact CZ-CG 3.46Å; F133-M137 VanDerWaalsContact CZ-CG 3.46Å; F133-M137 HydrophobicContact CZ-SD 3.8Å; F133-M137 WeakPolarHBondContact O-CG 3.39Å; F133-M137 PolarHBondContact O-N 3.19Å; C134-M137 PolarHBondContact O-N 2.99Å; M137-Q139 VanDerWaalsContact C-N 3.34Å; M137-Q139 PolarHBondContact O-N 3.29Å; M137-L140 HydrophobicContact CE-CD2 4.23Å; M137-L140 PolarHBondContact O-N 2.63Å; M137-L140 HydrophobicContact SD-CD2 4.26Å; M137-L141 WeakPolarHBondContact O-CB 3.4Å; M137-L141 WeakPolarHBondContact O-CG 3.32Å; M137-L141 PolarHBondContact O-N 3.23Å; M137-L156 HydrophobicContact CE-CD1 3.7Å
138	V	97.6	Very high	96.7	Very high	18 Å²	18	57.6 Å²	57.6	11%	0.109	28%	0.283	C	S	.	.	H	α-helix	trans	-58.7	-48.1	172.8	172.5	0	0	0	0	110.4	T54 L63 C134 G135 L140 L141 H142	T54-V138 HydrophobicContact CG2-CB 4.34Å; T54-V138 HydrophobicContact CG2-CG1 4.28Å; T54-V138 HydrophobicContact CG2-CG2 4.1Å; L63-V138 HydrophobicContact CB-CG2 4.04Å; L63-V138 HydrophobicContact CD1-CG2 4.48Å; L63-V138 VanDerWaalsContact N-CG2 3.34Å; C134-V138 WeakPolarHBondContact O-CG2 3.32Å; C134-V138 PolarHBondContact O-N 3.5Å; G135-V138 PolarHBondContact O-N 3.28Å; V138-L140 VanDerWaalsContact C-N 3.33Å; V138-L140 PolarHBondContact O-N 2.61Å; V138-L141 PolarHBondContact O-N 3.43Å; V138-H142 WeakPolarHBondContact O-CB 3.07Å; V138-H142 PolarHBondContact O-CD2 2.97Å; V138-H142 VanDerWaalsContact O-CD2 3.27Å; V138-H142 PolarHBondContact O-N 3.17Å
139	Q	96.9	Very high	96.3	Very high	82 Å²	82	58.3 Å²	58.3	38%	0.383	31%	0.31	S	S	.	.	H	α-helix	trans	-59	-44.6	176.8	179.9	-178.7	-24.1	0	0	111.8	G135 L136 M137 H142 K143 V146	G135-Q139 PolarHBondContact O-N 2.91Å; L136-Q139 PolarHBondContact O-N 3.42Å; M137-Q139 VanDerWaalsContact C-N 3.34Å; M137-Q139 PolarHBondContact O-N 3.29Å; Q139-H142 PolarHBondContact O-N 3.01Å; Q139-K143 HydrophobicContact CG-CD 4.03Å; Q139-K143 WeakPolarHBondContact O-CB 3.42Å; Q139-K143 PolarHBondContact O-N 2.89Å; Q139-V146 HydrophobicContact CG-CG2 4.26Å
140	L	97.9	Very high	95.8	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-60.8	-48.5	178.5	172.7	62.4	0	0	0	111.8	I118 L136 M137 V138 H142 K143 L144 V146 L156 V158	I118-L140 HydrophobicContact CD1-CD2 3.83Å; I118-L140 HydrophobicContact CG1-CD2 4.27Å; I118-L140 HydrophobicContact CG2-CD2 3.67Å; L136-L140 WeakPolarHBondContact O-CB 3.36Å; L136-L140 PolarHBondContact O-N 2.64Å; M137-L140 HydrophobicContact CE-CD2 4.23Å; M137-L140 PolarHBondContact O-N 2.63Å; M137-L140 HydrophobicContact SD-CD2 4.26Å; V138-L140 VanDerWaalsContact C-N 3.33Å; V138-L140 PolarHBondContact O-N 2.61Å; L140-H142 VanDerWaalsContact C-N 3.28Å; L140-H142 PolarHBondContact O-N 3.45Å; L140-K143 PolarHBondContact O-N 2.99Å; L140-L144 WeakPolarHBondContact O-CA 3.43Å; L140-L144 PolarHBondContact O-N 3.01Å; L140-V146 HydrophobicContact CB-CG2 3.88Å; L140-V146 HydrophobicContact CD1-CG2 4.27Å; L140-L156 HydrophobicContact CD1-CB 3.72Å; L140-L156 HydrophobicContact CD2-CB 3.93Å; L140-L156 HydrophobicContact CD2-CD1 4.23Å; L140-L156 HydrophobicContact CG-CB 4.38Å; L140-V158 HydrophobicContact CD1-CG2 4.25Å; L140-V158 HydrophobicContact CG-CG2 4.45Å
141	L	97.1	Very high	95.3	Very high	34 Å²	34	61.2 Å²	61.2	18%	0.178	33%	0.332	C	S	.	.	H	α-helix	trans	-66.8	-30.7	-177.7	-69	174.1	0	0	0	112.1	T54 L63 V116 M137 V138	T54-L141 HydrophobicContact CG2-CB 4.01Å; T54-L141 HydrophobicContact CG2-CD1 3.79Å; L63-L141 HydrophobicContact CD1-CD1 4.25Å; V116-L141 HydrophobicContact CG1-CD2 4.09Å; M137-L141 WeakPolarHBondContact O-CB 3.4Å; M137-L141 WeakPolarHBondContact O-CG 3.32Å; M137-L141 PolarHBondContact O-N 3.23Å; V138-L141 PolarHBondContact O-N 3.43Å
142	H	95.6	Very high	95	Very high	92 Å²	92	61.7 Å²	61.7	43%	0.426	34%	0.34	S	S	.	.	H	α-helix	trans	-80	-41.9	176.7	-79	-135.4	0	0	0	113.4	Y61 V138 Q139 L140	Y61-H142 AromaticContact CD1-CE1 3.56Å; Y61-H142 AromaticContact CD1-NE2 3.63Å; Y61-H142 AromaticContact CD2-CE1 3.5Å; Y61-H142 AromaticContact CE1-CE1 3.94Å; Y61-H142 AromaticContact CE2-CE1 3.87Å; Y61-H142 AromaticContact CG-CE1 3.32Å; Y61-H142 AromaticContact CG-NE2 3.69Å; V138-H142 WeakPolarHBondContact O-CB 3.07Å; V138-H142 PolarHBondContact O-CD2 2.97Å; V138-H142 VanDerWaalsContact O-CD2 3.27Å; V138-H142 PolarHBondContact O-N 3.17Å; Q139-H142 PolarHBondContact O-N 3.01Å; L140-H142 VanDerWaalsContact C-N 3.28Å; L140-H142 PolarHBondContact O-N 3.45Å
143	K	96.6	Very high	94.7	Very high	144 Å²	144	58.4 Å²	58.4	63%	0.626	33%	0.331	S	S	*	.	H	α-helix	trans	-96.2	-4.4	-174.7	-63.8	-171.9	178.5	-179.2	0	113.6	Q139 L140 S145	Q139-K143 HydrophobicContact CG-CD 4.03Å; Q139-K143 WeakPolarHBondContact O-CB 3.42Å; Q139-K143 PolarHBondContact O-N 2.89Å; L140-K143 PolarHBondContact O-N 2.99Å; K143-S145 PolarHBondContact O-N 3.17Å
144	L	97	Very high	94.5	Very high	103 Å²	103	62.1 Å²	62.1	54%	0.539	35%	0.347	S	S	.	.	S	Bend	trans	58.8	-2.1	-174.3	-51.3	178.7	0	0	0	115	L140 V158	L140-L144 WeakPolarHBondContact O-CA 3.43Å; L140-L144 PolarHBondContact O-N 3.01Å; L144-V158 HydrophobicContact CB-CB 4.26Å; L144-V158 HydrophobicContact CB-CG2 4.43Å; L144-V158 HydrophobicContact CD2-CB 4.3Å; L144-V158 HydrophobicContact CD2-CG1 4.47Å; L144-V158 HydrophobicContact CD2-CG2 4.2Å; L144-V158 PolarHBondContact O-N 3.3Å
145	S	96.5	Very high	94.4	Very high	21 Å²	21	63 Å²	63	15%	0.147	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	153.9	172.3	57.1	0	0	0	0	111.8	K143 L156	K143-S145 PolarHBondContact O-N 3.17Å; S145-L156 CarbonylContact C-O 3.57Å; S145-L156 WeakPolarHBondContact CA-O 3.4Å; S145-L156 WeakPolarHBondContact CB-O 3.45Å
146	V	96.8	Very high	94.4	Very high	12 Å²	12	61.1 Å²	61.1	7%	0.073	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	131	171.4	-177.5	0	0	0	0	108.4	L136 Q139 L140 K154 L155 L156	L136-V146 HydrophobicContact CD1-CB 4.32Å; L136-V146 HydrophobicContact CD1-CG1 3.8Å; L136-V146 HydrophobicContact CD1-CG2 3.99Å; Q139-V146 HydrophobicContact CG-CG2 4.26Å; L140-V146 HydrophobicContact CB-CG2 3.88Å; L140-V146 HydrophobicContact CD1-CG2 4.27Å; V146-K154 CarbonylContact O-C 3.56Å; V146-K154 WeakPolarHBondContact O-CA 3.23Å; V146-L155 PolarHBondContact O-N 2.83Å; V146-L156 HydrophobicContact CB-CB 4.26Å; V146-L156 HydrophobicContact CG2-CB 4.48Å; V146-L156 PolarHBondContact N-O 3.01Å; V146-L156 PolarHBondContact O-N 2.73Å
147	R	94.1	Very high	94.5	Very high	135 Å²	135	63.8 Å²	63.8	51%	0.509	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	157.8	179.1	-64.3	-178.5	-169.7	-93.7	9.2	111.2	P152 Q153 K154	R147-P152 PolarHBondContact NH1-O 3.32Å; R147-Q153 CarbonylContact C-O 3.5Å; R147-Q153 WeakPolarHBondContact CA-O 3.13Å; R147-K154 HydrophobicContact CG-CG 4.13Å
148	A	91.4	Very high	94.5	Very high	19 Å²	19	65.2 Å²	65.2	16%	0.157	35%	0.35	C	S	.	.			trans	-61.8	149	169	0	0	0	0	0	110.2	D150 Q153 L155	A148-D150 VanDerWaalsContact C-N 3.26Å; A148-D150 VanDerWaalsContact CB-OD1 3.28Å; A148-D150 WeakPolarHBondContact CB-OD1 3.49Å; A148-Q153 PolarHBondContact N-O 3.03Å; A148-L155 HydrophobicContact CB-CD1 4.01Å; A148-L155 HydrophobicContact CB-CD2 4.45Å; A148-L155 HydrophobicContact CB-CG 4.14Å
149	A	87.7	Confident	94.5	Very high	116 Å²	116	65.3 Å²	65.3	96%	0.959	35%	0.35	S	S	*	.	S	Bend	trans	-72.3	-27.9	178.7	0	0	0	0	0	111.8
150	D	88.7	Confident	94.6	Very high	154 Å²	154	69.8 Å²	69.8	82%	0.824	37%	0.368	S	S	*	.	S	Bend	trans	-100.4	4.4	-175.1	61.6	-33.9	0	0	0	113.4	A148	A148-D150 VanDerWaalsContact C-N 3.26Å; A148-D150 VanDerWaalsContact CB-OD1 3.28Å; A148-D150 WeakPolarHBondContact CB-OD1 3.49Å
151	G	86.3	Confident	94.5	Very high	27 Å²	27	72.5 Å²	72.5	28%	0.278	38%	0.382	S	S	.	.	S	Bend	trans	-171.9	170.2	-178.8	0	0	0	0	0	116.2	Q153	G151-Q153 PolarHBondContact O-N 2.86Å
152	P	89.9	Confident	94.6	Very high	111 Å²	111	73.9 Å²	73.9	72%	0.721	39%	0.393	S	S	*	.	S	Bend	trans	-74.2	-7.7	-177.1	31.1	-36.1	0	0	0	113.4	R147 K154	R147-P152 PolarHBondContact NH1-O 3.32Å; P152-K154 PolarHBondContact O-N 3.12Å
153	Q	90.8	Very high	94.6	Very high	72 Å²	72	69.8 Å²	69.8	34%	0.336	38%	0.375	S	S	.	.			trans	-62.5	132.5	-174.9	-179.5	174.9	-19.9	0	0	112	N121 Q123 R147 A148 G151	N121-Q153 PolarHBondContact ND2-NE2 3.07Å; N121-Q153 PolarHBondContact OD1-NE2 3.2Å; Q123-Q153 VanDerWaalsContact OE1-CD 3.25Å; R147-Q153 CarbonylContact C-O 3.5Å; R147-Q153 WeakPolarHBondContact CA-O 3.13Å; A148-Q153 PolarHBondContact N-O 3.03Å; G151-Q153 PolarHBondContact O-N 2.86Å
154	K	93.9	Very high	94.6	Very high	79 Å²	79	65 Å²	65	34%	0.343	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	119.7	171.1	-65	-177.8	177.7	-173.3	0	108.9	N121 V146 R147 P152 K157	N121-K154 PolarHBondContact ND2-O 2.82Å; V146-K154 CarbonylContact O-C 3.56Å; V146-K154 WeakPolarHBondContact O-CA 3.23Å; R147-K154 HydrophobicContact CG-CG 4.13Å; P152-K154 PolarHBondContact O-N 3.12Å; K154-K157 HydrophobicContact CD-CD 4.23Å; K154-K157 HydrophobicContact CD-CG 4.39Å
155	L	95.2	Very high	94.5	Very high	32 Å²	32	65.8 Å²	65.8	17%	0.168	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	-41.7	177.4	-66.5	-179.6	0	0	0	111	N121 Q123 T124 V146 A148	N121-L155 WeakPolarHBondContact CB-O 3.5Å; N121-L155 PolarHBondContact N-O 2.83Å; Q123-L155 HydrophobicContact CB-CD2 4.35Å; T124-L155 HydrophobicContact CG2-CB 4.26Å; T124-L155 WeakPolarHBondContact OG1-CB 3.41Å; T124-L155 PolarHBondContact OG1-O 2.85Å; V146-L155 PolarHBondContact O-N 2.83Å; A148-L155 HydrophobicContact CB-CD1 4.01Å; A148-L155 HydrophobicContact CB-CD2 4.45Å; A148-L155 HydrophobicContact CB-CG 4.14Å
156	L	97.6	Very high	94.5	Very high	2 Å²	2	67.7 Å²	67.7	1%	0.01	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	139.4	174.4	-65.4	164.8	0	0	0	108.4	I118 V120 T124 L136 M137 L140 S145 V146	I118-L156 HydrophobicContact CG2-CD2 4.44Å; V120-L156 HydrophobicContact CB-CD2 4.13Å; V120-L156 HydrophobicContact CG1-CD2 3.89Å; V120-L156 HydrophobicContact CG2-CD2 3.8Å; T124-L156 HydrophobicContact CG2-CD1 4.43Å; T124-L156 HydrophobicContact CG2-CD2 4.28Å; T124-L156 HydrophobicContact CG2-CG 4.13Å; L136-L156 HydrophobicContact CD1-CD1 4.14Å; L136-L156 HydrophobicContact CD2-CD1 3.81Å; L136-L156 HydrophobicContact CG-CD1 3.91Å; M137-L156 HydrophobicContact CE-CD1 3.7Å; L140-L156 HydrophobicContact CD1-CB 3.72Å; L140-L156 HydrophobicContact CD2-CB 3.93Å; L140-L156 HydrophobicContact CD2-CD1 4.23Å; L140-L156 HydrophobicContact CG-CB 4.38Å; S145-L156 CarbonylContact C-O 3.57Å; S145-L156 WeakPolarHBondContact CA-O 3.4Å; S145-L156 WeakPolarHBondContact CB-O 3.45Å; V146-L156 HydrophobicContact CB-CB 4.26Å; V146-L156 HydrophobicContact CG2-CB 4.48Å; V146-L156 PolarHBondContact N-O 3.01Å; V146-L156 PolarHBondContact O-N 2.73Å
157	K	97.9	Very high	94.4	Very high	84 Å²	84	68.3 Å²	68.3	37%	0.365	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	130.7	-178	-175.4	-173.4	169.5	-161.5	0	110.5	I118 E119 K154 I159	I118-K157 WeakPolarHBondContact CA-O 3.36Å; E119-K157 PolarHBondContact N-O 3.02Å; E119-K157 PolarHBondContact O-N 2.69Å; E119-K157 VanDerWaalsContact O-N 3.12Å; K154-K157 HydrophobicContact CD-CD 4.23Å; K154-K157 HydrophobicContact CD-CG 4.39Å; K157-I159 HydrophobicContact CD-CG2 3.95Å; K157-I159 HydrophobicContact CG-CG2 4.05Å
158	V	98.4	Very high	94.3	Very high	33 Å²	33	63.7 Å²	63.7	20%	0.2	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	127.5	166	-180	0	0	0	0	108.3	V116 L117 I118 L140 L144	V116-V158 HydrophobicContact CG1-CG1 3.77Å; V116-V158 HydrophobicContact CG1-CG2 4.07Å; L117-V158 CarbonylContact O-C 3.54Å; L117-V158 WeakPolarHBondContact O-CA 3.24Å; I118-V158 HydrophobicContact CG1-CG2 4.43Å; L140-V158 HydrophobicContact CD1-CG2 4.25Å; L140-V158 HydrophobicContact CG-CG2 4.45Å; L144-V158 HydrophobicContact CB-CB 4.26Å; L144-V158 HydrophobicContact CB-CG2 4.43Å; L144-V158 HydrophobicContact CD2-CB 4.3Å; L144-V158 HydrophobicContact CD2-CG1 4.47Å; L144-V158 HydrophobicContact CD2-CG2 4.2Å; L144-V158 PolarHBondContact O-N 3.3Å
159	I	98.1	Very high	94.2	Very high	19 Å²	19	69.8 Å²	69.8	10%	0.097	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	167.3	-178.5	56.3	163.1	0	0	0	110.2	Y109 L117 E119 K157	Y109-I159 HydrophobicContact CD1-CD1 3.91Å; Y109-I159 HydrophobicContact CE1-CD1 3.68Å; L117-I159 HydrophobicContact CB-CG1 4.16Å; L117-I159 HydrophobicContact CD2-CD1 3.59Å; L117-I159 HydrophobicContact CD2-CG1 3.72Å; L117-I159 HydrophobicContact CG-CD1 3.82Å; L117-I159 HydrophobicContact CG-CG1 3.63Å; L117-I159 PolarHBondContact O-N 2.82Å; E119-I159 HydrophobicContact CB-CD1 4Å; E119-I159 HydrophobicContact CB-CG1 4.29Å; E119-I159 HydrophobicContact CB-CG2 4.09Å; K157-I159 HydrophobicContact CD-CG2 3.95Å; K157-I159 HydrophobicContact CG-CG2 4.05Å
160	K	98.2	Very high	94.2	Very high	177 Å²	177	67.2 Å²	67.2	77%	0.77	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-77.7	142	-177.5	-67.7	-175.2	175.9	-176.4	0	110.8	H166	K160-H166 PolarHBondContact O-NE2 3.42Å
161	N	97.6	Very high	94.3	Very high	57 Å²	57	60 Å²	60	31%	0.305	34%	0.342	S	S	.	.	S	Bend	trans	-72.6	160.8	165.7	-73.4	-53.2	0	0	0	111.7	N115 L117	N115-N161 PolarHBondContact O-ND2 2.89Å; N115-N161 PolarHBondContact OD1-ND2 2.78Å; L117-N161 WeakPolarHBondContact CB-OD1 3.24Å
162	P	97.6	Very high	94.7	Very high	63 Å²	63	62.4 Å²	62.4	41%	0.409	35%	0.347	S	S	.	.	P	Polyproline II helix	cis	-76.5	160.3	-6.5	32.8	-37.3	0	0	0	113.2	S164 D165 H166	P162-S164 WeakPolarHBondContact CG-OG 3.26Å; P162-S164 PolarHBondContact O-N 3.25Å; P162-D165 WeakPolarHBondContact CD-OD2 3.26Å; P162-D165 WeakPolarHBondContact CG-OD1 3.28Å; P162-D165 PolarHBondContact O-N 2.85Å; P162-H166 PolarHBondContact O-CD2 3.15Å
163	V	97.4	Very high	95.1	Very high	6 Å²	6	59.3 Å²	59.3	4%	0.036	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-62.8	-27.8	177.4	67.8	0	0	0	0	112.8	V46 Y109 L117 D165 H166 F167 Y212	V46-V163 HydrophobicContact CG2-CG2 4.14Å; Y109-V163 HydrophobicContact CD1-CG2 4.49Å; Y109-V163 HydrophobicContact CD2-CG2 4.34Å; Y109-V163 HydrophobicContact CG-CG2 4.09Å; L117-V163 HydrophobicContact CD1-CB 3.81Å; L117-V163 HydrophobicContact CD1-CG2 3.71Å; L117-V163 HydrophobicContact CD2-CB 3.74Å; L117-V163 HydrophobicContact CD2-CG2 4.02Å; L117-V163 HydrophobicContact CG-CB 4.45Å; L117-V163 HydrophobicContact CG-CG2 4.5Å; V163-D165 PolarHBondContact O-N 3.28Å; V163-H166 PolarHBondContact O-N 3.42Å; V163-H166 VanDerWaalsContact O-N 3.1Å; V163-F167 HydrophobicContact CB-CZ 4.31Å; V163-F167 HydrophobicContact CG1-CE2 4.37Å; V163-F167 HydrophobicContact CG1-CZ 3.85Å; V163-F167 HydrophobicContact CG2-CE1 3.73Å; V163-F167 HydrophobicContact CG2-CZ 3.75Å; V163-Y212 HydrophobicContact CG1-CD1 4.13Å; V163-Y212 HydrophobicContact CG1-CE1 3.49Å; V163-Y212 VanDerWaalsContact CG1-CE1 3.49Å; V163-Y212 HydrophobicContact CG1-CE2 4.37Å
164	S	95.4	Very high	95.5	Very high	44 Å²	44	55.9 Å²	55.9	31%	0.308	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-58.5	-30.3	178.5	50.4	0	0	0	0	114.1	P162 H166 F167	P162-S164 WeakPolarHBondContact CG-OG 3.26Å; P162-S164 PolarHBondContact O-N 3.25Å; S164-H166 PolarHBondContact O-N 3.16Å; S164-F167 PolarHBondContact O-N 3.33Å
165	D	95.8	Very high	95.7	Very high	119 Å²	119	52.1 Å²	52.1	64%	0.636	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-67.9	-17.3	-179.8	-69.8	4.7	0	0	0	112.6	P162 V163	P162-D165 WeakPolarHBondContact CD-OD2 3.26Å; P162-D165 WeakPolarHBondContact CG-OD1 3.28Å; P162-D165 PolarHBondContact O-N 2.85Å; V163-D165 PolarHBondContact O-N 3.28Å
166	H	95.6	Very high	95.8	Very high	61 Å²	61	51.4 Å²	51.4	28%	0.282	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-99.6	-1	-178.5	-52.8	-85.7	0	0	0	112.5	Y109 K160 P162 V163 S164	Y109-H166 HydrophobicContact CE1-CB 4.28Å; K160-H166 PolarHBondContact O-NE2 3.42Å; P162-H166 PolarHBondContact O-CD2 3.15Å; V163-H166 PolarHBondContact O-N 3.42Å; V163-H166 VanDerWaalsContact O-N 3.1Å; S164-H166 PolarHBondContact O-N 3.16Å
167	F	94.9	Very high	95.8	Very high	24 Å²	24	52.2 Å²	52.2	11%	0.105	29%	0.292	C	S	.	.	S	Bend	trans	-80.5	147.3	176.8	-60.4	-25.4	0	0	0	111.5	I44 V46 Y109 V163 S164 K173 V197 Y212	I44-F167 HydrophobicContact CD1-CD1 4.31Å; I44-F167 HydrophobicContact CG2-CD1 4.26Å; I44-F167 HydrophobicContact CG2-CE1 4Å; V46-F167 HydrophobicContact CG2-CE1 4.04Å; V46-F167 HydrophobicContact CG2-CZ 3.87Å; Y109-F167 HydrophobicContact CD2-CE1 4.37Å; Y109-F167 HydrophobicContact CE2-CE1 4.4Å; V163-F167 HydrophobicContact CB-CZ 4.31Å; V163-F167 HydrophobicContact CG1-CE2 4.37Å; V163-F167 HydrophobicContact CG1-CZ 3.85Å; V163-F167 HydrophobicContact CG2-CE1 3.73Å; V163-F167 HydrophobicContact CG2-CZ 3.75Å; S164-F167 PolarHBondContact O-N 3.33Å; F167-K173 HydrophobicContact CD2-CG 4.22Å; F167-K173 HydrophobicContact CE2-CG 4.21Å; F167-V197 HydrophobicContact CD1-CG2 3.75Å; F167-V197 HydrophobicContact CD2-CG2 3.95Å; F167-V197 HydrophobicContact CE1-CG1 4.34Å; F167-V197 HydrophobicContact CE1-CG2 3.75Å; F167-V197 HydrophobicContact CE2-CG1 4.27Å; F167-V197 HydrophobicContact CE2-CG2 3.96Å; F167-V197 HydrophobicContact CG-CG2 3.87Å; F167-V197 HydrophobicContact CZ-CG1 3.9Å; F167-V197 HydrophobicContact CZ-CG2 3.86Å; F167-Y212 AromaticContact CE2-CD2 3.86Å; F167-Y212 HydrophobicContact CE2-CD2 3.86Å; F167-Y212 AromaticContact CE2-CE2 3.97Å; F167-Y212 HydrophobicContact CE2-CE2 3.97Å; F167-Y212 HydrophobicContact CE2-CG 4.49Å; F167-Y212 HydrophobicContact CZ-CD2 4.46Å; F167-Y212 HydrophobicContact CZ-CE2 4.12Å
168	P	92.8	Very high	95.7	Very high	38 Å²	38	53.8 Å²	53.8	25%	0.247	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-69.8	157.5	172.7	30.2	-31.5	0	0	0	110.7	I44 C171 P195	I44-P168 HydrophobicContact CD1-CG 3.95Å; P168-C171 HydrophobicContact CG-CB 4.09Å; P168-C171 WeakPolarHBondContact O-CB 3.26Å; P168-P195 HydrophobicContact CB-CG 4.03Å; P168-P195 HydrophobicContact CG-CB 3.48Å; P168-P195 VanDerWaalsContact CG-CB 3.48Å; P168-P195 HydrophobicContact CG-CG 3.41Å; P168-P195 VanDerWaalsContact CG-CG 3.41Å
169	V	88.9	Confident	95.6	Very high	147 Å²	147	55.3 Å²	55.3	89%	0.891	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	147.5	175	-176	0	0	0	0	110.2	C171	V169-C171 PolarHBondContact O-N 3.26Å
170	G	86.6	Confident	95.5	Very high	63 Å²	63	56.4 Å²	56.4	65%	0.649	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.3	14.3	178.5	0	0	0	0	0	114.4
171	C	90.7	Very high	95.3	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.014	32%	0.318	C	S	.	.			trans	-86.2	121.7	-176.9	-169.1	0	0	0	0	111.6	P168 V169 K173 P195 I196 V197	P168-C171 HydrophobicContact CG-CB 4.09Å; P168-C171 WeakPolarHBondContact O-CB 3.26Å; V169-C171 PolarHBondContact O-N 3.26Å; C171-K173 VanDerWaalsContact O-CD 3.26Å; C171-K173 WeakPolarHBondContact O-CD 3.12Å; C171-K173 WeakPolarHBondContact O-CE 3.23Å; C171-K173 PolarHBondContact O-NZ 3.3Å; C171-P195 WeakPolarHBondContact CA-O 3.49Å; C171-P195 HydrophobicContact CB-CB 4.36Å; C171-P195 HydrophobicContact CB-CG 3.97Å; C171-P195 PolarHBondContact SG-O 2.7Å; C171-I196 VanDerWaalsContact SG-CA 3.56Å; C171-V197 VanDerWaalsContact SG-CG2 3.6Å
172	M	96.1	Very high	95.3	Very high	78 Å²	78	56 Å²	56	38%	0.384	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	142.5	170.4	-177	179.5	-65.3	0	0	110	V174 I196 V197	M172-V174 HydrophobicContact CG-CG2 4.08Å; M172-V174 HydrophobicContact SD-CG2 4.14Å; M172-I196 HydrophobicContact CB-CD1 4.37Å; M172-I196 HydrophobicContact CB-CG1 4.24Å; M172-I196 HydrophobicContact SD-CD1 4.35Å; M172-V197 PolarHBondContact O-N 3.26Å
173	K	97.9	Very high	95.2	Very high	46 Å²	46	55.5 Å²	55.5	20%	0.2	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	118.4	179.1	-55	90.6	-178.4	168.2	0	110.9	F167 C171 V197 Y212 E214	F167-K173 HydrophobicContact CD2-CG 4.22Å; F167-K173 HydrophobicContact CE2-CG 4.21Å; C171-K173 VanDerWaalsContact O-CD 3.26Å; C171-K173 WeakPolarHBondContact O-CD 3.12Å; C171-K173 WeakPolarHBondContact O-CE 3.23Å; C171-K173 PolarHBondContact O-NZ 3.3Å; K173-V197 HydrophobicContact CB-CB 4.22Å; K173-V197 HydrophobicContact CG-CB 3.97Å; K173-V197 HydrophobicContact CG-CG1 4.47Å; K173-V197 HydrophobicContact CG-CG2 4.23Å; K173-Y212 HydrophobicContact CB-CD2 4.26Å; K173-Y212 VanDerWaalsContact CB-O 3.26Å; K173-Y212 WeakPolarHBondContact CB-O 3.43Å; K173-Y212 HydrophobicContact CG-CD2 4.25Å; K173-E214 VanDerWaalsContact CD-OE1 3.28Å; K173-E214 WeakPolarHBondContact CD-OE1 3.44Å; K173-E214 IonicContact NZ-OE1 2.97Å; K173-E214 PolarHBondContact NZ-OE1 2.81Å; K173-E214 PolarHBondContact O-N 3.06Å
174	V	98.4	Very high	95.2	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	124.5	-174.7	-176.9	0	0	0	0	109.3	M172 I196 V197 F198 V199 K215 V217	M172-V174 HydrophobicContact CG-CG2 4.08Å; M172-V174 HydrophobicContact SD-CG2 4.14Å; V174-I196 HydrophobicContact CG2-CD1 4.18Å; V174-V197 PolarHBondContact N-O 3.08Å; V174-F198 HydrophobicContact CB-CD1 4.27Å; V174-F198 HydrophobicContact CB-CE1 4.11Å; V174-F198 HydrophobicContact CB-CE2 4.5Å; V174-F198 HydrophobicContact CB-CZ 4.23Å; V174-F198 HydrophobicContact CG1-CD1 4.25Å; V174-F198 HydrophobicContact CG1-CE1 3.82Å; V174-F198 HydrophobicContact CG1-CZ 4.21Å; V174-F198 CarbonylContact O-C 3.55Å; V174-F198 WeakPolarHBondContact O-CA 3.4Å; V174-V199 PolarHBondContact O-N 2.95Å; V174-K215 WeakPolarHBondContact CA-O 3.39Å; V174-K215 HydrophobicContact CG1-CG 4.3Å; V174-K215 HydrophobicContact CG2-CG 4.14Å; V174-V217 HydrophobicContact CG1-CB 4.29Å; V174-V217 HydrophobicContact CG1-CG1 3.81Å; V174-V217 HydrophobicContact CG1-CG2 3.55Å
175	G	98.3	Very high	95.4	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	-89.9	148	169.7	0	0	0	0	0	111.3	K215 M216 V217	G175-K215 PolarHBondContact N-O 3.21Å; G175-M216 VanDerWaalsContact CA-SD 3.51Å; G175-M216 CarbonylContact O-C 3.56Å; G175-M216 VanDerWaalsContact O-CA 3.32Å; G175-M216 WeakPolarHBondContact O-CA 3.19Å; G175-V217 PolarHBondContact O-N 3.19Å
176	T	98.1	Very high	95.4	Very high	16 Å²	16	52.4 Å²	52.4	10%	0.098	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	133.9	176.8	57.7	0	0	0	0	110.6	F198 V199 V217	T176-F198 HydrophobicContact CG2-CD1 3.8Å; T176-F198 HydrophobicContact CG2-CE1 4.37Å; T176-V199 PolarHBondContact N-O 3.28Å; T176-V199 PolarHBondContact OG1-O 3.35Å; T176-V217 WeakPolarHBondContact CA-O 3.19Å; T176-V217 HydrophobicContact CG2-CG2 4.46Å
177	S	97.3	Very high	95.5	Very high	19 Å²	19	54.6 Å²	54.6	13%	0.133	32%	0.318	C	S	.	.			trans	-155.3	132.1	173.5	-176.7	0	0	0	0	111.5	S179 I180 V217 S218	S177-S179 PolarHBondContact O-N 2.91Å; S177-S179 PolarHBondContact OG-N 2.97Å; S177-S179 PolarHBondContact OG-OG 3.29Å; S177-I180 PolarHBondContact O-N 3Å; S177-V217 PolarHBondContact N-O 3.37Å; S177-S218 WeakPolarHBondContact O-CA 3.31Å; S177-S218 WeakPolarHBondContact O-CB 3.37Å
178	F	96.1	Very high	95.7	Very high	118 Å²	118	61.3 Å²	61.3	52%	0.518	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-28	171	169	-107.5	0	0	0	112.9	I180 N221 P223	F178-I180 PolarHBondContact O-N 3.25Å; F178-I180 VanDerWaalsContact O-N 3.12Å; F178-N221 WeakPolarHBondContact CE2-O 3.3Å; F178-P223 HydrophobicContact CD1-CB 4.41Å; F178-P223 HydrophobicContact CD2-CB 4.36Å; F178-P223 HydrophobicContact CG-CB 4.26Å
179	S	95.1	Very high	95.8	Very high	65 Å²	65	60.8 Å²	60.8	46%	0.455	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-5.4	-177.9	65.7	0	0	0	0	114.9	S177 K207	S177-S179 PolarHBondContact O-N 2.91Å; S177-S179 PolarHBondContact OG-N 2.97Å; S177-S179 PolarHBondContact OG-OG 3.29Å; S179-K207 VanDerWaalsContact OG-CE 3.3Å; S179-K207 WeakPolarHBondContact OG-CE 3.29Å; S179-K207 PolarHBondContact OG-NZ 3.29Å
180	I	96.6	Very high	96.2	Very high	41 Å²	41	54.4 Å²	54.4	21%	0.21	31%	0.305	C	S	.	.			trans	-79.1	124.2	177.3	-55.8	-56.3	0	0	0	108.8	S177 F178 V182 M216 S218	S177-I180 PolarHBondContact O-N 3Å; F178-I180 PolarHBondContact O-N 3.25Å; F178-I180 VanDerWaalsContact O-N 3.12Å; I180-V182 VanDerWaalsContact C-N 3.31Å; I180-V182 PolarHBondContact O-N 3.1Å; I180-M216 HydrophobicContact CD1-CB 3.57Å; I180-M216 HydrophobicContact CG1-CB 3.86Å; I180-S218 VanDerWaalsContact O-CB 3.28Å; I180-S218 WeakPolarHBondContact O-CB 3.46Å
181	P	94.4	Very high	96.6	Very high	122 Å²	122	52.7 Å²	52.7	79%	0.792	28%	0.283	S	S	*	.	S	Bend	trans	-69.6	-27.3	-169.2	26.1	-35	0	0	0	113.6
182	V	96.6	Very high	96.6	Very high	104 Å²	104	57.3 Å²	57.3	63%	0.63	32%	0.315	S	S	*	.	S	Bend	trans	-100.2	122.7	180	-177	0	0	0	0	109.3	I180	I180-V182 VanDerWaalsContact C-N 3.31Å; I180-V182 PolarHBondContact O-N 3.1Å
183	V	97.3	Very high	96.2	Very high	53 Å²	53	55.9 Å²	55.9	32%	0.321	31%	0.313	S	S	.	.	B	Isolated β-bridge	trans	-79.4	129.7	172.6	177.6	0	0	0	0	109.5	S218 N221	V183-S218 WeakPolarHBondContact CA-O 3.46Å; V183-N221 WeakPolarHBondContact CG2-OD1 3.43Å
184	S	97.4	Very high	96	Very high	33 Å²	33	57.8 Å²	57.8	23%	0.231	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-98.2	139.7	174.6	-52.6	0	0	0	0	110.5	V186 S218	S184-V186 PolarHBondContact O-N 2.71Å; S184-S218 PolarHBondContact N-O 2.97Å
185	D	97.6	Very high	95.9	Very high	59 Å²	59	58.2 Å²	58.2	32%	0.316	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-71.3	122.4	162.8	-171.3	-25.2	0	0	0	108.2	R187 E188	D185-R187 PolarHBondContact O-N 3.03Å; D185-R187 WeakPolarHBondContact OD1-CB 3.39Å; D185-R187 PolarHBondContact OD1-N 3.25Å; D185-R187 IonicContact OD1-NE 3.33Å; D185-R187 PolarHBondContact OD1-NE 3.31Å; D185-R187 IonicContact OD2-CZ 2.64Å; D185-R187 IonicContact OD2-NE 2.61Å; D185-R187 PolarHBondContact OD2-NE 2.88Å; D185-R187 IonicContact OD2-NH2 2.63Å; D185-R187 PolarHBondContact OD2-NH2 2.9Å; D185-E188 HydrophobicContact CB-CG 4.09Å; D185-E188 PolarHBondContact O-N 2.87Å
186	V	97.7	Very high	95.8	Very high	12 Å²	12	58.3 Å²	58.3	7%	0.073	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-60.4	-32.9	-178.5	-178.1	0	0	0	0	111.1	S184 E188 L189 V190 I219 L233 A236 F237	S184-V186 PolarHBondContact O-N 2.71Å; V186-E188 VanDerWaalsContact C-N 3.27Å; V186-E188 PolarHBondContact O-N 3.29Å; V186-L189 WeakPolarHBondContact O-CA 3.47Å; V186-L189 WeakPolarHBondContact O-CB 3.3Å; V186-L189 PolarHBondContact O-N 3.43Å; V186-V190 WeakPolarHBondContact O-CG2 3.4Å; V186-V190 PolarHBondContact O-N 3.15Å; V186-I219 HydrophobicContact CG2-CB 3.87Å; V186-I219 HydrophobicContact CG2-CG2 3.61Å; V186-L233 HydrophobicContact CG1-CD2 3.72Å; V186-L233 HydrophobicContact CG2-CD2 4.27Å; V186-A236 HydrophobicContact CB-CB 3.63Å; V186-A236 HydrophobicContact CG1-CB 3.45Å; V186-A236 VanDerWaalsContact CG1-CB 3.45Å; V186-F237 HydrophobicContact CG1-CD2 4.42Å; V186-F237 HydrophobicContact CG1-CE2 4.23Å
187	R	97.8	Very high	95.9	Very high	107 Å²	107	57.6 Å²	57.6	40%	0.404	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-63.6	-33.9	-178.5	-65.6	174	-66.4	-177.6	2.3	112.2	D185 L189 V190 A236 E239 V240	D185-R187 PolarHBondContact O-N 3.03Å; D185-R187 WeakPolarHBondContact OD1-CB 3.39Å; D185-R187 PolarHBondContact OD1-N 3.25Å; D185-R187 IonicContact OD1-NE 3.33Å; D185-R187 PolarHBondContact OD1-NE 3.31Å; D185-R187 IonicContact OD2-CZ 2.64Å; D185-R187 IonicContact OD2-NE 2.61Å; D185-R187 PolarHBondContact OD2-NE 2.88Å; D185-R187 IonicContact OD2-NH2 2.63Å; D185-R187 PolarHBondContact OD2-NH2 2.9Å; R187-L189 PolarHBondContact O-N 2.94Å; R187-V190 PolarHBondContact O-N 3.43Å; R187-A236 HydrophobicContact CG-CB 3.93Å; R187-E239 WeakPolarHBondContact CD-OE1 3.33Å; R187-E239 IonicContact CZ-OE1 3.03Å; R187-E239 IonicContact NH1-OE1 3.22Å; R187-E239 PolarHBondContact NH1-OE1 2.89Å; R187-E239 IonicContact NH1-OE2 3.24Å; R187-V240 HydrophobicContact CB-CG2 3.77Å; R187-V240 HydrophobicContact CG-CG2 3.98Å
188	E	97.4	Very high	95.9	Very high	164 Å²	164	56.7 Å²	56.7	77%	0.766	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-72	-18.9	175.7	-62.7	-179.6	173	0	0	112.6	D185 V186	D185-E188 HydrophobicContact CB-CG 4.09Å; D185-E188 PolarHBondContact O-N 2.87Å; V186-E188 VanDerWaalsContact C-N 3.27Å; V186-E188 PolarHBondContact O-N 3.29Å
189	L	96.4	Very high	96.1	Very high	27 Å²	27	51 Å²	51	14%	0.141	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-87.3	-10.1	176.4	-55.6	177.8	0	0	0	112.7	V186 R187 P191 I196 F198 V217	V186-L189 WeakPolarHBondContact O-CA 3.47Å; V186-L189 WeakPolarHBondContact O-CB 3.3Å; V186-L189 PolarHBondContact O-N 3.43Å; R187-L189 PolarHBondContact O-N 2.94Å; L189-P191 WeakPolarHBondContact O-CD 3.15Å; L189-I196 WeakPolarHBondContact O-CD1 3.34Å; L189-F198 HydrophobicContact CB-CZ 4.14Å; L189-F198 HydrophobicContact CD1-CE1 4.3Å; L189-F198 HydrophobicContact CD1-CZ 3.97Å; L189-V217 HydrophobicContact CD1-CB 4.4Å; L189-V217 HydrophobicContact CD1-CG1 4.13Å; L189-V217 HydrophobicContact CD1-CG2 4.08Å
190	V	96.5	Very high	96.2	Very high	13 Å²	13	48 Å²	48	8%	0.079	27%	0.272	C	S	.	.			trans	-79.1	116.1	-177	-178.3	0	0	0	0	110.1	V186 R187 F237 V240 W241	V186-V190 WeakPolarHBondContact O-CG2 3.4Å; V186-V190 PolarHBondContact O-N 3.15Å; R187-V190 PolarHBondContact O-N 3.43Å; V190-F237 HydrophobicContact CB-CD1 4.44Å; V190-F237 HydrophobicContact CB-CE1 4.27Å; V190-F237 HydrophobicContact CB-CZ 4.43Å; V190-F237 HydrophobicContact CG1-CD1 3.72Å; V190-F237 HydrophobicContact CG1-CE1 3.78Å; V190-F237 HydrophobicContact CG1-CG 4.32Å; V190-F237 HydrophobicContact CG1-CZ 4.42Å; V190-F237 HydrophobicContact CG2-CD1 4Å; V190-F237 HydrophobicContact CG2-CD2 3.72Å; V190-F237 HydrophobicContact CG2-CE1 3.99Å; V190-F237 HydrophobicContact CG2-CE2 3.75Å; V190-F237 HydrophobicContact CG2-CG 3.89Å; V190-F237 HydrophobicContact CG2-CZ 3.87Å; V190-V240 HydrophobicContact CB-CB 4.01Å; V190-V240 HydrophobicContact CB-CG1 3.84Å; V190-V240 HydrophobicContact CB-CG2 4.11Å; V190-V240 HydrophobicContact CG1-CB 3.83Å; V190-V240 HydrophobicContact CG1-CG1 3.6Å; V190-V240 HydrophobicContact CG1-CG2 4.48Å; V190-V240 HydrophobicContact CG2-CB 4.24Å; V190-V240 HydrophobicContact CG2-CG2 4.08Å; V190-W241 HydrophobicContact CG1-CD2 4.42Å; V190-W241 HydrophobicContact CG1-CZ2 4.06Å; V190-W241 VanDerWaalsContact CG1-NE1 3.26Å
191	P	94.6	Very high	96.3	Very high	28 Å²	28	46.8 Å²	46.8	18%	0.182	27%	0.269	C	S	.	.			trans	-71.2	150.5	174.6	31.5	-36.8	0	0	0	111.3	L189 D194 I196 W241	L189-P191 WeakPolarHBondContact O-CD 3.15Å; P191-D194 HydrophobicContact CB-CB 4.02Å; P191-D194 HydrophobicContact CG-CB 4.33Å; P191-D194 WeakPolarHBondContact CG-O 3.15Å; P191-I196 HydrophobicContact CG-CB 4.05Å; P191-I196 HydrophobicContact CG-CG2 3.96Å; P191-W241 PolarHBondContact O-NE1 3.3Å
192	S	90.5	Very high	96.5	Very high	99 Å²	99	41 Å²	41	69%	0.692	23%	0.232	S	C	*	.	S	Bend	trans	-69.6	-41	-179.6	-49.1	0	0	0	0	113
193	S	89.1	Confident	96.5	Very high	48 Å²	48	38 Å²	38	34%	0.336	21%	0.21	S	C	.	.	S	Bend	trans	-131.6	-11.2	-171.6	53.5	0	0	0	0	115.6	G39 R41	G39-S193 CarbonylContact C-O 3.58Å; R41-S193 WeakPolarHBondContact CB-O 3.38Å; R41-S193 PolarHBondContact N-O 3.08Å; R41-S193 VanDerWaalsContact N-O 3.17Å
194	D	92.6	Very high	96.3	Very high	86 Å²	86	36.5 Å²	36.5	46%	0.46	20%	0.203	S	C	.	.	S	Bend	trans	-96.9	151.5	-172.2	-59.4	-41.8	0	0	0	112.1	P191	P191-D194 HydrophobicContact CB-CB 4.02Å; P191-D194 HydrophobicContact CG-CB 4.33Å; P191-D194 WeakPolarHBondContact CG-O 3.15Å
195	P	95.8	Very high	96	Very high	9 Å²	9	41.3 Å²	41.3	6%	0.058	22%	0.222	C	C	.	.			trans	-69.8	148.5	167.8	29.6	-33.6	0	0	0	110.7	R42 P168 C171	R42-P195 HydrophobicContact CG-CB 4.12Å; R42-P195 WeakPolarHBondContact O-CA 3.46Å; P168-P195 HydrophobicContact CB-CG 4.03Å; P168-P195 HydrophobicContact CG-CB 3.48Å; P168-P195 VanDerWaalsContact CG-CB 3.48Å; P168-P195 HydrophobicContact CG-CG 3.41Å; P168-P195 VanDerWaalsContact CG-CG 3.41Å; C171-P195 WeakPolarHBondContact CA-O 3.49Å; C171-P195 HydrophobicContact CB-CB 4.36Å; C171-P195 HydrophobicContact CB-CG 3.97Å; C171-P195 PolarHBondContact SG-O 2.7Å
196	I	97.8	Very high	95.8	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.01	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	139.2	176.5	-174.3	164.7	0	0	0	110.7	R42 L43 I44 C171 M172 V174 L189 P191 F198 F237	R42-I196 PolarHBondContact O-N 3.1Å; R42-I196 VanDerWaalsContact O-N 3.12Å; L43-I196 HydrophobicContact CD1-CG2 4.33Å; I44-I196 PolarHBondContact N-O 3.01Å; C171-I196 VanDerWaalsContact SG-CA 3.56Å; M172-I196 HydrophobicContact CB-CD1 4.37Å; M172-I196 HydrophobicContact CB-CG1 4.24Å; M172-I196 HydrophobicContact SD-CD1 4.35Å; V174-I196 HydrophobicContact CG2-CD1 4.18Å; L189-I196 WeakPolarHBondContact O-CD1 3.34Å; P191-I196 HydrophobicContact CG-CB 4.05Å; P191-I196 HydrophobicContact CG-CG2 3.96Å; I196-F198 HydrophobicContact CD1-CD2 4.47Å; I196-F198 HydrophobicContact CD1-CE2 3.75Å; I196-F198 HydrophobicContact CG1-CD2 4.21Å; I196-F198 HydrophobicContact CG1-CE2 3.98Å; I196-F237 HydrophobicContact CG2-CE1 3.34Å; I196-F237 HydrophobicContact CG2-CZ 3.39Å
197	V	98.6	Very high	95.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	129.8	176	173.3	0	0	0	0	109.4	I44 V46 F167 C171 M172 K173 V174 V199	I44-V197 HydrophobicContact CB-CB 4.41Å; I44-V197 HydrophobicContact CB-CG2 3.73Å; I44-V197 HydrophobicContact CD1-CG2 3.91Å; I44-V197 HydrophobicContact CG1-CG2 4.39Å; I44-V197 HydrophobicContact CG2-CG2 3.92Å; I44-V197 CarbonylContact O-C 3.52Å; I44-V197 VanDerWaalsContact O-CA 3.26Å; I44-V197 WeakPolarHBondContact O-CA 3.5Å; V46-V197 HydrophobicContact CG2-CG1 4.01Å; F167-V197 HydrophobicContact CD1-CG2 3.75Å; F167-V197 HydrophobicContact CD2-CG2 3.95Å; F167-V197 HydrophobicContact CE1-CG1 4.34Å; F167-V197 HydrophobicContact CE1-CG2 3.75Å; F167-V197 HydrophobicContact CE2-CG1 4.27Å; F167-V197 HydrophobicContact CE2-CG2 3.96Å; F167-V197 HydrophobicContact CG-CG2 3.87Å; F167-V197 HydrophobicContact CZ-CG1 3.9Å; F167-V197 HydrophobicContact CZ-CG2 3.86Å; C171-V197 VanDerWaalsContact SG-CG2 3.6Å; M172-V197 PolarHBondContact O-N 3.26Å; K173-V197 HydrophobicContact CB-CB 4.22Å; K173-V197 HydrophobicContact CG-CB 3.97Å; K173-V197 HydrophobicContact CG-CG1 4.47Å; K173-V197 HydrophobicContact CG-CG2 4.23Å; V174-V197 PolarHBondContact N-O 3.08Å; V197-V199 HydrophobicContact CG1-CG2 4.1Å
198	F	98.8	Very high	95.6	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	126.7	164.3	-87.4	-98	0	0	0	110.2	L43 I44 V45 V46 V174 T176 L189 I196 V217 L233 F237	L43-F198 HydrophobicContact CD1-CB 4.3Å; L43-F198 HydrophobicContact CD1-CD2 3.74Å; L43-F198 HydrophobicContact CD1-CG 4.4Å; I44-F198 PolarHBondContact O-N 3.33Å; V45-F198 WeakPolarHBondContact CA-O 3.19Å; V46-F198 PolarHBondContact N-O 2.84Å; V174-F198 HydrophobicContact CB-CD1 4.27Å; V174-F198 HydrophobicContact CB-CE1 4.11Å; V174-F198 HydrophobicContact CB-CE2 4.5Å; V174-F198 HydrophobicContact CB-CZ 4.23Å; V174-F198 HydrophobicContact CG1-CD1 4.25Å; V174-F198 HydrophobicContact CG1-CE1 3.82Å; V174-F198 HydrophobicContact CG1-CZ 4.21Å; V174-F198 CarbonylContact O-C 3.55Å; V174-F198 WeakPolarHBondContact O-CA 3.4Å; T176-F198 HydrophobicContact CG2-CD1 3.8Å; T176-F198 HydrophobicContact CG2-CE1 4.37Å; L189-F198 HydrophobicContact CB-CZ 4.14Å; L189-F198 HydrophobicContact CD1-CE1 4.3Å; L189-F198 HydrophobicContact CD1-CZ 3.97Å; I196-F198 HydrophobicContact CD1-CD2 4.47Å; I196-F198 HydrophobicContact CD1-CE2 3.75Å; I196-F198 HydrophobicContact CG1-CD2 4.21Å; I196-F198 HydrophobicContact CG1-CE2 3.98Å; F198-V217 HydrophobicContact CE1-CG2 4.27Å; F198-L233 HydrophobicContact CB-CD1 3.82Å; F198-L233 HydrophobicContact CD1-CD1 3.91Å; F198-L233 HydrophobicContact CD1-CD2 3.53Å; F198-L233 HydrophobicContact CD1-CG 4.39Å; F198-L233 HydrophobicContact CE1-CD2 3.6Å; F198-L233 HydrophobicContact CG-CD1 4Å; F198-L233 HydrophobicContact CG-CD2 4.02Å; F198-L233 HydrophobicContact CZ-CD2 4.16Å; F198-F237 HydrophobicContact CD2-CE2 4.2Å; F198-F237 HydrophobicContact CD2-CZ 4.13Å; F198-F237 AromaticContact CE2-CE2 3.8Å; F198-F237 HydrophobicContact CE2-CE2 3.8Å; F198-F237 AromaticContact CE2-CZ 3.71Å; F198-F237 HydrophobicContact CE2-CZ 3.71Å; F198-F237 HydrophobicContact CZ-CE2 4.47Å
199	V	98.8	Very high	95.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	121.7	175.8	-168.5	0	0	0	0	109.1	V46 E48 V174 T176 V197 V208 V210 Y212 T213	V46-V199 HydrophobicContact CB-CG1 4.43Å; E48-V199 HydrophobicContact CB-CG1 3.59Å; E48-V199 HydrophobicContact CG-CG1 4.13Å; V174-V199 PolarHBondContact O-N 2.95Å; T176-V199 PolarHBondContact N-O 3.28Å; T176-V199 PolarHBondContact OG1-O 3.35Å; V197-V199 HydrophobicContact CG1-CG2 4.1Å; V199-V208 HydrophobicContact CB-CG1 3.98Å; V199-V208 HydrophobicContact CG1-CG1 3.53Å; V199-V210 HydrophobicContact CG1-CG2 4.35Å; V199-V210 HydrophobicContact CG2-CG2 4.35Å; V199-Y212 HydrophobicContact CG2-CE2 3.45Å; V199-Y212 VanDerWaalsContact CG2-CE2 3.45Å; V199-Y212 WeakPolarHBondContact CG2-OH 3.2Å; V199-T213 HydrophobicContact CB-CG2 4.34Å; V199-T213 HydrophobicContact CG2-CG2 3.67Å
200	V	98.8	Very high	95.4	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.012	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.3	-177.8	-178.4	0	0	0	0	108.8	V45 V46 L47 E48 A202 A226 T229 L233	V45-V200 HydrophobicContact CG1-CG2 4.22Å; V46-V200 PolarHBondContact O-N 2.96Å; L47-V200 CarbonylContact C-O 3.39Å; L47-V200 WeakPolarHBondContact CA-O 3.34Å; L47-V200 HydrophobicContact CD2-CB 4.26Å; E48-V200 PolarHBondContact N-O 2.64Å; V200-A202 PolarHBondContact O-N 3.42Å; V200-A226 HydrophobicContact CG1-CB 4.11Å; V200-T229 HydrophobicContact CG1-CG2 3.94Å; V200-T229 HydrophobicContact CG2-CG2 3.95Å; V200-L233 HydrophobicContact CG2-CD1 3.79Å
201	G	98.4	Very high	95.4	Very high	15 Å²	15	48.6 Å²	48.6	16%	0.155	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	125.5	177.7	0	0	0	0	0	111.9	F203 V208 A226	G201-F203 VanDerWaalsContact CA-CE1 3.44Å; G201-V208 VanDerWaalsContact N-CG2 3.34Å; G201-A226 VanDerWaalsContact O-CB 3.23Å; G201-A226 WeakPolarHBondContact O-CB 3.47Å
202	A	98.1	Very high	95.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	29%	0.286	C	S	.	.			trans	-112	32	178.3	0	0	0	0	0	112.4	L47 E48 A50 I87 V200	L47-A202 HydrophobicContact CB-CB 3.97Å; E48-A202 PolarHBondContact O-N 3.16Å; A50-A202 WeakPolarHBondContact CA-O 3.37Å; A50-A202 HydrophobicContact CB-CB 4.02Å; I87-A202 HydrophobicContact CG2-CB 4.47Å; V200-A202 PolarHBondContact O-N 3.42Å
203	F	96.1	Very high	95.8	Very high	42 Å²	42	46 Å²	46	18%	0.184	26%	0.261	C	S	.	.	S	Bend	trans	-106.7	163.9	176.2	43.5	-104.9	0	0	0	111	I87 G201 H205 G206 V208	I87-F203 WeakPolarHBondContact CD1-O 3.37Å; G201-F203 VanDerWaalsContact CA-CE1 3.44Å; F203-H205 WeakPolarHBondContact CD2-O 3.33Å; F203-G206 VanDerWaalsContact CE2-CA 3.46Å; F203-G206 VanDerWaalsContact CE2-O 3.29Å; F203-G206 WeakPolarHBondContact CE2-O 3.45Å; F203-V208 HydrophobicContact CE1-CG2 4.38Å; F203-V208 HydrophobicContact CZ-CG2 4.35Å
204	A	93.3	Very high	96.2	Very high	21 Å²	21	49.3 Å²	49.3	17%	0.174	27%	0.271	C	S	.	.	S	Bend	trans	-68.7	-50.7	176.8	0	0	0	0	0	111.5	G81 R84 I87	G81-A204 WeakPolarHBondContact O-CB 3.33Å; R84-A204 HydrophobicContact CB-CB 4.19Å; R84-A204 HydrophobicContact CG-CB 3.73Å; I87-A204 HydrophobicContact CD1-CB 4.45Å
205	H	91.9	Very high	96.4	Very high	134 Å²	134	49.3 Å²	49.3	62%	0.62	27%	0.267	S	S	*	.	S	Bend	trans	-135.5	147.7	176.8	-56.6	-62.5	0	0	0	110.2	E82 F203	E82-H205 WeakPolarHBondContact OE1-CB 3.43Å; E82-H205 IonicContact OE1-CD2 2.89Å; E82-H205 PolarHBondContact OE1-CD2 2.88Å; E82-H205 VanDerWaalsContact OE1-CD2 3.3Å; E82-H205 IonicContact OE1-CG 3.45Å; F203-H205 WeakPolarHBondContact CD2-O 3.33Å
206	G	92.9	Very high	96.5	Very high	65 Å²	65	51.3 Å²	51.3	67%	0.67	28%	0.276	S	S	*	.			trans	142.5	-168	179.4	0	0	0	0	0	113.4	F203	F203-G206 VanDerWaalsContact CE2-CA 3.46Å; F203-G206 VanDerWaalsContact CE2-O 3.29Å; F203-G206 WeakPolarHBondContact CE2-O 3.45Å
207	K	94.4	Very high	96.5	Very high	121 Å²	121	51.6 Å²	51.6	53%	0.526	28%	0.278	S	S	.	.			trans	-140.1	139.2	178.2	-179	173.3	173.2	169.6	0	109	S179 S209	S179-K207 VanDerWaalsContact OG-CE 3.3Å; S179-K207 WeakPolarHBondContact OG-CE 3.29Å; S179-K207 PolarHBondContact OG-NZ 3.29Å; K207-S209 PolarHBondContact O-N 2.9Å
208	V	96.6	Very high	96.5	Very high	7 Å²	7	51.8 Å²	51.8	4%	0.042	28%	0.279	C	S	.	.			trans	-62	120.5	170.8	174.5	0	0	0	0	108.3	V199 G201 F203 V210 M216	V199-V208 HydrophobicContact CB-CG1 3.98Å; V199-V208 HydrophobicContact CG1-CG1 3.53Å; G201-V208 VanDerWaalsContact N-CG2 3.34Å; F203-V208 HydrophobicContact CE1-CG2 4.38Å; F203-V208 HydrophobicContact CZ-CG2 4.35Å; V208-V210 HydrophobicContact CG1-CG2 4.34Å; V208-M216 HydrophobicContact CB-CE 4.13Å; V208-M216 HydrophobicContact CG1-CE 4.37Å; V208-M216 WeakPolarHBondContact O-CE 3.42Å
209	S	94.7	Very high	96.4	Very high	111 Å²	111	52.9 Å²	52.9	78%	0.776	29%	0.285	S	S	*	.			trans	-145.1	89.5	179.8	-177.7	0	0	0	0	108.3	K207	K207-S209 PolarHBondContact O-N 2.9Å
210	V	96	Very high	96.4	Very high	26 Å²	26	53.9 Å²	53.9	16%	0.158	29%	0.292	C	S	.	.			trans	-129.2	144.6	-178.2	-63.4	0	0	0	0	109.4	E48 V199 V208 Y212 T213	E48-V210 HydrophobicContact CG-CG1 3.82Å; V199-V210 HydrophobicContact CG1-CG2 4.35Å; V199-V210 HydrophobicContact CG2-CG2 4.35Å; V208-V210 HydrophobicContact CG1-CG2 4.34Å; V210-Y212 VanDerWaalsContact C-N 3.27Å; V210-Y212 HydrophobicContact CB-CD1 3.92Å; V210-Y212 HydrophobicContact CB-CE1 3.53Å; V210-Y212 HydrophobicContact CG1-CE1 3.99Å; V210-Y212 HydrophobicContact CG2-CD1 4.05Å; V210-Y212 HydrophobicContact CG2-CD2 4.27Å; V210-Y212 HydrophobicContact CG2-CE1 3.64Å; V210-Y212 HydrophobicContact CG2-CE2 3.91Å; V210-Y212 HydrophobicContact CG2-CG 4.34Å; V210-Y212 PolarHBondContact O-N 3.3Å; V210-T213 HydrophobicContact CG2-CG2 3.49Å; V210-T213 VanDerWaalsContact CG2-CG2 3.49Å; V210-T213 PolarHBondContact O-OG1 3.4Å
211	E	95.6	Very high	96.3	Very high	205 Å²	205	59.7 Å²	59.7	96%	0.958	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-22.5	-171.9	-63.2	179.7	173.8	0	0	113.5
212	Y	96.2	Very high	96.3	Very high	44 Å²	44	67.1 Å²	67.1	17%	0.173	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-4.1	-173.4	62.9	-99.3	0	0	0	114.3	V163 F167 K173 V199 V210	V163-Y212 HydrophobicContact CG1-CD1 4.13Å; V163-Y212 HydrophobicContact CG1-CE1 3.49Å; V163-Y212 VanDerWaalsContact CG1-CE1 3.49Å; V163-Y212 HydrophobicContact CG1-CE2 4.37Å; F167-Y212 AromaticContact CE2-CD2 3.86Å; F167-Y212 HydrophobicContact CE2-CD2 3.86Å; F167-Y212 AromaticContact CE2-CE2 3.97Å; F167-Y212 HydrophobicContact CE2-CE2 3.97Å; F167-Y212 HydrophobicContact CE2-CG 4.49Å; F167-Y212 HydrophobicContact CZ-CD2 4.46Å; F167-Y212 HydrophobicContact CZ-CE2 4.12Å; K173-Y212 HydrophobicContact CB-CD2 4.26Å; K173-Y212 VanDerWaalsContact CB-O 3.26Å; K173-Y212 WeakPolarHBondContact CB-O 3.43Å; K173-Y212 HydrophobicContact CG-CD2 4.25Å; V199-Y212 HydrophobicContact CG2-CE2 3.45Å; V199-Y212 VanDerWaalsContact CG2-CE2 3.45Å; V199-Y212 WeakPolarHBondContact CG2-OH 3.2Å; V210-Y212 VanDerWaalsContact C-N 3.27Å; V210-Y212 HydrophobicContact CB-CD1 3.92Å; V210-Y212 HydrophobicContact CB-CE1 3.53Å; V210-Y212 HydrophobicContact CG1-CE1 3.99Å; V210-Y212 HydrophobicContact CG2-CD1 4.05Å; V210-Y212 HydrophobicContact CG2-CD2 4.27Å; V210-Y212 HydrophobicContact CG2-CE1 3.64Å; V210-Y212 HydrophobicContact CG2-CE2 3.91Å; V210-Y212 HydrophobicContact CG2-CG 4.34Å; V210-Y212 PolarHBondContact O-N 3.3Å
213	T	97.2	Very high	96.2	Very high	28 Å²	28	71.7 Å²	71.7	17%	0.172	38%	0.378	C	S	.	.			trans	-81.4	130.6	176.2	48.6	0	0	0	0	111.1	V199 V210	V199-T213 HydrophobicContact CB-CG2 4.34Å; V199-T213 HydrophobicContact CG2-CG2 3.67Å; V210-T213 HydrophobicContact CG2-CG2 3.49Å; V210-T213 VanDerWaalsContact CG2-CG2 3.49Å; V210-T213 PolarHBondContact O-OG1 3.4Å
214	E	97.3	Very high	96.3	Very high	117 Å²	117	72 Å²	72	55%	0.547	38%	0.381	S	S	.	.	S	Bend	trans	-84	-27.8	179.8	-66.2	162.2	-156	0	0	111.7	K173	K173-E214 VanDerWaalsContact CD-OE1 3.28Å; K173-E214 WeakPolarHBondContact CD-OE1 3.44Å; K173-E214 IonicContact NZ-OE1 2.97Å; K173-E214 PolarHBondContact NZ-OE1 2.81Å; K173-E214 PolarHBondContact O-N 3.06Å
215	K	96.6	Very high	96.5	Very high	87 Å²	87	74.2 Å²	74.2	38%	0.378	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	160.1	175.8	64.8	-176.9	178.3	-175.5	0	112.2	V174 G175	V174-K215 WeakPolarHBondContact CA-O 3.39Å; V174-K215 HydrophobicContact CG1-CG 4.3Å; V174-K215 HydrophobicContact CG2-CG 4.14Å; G175-K215 PolarHBondContact N-O 3.21Å
216	M	98.1	Very high	96.9	Very high	51 Å²	51	68.5 Å²	68.5	25%	0.251	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	138.2	173.3	-64.3	-64.1	-68	0	0	110	G175 I180 V208	G175-M216 VanDerWaalsContact CA-SD 3.51Å; G175-M216 CarbonylContact O-C 3.56Å; G175-M216 VanDerWaalsContact O-CA 3.32Å; G175-M216 WeakPolarHBondContact O-CA 3.19Å; I180-M216 HydrophobicContact CD1-CB 3.57Å; I180-M216 HydrophobicContact CG1-CB 3.86Å; V208-M216 HydrophobicContact CB-CE 4.13Å; V208-M216 HydrophobicContact CG1-CE 4.37Å; V208-M216 WeakPolarHBondContact O-CE 3.42Å
217	V	98.1	Very high	97.1	Very high	7 Å²	7	65.9 Å²	65.9	4%	0.042	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	147.4	178.3	-58.1	0	0	0	0	111.7	V174 G175 T176 S177 L189 F198 I219	V174-V217 HydrophobicContact CG1-CB 4.29Å; V174-V217 HydrophobicContact CG1-CG1 3.81Å; V174-V217 HydrophobicContact CG1-CG2 3.55Å; G175-V217 PolarHBondContact O-N 3.19Å; T176-V217 WeakPolarHBondContact CA-O 3.19Å; T176-V217 HydrophobicContact CG2-CG2 4.46Å; S177-V217 PolarHBondContact N-O 3.37Å; L189-V217 HydrophobicContact CD1-CB 4.4Å; L189-V217 HydrophobicContact CD1-CG1 4.13Å; L189-V217 HydrophobicContact CD1-CG2 4.08Å; F198-V217 HydrophobicContact CE1-CG2 4.27Å; V217-I219 HydrophobicContact CG2-CG2 4.2Å
218	S	98.1	Very high	97.3	Very high	4 Å²	4	63.9 Å²	63.9	3%	0.028	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-97.4	139.5	160.6	-179.8	0	0	0	0	108.7	S177 I180 V183 S184 S220	S177-S218 WeakPolarHBondContact O-CA 3.31Å; S177-S218 WeakPolarHBondContact O-CB 3.37Å; I180-S218 VanDerWaalsContact O-CB 3.28Å; I180-S218 WeakPolarHBondContact O-CB 3.46Å; V183-S218 WeakPolarHBondContact CA-O 3.46Å; S184-S218 PolarHBondContact N-O 2.97Å; S218-S220 PolarHBondContact OG-N 2.94Å; S218-S220 PolarHBondContact OG-O 3.34Å
219	I	98.2	Very high	97.4	Very high	24 Å²	24	64.2 Å²	64.2	12%	0.123	34%	0.339	C	S	.	.			trans	-111.9	4.4	177.9	67.5	164.4	0	0	0	112.2	V186 V217 L224 T229 K232	V186-I219 HydrophobicContact CG2-CB 3.87Å; V186-I219 HydrophobicContact CG2-CG2 3.61Å; V217-I219 HydrophobicContact CG2-CG2 4.2Å; I219-L224 HydrophobicContact CD1-CD1 4.11Å; I219-L224 HydrophobicContact CG1-CD1 4.1Å; I219-T229 HydrophobicContact CD1-CG2 3.84Å; I219-K232 HydrophobicContact CD1-CB 4.19Å; I219-K232 HydrophobicContact CD1-CD 4.28Å
220	S	98	Very high	97.6	Very high	21 Å²	21	58.9 Å²	58.9	15%	0.147	30%	0.302	C	S	.	.			trans	-162.7	148.9	178.8	-168.9	0	0	0	0	111.7	S218 Y222	S218-S220 PolarHBondContact OG-N 2.94Å; S218-S220 PolarHBondContact OG-O 3.34Å; S220-Y222 PolarHBondContact O-N 3.25Å; S220-Y222 PolarHBondContact OG-N 3.18Å
221	N	96.9	Very high	97.8	Very high	124 Å²	124	58.8 Å²	58.8	66%	0.663	30%	0.304	S	S	*	.	S	Bend	trans	-72.6	-4.1	168.7	-67.6	-48.4	0	0	0	113.1	F178 V183	F178-N221 WeakPolarHBondContact CE2-O 3.3Å; V183-N221 WeakPolarHBondContact CG2-OD1 3.43Å
222	Y	97.7	Very high	97.9	Very high	170 Å²	170	53.3 Å²	53.3	67%	0.667	28%	0.277	S	S	*	.	S	Bend	trans	-115.7	144.9	178.6	-59.3	-82.9	0	0	0	110.4	S220 L224	S220-Y222 PolarHBondContact O-N 3.25Å; S220-Y222 PolarHBondContact OG-N 3.18Å; Y222-L224 PolarHBondContact O-N 2.88Å
223	P	96.8	Very high	98	Very high	97 Å²	97	51.2 Å²	51.2	63%	0.63	27%	0.269	S	S	*	.			trans	-64.6	126.9	169.8	28	-33.1	0	0	0	109.2	F178	F178-P223 HydrophobicContact CD1-CB 4.41Å; F178-P223 HydrophobicContact CD2-CB 4.36Å; F178-P223 HydrophobicContact CG-CB 4.26Å
224	L	97.9	Very high	98.1	Very high	49 Å²	49	50.1 Å²	50.1	26%	0.257	26%	0.262	S	S	.	.			trans	-107.9	151.5	-177.8	-54.9	-176.1	0	0	0	110.9	I219 Y222 L228 K232	I219-L224 HydrophobicContact CD1-CD1 4.11Å; I219-L224 HydrophobicContact CG1-CD1 4.1Å; Y222-L224 PolarHBondContact O-N 2.88Å; L224-L228 HydrophobicContact CD2-CD2 4.02Å; L224-K232 HydrophobicContact CD1-CD 3.72Å
225	S	98.4	Very high	98.2	Very high	67 Å²	67	48.1 Å²	48.1	47%	0.469	26%	0.258	S	S	.	.			trans	-67	151.9	164.3	69.2	0	0	0	0	110.4	A227 L228 T229	S225-A227 PolarHBondContact O-N 2.99Å; S225-L228 PolarHBondContact O-N 3.49Å; S225-L228 WeakPolarHBondContact OG-CB 3.46Å; S225-L228 PolarHBondContact OG-N 3.03Å; S225-T229 PolarHBondContact O-N 3.04Å; S225-T229 PolarHBondContact O-OG1 3.33Å
226	A	98.4	Very high	98.3	Very high	13 Å²	13	44.4 Å²	44.4	11%	0.107	24%	0.244	C	C	.	.	H	α-helix	trans	-55.3	-39.7	176.2	0	0	0	0	0	112.1	I87 S91 V200 G201 T229 C230	I87-A226 HydrophobicContact CG2-CB 3.68Å; S91-A226 WeakPolarHBondContact OG-CB 3.45Å; V200-A226 HydrophobicContact CG1-CB 4.11Å; G201-A226 VanDerWaalsContact O-CB 3.23Å; G201-A226 WeakPolarHBondContact O-CB 3.47Å; A226-T229 WeakPolarHBondContact O-CB 3.43Å; A226-T229 PolarHBondContact O-N 2.93Å; A226-C230 PolarHBondContact O-N 3.26Å; A226-C230 PolarHBondContact O-SG 2.77Å
227	A	98.6	Very high	98.3	Very high	10 Å²	10	42 Å²	42	8%	0.083	23%	0.232	C	C	.	.	H	α-helix	trans	-65.4	-42.8	179.2	0	0	0	0	0	112.5	Q90 S91 M94 S225 C230 A231	Q90-A227 HydrophobicContact CB-CB 3.95Å; S91-A227 PolarHBondContact OG-N 3.19Å; M94-A227 HydrophobicContact CG-CB 4.04Å; S225-A227 PolarHBondContact O-N 2.99Å; A227-C230 WeakPolarHBondContact O-CB 3.4Å; A227-C230 PolarHBondContact O-N 3.44Å; A227-A231 PolarHBondContact O-N 2.88Å
228	L	98.7	Very high	98.3	Very high	80 Å²	80	42.6 Å²	42.6	42%	0.419	23%	0.234	S	C	.	.	H	α-helix	trans	-69	-36.9	177	-177.8	58.1	0	0	0	111.8	L224 S225 A231 K232	L224-L228 HydrophobicContact CD2-CD2 4.02Å; S225-L228 PolarHBondContact O-N 3.49Å; S225-L228 WeakPolarHBondContact OG-CB 3.46Å; S225-L228 PolarHBondContact OG-N 3.03Å; L228-A231 PolarHBondContact O-N 3.28Å; L228-K232 WeakPolarHBondContact O-CG 3.44Å; L228-K232 PolarHBondContact O-N 2.88Å
229	T	98.8	Very high	98.3	Very high	13 Å²	13	48 Å²	48	8%	0.08	26%	0.259	C	S	.	.	H	α-helix	trans	-58	-48	170.3	-64	0	0	0	0	110.8	V200 I219 S225 A226 A231 K232 L233	V200-T229 HydrophobicContact CG1-CG2 3.94Å; V200-T229 HydrophobicContact CG2-CG2 3.95Å; I219-T229 HydrophobicContact CD1-CG2 3.84Å; S225-T229 PolarHBondContact O-N 3.04Å; S225-T229 PolarHBondContact O-OG1 3.33Å; A226-T229 WeakPolarHBondContact O-CB 3.43Å; A226-T229 PolarHBondContact O-N 2.93Å; T229-A231 VanDerWaalsContact C-N 3.34Å; T229-A231 PolarHBondContact O-N 2.99Å; T229-K232 PolarHBondContact O-N 3.22Å; T229-L233 HydrophobicContact CG2-CD1 4.19Å; T229-L233 VanDerWaalsContact O-CG 3.31Å; T229-L233 WeakPolarHBondContact O-CG 3.32Å; T229-L233 PolarHBondContact O-N 3.27Å
230	C	98.8	Very high	98.2	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-57.5	-45.9	176.5	-69.1	0	0	0	0	112.1	M94 L95 A226 A227 L233 T234	M94-C230 HydrophobicContact CB-CB 4.42Å; L95-C230 HydrophobicContact CD1-CB 4.45Å; L95-C230 HydrophobicContact CD2-CB 3.72Å; L95-C230 HydrophobicContact CG-CB 3.81Å; A226-C230 PolarHBondContact O-N 3.26Å; A226-C230 PolarHBondContact O-SG 2.77Å; A227-C230 WeakPolarHBondContact O-CB 3.4Å; A227-C230 PolarHBondContact O-N 3.44Å; C230-L233 PolarHBondContact O-N 3.38Å; C230-T234 PolarHBondContact O-N 3Å; C230-T234 PolarHBondContact O-OG1 2.89Å
231	A	98.7	Very high	98.2	Very high	24 Å²	24	49.6 Å²	49.6	20%	0.198	27%	0.268	C	S	.	.	H	α-helix	trans	-62.3	-45.8	178.4	0	0	0	0	0	112.1	M94 A227 L228 T229 L233 T234 T235	M94-A231 HydrophobicContact CB-CB 4.45Å; M94-A231 HydrophobicContact CG-CB 4.5Å; M94-A231 HydrophobicContact SD-CB 4.48Å; A227-A231 PolarHBondContact O-N 2.88Å; L228-A231 PolarHBondContact O-N 3.28Å; T229-A231 VanDerWaalsContact C-N 3.34Å; T229-A231 PolarHBondContact O-N 2.99Å; A231-L233 VanDerWaalsContact C-N 3.32Å; A231-L233 PolarHBondContact O-N 3.29Å; A231-T234 PolarHBondContact O-N 3.35Å; A231-T234 PolarHBondContact O-OG1 3.23Å; A231-T235 WeakPolarHBondContact O-CB 3.3Å; A231-T235 PolarHBondContact O-N 2.91Å; A231-T235 PolarHBondContact O-OG1 3.25Å
232	K	98.7	Very high	98.1	Very high	90 Å²	90	46.3 Å²	46.3	39%	0.391	26%	0.262	S	S	.	.	H	α-helix	trans	-61	-40.8	176.8	-77.1	179.1	175.4	-69.2	0	112.4	I219 L224 L228 T229 A236	I219-K232 HydrophobicContact CD1-CB 4.19Å; I219-K232 HydrophobicContact CD1-CD 4.28Å; L224-K232 HydrophobicContact CD1-CD 3.72Å; L228-K232 WeakPolarHBondContact O-CG 3.44Å; L228-K232 PolarHBondContact O-N 2.88Å; T229-K232 PolarHBondContact O-N 3.22Å; K232-A236 WeakPolarHBondContact O-CB 3.37Å; K232-A236 PolarHBondContact O-N 3.43Å; K232-A236 VanDerWaalsContact O-N 3.08Å
233	L	98.8	Very high	98	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-61.9	-55.4	174.7	-68.6	175.2	0	0	0	110.2	V186 F198 V200 T229 C230 A231 T235 A236 F237	V186-L233 HydrophobicContact CG1-CD2 3.72Å; V186-L233 HydrophobicContact CG2-CD2 4.27Å; F198-L233 HydrophobicContact CB-CD1 3.82Å; F198-L233 HydrophobicContact CD1-CD1 3.91Å; F198-L233 HydrophobicContact CD1-CD2 3.53Å; F198-L233 HydrophobicContact CD1-CG 4.39Å; F198-L233 HydrophobicContact CE1-CD2 3.6Å; F198-L233 HydrophobicContact CG-CD1 4Å; F198-L233 HydrophobicContact CG-CD2 4.02Å; F198-L233 HydrophobicContact CZ-CD2 4.16Å; V200-L233 HydrophobicContact CG2-CD1 3.79Å; T229-L233 HydrophobicContact CG2-CD1 4.19Å; T229-L233 VanDerWaalsContact O-CG 3.31Å; T229-L233 WeakPolarHBondContact O-CG 3.32Å; T229-L233 PolarHBondContact O-N 3.27Å; C230-L233 PolarHBondContact O-N 3.38Å; A231-L233 VanDerWaalsContact C-N 3.32Å; A231-L233 PolarHBondContact O-N 3.29Å; L233-T235 VanDerWaalsContact C-N 3.3Å; L233-T235 PolarHBondContact O-N 3.39Å; L233-A236 PolarHBondContact O-N 3.33Å; L233-F237 WeakPolarHBondContact O-CD2 3.41Å; L233-F237 PolarHBondContact O-N 2.89Å; L233-F237 VanDerWaalsContact O-N 3.1Å
234	T	98.6	Very high	97.7	Very high	4 Å²	4	45.2 Å²	45.2	3%	0.025	26%	0.262	C	S	.	.	H	α-helix	trans	-58.8	-42.3	-177.9	50.5	0	0	0	0	112.2	L43 L95 L100 L106 C230 A231 F237 E238	L43-T234 HydrophobicContact CD2-CG2 4.39Å; L95-T234 HydrophobicContact CD2-CG2 3.94Å; L100-T234 HydrophobicContact CD2-CG2 4.24Å; L106-T234 HydrophobicContact CD2-CG2 4.47Å; C230-T234 PolarHBondContact O-N 3Å; C230-T234 PolarHBondContact O-OG1 2.89Å; A231-T234 PolarHBondContact O-N 3.35Å; A231-T234 PolarHBondContact O-OG1 3.23Å; T234-F237 PolarHBondContact O-N 3.36Å; T234-E238 WeakPolarHBondContact O-CB 3.5Å; T234-E238 VanDerWaalsContact O-CD 3.27Å; T234-E238 WeakPolarHBondContact O-CG 3.36Å; T234-E238 PolarHBondContact O-N 3.12Å
235	T	98.8	Very high	97.7	Very high	75 Å²	75	45.1 Å²	45.1	46%	0.46	26%	0.262	S	S	.	.	H	α-helix	trans	-63.7	-43.4	178.7	-62.2	0	0	0	0	113.2	A231 L233 F237 E238 E239	A231-T235 WeakPolarHBondContact O-CB 3.3Å; A231-T235 PolarHBondContact O-N 2.91Å; A231-T235 PolarHBondContact O-OG1 3.25Å; L233-T235 VanDerWaalsContact C-N 3.3Å; L233-T235 PolarHBondContact O-N 3.39Å; T235-F237 VanDerWaalsContact C-N 3.31Å; T235-F237 PolarHBondContact O-N 3.35Å; T235-E238 WeakPolarHBondContact CA-OE2 3.13Å; T235-E238 WeakPolarHBondContact O-CB 3.37Å; T235-E238 PolarHBondContact O-N 3.45Å; T235-E239 PolarHBondContact O-N 2.82Å
236	A	98.5	Very high	97.6	Very high	10 Å²	10	43.9 Å²	43.9	8%	0.083	25%	0.251	C	S	.	.	H	α-helix	trans	-63.9	-38.7	177.2	0	0	0	0	0	112.1	V186 R187 K232 L233 V240	V186-A236 HydrophobicContact CB-CB 3.63Å; V186-A236 HydrophobicContact CG1-CB 3.45Å; V186-A236 VanDerWaalsContact CG1-CB 3.45Å; R187-A236 HydrophobicContact CG-CB 3.93Å; K232-A236 WeakPolarHBondContact O-CB 3.37Å; K232-A236 PolarHBondContact O-N 3.43Å; K232-A236 VanDerWaalsContact O-N 3.08Å; L233-A236 PolarHBondContact O-N 3.33Å; A236-V240 WeakPolarHBondContact O-CG2 3.39Å; A236-V240 PolarHBondContact O-N 3.3Å; A236-V240 VanDerWaalsContact O-N 3.15Å
237	F	98.3	Very high	97.6	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-68.6	-37.2	175.6	-85.2	-100.6	0	0	0	112.5	L43 L100 V186 V190 I196 F198 L233 T234 T235 W241	L43-F237 HydrophobicContact CB-CD1 3.99Å; L43-F237 HydrophobicContact CB-CE1 4.14Å; L43-F237 HydrophobicContact CB-CG 4.38Å; L43-F237 HydrophobicContact CD1-CD1 4.48Å; L43-F237 HydrophobicContact CD1-CD2 4.4Å; L43-F237 HydrophobicContact CD1-CE1 4.02Å; L43-F237 HydrophobicContact CD1-CE2 3.91Å; L43-F237 HydrophobicContact CD1-CZ 3.71Å; L43-F237 HydrophobicContact CD2-CB 4.45Å; L43-F237 HydrophobicContact CD2-CD1 4.4Å; L43-F237 HydrophobicContact CD2-CD2 3.94Å; L43-F237 HydrophobicContact CD2-CE2 4.25Å; L43-F237 HydrophobicContact CD2-CG 3.99Å; L43-F237 HydrophobicContact CG-CE1 4.5Å; L100-F237 HydrophobicContact CD1-CB 4.17Å; L100-F237 HydrophobicContact CD2-CB 3.73Å; L100-F237 HydrophobicContact CD2-CG 4.46Å; V186-F237 HydrophobicContact CG1-CD2 4.42Å; V186-F237 HydrophobicContact CG1-CE2 4.23Å; V190-F237 HydrophobicContact CB-CD1 4.44Å; V190-F237 HydrophobicContact CB-CE1 4.27Å; V190-F237 HydrophobicContact CB-CZ 4.43Å; V190-F237 HydrophobicContact CG1-CD1 3.72Å; V190-F237 HydrophobicContact CG1-CE1 3.78Å; V190-F237 HydrophobicContact CG1-CG 4.32Å; V190-F237 HydrophobicContact CG1-CZ 4.42Å; V190-F237 HydrophobicContact CG2-CD1 4Å; V190-F237 HydrophobicContact CG2-CD2 3.72Å; V190-F237 HydrophobicContact CG2-CE1 3.99Å; V190-F237 HydrophobicContact CG2-CE2 3.75Å; V190-F237 HydrophobicContact CG2-CG 3.89Å; V190-F237 HydrophobicContact CG2-CZ 3.87Å; I196-F237 HydrophobicContact CG2-CE1 3.34Å; I196-F237 HydrophobicContact CG2-CZ 3.39Å; F198-F237 HydrophobicContact CD2-CE2 4.2Å; F198-F237 HydrophobicContact CD2-CZ 4.13Å; F198-F237 AromaticContact CE2-CE2 3.8Å; F198-F237 HydrophobicContact CE2-CE2 3.8Å; F198-F237 AromaticContact CE2-CZ 3.71Å; F198-F237 HydrophobicContact CE2-CZ 3.71Å; F198-F237 HydrophobicContact CZ-CE2 4.47Å; L233-F237 WeakPolarHBondContact O-CD2 3.41Å; L233-F237 PolarHBondContact O-N 2.89Å; L233-F237 VanDerWaalsContact O-N 3.1Å; T234-F237 PolarHBondContact O-N 3.36Å; T235-F237 VanDerWaalsContact C-N 3.31Å; T235-F237 PolarHBondContact O-N 3.35Å; F237-W241 HydrophobicContact CD1-CD2 4.25Å; F237-W241 AromaticContact CD1-CE2 3.99Å; F237-W241 HydrophobicContact CD1-CE3 4.11Å; F237-W241 AromaticContact CD1-CH2 3.4Å; F237-W241 HydrophobicContact CD1-CH2 3.4Å; F237-W241 AromaticContact CD1-CZ2 3.59Å; F237-W241 HydrophobicContact CD1-CZ2 3.59Å; F237-W241 AromaticContact CD1-CZ3 3.68Å; F237-W241 HydrophobicContact CD1-CZ3 3.68Å; F237-W241 AromaticContact CE1-CH2 3.68Å; F237-W241 HydrophobicContact CE1-CH2 3.68Å; F237-W241 AromaticContact CE1-CZ2 3.72Å; F237-W241 HydrophobicContact CE1-CZ2 3.72Å; F237-W241 HydrophobicContact CE1-CZ3 4.4Å; F237-W241 VanDerWaalsContact O-CB 3.3Å; F237-W241 WeakPolarHBondContact O-CB 3.48Å; F237-W241 PolarHBondContact O-N 2.78Å
238	E	98.4	Very high	97.5	Very high	19 Å²	19	47.7 Å²	47.7	9%	0.089	27%	0.27	C	S	.	.	H	α-helix	trans	-59.4	-48.3	174	-75.2	157	-174.3	0	0	111.3	S98 P99 L100 T234 T235 G242 V243	S98-E238 WeakPolarHBondContact CB-OE1 3.4Å; P99-E238 HydrophobicContact CB-CG 4.24Å; P99-E238 WeakPolarHBondContact CD-OE1 3.28Å; L100-E238 HydrophobicContact CB-CG 3.84Å; L100-E238 WeakPolarHBondContact CB-OE1 3.45Å; L100-E238 HydrophobicContact CD1-CG 4.1Å; L100-E238 PolarHBondContact N-OE1 2.88Å; T234-E238 WeakPolarHBondContact O-CB 3.5Å; T234-E238 VanDerWaalsContact O-CD 3.27Å; T234-E238 WeakPolarHBondContact O-CG 3.36Å; T234-E238 PolarHBondContact O-N 3.12Å; T235-E238 WeakPolarHBondContact CA-OE2 3.13Å; T235-E238 WeakPolarHBondContact O-CB 3.37Å; T235-E238 PolarHBondContact O-N 3.45Å; E238-G242 PolarHBondContact O-N 3.24Å; E238-V243 HydrophobicContact CB-CB 4.21Å; E238-V243 HydrophobicContact CG-CB 4.13Å; E238-V243 HydrophobicContact CG-CG1 4.21Å; E238-V243 PolarHBondContact O-N 3.23Å
239	E	97.8	Very high	97.4	Very high	118 Å²	118	45.7 Å²	45.7	55%	0.551	26%	0.26	S	S	*	.	H	α-helix	trans	-59.9	-49.5	178.4	-171.4	179.6	150.7	0	0	111.7	R187 T235 G242	R187-E239 WeakPolarHBondContact CD-OE1 3.33Å; R187-E239 IonicContact CZ-OE1 3.03Å; R187-E239 IonicContact NH1-OE1 3.22Å; R187-E239 PolarHBondContact NH1-OE1 2.89Å; R187-E239 IonicContact NH1-OE2 3.24Å; T235-E239 PolarHBondContact O-N 2.82Å; E239-G242 PolarHBondContact O-N 3.22Å
240	V	97.6	Very high	97.3	Very high	65 Å²	65	47.9 Å²	47.9	39%	0.394	27%	0.272	S	S	.	.	H	α-helix	trans	-71.8	-35.1	-176.8	176.6	0	0	0	0	112.5	R187 V190 A236	R187-V240 HydrophobicContact CB-CG2 3.77Å; R187-V240 HydrophobicContact CG-CG2 3.98Å; V190-V240 HydrophobicContact CB-CB 4.01Å; V190-V240 HydrophobicContact CB-CG1 3.84Å; V190-V240 HydrophobicContact CB-CG2 4.11Å; V190-V240 HydrophobicContact CG1-CB 3.83Å; V190-V240 HydrophobicContact CG1-CG1 3.6Å; V190-V240 HydrophobicContact CG1-CG2 4.48Å; V190-V240 HydrophobicContact CG2-CB 4.24Å; V190-V240 HydrophobicContact CG2-CG2 4.08Å; A236-V240 WeakPolarHBondContact O-CG2 3.39Å; A236-V240 PolarHBondContact O-N 3.3Å; A236-V240 VanDerWaalsContact O-N 3.15Å
241	W	96.2	Very high	97.2	Very high	14 Å²	14	51.3 Å²	51.3	5%	0.053	29%	0.292	C	S	.	.	H	α-helix	trans	-89.4	-0.7	-179.8	-68.8	-13.4	0	0	0	114.5	R41 R42 L43 L100 L105 V190 P191 F237	R41-W241 HydrophobicContact CB-CH2 4.4Å; R41-W241 HydrophobicContact CB-CZ2 4.04Å; R41-W241 PolarHBondContact NH2-O 3.06Å; R42-W241 VanDerWaalsContact C-CH2 3.42Å; L43-W241 HydrophobicContact CB-CH2 4.31Å; L43-W241 HydrophobicContact CB-CZ3 4.31Å; L100-W241 HydrophobicContact CD1-CE3 3.77Å; L100-W241 HydrophobicContact CD1-CZ3 4.12Å; L105-W241 HydrophobicContact CB-CE3 4.18Å; L105-W241 HydrophobicContact CB-CZ3 4.06Å; L105-W241 HydrophobicContact CD1-CE3 3.93Å; V190-W241 HydrophobicContact CG1-CD2 4.42Å; V190-W241 HydrophobicContact CG1-CZ2 4.06Å; V190-W241 VanDerWaalsContact CG1-NE1 3.26Å; P191-W241 PolarHBondContact O-NE1 3.3Å; F237-W241 HydrophobicContact CD1-CD2 4.25Å; F237-W241 AromaticContact CD1-CE2 3.99Å; F237-W241 HydrophobicContact CD1-CE3 4.11Å; F237-W241 AromaticContact CD1-CH2 3.4Å; F237-W241 HydrophobicContact CD1-CH2 3.4Å; F237-W241 AromaticContact CD1-CZ2 3.59Å; F237-W241 HydrophobicContact CD1-CZ2 3.59Å; F237-W241 AromaticContact CD1-CZ3 3.68Å; F237-W241 HydrophobicContact CD1-CZ3 3.68Å; F237-W241 AromaticContact CE1-CH2 3.68Å; F237-W241 HydrophobicContact CE1-CH2 3.68Å; F237-W241 AromaticContact CE1-CZ2 3.72Å; F237-W241 HydrophobicContact CE1-CZ2 3.72Å; F237-W241 HydrophobicContact CE1-CZ3 4.4Å; F237-W241 VanDerWaalsContact O-CB 3.3Å; F237-W241 WeakPolarHBondContact O-CB 3.48Å; F237-W241 PolarHBondContact O-N 2.78Å
242	G	95.9	Very high	97.1	Very high	54 Å²	54	53.4 Å²	53.4	56%	0.557	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	72	36.2	177.1	0	0	0	0	0	113.5	E238 E239	E238-G242 PolarHBondContact O-N 3.24Å; E239-G242 PolarHBondContact O-N 3.22Å
243	V	95.5	Very high	97	Very high	28 Å²	28	50.3 Å²	50.3	17%	0.17	29%	0.291	C	S	.	.			trans	-95.3	109.8	173.9	-179.7	0	0	0	0	108	P99 L100 A103 L105 E238	P99-V243 HydrophobicContact CB-CG1 3.74Å; L100-V243 HydrophobicContact CD1-CG2 4.34Å; A103-V243 HydrophobicContact CB-CG1 3.99Å; A103-V243 HydrophobicContact CB-CG2 4.18Å; L105-V243 HydrophobicContact CD1-CG2 3.82Å; E238-V243 HydrophobicContact CB-CB 4.21Å; E238-V243 HydrophobicContact CG-CB 4.13Å; E238-V243 HydrophobicContact CG-CG1 4.21Å; E238-V243 PolarHBondContact O-N 3.23Å
244	I	89.7	Confident	96.8	Very high	217 Å²	217	54.9 Å²	54.9	100%	1.113	32%	0.318	S	S	*	.			trans	-123.2	0	-173.4	-53.3	173.4	0	0	0	109.8

Retrieved 244 of 244 residues in 441.9 ms (Link to these results)

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