A0A087YIZ8_POEFO Loading...

NADH dehydrogenase [ubiquinone] 1 alpha subcomplex assembly factor 3

Essential factor for the assembly of mitochondrial NADH:ubiquinone oxidoreductase complex (complex I).

AlphaFold DB , UniProt , Accession A0A087YIZ8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 191 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	N	36.8	Very low	38.3	Very low	214 Å²	214	158.7 Å²	158.7	100%	1.144	81%	0.813	S	S	*	*				0	133.3	0	-62.1	2.3	0	0	0	108.9
2	M	36.7	Very low	38.7	Very low	180 Å²	180	155 Å²	155	89%	0.887	80%	0.804	S	S	*	*			cis	-160.6	117.1	-7.6	-173.7	163	174.4	0	0	110.1
3	A	35.5	Very low	38.6	Very low	88 Å²	88	161.8 Å²	161.8	73%	0.727	81%	0.813	S	S	*	*			trans	21	119.9	145.5	0	0	0	0	0	123.1
4	A	41.4	Very low	38.5	Very low	95 Å²	95	155.1 Å²	155.1	79%	0.785	81%	0.805	S	S	*	*				79.9	162.2	117	0	0	0	0	0	122.9
5	R	41	Very low	38.7	Very low	219 Å²	219	155.7 Å²	155.7	83%	0.826	81%	0.808	S	S	*	*			trans	107.3	141.2	171.9	-64	-170.2	161.6	179	-5	114.8
6	F	36.2	Very low	39.2	Very low	154 Å²	154	156.1 Å²	156.1	68%	0.675	81%	0.811	S	S	*	*			cis	-162.2	153.5	-2.8	-132.2	-149.1	0	0	0	112
7	L	43.1	Very low	39.3	Very low	132 Å²	132	158.8 Å²	158.8	69%	0.691	82%	0.815	S	S	*	*			trans	57.7	149.1	154.3	-59.1	173.7	0	0	0	120.4
8	L	39.5	Very low	39.4	Very low	136 Å²	136	156.9 Å²	156.9	71%	0.712	82%	0.818	S	S	*	*			cis	131.7	113.6	-2.7	-172.7	153.2	0	0	0	109.1
9	Q	38.8	Very low	39.7	Very low	198 Å²	198	154.2 Å²	154.2	93%	0.925	81%	0.814	S	S	*	*			trans	-150.6	153	161.5	-156.9	156.3	-29.4	0	0	112.7
10	R	34.6	Very low	39.7	Very low	229 Å²	229	158.4 Å²	158.4	86%	0.864	82%	0.818	S	S	*	*			trans	-110.7	156.2	-166	-62.5	165.9	157.4	-175.2	-7	113.3
11	S	37.4	Very low	39.9	Very low	101 Å²	101	155.2 Å²	155.2	71%	0.706	81%	0.81	S	S	*	*			trans	-170.2	120.7	140	-160.4	0	0	0	0	109.2
12	T	43.5	Very low	40.7	Very low	114 Å²	114	151.2 Å²	151.2	70%	0.699	79%	0.793	S	S	*	*				49.7	133.9	80	87.6	0	0	0	0	114.5
13	R	37.9	Very low	41.4	Very low	244 Å²	244	148.7 Å²	148.7	92%	0.921	79%	0.79	S	S	*	*			cis	-148.5	175.6	8.3	-57.1	172.1	179	156.8	-2.1	108.8
14	G	36.9	Very low	42.1	Very low	68 Å²	68	150.3 Å²	150.3	70%	0.701	79%	0.79	S	S	*	*			cis	146.6	105.3	-12.8	0	0	0	0	0	116.1
15	L	41.6	Very low	42.2	Very low	164 Å²	164	155.4 Å²	155.4	86%	0.859	80%	0.795	S	S	*	*			trans	68.4	142.7	168.8	-62	159.7	0	0	0	117.8
16	L	46.2	Very low	42.3	Very low	162 Å²	162	149.6 Å²	149.6	85%	0.848	79%	0.788	S	S	*	*				-163.4	158.5	64.5	-90.2	167.9	0	0	0	114.6
17	F	41.9	Very low	43	Very low	202 Å²	202	146.5 Å²	146.5	89%	0.886	79%	0.786	S	S	*	*			trans	-87.9	158	168	-82.5	-105.1	0	0	0	112.2
18	S	40.3	Very low	43.4	Very low	125 Å²	125	146 Å²	146	87%	0.874	79%	0.791	S	S	*	*			trans	-153.8	151	150.6	-165.9	0	0	0	0	111.9
19	S	45.9	Very low	43.9	Very low	105 Å²	105	148 Å²	148	73%	0.734	79%	0.794	S	S	*	*			trans	-143.3	149	-173.1	58.2	0	0	0	0	111.9
20	R	39.2	Very low	44.2	Very low	237 Å²	237	147.1 Å²	147.1	89%	0.894	79%	0.794	S	S	*	*			trans	172.2	152.2	165.2	-101.5	161	178.2	-95	0.6	107.6
21	S	43.1	Very low	44.7	Very low	93 Å²	93	142.3 Å²	142.3	65%	0.65	80%	0.795	S	S	*	*			cis	170	137.5	-21	49.6	0	0	0	0	104.7
22	V	53.2	Low	45	Very low	130 Å²	130	147.5 Å²	147.5	79%	0.788	80%	0.799	S	S	*	*			trans	-70.5	169.1	-173.1	-139.6	0	0	0	0	113.3
23	P	53.2	Low	45.3	Very low	126 Å²	126	147 Å²	147	82%	0.818	81%	0.807	S	S	*	*				-130.1	155.8	123.4	37.4	-30.4	0	0	0	114.4
24	V	49.3	Very low	45.5	Very low	122 Å²	122	141.9 Å²	141.9	74%	0.739	79%	0.793	S	S	*	*			trans	-115	138.9	176.3	170.1	0	0	0	0	108.8
25	F	43	Very low	46.2	Very low	202 Å²	202	150.4 Å²	150.4	89%	0.886	80%	0.804	S	S	*	*			trans	-153.9	103.3	155.5	-122.7	-94	0	0	0	108.2
26	S	44.4	Very low	46.5	Very low	97 Å²	97	149.9 Å²	149.9	68%	0.678	80%	0.801	S	S	*	*				69.4	119.8	104.3	-161.4	0	0	0	0	115.6
27	S	49.2	Very low	46.8	Very low	89 Å²	89	144.2 Å²	144.2	62%	0.622	78%	0.782	S	S	*	*			trans	-79.5	173	172	58.6	0	0	0	0	112
28	P	53.1	Low	47.3	Very low	123 Å²	123	140.4 Å²	140.4	80%	0.799	78%	0.777	S	S	*	*				-140.9	174.2	90.5	37.2	-21.5	0	0	0	115.7
29	F	49.6	Very low	47.9	Very low	178 Å²	178	139.4 Å²	139.4	78%	0.781	77%	0.77	S	S	*	*			trans	-70.8	144.2	-172.9	-52.3	-99	0	0	0	114.9
30	L	45.3	Very low	48.3	Very low	178 Å²	178	141.6 Å²	141.6	93%	0.932	77%	0.773	S	S	*	*			trans	-144	117.1	138	-80.9	-174.7	0	0	0	109.9	R32	L30-R32 PolarHBondContact O-N 3.14Å
31	C	45.3	Very low	49.1	Very low	129 Å²	129	136.9 Å²	136.9	87%	0.872	77%	0.766	S	S	*	*			trans	-75.5	117.5	174.4	-62.2	0	0	0	0	110.2
32	R	42.9	Very low	49.7	Very low	209 Å²	209	140.3 Å²	140.3	79%	0.789	77%	0.772	S	S	*	*			trans	-118.7	103.9	160.3	-164.2	174.9	-166.6	175.6	4.9	109	L30 H34	L30-R32 PolarHBondContact O-N 3.14Å; R32-H34 PolarHBondContact O-N 2.79Å
33	A	50.9	Low	49.6	Very low	105 Å²	105	142.3 Å²	142.3	87%	0.868	78%	0.775	S	S	*	*			trans	-68	91.1	178.1	0	0	0	0	0	110.5	R35	A33-R35 PolarHBondContact O-N 2.99Å
34	H	41.4	Very low	49.5	Very low	135 Å²	135	145.4 Å²	145.4	63%	0.625	77%	0.772	S	S	*	*			trans	-79.7	107.3	163.6	-84.3	-94	0	0	0	108.5	R32 L36	R32-H34 PolarHBondContact O-N 2.79Å; H34-L36 VanDerWaalsContact C-N 3.29Å; H34-L36 PolarHBondContact O-N 2.89Å
35	R	51.2	Low	49.9	Very low	247 Å²	247	147.9 Å²	147.9	93%	0.932	78%	0.775	S	S	*	*			trans	-65.5	90.6	168	178.3	-168.5	-100.2	-131.6	-1.5	108.2	A33	A33-R35 PolarHBondContact O-N 2.99Å
36	L	47.2	Very low	50.6	Low	154 Å²	154	149 Å²	149	81%	0.806	77%	0.773	S	S	*	*			trans	-74.2	120.7	162.7	-61.1	175.4	0	0	0	107.2	H34	H34-L36 VanDerWaalsContact C-N 3.29Å; H34-L36 PolarHBondContact O-N 2.89Å
37	G	54	Low	51	Low	43 Å²	43	150.5 Å²	150.5	44%	0.443	78%	0.779	S	S	.	*			trans	-71	157.4	156.9	0	0	0	0	0	108.8	S39	G37-S39 PolarHBondContact O-N 2.76Å; G37-S39 PolarHBondContact O-OG 2.86Å
38	P	52.3	Low	51.6	Low	121 Å²	121	152.6 Å²	152.6	79%	0.786	79%	0.788	S	S	*	*			trans	-61.6	108	169.9	26.9	-32.2	0	0	0	108.1
39	S	53.3	Low	51.7	Low	104 Å²	104	152.6 Å²	152.6	73%	0.727	79%	0.785	S	S	*	*			trans	-100.2	105.4	175.4	-61.1	0	0	0	0	107.4	G37	G37-S39 PolarHBondContact O-N 2.76Å; G37-S39 PolarHBondContact O-OG 2.86Å
40	D	53.3	Low	51.9	Low	151 Å²	151	148.9 Å²	148.9	81%	0.807	78%	0.781	S	S	*	*			trans	48.4	62.1	171	-59.5	-20	0	0	0	116.8	E42	D40-E42 PolarHBondContact O-N 3.01Å
41	D	55.3	Low	52.7	Low	139 Å²	139	147.8 Å²	147.8	74%	0.743	78%	0.775	S	S	*	*			trans	-70.9	42.6	154.1	-75.5	-42.5	0	0	0	111.5
42	E	57.3	Low	53.1	Low	164 Å²	164	149.5 Å²	149.5	77%	0.766	77%	0.772	S	S	*	*			trans	-124.4	36.1	178.1	-77.4	-143.4	145.8	0	0	113.9	D40 Y44	D40-E42 PolarHBondContact O-N 3.01Å; E42-Y44 VanDerWaalsContact C-N 3.28Å
43	M	50.8	Low	53.5	Low	172 Å²	172	149.1 Å²	149.1	85%	0.847	78%	0.776	S	S	*	*			trans	-95.1	60.7	146.6	-70.5	-158.3	84.2	0	0	110.8	Q45	M43-Q45 VanDerWaalsContact C-N 3.27Å; M43-Q45 PolarHBondContact O-N 3.16Å
44	Y	50.2	Low	53.6	Low	192 Å²	192	150 Å²	150	75%	0.753	77%	0.771	S	S	*	*			trans	-60.7	92.2	159.9	-88.5	-85.3	0	0	0	109.1	E42 R46	E42-Y44 VanDerWaalsContact C-N 3.28Å; Y44-R46 PolarHBondContact O-N 3.21Å
45	Q	57.3	Low	53.9	Low	174 Å²	174	149.8 Å²	149.8	81%	0.813	77%	0.77	S	S	*	*			trans	-64.4	84.8	161.8	-72.4	-173	-21.1	0	0	108.3	M43 T47	M43-Q45 VanDerWaalsContact C-N 3.27Å; M43-Q45 PolarHBondContact O-N 3.16Å; Q45-T47 PolarHBondContact O-N 3.3Å
46	R	58.3	Low	53.9	Low	224 Å²	224	143.2 Å²	143.2	85%	0.845	77%	0.769	S	S	*	*			trans	-61.5	101.3	167	-85.1	-173.9	174	136.9	1.1	107.8	Y44 T48	Y44-R46 PolarHBondContact O-N 3.21Å; R46-T48 VanDerWaalsContact C-N 3.32Å; R46-T48 PolarHBondContact O-N 3.37Å
47	T	53.1	Low	54.1	Low	129 Å²	129	141.9 Å²	141.9	79%	0.791	76%	0.758	S	S	*	*			trans	-60.3	99.2	160	23.5	0	0	0	0	107.6	Q45 V49	Q45-T47 PolarHBondContact O-N 3.3Å; T47-V49 PolarHBondContact O-N 3.17Å
48	T	61.9	Low	54.4	Low	133 Å²	133	145.3 Å²	145.3	82%	0.816	77%	0.766	S	S	*	*			trans	-65.6	100	170.3	47	0	0	0	0	107.8	R46 S50	R46-T48 VanDerWaalsContact C-N 3.32Å; R46-T48 PolarHBondContact O-N 3.37Å; T48-S50 VanDerWaalsContact C-N 3.31Å; T48-S50 PolarHBondContact O-N 2.64Å
49	V	55	Low	55.6	Low	124 Å²	124	140.8 Å²	140.8	75%	0.752	74%	0.742	S	S	*	*			trans	-66.6	97.2	168.2	-178	0	0	0	0	107	T47 I51	T47-V49 PolarHBondContact O-N 3.17Å; V49-I51 PolarHBondContact O-N 3.43Å; V49-I51 VanDerWaalsContact O-N 3.12Å
50	S	54.7	Low	57.4	Low	99 Å²	99	136.7 Å²	136.7	69%	0.692	71%	0.711	S	S	*	*			trans	-63.1	111.9	161.7	-175.8	0	0	0	0	106.6	T48 M52	T48-S50 VanDerWaalsContact C-N 3.31Å; T48-S50 PolarHBondContact O-N 2.64Å; S50-M52 VanDerWaalsContact C-N 3.26Å; S50-M52 PolarHBondContact O-N 3.07Å
51	I	62	Low	59.3	Low	156 Å²	156	131.2 Å²	131.2	80%	0.8	68%	0.682	S	S	*	*			trans	-66.9	93.8	173.9	-59.5	172.1	0	0	0	106.2	V49 K53	V49-I51 PolarHBondContact O-N 3.43Å; V49-I51 VanDerWaalsContact O-N 3.12Å; I51-K53 PolarHBondContact O-N 3.12Å
52	M	52.2	Low	61.3	Low	164 Å²	164	125 Å²	125	81%	0.808	65%	0.648	S	S	*	*			trans	-60.1	126.3	174	-65.2	-163.9	-57.9	0	0	107.9	S50 T54	S50-M52 VanDerWaalsContact C-N 3.26Å; S50-M52 PolarHBondContact O-N 3.07Å; M52-T54 PolarHBondContact O-N 3.01Å; M52-T54 VanDerWaalsContact O-N 3.07Å
53	K	51.6	Low	63.2	Low	202 Å²	202	122.6 Å²	122.6	88%	0.878	64%	0.637	S	S	*	*			trans	-57	116.8	177.8	-169.9	179.6	-177.8	-175.1	0	108.1	I51 E55	I51-K53 PolarHBondContact O-N 3.12Å; K53-E55 PolarHBondContact O-N 3.37Å
54	T	54.2	Low	65.4	Low	123 Å²	123	117.2 Å²	117.2	76%	0.755	62%	0.616	S	S	*	*			trans	-43.2	125.8	-179.1	-66.4	0	0	0	0	112	M52	M52-T54 PolarHBondContact O-N 3.01Å; M52-T54 VanDerWaalsContact O-N 3.07Å
55	E	47.6	Very low	67.6	Low	130 Å²	130	113.3 Å²	113.3	61%	0.607	60%	0.601	S	S	*	*			trans	27.3	119.9	156.2	-66.1	-59	136.4	0	0	118	K53 H57	K53-E55 PolarHBondContact O-N 3.37Å; E55-H57 HydrophobicContact CB-CB 4.41Å; E55-H57 PolarHBondContact O-N 3.48Å; E55-H57 IonicContact OE2-CE1 3.44Å; E55-H57 PolarHBondContact OE2-CE1 3.38Å; E55-H57 IonicContact OE2-ND1 2.97Å; E55-H57 PolarHBondContact OE2-ND1 3.3Å
56	A	50.1	Low	69.5	Low	109 Å²	109	107.4 Å²	107.4	90%	0.901	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	35.6	175.1	0	0	0	0	0	114.1
57	H	51.4	Low	71.3	Confident	126 Å²	126	98.7 Å²	98.7	58%	0.583	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.6	-4	-171.7	-66	106.7	0	0	0	113.2	E55 R164	E55-H57 HydrophobicContact CB-CB 4.41Å; E55-H57 PolarHBondContact O-N 3.48Å; E55-H57 IonicContact OE2-CE1 3.44Å; E55-H57 PolarHBondContact OE2-CE1 3.38Å; E55-H57 IonicContact OE2-ND1 2.97Å; E55-H57 PolarHBondContact OE2-ND1 3.3Å; H57-R164 VanDerWaalsContact O-CZ 3.22Å; H57-R164 PolarHBondContact O-NH1 3.02Å; H57-R164 PolarHBondContact O-NH2 3.38Å
58	N	60.5	Low	73.3	Confident	116 Å²	116	97.9 Å²	97.9	62%	0.62	54%	0.54	S	S	*	.			trans	-80.1	125.4	168	-98.8	7.3	0	0	0	110.4
59	G	77.7	Confident	75	Confident	26 Å²	26	91.7 Å²	91.7	27%	0.268	50%	0.503	S	S	.	.			trans	-67.7	175.3	164.9	0	0	0	0	0	111.1	L61 N161	G59-L61 PolarHBondContact O-N 3.26Å; G59-N161 PolarHBondContact O-ND2 3.31Å
60	I	90.6	Very high	77	Confident	18 Å²	18	86.1 Å²	86.1	9%	0.092	47%	0.468	C	S	.	.			trans	-55.4	128.6	-170.9	-64.5	-172.7	0	0	0	113.6	I72 D73 V83 P85 V88 F157 N161	I60-I72 HydrophobicContact CG2-CG2 3.21Å; I60-D73 VanDerWaalsContact CA-OD2 3.26Å; I60-D73 WeakPolarHBondContact CA-OD2 3.5Å; I60-V83 HydrophobicContact CG2-CG1 3.9Å; I60-P85 HydrophobicContact CB-CG 4.27Å; I60-P85 HydrophobicContact CD1-CB 4.36Å; I60-P85 HydrophobicContact CG1-CB 4.3Å; I60-V88 HydrophobicContact CD1-CG2 3.94Å; I60-F157 WeakPolarHBondContact O-CE1 3.43Å; I60-N161 PolarHBondContact N-ND2 2.97Å; I60-N161 PolarHBondContact O-ND2 3.44Å
61	L	94.7	Very high	79	Confident	36 Å²	36	83.6 Å²	83.6	19%	0.188	45%	0.447	C	S	.	.			trans	-117.7	135.1	176.5	-67.3	176.5	0	0	0	112.9	G59 I72 D73 N158	G59-L61 PolarHBondContact O-N 3.26Å; L61-I72 CarbonylContact O-C 3.53Å; L61-I72 WeakPolarHBondContact O-CA 3.32Å; L61-D73 PolarHBondContact N-OD1 2.86Å; L61-D73 PolarHBondContact N-OD2 3.46Å; L61-D73 PolarHBondContact O-N 2.78Å; L61-N158 HydrophobicContact CD2-CB 4.06Å
62	I	97.4	Very high	80.7	Confident	7 Å²	7	76.2 Å²	76.2	4%	0.036	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	109.8	170.5	-53	161.7	0	0	0	107.5	F70 I72 C154 F157 N158 L171	I62-F70 HydrophobicContact CG2-CD1 4.3Å; I62-I72 HydrophobicContact CG1-CD1 4.39Å; I62-I72 HydrophobicContact CG1-CG1 4.21Å; I62-I72 HydrophobicContact CG2-CG1 4.46Å; I62-C154 HydrophobicContact CB-CB 4.41Å; I62-C154 HydrophobicContact CD1-CB 4.15Å; I62-C154 HydrophobicContact CG2-CB 4.15Å; I62-F157 HydrophobicContact CD1-CB 4.38Å; I62-F157 HydrophobicContact CD1-CD1 3.5Å; I62-F157 HydrophobicContact CD1-CE1 4.14Å; I62-F157 HydrophobicContact CD1-CG 4.14Å; I62-F157 HydrophobicContact CG1-CD1 4.03Å; I62-F157 HydrophobicContact CG1-CE1 4.28Å; I62-N158 PolarHBondContact N-OD1 2.84Å; I62-N158 PolarHBondContact O-ND2 2.73Å; I62-L171 HydrophobicContact CD1-CD1 3.48Å; I62-L171 VanDerWaalsContact CD1-CD1 3.48Å
63	H	96.3	Very high	82.5	Confident	115 Å²	115	71.7 Å²	71.7	53%	0.532	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-38.3	-177	-68.8	-50.8	0	0	0	113.3	N71	H63-N71 PolarHBondContact N-O 3.48Å
64	S	96.8	Very high	84.3	Confident	59 Å²	59	64.6 Å²	64.6	41%	0.413	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	161.2	178.9	64.6	0	0	0	0	111.9	N71	S64-N71 PolarHBondContact N-O 3.28Å; S64-N71 PolarHBondContact O-N 3.47Å; S64-N71 WeakPolarHBondContact OG-CB 3.48Å
65	Y	97.1	Very high	86.1	Confident	109 Å²	109	64.1 Å²	64.1	43%	0.427	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	162.4	175.1	55.9	-99.2	0	0	0	110.2	G69 P151 P174	Y65-G69 CarbonylContact C-O 3.6Å; Y65-G69 WeakPolarHBondContact CA-O 3.27Å; Y65-P151 HydrophobicContact CE1-CB 4.01Å; Y65-P151 HydrophobicContact CE1-CG 4.27Å; Y65-P151 HydrophobicContact CE2-CG 4.02Å; Y65-P151 WeakPolarHBondContact OH-CB 3.28Å; Y65-P174 HydrophobicContact CD2-CG 3.56Å; Y65-P174 HydrophobicContact CE2-CG 4.06Å; Y65-P174 HydrophobicContact CG-CG 4.42Å
66	S	96.2	Very high	88.4	Confident	50 Å²	50	67.6 Å²	67.6	35%	0.35	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	168.5	176.9	67.5	0	0	0	0	108.7	M68 G69 P173	S66-M68 PolarHBondContact O-N 3.48Å; S66-M68 PolarHBondContact OG-N 2.87Å; S66-G69 PolarHBondContact N-O 2.69Å; S66-G69 PolarHBondContact O-N 3.38Å; S66-G69 VanDerWaalsContact O-O 3.13Å; S66-G69 PolarHBondContact OG-N 3.44Å; S66-G69 PolarHBondContact OG-O 3.21Å; S66-G69 VanDerWaalsContact OG-O 3.07Å; S66-P173 WeakPolarHBondContact O-CB 3.33Å
67	P	95.8	Very high	90.6	Very high	42 Å²	42	63.7 Å²	63.7	27%	0.273	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-13.6	171.5	-24.9	35.8	0	0	0	114.8	P174 Y176	P67-P174 VanDerWaalsContact CA-O 3.24Å; P67-P174 WeakPolarHBondContact CA-O 3.43Å; P67-P174 WeakPolarHBondContact CB-O 3.43Å; P67-P174 WeakPolarHBondContact CG-O 3.39Å; P67-Y176 HydrophobicContact CB-CD2 3.67Å; P67-Y176 HydrophobicContact CB-CE1 4.39Å; P67-Y176 HydrophobicContact CB-CE2 3.46Å; P67-Y176 VanDerWaalsContact CB-CE2 3.46Å; P67-Y176 HydrophobicContact CB-CG 4.22Å; P67-Y176 HydrophobicContact CG-CD1 3.85Å; P67-Y176 HydrophobicContact CG-CD2 3.83Å; P67-Y176 HydrophobicContact CG-CE1 3.83Å; P67-Y176 HydrophobicContact CG-CE2 3.8Å; P67-Y176 HydrophobicContact CG-CG 3.85Å
68	M	95.9	Very high	92.8	Very high	111 Å²	111	64.1 Å²	64.1	55%	0.547	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-11.8	174.7	-64.2	-71.5	89.5	0	0	113.7	S66 F78 G79	S66-M68 PolarHBondContact O-N 3.48Å; S66-M68 PolarHBondContact OG-N 2.87Å; M68-F78 HydrophobicContact CB-CD1 4.44Å; M68-F78 CarbonylContact O-C 3.52Å; M68-F78 VanDerWaalsContact O-CA 3.3Å; M68-F78 WeakPolarHBondContact O-CA 3.5Å; M68-G79 PolarHBondContact O-N 2.83Å
69	G	96.6	Very high	94.5	Very high	3 Å²	3	59.6 Å²	59.6	3%	0.031	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	130.5	-152.6	-173.8	0	0	0	0	0	113.6	Y65 S66 V77	Y65-G69 CarbonylContact C-O 3.6Å; Y65-G69 WeakPolarHBondContact CA-O 3.27Å; S66-G69 PolarHBondContact N-O 2.69Å; S66-G69 PolarHBondContact O-N 3.38Å; S66-G69 VanDerWaalsContact O-O 3.13Å; S66-G69 PolarHBondContact OG-N 3.44Å; S66-G69 PolarHBondContact OG-O 3.21Å; S66-G69 VanDerWaalsContact OG-O 3.07Å; G69-V77 CarbonylContact C-O 3.52Å; G69-V77 WeakPolarHBondContact CA-O 3.36Å
70	F	98	Very high	95.5	Very high	7 Å²	7	59.4 Å²	59.4	3%	0.031	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	154.3	-161	-56.6	-84.9	0	0	0	112.9	I62 I72 R76 V77 C81 T150 L171 P173	I62-F70 HydrophobicContact CG2-CD1 4.3Å; F70-I72 HydrophobicContact CB-CD1 4.04Å; F70-I72 HydrophobicContact CB-CG1 3.96Å; F70-R76 WeakPolarHBondContact O-CA 3.27Å; F70-V77 PolarHBondContact N-O 2.92Å; F70-V77 PolarHBondContact O-N 2.87Å; F70-C81 WeakPolarHBondContact CD2-SG 3.38Å; F70-T150 HydrophobicContact CE1-CG2 3.46Å; F70-T150 VanDerWaalsContact CE1-CG2 3.46Å; F70-T150 HydrophobicContact CZ-CG2 3.67Å; F70-L171 HydrophobicContact CD1-CD1 4.48Å; F70-L171 HydrophobicContact CE1-CB 4.08Å; F70-L171 HydrophobicContact CE1-CD1 4.23Å; F70-L171 HydrophobicContact CE2-CB 3.88Å; F70-L171 HydrophobicContact CZ-CB 3.51Å; F70-L171 HydrophobicContact CZ-CD1 4.45Å; F70-P173 HydrophobicContact CE2-CB 4.39Å; F70-P173 HydrophobicContact CE2-CG 3.85Å; F70-P173 HydrophobicContact CZ-CB 4.41Å; F70-P173 HydrophobicContact CZ-CG 4.3Å
71	N	97.3	Very high	95.8	Very high	46 Å²	46	58.5 Å²	58.5	25%	0.246	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	114.2	166.7	-179.2	7.1	0	0	0	108.5	H63 S64 G74 N75	H63-N71 PolarHBondContact N-O 3.48Å; S64-N71 PolarHBondContact N-O 3.28Å; S64-N71 PolarHBondContact O-N 3.47Å; S64-N71 WeakPolarHBondContact OG-CB 3.48Å; N71-G74 WeakPolarHBondContact OD1-CA 3.26Å; N71-G74 PolarHBondContact OD1-N 2.91Å; N71-N75 WeakPolarHBondContact CA-O 3.33Å
72	I	96.1	Very high	95.9	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	110.7	-171.4	-58	-178.6	0	0	0	107.9	I60 L61 I62 F70 G74 N75 V77 V83 V88	I60-I72 HydrophobicContact CG2-CG2 3.21Å; L61-I72 CarbonylContact O-C 3.53Å; L61-I72 WeakPolarHBondContact O-CA 3.32Å; I62-I72 HydrophobicContact CG1-CD1 4.39Å; I62-I72 HydrophobicContact CG1-CG1 4.21Å; I62-I72 HydrophobicContact CG2-CG1 4.46Å; F70-I72 HydrophobicContact CB-CD1 4.04Å; F70-I72 HydrophobicContact CB-CG1 3.96Å; I72-G74 PolarHBondContact O-N 2.83Å; I72-N75 PolarHBondContact N-O 2.86Å; I72-N75 WeakPolarHBondContact O-CA 3.44Å; I72-N75 WeakPolarHBondContact O-CB 3.29Å; I72-N75 PolarHBondContact O-N 2.8Å; I72-V77 HydrophobicContact CD1-CG2 4.22Å; I72-V83 HydrophobicContact CD1-CG2 3.82Å; I72-V88 HydrophobicContact CD1-CG1 4.08Å; I72-V88 HydrophobicContact CG2-CG2 4.23Å
73	D	91.5	Very high	95.9	Very high	69 Å²	69	56.5 Å²	56.5	37%	0.369	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	24.6	-172.1	-58.1	-41.2	0	0	0	115.8	I60 L61	I60-D73 VanDerWaalsContact CA-OD2 3.26Å; I60-D73 WeakPolarHBondContact CA-OD2 3.5Å; L61-D73 PolarHBondContact N-OD1 2.86Å; L61-D73 PolarHBondContact N-OD2 3.46Å; L61-D73 PolarHBondContact O-N 2.78Å
74	G	88.3	Confident	95.6	Very high	53 Å²	53	51.6 Å²	51.6	55%	0.546	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	98.7	-12	-175.8	0	0	0	0	0	114.5	N71 I72	N71-G74 WeakPolarHBondContact OD1-CA 3.26Å; N71-G74 PolarHBondContact OD1-N 2.91Å; I72-G74 PolarHBondContact O-N 2.83Å
75	N	91.9	Very high	95.2	Very high	112 Å²	112	51.2 Å²	51.2	60%	0.599	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	130.8	173.9	-60.7	-48.5	0	0	0	110.4	N71 I72	N71-N75 WeakPolarHBondContact CA-O 3.33Å; I72-N75 PolarHBondContact N-O 2.86Å; I72-N75 WeakPolarHBondContact O-CA 3.44Å; I72-N75 WeakPolarHBondContact O-CB 3.29Å; I72-N75 PolarHBondContact O-N 2.8Å
76	R	96.4	Very high	94.7	Very high	204 Å²	204	52.1 Å²	52.1	77%	0.77	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	119.4	174.2	-64.1	-175.6	-176.8	-166.1	0.5	109.8	F70	F70-R76 WeakPolarHBondContact O-CA 3.27Å
77	V	96.9	Very high	94.4	Very high	26 Å²	26	51.5 Å²	51.5	16%	0.158	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	121.1	177.8	-176.1	0	0	0	0	107.6	G69 F70 I72 C81 V88	G69-V77 CarbonylContact C-O 3.52Å; G69-V77 WeakPolarHBondContact CA-O 3.36Å; F70-V77 PolarHBondContact N-O 2.92Å; F70-V77 PolarHBondContact O-N 2.87Å; I72-V77 HydrophobicContact CD1-CG2 4.22Å; V77-C81 HydrophobicContact CG1-CB 3.6Å; V77-V88 HydrophobicContact CG1-CG1 4.46Å; V77-V88 HydrophobicContact CG2-CG1 4.04Å
78	F	96.8	Very high	94.3	Very high	135 Å²	135	52 Å²	52	59%	0.592	29%	0.291	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	141.2	-176.1	-67.3	-79.8	0	0	0	111.2	M68 Q90	M68-F78 HydrophobicContact CB-CD1 4.44Å; M68-F78 CarbonylContact O-C 3.52Å; M68-F78 VanDerWaalsContact O-CA 3.3Å; M68-F78 WeakPolarHBondContact O-CA 3.5Å; F78-Q90 PolarHBondContact O-NE2 2.95Å; F78-Q90 PolarHBondContact O-OE1 3.17Å
79	G	97.2	Very high	94.1	Very high	21 Å²	21	50.1 Å²	50.1	22%	0.216	28%	0.283	C	S	.	.	S	Bend	trans	65.7	-163.3	180	0	0	0	0	0	114	M68 P173	M68-G79 PolarHBondContact O-N 2.83Å; G79-P173 VanDerWaalsContact C-CG 3.43Å; G79-P173 WeakPolarHBondContact O-CG 3.36Å
80	P	98.1	Very high	94.1	Very high	22 Å²	22	55.8 Å²	55.8	14%	0.143	31%	0.308	C	S	.	.	S	Bend	trans	-69.2	139.5	-179.4	-24.3	37.8	0	0	0	113.9	Q90 W91 V93 L171 I172	P80-Q90 PolarHBondContact O-NE2 3.48Å; P80-W91 HydrophobicContact CB-CB 4.44Å; P80-W91 PolarHBondContact O-N 3.12Å; P80-V93 HydrophobicContact CB-CG2 3.78Å; P80-V93 HydrophobicContact CG-CG2 4.28Å; P80-V93 WeakPolarHBondContact CG-O 3.39Å; P80-L171 CarbonylContact C-O 3.42Å; P80-L171 WeakPolarHBondContact CA-O 3.44Å; P80-L171 WeakPolarHBondContact CB-O 3.45Å; P80-I172 HydrophobicContact CB-CG1 4.38Å; P80-I172 HydrophobicContact CG-CG2 4.34Å
81	C	97.5	Very high	94	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	151.3	-175.2	67.8	0	0	0	0	113.5	F70 V77 V88 L89 L171	F70-C81 WeakPolarHBondContact CD2-SG 3.38Å; V77-C81 HydrophobicContact CG1-CB 3.6Å; C81-V88 HydrophobicContact CB-CG1 4.47Å; C81-L89 CarbonylContact C-O 3.55Å; C81-L89 VanDerWaalsContact CA-O 3.29Å; C81-L89 WeakPolarHBondContact CA-O 3.14Å; C81-L89 WeakPolarHBondContact CB-O 3.5Å; C81-L171 PolarHBondContact N-O 2.88Å; C81-L171 PolarHBondContact O-N 3.02Å
82	A	96.8	Very high	93.9	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	121.4	169.6	0	0	0	0	0	109.3	M84 V88 L89 W91 L106 F107 A169	A82-M84 HydrophobicContact CB-CE 4.32Å; A82-V88 WeakPolarHBondContact O-CA 3.48Å; A82-L89 HydrophobicContact CB-CB 4.45Å; A82-L89 PolarHBondContact N-O 3.28Å; A82-L89 PolarHBondContact O-N 2.97Å; A82-W91 HydrophobicContact CB-CB 4.37Å; A82-L106 HydrophobicContact CB-CD1 3.48Å; A82-L106 VanDerWaalsContact CB-CD1 3.48Å; A82-L106 HydrophobicContact CB-CD2 4.41Å; A82-F107 HydrophobicContact CB-CE1 3.66Å; A82-F107 HydrophobicContact CB-CZ 3.57Å; A82-A169 CarbonylContact C-O 3.56Å; A82-A169 WeakPolarHBondContact CA-O 3.42Å
83	V	95.6	Very high	93.9	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	117.5	177.2	-171.3	0	0	0	0	108	I60 I72 V88 F157 A168 A169 L171	I60-V83 HydrophobicContact CG2-CG1 3.9Å; I72-V83 HydrophobicContact CD1-CG2 3.82Å; V83-V88 HydrophobicContact CG1-CG2 4.36Å; V83-V88 HydrophobicContact CG2-CG1 4.4Å; V83-F157 HydrophobicContact CB-CE2 4.35Å; V83-F157 HydrophobicContact CB-CZ 4.17Å; V83-F157 HydrophobicContact CG1-CE1 3.85Å; V83-F157 HydrophobicContact CG1-CE2 4.01Å; V83-F157 HydrophobicContact CG1-CZ 3.39Å; V83-A168 CarbonylContact O-C 3.53Å; V83-A168 VanDerWaalsContact O-CA 3.27Å; V83-A168 WeakPolarHBondContact O-CA 3.47Å; V83-A169 HydrophobicContact CB-CB 4.39Å; V83-A169 PolarHBondContact N-O 3.11Å; V83-A169 PolarHBondContact O-N 2.79Å; V83-L171 HydrophobicContact CG2-CD1 4.17Å
84	M	90.8	Very high	93.9	Very high	13 Å²	13	61 Å²	61	6%	0.064	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	84.8	-178.1	-70.4	179.4	-69	0	0	108.1	A82 A87 L89 L106 F107 L110 A168	A82-M84 HydrophobicContact CB-CE 4.32Å; M84-A87 CarbonylContact C-O 3.35Å; M84-A87 PolarHBondContact N-O 2.73Å; M84-A87 WeakPolarHBondContact O-CA 3.29Å; M84-A87 WeakPolarHBondContact O-CB 3.36Å; M84-A87 PolarHBondContact O-N 2.72Å; M84-A87 VanDerWaalsContact O-O 3.12Å; M84-L89 HydrophobicContact CE-CD1 3.62Å; M84-L89 HydrophobicContact CE-CG 4.37Å; M84-L106 HydrophobicContact CE-CD1 3.37Å; M84-L106 HydrophobicContact SD-CD1 3.9Å; M84-F107 HydrophobicContact CG-CD1 3.87Å; M84-F107 HydrophobicContact CG-CE1 4.14Å; M84-F107 HydrophobicContact SD-CD1 3.61Å; M84-F107 HydrophobicContact SD-CE1 4.22Å; M84-F107 HydrophobicContact SD-CG 4.37Å; M84-L110 HydrophobicContact CE-CD1 3.42Å; M84-L110 VanDerWaalsContact CE-CD1 3.42Å; M84-L110 HydrophobicContact SD-CD1 3.9Å; M84-A168 HydrophobicContact CG-CB 3.73Å
85	P	88.1	Confident	94.1	Very high	50 Å²	50	60.4 Å²	60.4	33%	0.325	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	129.2	-168.1	-28.7	35.4	0	0	0	113.3	I60 F157 V167	I60-P85 HydrophobicContact CB-CG 4.27Å; I60-P85 HydrophobicContact CD1-CB 4.36Å; I60-P85 HydrophobicContact CG1-CB 4.3Å; P85-F157 HydrophobicContact CG-CE2 4.39Å; P85-F157 HydrophobicContact CG-CZ 3.92Å; P85-V167 WeakPolarHBondContact CD-O 3.42Å
86	P	87.1	Confident	94.2	Very high	129 Å²	129	56.1 Å²	56.1	84%	0.838	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	cis	-91.9	10.5	8.9	38.4	-37.6	0	0	0	115.3
87	A	88.9	Confident	94.1	Very high	36 Å²	36	54.6 Å²	54.6	30%	0.298	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	147.6	-178.7	0	0	0	0	0	113.2	M84	M84-A87 CarbonylContact C-O 3.35Å; M84-A87 PolarHBondContact N-O 2.73Å; M84-A87 WeakPolarHBondContact O-CA 3.29Å; M84-A87 WeakPolarHBondContact O-CB 3.36Å; M84-A87 PolarHBondContact O-N 2.72Å; M84-A87 VanDerWaalsContact O-O 3.12Å
88	V	93.7	Very high	94.1	Very high	53 Å²	53	56.8 Å²	56.8	32%	0.321	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	125.6	163.8	-173	0	0	0	0	107.6	I60 I72 V77 C81 A82 V83	I60-V88 HydrophobicContact CD1-CG2 3.94Å; I72-V88 HydrophobicContact CD1-CG1 4.08Å; I72-V88 HydrophobicContact CG2-CG2 4.23Å; V77-V88 HydrophobicContact CG1-CG1 4.46Å; V77-V88 HydrophobicContact CG2-CG1 4.04Å; C81-V88 HydrophobicContact CB-CG1 4.47Å; A82-V88 WeakPolarHBondContact O-CA 3.48Å; V83-V88 HydrophobicContact CG1-CG2 4.36Å; V83-V88 HydrophobicContact CG2-CG1 4.4Å
89	L	93.4	Very high	94.1	Very high	72 Å²	72	50.4 Å²	50.4	38%	0.377	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	150.2	-174.8	-57.1	178.6	0	0	0	110.5	C81 A82 M84 W91 L110	C81-L89 CarbonylContact C-O 3.55Å; C81-L89 VanDerWaalsContact CA-O 3.29Å; C81-L89 WeakPolarHBondContact CA-O 3.14Å; C81-L89 WeakPolarHBondContact CB-O 3.5Å; A82-L89 HydrophobicContact CB-CB 4.45Å; A82-L89 PolarHBondContact N-O 3.28Å; A82-L89 PolarHBondContact O-N 2.97Å; M84-L89 HydrophobicContact CE-CD1 3.62Å; M84-L89 HydrophobicContact CE-CG 4.37Å; L89-W91 PolarHBondContact O-N 2.95Å; L89-L110 HydrophobicContact CD1-CD1 4.4Å
90	Q	95.6	Very high	94.1	Very high	121 Å²	121	51.6 Å²	51.6	57%	0.565	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.8	131.2	166.7	-164.4	72.3	46.4	0	0	109	F78 P80	F78-Q90 PolarHBondContact O-NE2 2.95Å; F78-Q90 PolarHBondContact O-OE1 3.17Å; P80-Q90 PolarHBondContact O-NE2 3.48Å
91	W	96.6	Very high	93.9	Very high	6 Å²	6	53.3 Å²	53.3	2%	0.023	31%	0.311	C	S	.	.			trans	-102.8	119.5	176.5	-169.2	28.5	0	0	0	109.5	P80 A82 L89 V93 I99 S103 I104 L106 F107 L121 G170 I172	P80-W91 HydrophobicContact CB-CB 4.44Å; P80-W91 PolarHBondContact O-N 3.12Å; A82-W91 HydrophobicContact CB-CB 4.37Å; L89-W91 PolarHBondContact O-N 2.95Å; W91-V93 VanDerWaalsContact C-N 3.25Å; W91-V93 HydrophobicContact CD2-CB 4.42Å; W91-V93 HydrophobicContact CD2-CG1 3.98Å; W91-V93 HydrophobicContact CD2-CG2 3.52Å; W91-V93 HydrophobicContact CE3-CG2 3.45Å; W91-V93 VanDerWaalsContact CE3-CG2 3.45Å; W91-V93 HydrophobicContact CG-CG1 4.34Å; W91-V93 HydrophobicContact CG-CG2 4.01Å; W91-V93 HydrophobicContact CH2-CG1 4.45Å; W91-V93 HydrophobicContact CH2-CG2 4.26Å; W91-V93 HydrophobicContact CZ2-CG1 3.86Å; W91-V93 HydrophobicContact CZ2-CG2 4.34Å; W91-V93 HydrophobicContact CZ3-CG2 3.84Å; W91-V93 PolarHBondContact O-N 2.84Å; W91-I99 HydrophobicContact CH2-CD1 3.84Å; W91-I99 HydrophobicContact CH2-CG1 3.79Å; W91-I99 HydrophobicContact CH2-CG2 4.41Å; W91-I99 HydrophobicContact CZ2-CG1 4.15Å; W91-I99 HydrophobicContact CZ2-CG2 4.34Å; W91-S103 PolarHBondContact NE1-O 3.43Å; W91-I104 HydrophobicContact CZ2-CD1 4.01Å; W91-L106 VanDerWaalsContact CD1-CD2 3.46Å; W91-L106 HydrophobicContact CG-CD2 4.44Å; W91-F107 HydrophobicContact CZ2-CE2 4.32Å; W91-L121 HydrophobicContact CH2-CD2 3.81Å; W91-L121 HydrophobicContact CZ3-CD2 4.34Å; W91-G170 VanDerWaalsContact CZ3-C 3.47Å; W91-I172 HydrophobicContact CZ3-CG1 4.11Å
92	N	95.4	Very high	93.8	Very high	155 Å²	155	59.9 Å²	59.9	83%	0.829	34%	0.342	S	S	*	.			trans	-82.8	69.7	-175.7	-171.3	62.5	0	0	0	111.5
93	V	95.4	Very high	93.8	Very high	10 Å²	10	60.8 Å²	60.8	6%	0.061	35%	0.348	C	S	.	.			trans	-131.7	144.8	171.6	-63.5	0	0	0	0	108.2	P80 W91 D98 I172	P80-V93 HydrophobicContact CB-CG2 3.78Å; P80-V93 HydrophobicContact CG-CG2 4.28Å; P80-V93 WeakPolarHBondContact CG-O 3.39Å; W91-V93 VanDerWaalsContact C-N 3.25Å; W91-V93 HydrophobicContact CD2-CB 4.42Å; W91-V93 HydrophobicContact CD2-CG1 3.98Å; W91-V93 HydrophobicContact CD2-CG2 3.52Å; W91-V93 HydrophobicContact CE3-CG2 3.45Å; W91-V93 VanDerWaalsContact CE3-CG2 3.45Å; W91-V93 HydrophobicContact CG-CG1 4.34Å; W91-V93 HydrophobicContact CG-CG2 4.01Å; W91-V93 HydrophobicContact CH2-CG1 4.45Å; W91-V93 HydrophobicContact CH2-CG2 4.26Å; W91-V93 HydrophobicContact CZ2-CG1 3.86Å; W91-V93 HydrophobicContact CZ2-CG2 4.34Å; W91-V93 HydrophobicContact CZ3-CG2 3.84Å; W91-V93 PolarHBondContact O-N 2.84Å; V93-D98 HydrophobicContact CB-CB 3.86Å; V93-D98 HydrophobicContact CG1-CB 4.05Å; V93-D98 WeakPolarHBondContact CG1-O 3.48Å; V93-I172 HydrophobicContact CG2-CD1 4.22Å; V93-I172 HydrophobicContact CG2-CG1 4.03Å
94	G	91	Very high	93.7	Very high	63 Å²	63	60.8 Å²	60.8	65%	0.649	35%	0.348	S	S	*	.	S	Bend	trans	-96.8	-30.1	172	0	0	0	0	0	112.6	D98	G94-D98 WeakPolarHBondContact CA-OD2 3.45Å; G94-D98 PolarHBondContact N-OD2 2.62Å
95	S	93.3	Very high	93.8	Very high	41 Å²	41	61.7 Å²	61.7	29%	0.287	36%	0.355	S	S	.	.	S	Bend	trans	-152.1	178.6	-169.2	70.7	0	0	0	0	111.2	E97 D98 I172	S95-E97 PolarHBondContact O-N 3.08Å; S95-E97 PolarHBondContact OG-N 2.94Å; S95-D98 PolarHBondContact N-OD2 2.95Å; S95-D98 PolarHBondContact O-N 3.37Å; S95-D98 PolarHBondContact OG-OD2 2.98Å; S95-I172 VanDerWaalsContact C-CD1 3.44Å; S95-I172 WeakPolarHBondContact O-CD1 3.1Å
96	S	93.3	Very high	93.8	Very high	21 Å²	21	61 Å²	61	15%	0.147	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-64.9	-21.7	171.4	53	0	0	0	0	114	D98 I99 E128	S96-D98 VanDerWaalsContact C-N 3.32Å; S96-I99 WeakPolarHBondContact O-CB 3.42Å; S96-I99 WeakPolarHBondContact O-CG1 3.31Å; S96-I99 PolarHBondContact O-N 3.44Å; S96-E128 WeakPolarHBondContact OG-CB 3.42Å; S96-E128 WeakPolarHBondContact OG-CG 3.43Å
97	E	94.3	Very high	94	Very high	172 Å²	172	55 Å²	55	80%	0.804	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-74.3	-26.5	179.7	-59.4	-176.2	175.5	0	0	111.7	S95 I99	S95-E97 PolarHBondContact O-N 3.08Å; S95-E97 PolarHBondContact OG-N 2.94Å; E97-I99 PolarHBondContact O-N 3.12Å
98	D	96.3	Very high	93.9	Very high	72 Å²	72	54.8 Å²	54.8	39%	0.385	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-80.2	3	176.8	-50.3	-67.4	0	0	0	113.1	V93 G94 S95 S96 T100 S103	V93-D98 HydrophobicContact CB-CB 3.86Å; V93-D98 HydrophobicContact CG1-CB 4.05Å; V93-D98 WeakPolarHBondContact CG1-O 3.48Å; G94-D98 WeakPolarHBondContact CA-OD2 3.45Å; G94-D98 PolarHBondContact N-OD2 2.62Å; S95-D98 PolarHBondContact N-OD2 2.95Å; S95-D98 PolarHBondContact O-N 3.37Å; S95-D98 PolarHBondContact OG-OD2 2.98Å; S96-D98 VanDerWaalsContact C-N 3.32Å; D98-T100 PolarHBondContact O-N 3.18Å; D98-T100 VanDerWaalsContact O-N 3.17Å; D98-S103 PolarHBondContact O-OG 2.91Å
99	I	96.9	Very high	93.4	Very high	2 Å²	2	58.5 Å²	58.5	1%	0.01	32%	0.318	C	S	.	.			trans	-82.7	91.6	176.1	-54.9	177.5	0	0	0	108.8	W91 S96 E97 I104 L121 T123 I130 I172	W91-I99 HydrophobicContact CH2-CD1 3.84Å; W91-I99 HydrophobicContact CH2-CG1 3.79Å; W91-I99 HydrophobicContact CH2-CG2 4.41Å; W91-I99 HydrophobicContact CZ2-CG1 4.15Å; W91-I99 HydrophobicContact CZ2-CG2 4.34Å; S96-I99 WeakPolarHBondContact O-CB 3.42Å; S96-I99 WeakPolarHBondContact O-CG1 3.31Å; S96-I99 PolarHBondContact O-N 3.44Å; E97-I99 PolarHBondContact O-N 3.12Å; I99-I104 HydrophobicContact CG2-CD1 3.87Å; I99-I104 HydrophobicContact CG2-CG1 3.84Å; I99-L121 HydrophobicContact CG2-CD1 4.21Å; I99-T123 HydrophobicContact CD1-CG2 4.22Å; I99-I130 HydrophobicContact CD1-CD1 3.69Å; I99-I130 HydrophobicContact CG2-CD1 4.32Å; I99-I130 HydrophobicContact CG2-CG2 4.41Å; I99-I172 HydrophobicContact CD1-CD1 4.27Å
100	T	97	Very high	92.5	Very high	46 Å²	46	58.7 Å²	58.7	28%	0.282	32%	0.319	S	S	.	.			trans	-113.7	175.8	-177.6	76	0	0	0	0	111.7	D98 E102 S103 I104 V134	D98-T100 PolarHBondContact O-N 3.18Å; D98-T100 VanDerWaalsContact O-N 3.17Å; T100-E102 WeakPolarHBondContact CB-OE2 3.35Å; T100-E102 PolarHBondContact O-N 3.06Å; T100-E102 PolarHBondContact OG1-N 2.82Å; T100-E102 PolarHBondContact OG1-OE2 2.96Å; T100-S103 PolarHBondContact N-OG 2.93Å; T100-S103 PolarHBondContact O-N 2.84Å; T100-S103 PolarHBondContact OG1-N 2.79Å; T100-I104 WeakPolarHBondContact O-CB 3.36Å; T100-I104 VanDerWaalsContact O-CG1 3.29Å; T100-I104 WeakPolarHBondContact O-CG1 3.3Å; T100-I104 PolarHBondContact O-N 2.94Å; T100-I104 VanDerWaalsContact O-N 3.12Å; T100-V134 WeakPolarHBondContact O-CG2 3.17Å
101	E	95.8	Very high	90.9	Very high	57 Å²	57	61.7 Å²	61.7	27%	0.266	33%	0.333	S	S	.	.	H	α-helix	trans	-60.9	-35.3	174.3	-71.2	-155.9	-165.7	0	0	111.1	S105 S133 V134 L137 R140	E101-S105 PolarHBondContact O-N 2.92Å; E101-S105 VanDerWaalsContact O-N 3.12Å; E101-S133 WeakPolarHBondContact OE1-CB 3.44Å; E101-V134 HydrophobicContact CG-CG2 4.46Å; E101-L137 HydrophobicContact CB-CD2 3.76Å; E101-L137 HydrophobicContact CG-CB 4.13Å; E101-L137 HydrophobicContact CG-CD2 3.8Å; E101-R140 IonicContact OE1-NH2 3.46Å; E101-R140 PolarHBondContact OE1-NH2 3.11Å; E101-R140 IonicContact OE2-NH2 3.21Å; E101-R140 PolarHBondContact OE2-NH2 3.48Å
102	E	95.2	Very high	89.3	Confident	139 Å²	139	65.9 Å²	65.9	65%	0.65	36%	0.361	S	S	*	.	H	α-helix	trans	-69.6	-47.6	178.2	-57	72.7	-159	0	0	112.1	T100 I104 S105	T100-E102 WeakPolarHBondContact CB-OE2 3.35Å; T100-E102 PolarHBondContact O-N 3.06Å; T100-E102 PolarHBondContact OG1-N 2.82Å; T100-E102 PolarHBondContact OG1-OE2 2.96Å; E102-I104 VanDerWaalsContact C-N 3.26Å; E102-I104 PolarHBondContact O-N 3.21Å; E102-S105 VanDerWaalsContact O-CB 3.27Å; E102-S105 WeakPolarHBondContact O-CB 3.42Å; E102-S105 PolarHBondContact O-N 3.46Å; E102-S105 PolarHBondContact O-OG 3.46Å
103	S	95.4	Very high	87.6	Confident	19 Å²	19	63.4 Å²	63.4	13%	0.133	35%	0.353	C	S	.	.	H	α-helix	trans	-72	-20.9	-179.6	66.8	0	0	0	0	112.9	W91 D98 T100 L106	W91-S103 PolarHBondContact NE1-O 3.43Å; D98-S103 PolarHBondContact O-OG 2.91Å; T100-S103 PolarHBondContact N-OG 2.93Å; T100-S103 PolarHBondContact O-N 2.84Å; T100-S103 PolarHBondContact OG1-N 2.79Å; S103-L106 WeakPolarHBondContact O-CD2 3.33Å
104	I	94.5	Very high	85.8	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-83.7	-18.8	171.9	-70	-73.4	0	0	0	113	W91 I99 T100 E102 L106 F107 L119 L121 V134 L137 L138	W91-I104 HydrophobicContact CZ2-CD1 4.01Å; I99-I104 HydrophobicContact CG2-CD1 3.87Å; I99-I104 HydrophobicContact CG2-CG1 3.84Å; T100-I104 WeakPolarHBondContact O-CB 3.36Å; T100-I104 VanDerWaalsContact O-CG1 3.29Å; T100-I104 WeakPolarHBondContact O-CG1 3.3Å; T100-I104 PolarHBondContact O-N 2.94Å; T100-I104 VanDerWaalsContact O-N 3.12Å; E102-I104 VanDerWaalsContact C-N 3.26Å; E102-I104 PolarHBondContact O-N 3.21Å; I104-L106 PolarHBondContact O-N 3.07Å; I104-F107 HydrophobicContact CD1-CD2 4.09Å; I104-F107 HydrophobicContact CD1-CE2 4.11Å; I104-F107 HydrophobicContact CG2-CD2 4.49Å; I104-F107 WeakPolarHBondContact O-CD2 3.46Å; I104-F107 PolarHBondContact O-N 3.02Å; I104-L119 HydrophobicContact CD1-CD2 4.01Å; I104-L121 HydrophobicContact CD1-CD1 4.14Å; I104-L121 HydrophobicContact CD1-CD2 4.21Å; I104-V134 HydrophobicContact CD1-CG1 4.39Å; I104-V134 HydrophobicContact CG1-CG1 3.82Å; I104-V134 HydrophobicContact CG1-CG2 4.36Å; I104-V134 HydrophobicContact CG2-CG1 4.47Å; I104-L137 HydrophobicContact CG2-CD2 4.42Å; I104-L138 HydrophobicContact CG2-CD1 4.38Å; I104-L138 HydrophobicContact CG2-CD2 3.74Å; I104-L138 HydrophobicContact CG2-CG 4.16Å
105	S	91.9	Very high	84.6	Confident	31 Å²	31	67.8 Å²	67.8	22%	0.217	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.4	-33.2	-173.1	70.3	0	0	0	0	114.3	E101 E102 F107 H108 M109	E101-S105 PolarHBondContact O-N 2.92Å; E101-S105 VanDerWaalsContact O-N 3.12Å; E102-S105 VanDerWaalsContact O-CB 3.27Å; E102-S105 WeakPolarHBondContact O-CB 3.42Å; E102-S105 PolarHBondContact O-N 3.46Å; E102-S105 PolarHBondContact O-OG 3.46Å; S105-F107 PolarHBondContact O-N 2.87Å; S105-F107 VanDerWaalsContact O-N 3.16Å; S105-H108 CarbonylContact O-C 3.6Å; S105-H108 PolarHBondContact O-N 3.12Å; S105-H108 PolarHBondContact O-ND1 2.85Å; S105-M109 WeakPolarHBondContact O-CB 3.45Å; S105-M109 VanDerWaalsContact O-CG 3.28Å; S105-M109 WeakPolarHBondContact O-CG 3.24Å; S105-M109 PolarHBondContact O-N 2.99Å
106	L	89.9	Confident	83.9	Confident	37 Å²	37	66.1 Å²	66.1	19%	0.194	36%	0.355	C	S	.	.	H	α-helix	trans	-55.3	-32.5	177.5	71.5	92.7	0	0	0	113.2	A82 M84 W91 S103 I104 H108	A82-L106 HydrophobicContact CB-CD1 3.48Å; A82-L106 VanDerWaalsContact CB-CD1 3.48Å; A82-L106 HydrophobicContact CB-CD2 4.41Å; M84-L106 HydrophobicContact CE-CD1 3.37Å; M84-L106 HydrophobicContact SD-CD1 3.9Å; W91-L106 VanDerWaalsContact CD1-CD2 3.46Å; W91-L106 HydrophobicContact CG-CD2 4.44Å; S103-L106 WeakPolarHBondContact O-CD2 3.33Å; I104-L106 PolarHBondContact O-N 3.07Å; L106-H108 PolarHBondContact O-N 3.26Å
107	F	90.6	Very high	83.8	Confident	3 Å²	3	69 Å²	69	1%	0.013	37%	0.366	C	S	.	.	H	α-helix	trans	-73.9	-10.6	-179.4	-63.2	-73.2	0	0	0	113.5	A82 M84 W91 I104 S105 L119 A168 A169	A82-F107 HydrophobicContact CB-CE1 3.66Å; A82-F107 HydrophobicContact CB-CZ 3.57Å; M84-F107 HydrophobicContact CG-CD1 3.87Å; M84-F107 HydrophobicContact CG-CE1 4.14Å; M84-F107 HydrophobicContact SD-CD1 3.61Å; M84-F107 HydrophobicContact SD-CE1 4.22Å; M84-F107 HydrophobicContact SD-CG 4.37Å; W91-F107 HydrophobicContact CZ2-CE2 4.32Å; I104-F107 HydrophobicContact CD1-CD2 4.09Å; I104-F107 HydrophobicContact CD1-CE2 4.11Å; I104-F107 HydrophobicContact CG2-CD2 4.49Å; I104-F107 WeakPolarHBondContact O-CD2 3.46Å; I104-F107 PolarHBondContact O-N 3.02Å; S105-F107 PolarHBondContact O-N 2.87Å; S105-F107 VanDerWaalsContact O-N 3.16Å; F107-L119 HydrophobicContact CB-CD2 4.41Å; F107-L119 HydrophobicContact CD1-CD1 3.63Å; F107-L119 HydrophobicContact CD2-CD1 4.13Å; F107-L119 HydrophobicContact CD2-CD2 3.97Å; F107-L119 HydrophobicContact CE1-CD1 3.67Å; F107-L119 HydrophobicContact CE2-CD1 4.19Å; F107-L119 HydrophobicContact CE2-CD2 4.44Å; F107-L119 HydrophobicContact CG-CD1 3.87Å; F107-L119 HydrophobicContact CG-CD2 4.13Å; F107-L119 HydrophobicContact CZ-CD1 3.97Å; F107-A168 HydrophobicContact CD1-CB 3.8Å; F107-A168 HydrophobicContact CE1-CB 4.21Å; F107-A169 WeakPolarHBondContact CE1-O 3.43Å
108	H	86.2	Confident	83.8	Confident	30 Å²	30	61.7 Å²	61.7	14%	0.139	33%	0.332	C	S	.	.	H	α-helix	trans	-134.5	5.5	-179.3	75.4	51.1	0	0	0	114.2	S105 L106 K141 I143	S105-H108 CarbonylContact O-C 3.6Å; S105-H108 PolarHBondContact O-N 3.12Å; S105-H108 PolarHBondContact O-ND1 2.85Å; L106-H108 PolarHBondContact O-N 3.26Å; H108-K141 HydrophobicContact CB-CD 4.23Å; H108-K141 HydrophobicContact CB-CG 4.44Å; H108-K141 PolarHBondContact ND1-NZ 2.84Å; H108-I143 HydrophobicContact CB-CD1 3.95Å
109	M	84.3	Confident	83.9	Confident	132 Å²	132	58.2 Å²	58.2	65%	0.65	31%	0.314	S	S	*	.	H	α-helix	trans	-105.1	-17.3	180	-78.2	-174.8	65	0	0	113.5	S105	S105-M109 WeakPolarHBondContact O-CB 3.45Å; S105-M109 VanDerWaalsContact O-CG 3.28Å; S105-M109 WeakPolarHBondContact O-CG 3.24Å; S105-M109 PolarHBondContact O-N 2.99Å
110	L	73.4	Confident	83.9	Confident	76 Å²	76	58.1 Å²	58.1	40%	0.398	31%	0.313	S	S	.	.	S	Bend	trans	-70.5	142.1	173.8	-63	179.6	0	0	0	110.6	M84 L89 P112	M84-L110 HydrophobicContact CE-CD1 3.42Å; M84-L110 VanDerWaalsContact CE-CD1 3.42Å; M84-L110 HydrophobicContact SD-CD1 3.9Å; L89-L110 HydrophobicContact CD1-CD1 4.4Å; L110-P112 CarbonylContact O-C 3.27Å; L110-P112 VanDerWaalsContact O-C 3.27Å; L110-P112 VanDerWaalsContact O-O 3.12Å
111	E	61.5	Low	84	Confident	184 Å²	184	56 Å²	56	86%	0.86	30%	0.3	S	S	*	.	S	Bend	trans	-87	137.4	171.8	-67.4	-168.8	158.7	0	0	110.5
112	P	64	Low	84.1	Confident	93 Å²	93	53.3 Å²	53.3	60%	0.604	29%	0.288	S	S	*	.	S	Bend	cis	-73.8	147.3	-1.2	31.4	-35.3	0	0	0	112.5	L110 I114 A115	L110-P112 CarbonylContact O-C 3.27Å; L110-P112 VanDerWaalsContact O-C 3.27Å; L110-P112 VanDerWaalsContact O-O 3.12Å; P112-I114 PolarHBondContact O-N 3.47Å; P112-A115 PolarHBondContact O-N 2.83Å; P112-A115 VanDerWaalsContact O-N 3.14Å
113	P	59.4	Low	84.2	Confident	103 Å²	103	47.2 Å²	47.2	67%	0.669	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	10.4	-172.3	28.5	-37.4	0	0	0	115.7
114	I	57.5	Low	84.3	Confident	121 Å²	121	46.4 Å²	46.4	62%	0.621	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.7	33.4	176.7	-35.7	175.2	0	0	0	109.2	P112 S116	P112-I114 PolarHBondContact O-N 3.47Å; I114-S116 PolarHBondContact O-N 2.99Å
115	A	65.3	Low	84.4	Confident	44 Å²	44	49 Å²	49	36%	0.364	27%	0.273	S	S	.	.	S	Bend	trans	-58.9	-29.4	-177.3	0	0	0	0	0	113.3	P112	P112-A115 PolarHBondContact O-N 2.83Å; P112-A115 VanDerWaalsContact O-N 3.14Å
116	S	78.4	Confident	84.6	Confident	6 Å²	6	53.2 Å²	53.2	4%	0.042	29%	0.287	C	S	.	.			trans	-150.1	128.6	177	53.4	0	0	0	0	112.4	I114 L166	I114-S116 PolarHBondContact O-N 2.99Å; S116-L166 CarbonylContact C-O 3.53Å; S116-L166 WeakPolarHBondContact CA-O 3.3Å
117	E	91.3	Very high	84.9	Confident	81 Å²	81	55.6 Å²	55.6	38%	0.379	30%	0.303	S	S	.	.	S	Bend	trans	-80.2	-28.8	167.3	-67.7	176.6	157.6	0	0	112	I143 A144 R165 L166	E117-I143 WeakPolarHBondContact O-CA 3.42Å; E117-A144 PolarHBondContact O-N 2.9Å; E117-R165 IonicContact OE2-CZ 3.61Å; E117-R165 IonicContact OE2-NE 3.65Å; E117-R165 IonicContact OE2-NH2 2.72Å; E117-R165 PolarHBondContact OE2-NH2 2.88Å; E117-L166 HydrophobicContact CB-CB 4.31Å; E117-L166 HydrophobicContact CG-CB 4.02Å; E117-L166 HydrophobicContact CG-CD1 4.13Å; E117-L166 PolarHBondContact N-O 3.19Å
118	I	95.4	Very high	85.2	Confident	19 Å²	19	58.3 Å²	58.3	10%	0.097	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129	-177.5	-53.4	171.6	0	0	0	108.7	V120 A144 L160 L166 V167 A168	I118-V120 HydrophobicContact CG2-CG2 4.27Å; I118-A144 CarbonylContact C-O 3.53Å; I118-A144 WeakPolarHBondContact CA-O 3.36Å; I118-A144 HydrophobicContact CG1-CB 4.43Å; I118-L160 HydrophobicContact CD1-CD1 4.06Å; I118-L160 HydrophobicContact CD1-CD2 4.04Å; I118-L160 HydrophobicContact CG2-CD1 3.98Å; I118-L166 PolarHBondContact N-O 2.91Å; I118-L166 VanDerWaalsContact N-O 3.11Å; I118-V167 HydrophobicContact CB-CG2 4.21Å; I118-V167 HydrophobicContact CG2-CG2 4.32Å; I118-V167 CarbonylContact O-C 3.5Å; I118-V167 WeakPolarHBondContact O-CA 3.48Å; I118-A168 PolarHBondContact O-N 3.13Å
119	L	97.1	Very high	85.7	Confident	0 Å²	0	68 Å²	68	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	122.3	168.5	177.2	59.1	0	0	0	109	I104 F107 L121 L138 I143 A144 L145 E146 A168	I104-L119 HydrophobicContact CD1-CD2 4.01Å; F107-L119 HydrophobicContact CB-CD2 4.41Å; F107-L119 HydrophobicContact CD1-CD1 3.63Å; F107-L119 HydrophobicContact CD2-CD1 4.13Å; F107-L119 HydrophobicContact CD2-CD2 3.97Å; F107-L119 HydrophobicContact CE1-CD1 3.67Å; F107-L119 HydrophobicContact CE2-CD1 4.19Å; F107-L119 HydrophobicContact CE2-CD2 4.44Å; F107-L119 HydrophobicContact CG-CD1 3.87Å; F107-L119 HydrophobicContact CG-CD2 4.13Å; F107-L119 HydrophobicContact CZ-CD1 3.97Å; L119-L121 HydrophobicContact CD1-CD2 4.13Å; L119-L121 HydrophobicContact CD2-CD2 4.12Å; L119-L121 HydrophobicContact CD2-CG 4.39Å; L119-L121 HydrophobicContact CG-CD2 4.04Å; L119-L121 HydrophobicContact CG-CG 4.24Å; L119-L138 HydrophobicContact CD2-CD1 4.05Å; L119-L138 HydrophobicContact CD2-CD2 4.07Å; L119-I143 HydrophobicContact CB-CG2 3.75Å; L119-A144 PolarHBondContact N-O 2.81Å; L119-L145 HydrophobicContact CB-CD1 4.37Å; L119-L145 HydrophobicContact CD2-CD1 4.26Å; L119-L145 HydrophobicContact CG-CD1 4.16Å; L119-L145 WeakPolarHBondContact O-CA 3.37Å; L119-E146 PolarHBondContact O-N 2.74Å; L119-A168 WeakPolarHBondContact CA-O 3.46Å; L119-A168 HydrophobicContact CD1-CB 4.04Å
120	V	98.3	Very high	86.3	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	117.8	173.5	-170.7	0	0	0	0	108.9	I118 E146 A153 T156 L160 V167 A168 A169 G170	I118-V120 HydrophobicContact CG2-CG2 4.27Å; V120-E146 CarbonylContact C-O 3.58Å; V120-E146 WeakPolarHBondContact CA-O 3.43Å; V120-E146 HydrophobicContact CG1-CB 4.44Å; V120-E146 HydrophobicContact CG2-CB 4.47Å; V120-A153 HydrophobicContact CG1-CB 3.82Å; V120-T156 HydrophobicContact CG1-CG2 4.32Å; V120-T156 HydrophobicContact CG2-CG2 4.12Å; V120-L160 HydrophobicContact CG2-CD1 4.11Å; V120-V167 HydrophobicContact CG2-CG2 3.91Å; V120-A168 PolarHBondContact N-O 2.94Å; V120-A169 HydrophobicContact CB-CB 4.43Å; V120-A169 CarbonylContact O-C 3.6Å; V120-A169 WeakPolarHBondContact O-CA 3.49Å; V120-G170 PolarHBondContact O-N 3.25Å
121	L	98.4	Very high	87.4	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.005	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	116	175.5	-67.4	-175.4	0	0	0	111.1	W91 I99 I104 L119 I130 L145 E146 Q148 G170	W91-L121 HydrophobicContact CH2-CD2 3.81Å; W91-L121 HydrophobicContact CZ3-CD2 4.34Å; I99-L121 HydrophobicContact CG2-CD1 4.21Å; I104-L121 HydrophobicContact CD1-CD1 4.14Å; I104-L121 HydrophobicContact CD1-CD2 4.21Å; L119-L121 HydrophobicContact CD1-CD2 4.13Å; L119-L121 HydrophobicContact CD2-CD2 4.12Å; L119-L121 HydrophobicContact CD2-CG 4.39Å; L119-L121 HydrophobicContact CG-CD2 4.04Å; L119-L121 HydrophobicContact CG-CG 4.24Å; L121-I130 HydrophobicContact CD1-CD1 4.01Å; L121-I130 HydrophobicContact CD1-CG1 4.27Å; L121-L145 HydrophobicContact CB-CD1 4.36Å; L121-L145 HydrophobicContact CD1-CD1 3.63Å; L121-L145 HydrophobicContact CG-CD1 3.64Å; L121-E146 PolarHBondContact N-O 3.02Å; L121-Q148 PolarHBondContact O-N 2.89Å; L121-Q148 VanDerWaalsContact O-O 3.1Å; L121-G170 CarbonylContact C-O 3.56Å; L121-G170 WeakPolarHBondContact CA-O 3.46Å
122	G	98.4	Very high	89.1	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.01	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	108.8	168.7	0	0	0	0	0	109.9	G124 T150 A153 G170 I172	G122-G124 VanDerWaalsContact C-N 3.34Å; G122-G124 PolarHBondContact O-N 3.32Å; G122-T150 WeakPolarHBondContact CA-OG1 3.46Å; G122-T150 PolarHBondContact O-OG1 3.04Å; G122-A153 VanDerWaalsContact CA-CB 3.48Å; G122-G170 PolarHBondContact N-O 3.46Å; G122-I172 PolarHBondContact O-N 3.05Å
123	T	97.9	Very high	90.6	Very high	10 Å²	10	56.2 Å²	56.2	6%	0.061	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	17.1	-171	45.6	0	0	0	0	114.6	I99 K126 V127 E128 I130 V147 Q148	I99-T123 HydrophobicContact CD1-CG2 4.22Å; T123-K126 PolarHBondContact OG1-O 3.37Å; T123-V127 WeakPolarHBondContact OG1-CA 3.45Å; T123-E128 HydrophobicContact CG2-CB 4.3Å; T123-E128 PolarHBondContact OG1-N 3.35Å; T123-I130 HydrophobicContact CG2-CD1 3.96Å; T123-V147 HydrophobicContact CG2-CG1 3.94Å; T123-Q148 PolarHBondContact N-O 3.28Å; T123-Q148 PolarHBondContact OG1-O 2.93Å
124	G	96.9	Very high	92.4	Very high	3 Å²	3	51.3 Å²	51.3	3%	0.031	27%	0.268	C	S	.	.	S	Bend	trans	101.1	-138.7	-178.8	0	0	0	0	0	111.9	G122 K126 T150	G122-G124 VanDerWaalsContact C-N 3.34Å; G122-G124 PolarHBondContact O-N 3.32Å; G124-K126 VanDerWaalsContact C-N 3.29Å; G124-K126 PolarHBondContact O-N 3.13Å; G124-T150 WeakPolarHBondContact CA-OG1 3.45Å; G124-T150 PolarHBondContact N-OG1 2.81Å; G124-T150 WeakPolarHBondContact O-CB 3.48Å; G124-T150 PolarHBondContact O-N 3.16Å; G124-T150 PolarHBondContact O-OG1 3.1Å
125	S	96.1	Very high	94.3	Very high	53 Å²	53	49.4 Å²	49.4	37%	0.371	26%	0.259	S	S	.	.	S	Bend	trans	-78.9	-5.6	-174.2	-45.6	0	0	0	0	114.9	P174 S175	S125-P174 WeakPolarHBondContact OG-CA 3.15Å; S125-S175 PolarHBondContact OG-N 3.38Å; S125-S175 PolarHBondContact OG-O 3.02Å
126	K	96	Very high	95.8	Very high	121 Å²	121	49.3 Å²	49.3	53%	0.526	26%	0.258	S	S	.	.	S	Bend	trans	-151.7	161.4	178.8	62.7	-175.8	174.2	98.7	0	109.9	T123 G124 E128	T123-K126 PolarHBondContact OG1-O 3.37Å; G124-K126 VanDerWaalsContact C-N 3.29Å; G124-K126 PolarHBondContact O-N 3.13Å; K126-E128 WeakPolarHBondContact CE-OE1 3.49Å; K126-E128 HydrophobicContact CG-CG 4.46Å; K126-E128 IonicContact NZ-OE1 2.58Å; K126-E128 PolarHBondContact NZ-OE1 3.41Å; K126-E128 IonicContact NZ-OE2 2.85Å; K126-E128 PolarHBondContact NZ-OE2 3.1Å; K126-E128 PolarHBondContact O-N 3.02Å
127	V	97.6	Very high	96.6	Very high	86 Å²	86	49.7 Å²	49.7	52%	0.521	26%	0.259	S	S	.	.			trans	-72.1	121.1	172.8	-167.7	0	0	0	0	109.6	T123 V147	T123-V127 WeakPolarHBondContact OG1-CA 3.45Å; V127-V147 HydrophobicContact CG1-CG1 4.15Å
128	E	96.9	Very high	96.8	Very high	60 Å²	60	45.9 Å²	45.9	28%	0.28	24%	0.242	S	C	.	.			trans	-105.7	160.4	174.6	-62.5	-75.1	-153.7	0	0	112.3	S96 T123 K126	S96-E128 WeakPolarHBondContact OG-CB 3.42Å; S96-E128 WeakPolarHBondContact OG-CG 3.43Å; T123-E128 HydrophobicContact CG2-CB 4.3Å; T123-E128 PolarHBondContact OG1-N 3.35Å; K126-E128 WeakPolarHBondContact CE-OE1 3.49Å; K126-E128 HydrophobicContact CG-CG 4.46Å; K126-E128 IonicContact NZ-OE1 2.58Å; K126-E128 PolarHBondContact NZ-OE1 3.41Å; K126-E128 IonicContact NZ-OE2 2.85Å; K126-E128 PolarHBondContact NZ-OE2 3.1Å; K126-E128 PolarHBondContact O-N 3.02Å
129	R	95.9	Very high	96.7	Very high	235 Å²	235	53.3 Å²	53.3	89%	0.887	27%	0.274	S	S	*	.	P	Polyproline II helix	trans	-80	129.3	176.9	-58.8	-172	96.5	85.9	-2.5	110.5
130	I	96.8	Very high	96.6	Very high	17 Å²	17	60.6 Å²	60.6	9%	0.087	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-85.4	145.3	173.7	-56.3	-55.3	0	0	0	110.5	I99 L121 T123 V134 L135 V147	I99-I130 HydrophobicContact CD1-CD1 3.69Å; I99-I130 HydrophobicContact CG2-CD1 4.32Å; I99-I130 HydrophobicContact CG2-CG2 4.41Å; L121-I130 HydrophobicContact CD1-CD1 4.01Å; L121-I130 HydrophobicContact CD1-CG1 4.27Å; T123-I130 HydrophobicContact CG2-CD1 3.96Å; I130-V134 HydrophobicContact CG2-CB 3.84Å; I130-V134 HydrophobicContact CG2-CG1 3.68Å; I130-L135 HydrophobicContact CB-CD2 4.12Å; I130-L135 HydrophobicContact CG2-CD2 4.03Å; I130-V147 HydrophobicContact CD1-CG1 4.18Å; I130-V147 HydrophobicContact CG1-CB 4.45Å; I130-V147 HydrophobicContact CG1-CG1 3.87Å; I130-V147 HydrophobicContact CG1-CG2 3.68Å
131	N	96.3	Very high	96.3	Very high	83 Å²	83	65.3 Å²	65.3	44%	0.444	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-58.1	130.1	178.2	-169.5	-33.3	0	0	0	111.4	S133 V134 L135	N131-S133 PolarHBondContact O-N 2.96Å; N131-S133 VanDerWaalsContact O-N 3.08Å; N131-S133 PolarHBondContact OD1-N 2.96Å; N131-S133 VanDerWaalsContact OD1-N 3.11Å; N131-S133 PolarHBondContact OD1-OG 3.11Å; N131-V134 HydrophobicContact CB-CG2 4.41Å; N131-V134 WeakPolarHBondContact O-CB 3.47Å; N131-V134 PolarHBondContact O-N 2.76Å; N131-V134 VanDerWaalsContact O-N 3.08Å; N131-L135 PolarHBondContact O-N 2.93Å
132	P	96.6	Very high	96	Very high	97 Å²	97	76.2 Å²	76.2	63%	0.63	36%	0.363	S	S	*	.	H	α-helix	trans	-54.5	-26.3	178	-28.6	36	0	0	0	115.5	L135 A136	P132-L135 PolarHBondContact O-N 2.9Å; P132-A136 PolarHBondContact O-N 2.88Å
133	S	97	Very high	95.8	Very high	40 Å²	40	77 Å²	77	28%	0.28	37%	0.366	S	S	.	.	H	α-helix	trans	-62.2	-49.4	174.2	59.9	0	0	0	0	111.7	E101 N131 L135 A136 L137	E101-S133 WeakPolarHBondContact OE1-CB 3.44Å; N131-S133 PolarHBondContact O-N 2.96Å; N131-S133 VanDerWaalsContact O-N 3.08Å; N131-S133 PolarHBondContact OD1-N 2.96Å; N131-S133 VanDerWaalsContact OD1-N 3.11Å; N131-S133 PolarHBondContact OD1-OG 3.11Å; S133-L135 VanDerWaalsContact C-N 3.33Å; S133-L135 PolarHBondContact O-N 2.93Å; S133-A136 CarbonylContact O-C 3.6Å; S133-A136 WeakPolarHBondContact O-CA 3.16Å; S133-A136 WeakPolarHBondContact O-CB 3.31Å; S133-A136 PolarHBondContact O-N 2.88Å; S133-L137 PolarHBondContact O-N 2.98Å
134	V	96.9	Very high	95.7	Very high	0 Å²	0	79 Å²	79	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-57.9	-43.3	174.9	171.7	0	0	0	0	111.6	T100 E101 I104 I130 N131 A136 L137 L138	T100-V134 WeakPolarHBondContact O-CG2 3.17Å; E101-V134 HydrophobicContact CG-CG2 4.46Å; I104-V134 HydrophobicContact CD1-CG1 4.39Å; I104-V134 HydrophobicContact CG1-CG1 3.82Å; I104-V134 HydrophobicContact CG1-CG2 4.36Å; I104-V134 HydrophobicContact CG2-CG1 4.47Å; I130-V134 HydrophobicContact CG2-CB 3.84Å; I130-V134 HydrophobicContact CG2-CG1 3.68Å; N131-V134 HydrophobicContact CB-CG2 4.41Å; N131-V134 WeakPolarHBondContact O-CB 3.47Å; N131-V134 PolarHBondContact O-N 2.76Å; N131-V134 VanDerWaalsContact O-N 3.08Å; V134-A136 VanDerWaalsContact C-N 3.31Å; V134-A136 PolarHBondContact O-N 2.92Å; V134-L137 PolarHBondContact O-N 2.86Å; V134-L138 HydrophobicContact CG1-CD1 3.85Å; V134-L138 HydrophobicContact CG1-CG 4.42Å; V134-L138 WeakPolarHBondContact O-CG 3.46Å; V134-L138 PolarHBondContact O-N 3.43Å
135	L	96.5	Very high	95.7	Very high	81 Å²	81	80.9 Å²	80.9	42%	0.424	39%	0.393	S	S	.	.	H	α-helix	trans	-59.6	-43.2	175.5	-56.5	-176.3	0	0	0	111.4	I130 N131 P132 S133 K139 L145	I130-L135 HydrophobicContact CB-CD2 4.12Å; I130-L135 HydrophobicContact CG2-CD2 4.03Å; N131-L135 PolarHBondContact O-N 2.93Å; P132-L135 PolarHBondContact O-N 2.9Å; S133-L135 VanDerWaalsContact C-N 3.33Å; S133-L135 PolarHBondContact O-N 2.93Å; L135-K139 VanDerWaalsContact O-CB 3.3Å; L135-K139 WeakPolarHBondContact O-CB 3.35Å; L135-K139 PolarHBondContact O-N 3.44Å; L135-K139 VanDerWaalsContact O-N 3.11Å; L135-L145 HydrophobicContact CD2-CD2 3.33Å
136	A	96.9	Very high	95.8	Very high	42 Å²	42	82.9 Å²	82.9	35%	0.347	40%	0.396	S	S	.	.	H	α-helix	trans	-67.8	-39.4	176.9	0	0	0	0	0	112.1	P132 S133 V134 R140	P132-A136 PolarHBondContact O-N 2.88Å; S133-A136 CarbonylContact O-C 3.6Å; S133-A136 WeakPolarHBondContact O-CA 3.16Å; S133-A136 WeakPolarHBondContact O-CB 3.31Å; S133-A136 PolarHBondContact O-N 2.88Å; V134-A136 VanDerWaalsContact C-N 3.31Å; V134-A136 PolarHBondContact O-N 2.92Å; A136-R140 VanDerWaalsContact O-CG 3.31Å; A136-R140 WeakPolarHBondContact O-CG 3.32Å; A136-R140 PolarHBondContact O-N 2.82Å; A136-R140 PolarHBondContact O-NH1 3.38Å
137	L	95.4	Very high	95.9	Very high	13 Å²	13	79 Å²	79	7%	0.068	38%	0.383	C	S	.	.	H	α-helix	trans	-60.6	-53.9	175.8	175	65.2	0	0	0	111.7	E101 I104 S133 V134 K139 R140 K141	E101-L137 HydrophobicContact CB-CD2 3.76Å; E101-L137 HydrophobicContact CG-CB 4.13Å; E101-L137 HydrophobicContact CG-CD2 3.8Å; I104-L137 HydrophobicContact CG2-CD2 4.42Å; S133-L137 PolarHBondContact O-N 2.98Å; V134-L137 PolarHBondContact O-N 2.86Å; L137-K139 VanDerWaalsContact C-N 3.29Å; L137-K139 PolarHBondContact O-N 2.77Å; L137-R140 WeakPolarHBondContact O-CB 3.33Å; L137-R140 PolarHBondContact O-N 3.37Å; L137-R140 VanDerWaalsContact O-N 3.08Å; L137-K141 HydrophobicContact CD1-CG 4.31Å; L137-K141 WeakPolarHBondContact O-CG 3.47Å; L137-K141 PolarHBondContact O-N 3.34Å
138	L	94.5	Very high	95.9	Very high	2 Å²	2	76.8 Å²	76.8	1%	0.01	37%	0.367	C	S	.	.	H	α-helix	trans	-61.9	-39.4	-179.1	-68.8	170.4	0	0	0	111.2	I104 L119 V134 R140 K141 R142 I143 L145	I104-L138 HydrophobicContact CG2-CD1 4.38Å; I104-L138 HydrophobicContact CG2-CD2 3.74Å; I104-L138 HydrophobicContact CG2-CG 4.16Å; L119-L138 HydrophobicContact CD2-CD1 4.05Å; L119-L138 HydrophobicContact CD2-CD2 4.07Å; V134-L138 HydrophobicContact CG1-CD1 3.85Å; V134-L138 HydrophobicContact CG1-CG 4.42Å; V134-L138 WeakPolarHBondContact O-CG 3.46Å; V134-L138 PolarHBondContact O-N 3.43Å; L138-R140 PolarHBondContact O-N 3.32Å; L138-K141 CarbonylContact O-C 3.54Å; L138-K141 WeakPolarHBondContact O-CA 3.5Å; L138-K141 PolarHBondContact O-N 3.42Å; L138-K141 VanDerWaalsContact O-N 3.12Å; L138-R142 PolarHBondContact O-N 2.98Å; L138-I143 HydrophobicContact CB-CB 4.39Å; L138-I143 HydrophobicContact CD2-CB 3.99Å; L138-I143 HydrophobicContact CD2-CD1 3.97Å; L138-I143 HydrophobicContact CD2-CG2 4.05Å; L138-I143 PolarHBondContact O-N 3.08Å; L138-L145 HydrophobicContact CD1-CB 4.09Å; L138-L145 HydrophobicContact CD1-CD1 3.9Å; L138-L145 HydrophobicContact CD1-CD2 3.99Å; L138-L145 HydrophobicContact CD1-CG 4.2Å
139	K	94.6	Very high	96	Very high	175 Å²	175	75.4 Å²	75.4	76%	0.761	36%	0.361	S	S	*	.	H	α-helix	trans	-60.8	-42.9	171.9	-173.1	175.2	-178.9	176.9	0	112.8	L135 L137 K141 R142	L135-K139 VanDerWaalsContact O-CB 3.3Å; L135-K139 WeakPolarHBondContact O-CB 3.35Å; L135-K139 PolarHBondContact O-N 3.44Å; L135-K139 VanDerWaalsContact O-N 3.11Å; L137-K139 VanDerWaalsContact C-N 3.29Å; L137-K139 PolarHBondContact O-N 2.77Å; K139-K141 VanDerWaalsContact C-N 3.28Å; K139-K141 PolarHBondContact O-N 3.24Å; K139-R142 PolarHBondContact O-N 3.11Å
140	R	93.9	Very high	96.1	Very high	152 Å²	152	64.2 Å²	64.2	57%	0.574	32%	0.319	S	S	*	.	H	α-helix	trans	-61.5	-37	173.3	-71.4	-176	-53.6	-95.6	11.4	111.6	E101 A136 L137 L138 R142	E101-R140 IonicContact OE1-NH2 3.46Å; E101-R140 PolarHBondContact OE1-NH2 3.11Å; E101-R140 IonicContact OE2-NH2 3.21Å; E101-R140 PolarHBondContact OE2-NH2 3.48Å; A136-R140 VanDerWaalsContact O-CG 3.31Å; A136-R140 WeakPolarHBondContact O-CG 3.32Å; A136-R140 PolarHBondContact O-N 2.82Å; A136-R140 PolarHBondContact O-NH1 3.38Å; L137-R140 WeakPolarHBondContact O-CB 3.33Å; L137-R140 PolarHBondContact O-N 3.37Å; L137-R140 VanDerWaalsContact O-N 3.08Å; L138-R140 PolarHBondContact O-N 3.32Å; R140-R142 VanDerWaalsContact C-N 3.28Å; R140-R142 PolarHBondContact O-N 3.29Å
141	K	92	Very high	96.1	Very high	99 Å²	99	65.1 Å²	65.1	43%	0.43	33%	0.326	S	S	.	.	H	α-helix	trans	-78.2	-5.4	177.1	-65.9	-72.8	-174.5	165.5	0	114.2	H108 L137 L138 K139 I143	H108-K141 HydrophobicContact CB-CD 4.23Å; H108-K141 HydrophobicContact CB-CG 4.44Å; H108-K141 PolarHBondContact ND1-NZ 2.84Å; L137-K141 HydrophobicContact CD1-CG 4.31Å; L137-K141 WeakPolarHBondContact O-CG 3.47Å; L137-K141 PolarHBondContact O-N 3.34Å; L138-K141 CarbonylContact O-C 3.54Å; L138-K141 WeakPolarHBondContact O-CA 3.5Å; L138-K141 PolarHBondContact O-N 3.42Å; L138-K141 VanDerWaalsContact O-N 3.12Å; K139-K141 VanDerWaalsContact C-N 3.28Å; K139-K141 PolarHBondContact O-N 3.24Å; K141-I143 HydrophobicContact CB-CD1 3.98Å; K141-I143 HydrophobicContact CB-CG1 4.03Å; K141-I143 PolarHBondContact O-N 3.08Å
142	R	92.5	Very high	96.2	Very high	231 Å²	231	65.3 Å²	65.3	87%	0.872	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.6	27.9	-173.8	-51.1	-178.5	-177	177.9	1.2	114	L138 K139 R140	L138-R142 PolarHBondContact O-N 2.98Å; K139-R142 PolarHBondContact O-N 3.11Å; R140-R142 VanDerWaalsContact C-N 3.28Å; R140-R142 PolarHBondContact O-N 3.29Å
143	I	93.9	Very high	96.3	Very high	17 Å²	17	60.7 Å²	60.7	9%	0.087	30%	0.297	C	S	.	.			trans	-91.6	122.4	174	-59	173.6	0	0	0	107.7	H108 E117 L119 L138 K141	H108-I143 HydrophobicContact CB-CD1 3.95Å; E117-I143 WeakPolarHBondContact O-CA 3.42Å; L119-I143 HydrophobicContact CB-CG2 3.75Å; L138-I143 HydrophobicContact CB-CB 4.39Å; L138-I143 HydrophobicContact CD2-CB 3.99Å; L138-I143 HydrophobicContact CD2-CD1 3.97Å; L138-I143 HydrophobicContact CD2-CG2 4.05Å; L138-I143 PolarHBondContact O-N 3.08Å; K141-I143 HydrophobicContact CB-CD1 3.98Å; K141-I143 HydrophobicContact CB-CG1 4.03Å; K141-I143 PolarHBondContact O-N 3.08Å
144	A	95.8	Very high	96.4	Very high	53 Å²	53	59.1 Å²	59.1	44%	0.438	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	133.1	170.2	0	0	0	0	0	109.1	E117 I118 L119	E117-A144 PolarHBondContact O-N 2.9Å; I118-A144 CarbonylContact C-O 3.53Å; I118-A144 WeakPolarHBondContact CA-O 3.36Å; I118-A144 HydrophobicContact CG1-CB 4.43Å; L119-A144 PolarHBondContact N-O 2.81Å
145	L	97.3	Very high	96.4	Very high	41 Å²	41	61.9 Å²	61.9	22%	0.215	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	123.2	179.9	177.1	69.5	0	0	0	110.3	L119 L121 L135 L138 V147	L119-L145 HydrophobicContact CB-CD1 4.37Å; L119-L145 HydrophobicContact CD2-CD1 4.26Å; L119-L145 HydrophobicContact CG-CD1 4.16Å; L119-L145 WeakPolarHBondContact O-CA 3.37Å; L121-L145 HydrophobicContact CB-CD1 4.36Å; L121-L145 HydrophobicContact CD1-CD1 3.63Å; L121-L145 HydrophobicContact CG-CD1 3.64Å; L135-L145 HydrophobicContact CD2-CD2 3.33Å; L138-L145 HydrophobicContact CD1-CB 4.09Å; L138-L145 HydrophobicContact CD1-CD1 3.9Å; L138-L145 HydrophobicContact CD1-CD2 3.99Å; L138-L145 HydrophobicContact CD1-CG 4.2Å; L145-V147 HydrophobicContact CD1-CG2 4.18Å; L145-V147 HydrophobicContact CD2-CG2 3.68Å; L145-V147 HydrophobicContact CG-CG2 3.75Å
146	E	97.8	Very high	96.5	Very high	95 Å²	95	59.7 Å²	59.7	44%	0.444	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	131.7	165.6	-69	-61.9	155.8	0	0	109	L119 V120 L121	L119-E146 PolarHBondContact O-N 2.74Å; V120-E146 CarbonylContact C-O 3.58Å; V120-E146 WeakPolarHBondContact CA-O 3.43Å; V120-E146 HydrophobicContact CG1-CB 4.44Å; V120-E146 HydrophobicContact CG2-CB 4.47Å; L121-E146 PolarHBondContact N-O 3.02Å
147	V	98.3	Very high	96.5	Very high	41 Å²	41	57.7 Å²	57.7	25%	0.248	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	121.5	179.3	-170.4	0	0	0	0	109.4	T123 V127 I130 L145	T123-V147 HydrophobicContact CG2-CG1 3.94Å; V127-V147 HydrophobicContact CG1-CG1 4.15Å; I130-V147 HydrophobicContact CD1-CG1 4.18Å; I130-V147 HydrophobicContact CG1-CB 4.45Å; I130-V147 HydrophobicContact CG1-CG1 3.87Å; I130-V147 HydrophobicContact CG1-CG2 3.68Å; L145-V147 HydrophobicContact CD1-CG2 4.18Å; L145-V147 HydrophobicContact CD2-CG2 3.68Å; L145-V147 HydrophobicContact CG-CG2 3.75Å
148	Q	98.5	Very high	96.6	Very high	39 Å²	39	58.8 Å²	58.8	18%	0.182	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	170.6	-174.3	-65.7	178.4	-6.8	0	0	110.4	L121 T123 N152 A153 T156	L121-Q148 PolarHBondContact O-N 2.89Å; L121-Q148 VanDerWaalsContact O-O 3.1Å; T123-Q148 PolarHBondContact N-O 3.28Å; T123-Q148 PolarHBondContact OG1-O 2.93Å; Q148-N152 HydrophobicContact CB-CB 4.27Å; Q148-N152 PolarHBondContact OE1-O 3.34Å; Q148-A153 HydrophobicContact CB-CB 4.18Å; Q148-A153 VanDerWaalsContact OE1-CA 3.31Å; Q148-A153 VanDerWaalsContact OE1-N 3.09Å; Q148-T156 PolarHBondContact NE2-OG1 2.94Å; Q148-T156 PolarHBondContact OE1-OG1 3.29Å
149	D	97.8	Very high	96.7	Very high	30 Å²	30	64.6 Å²	64.6	16%	0.16	31%	0.314	C	S	.	.			trans	-69.3	151.8	157.6	62.4	-62	0	0	0	109.3	P151 N152 A153	D149-P151 WeakPolarHBondContact OD2-CD 3.3Å; D149-N152 VanDerWaalsContact CG-ND2 3.34Å; D149-N152 PolarHBondContact O-N 3.15Å; D149-N152 PolarHBondContact OD1-ND2 2.95Å; D149-N152 PolarHBondContact OD2-ND2 3.27Å; D149-A153 WeakPolarHBondContact O-CB 3.24Å; D149-A153 PolarHBondContact O-N 3.42Å
150	T	98.2	Very high	96.7	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-59.6	-38.9	-170.6	-64.3	0	0	0	0	114.8	F70 G122 G124 N152 A153 C154 I172	F70-T150 HydrophobicContact CE1-CG2 3.46Å; F70-T150 VanDerWaalsContact CE1-CG2 3.46Å; F70-T150 HydrophobicContact CZ-CG2 3.67Å; G122-T150 WeakPolarHBondContact CA-OG1 3.46Å; G122-T150 PolarHBondContact O-OG1 3.04Å; G124-T150 WeakPolarHBondContact CA-OG1 3.45Å; G124-T150 PolarHBondContact N-OG1 2.81Å; G124-T150 WeakPolarHBondContact O-CB 3.48Å; G124-T150 PolarHBondContact O-N 3.16Å; G124-T150 PolarHBondContact O-OG1 3.1Å; T150-N152 PolarHBondContact O-N 3.07Å; T150-A153 PolarHBondContact O-N 2.84Å; T150-C154 PolarHBondContact O-N 2.99Å; T150-C154 PolarHBondContact O-SG 3.4Å; T150-I172 WeakPolarHBondContact CB-O 3.4Å; T150-I172 WeakPolarHBondContact CG2-O 3.47Å; T150-I172 PolarHBondContact OG1-O 2.58Å
151	P	97.6	Very high	96.7	Very high	37 Å²	37	50.8 Å²	50.8	24%	0.24	26%	0.26	C	S	.	.	H	α-helix	trans	-52.6	-51.3	171.9	-29.4	36.7	0	0	0	113.7	Y65 D149 C154 A155	Y65-P151 HydrophobicContact CE1-CB 4.01Å; Y65-P151 HydrophobicContact CE1-CG 4.27Å; Y65-P151 HydrophobicContact CE2-CG 4.02Å; Y65-P151 WeakPolarHBondContact OH-CB 3.28Å; D149-P151 WeakPolarHBondContact OD2-CD 3.3Å; P151-C154 PolarHBondContact O-N 3.41Å; P151-A155 PolarHBondContact O-N 2.7Å
152	N	98.4	Very high	96.7	Very high	87 Å²	87	48.8 Å²	48.8	47%	0.465	26%	0.258	S	S	.	.	H	α-helix	trans	-70.7	-37.8	179.6	-70.5	-44.6	0	0	0	111.7	Q148 D149 T150 C154 A155 T156	Q148-N152 HydrophobicContact CB-CB 4.27Å; Q148-N152 PolarHBondContact OE1-O 3.34Å; D149-N152 VanDerWaalsContact CG-ND2 3.34Å; D149-N152 PolarHBondContact O-N 3.15Å; D149-N152 PolarHBondContact OD1-ND2 2.95Å; D149-N152 PolarHBondContact OD2-ND2 3.27Å; T150-N152 PolarHBondContact O-N 3.07Å; N152-C154 VanDerWaalsContact C-N 3.31Å; N152-C154 PolarHBondContact O-N 3.45Å; N152-A155 PolarHBondContact O-N 3.38Å; N152-A155 VanDerWaalsContact O-N 3.15Å; N152-T156 WeakPolarHBondContact O-CB 3.48Å; N152-T156 PolarHBondContact O-N 2.6Å; N152-T156 PolarHBondContact O-OG1 2.99Å; N152-T156 VanDerWaalsContact O-OG1 3.13Å
153	A	98.6	Very high	96.8	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.8	-41.7	176	0	0	0	0	0	112.1	V120 G122 Q148 D149 T150 T156 F157 L171	V120-A153 HydrophobicContact CG1-CB 3.82Å; G122-A153 VanDerWaalsContact CA-CB 3.48Å; Q148-A153 HydrophobicContact CB-CB 4.18Å; Q148-A153 VanDerWaalsContact OE1-CA 3.31Å; Q148-A153 VanDerWaalsContact OE1-N 3.09Å; D149-A153 WeakPolarHBondContact O-CB 3.24Å; D149-A153 PolarHBondContact O-N 3.42Å; T150-A153 PolarHBondContact O-N 2.84Å; A153-T156 PolarHBondContact O-N 3.37Å; A153-F157 VanDerWaalsContact O-CB 3.31Å; A153-F157 WeakPolarHBondContact O-CB 3.36Å; A153-F157 PolarHBondContact O-N 3.47Å; A153-L171 HydrophobicContact CB-CD2 3.84Å
154	C	98.4	Very high	96.6	Very high	6 Å²	6	49.5 Å²	49.5	4%	0.041	27%	0.265	C	S	.	.	H	α-helix	trans	-62.8	-43.1	175.8	-65.4	0	0	0	0	111.8	I62 T150 P151 N152 N158	I62-C154 HydrophobicContact CB-CB 4.41Å; I62-C154 HydrophobicContact CD1-CB 4.15Å; I62-C154 HydrophobicContact CG2-CB 4.15Å; T150-C154 PolarHBondContact O-N 2.99Å; T150-C154 PolarHBondContact O-SG 3.4Å; P151-C154 PolarHBondContact O-N 3.41Å; N152-C154 VanDerWaalsContact C-N 3.31Å; N152-C154 PolarHBondContact O-N 3.45Å; C154-N158 WeakPolarHBondContact O-CB 3.42Å; C154-N158 PolarHBondContact O-N 3.41Å; C154-N158 PolarHBondContact O-ND2 2.87Å
155	A	98	Very high	96.4	Very high	58 Å²	58	52.2 Å²	52.2	48%	0.479	26%	0.264	S	S	.	.	H	α-helix	trans	-66	-43.7	177.7	0	0	0	0	0	112	P151 N152 N158 F159	P151-A155 PolarHBondContact O-N 2.7Å; N152-A155 PolarHBondContact O-N 3.38Å; N152-A155 VanDerWaalsContact O-N 3.15Å; A155-N158 PolarHBondContact O-N 2.89Å; A155-F159 WeakPolarHBondContact O-CB 3.34Å; A155-F159 PolarHBondContact O-N 3.37Å
156	T	98.3	Very high	96.1	Very high	36 Å²	36	54.1 Å²	54.1	22%	0.221	27%	0.273	C	S	.	.	H	α-helix	trans	-64.8	-44	178.3	-62.8	0	0	0	0	111.4	V120 Q148 N152 A153 F159 L160	V120-T156 HydrophobicContact CG1-CG2 4.32Å; V120-T156 HydrophobicContact CG2-CG2 4.12Å; Q148-T156 PolarHBondContact NE2-OG1 2.94Å; Q148-T156 PolarHBondContact OE1-OG1 3.29Å; N152-T156 WeakPolarHBondContact O-CB 3.48Å; N152-T156 PolarHBondContact O-N 2.6Å; N152-T156 PolarHBondContact O-OG1 2.99Å; N152-T156 VanDerWaalsContact O-OG1 3.13Å; A153-T156 PolarHBondContact O-N 3.37Å; T156-F159 PolarHBondContact O-N 3.01Å; T156-L160 HydrophobicContact CG2-CD1 3.91Å; T156-L160 HydrophobicContact CG2-CG 4.48Å; T156-L160 WeakPolarHBondContact O-CB 3.38Å; T156-L160 VanDerWaalsContact O-CG 3.3Å; T156-L160 WeakPolarHBondContact O-CG 3.37Å; T156-L160 PolarHBondContact O-N 3.44Å
157	F	97.9	Very high	96	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59.1	-51.4	173.1	172.3	-94.2	0	0	0	111.7	I60 I62 V83 P85 A153 F159 L160 N161 V167 A169	I60-F157 WeakPolarHBondContact O-CE1 3.43Å; I62-F157 HydrophobicContact CD1-CB 4.38Å; I62-F157 HydrophobicContact CD1-CD1 3.5Å; I62-F157 HydrophobicContact CD1-CE1 4.14Å; I62-F157 HydrophobicContact CD1-CG 4.14Å; I62-F157 HydrophobicContact CG1-CD1 4.03Å; I62-F157 HydrophobicContact CG1-CE1 4.28Å; V83-F157 HydrophobicContact CB-CE2 4.35Å; V83-F157 HydrophobicContact CB-CZ 4.17Å; V83-F157 HydrophobicContact CG1-CE1 3.85Å; V83-F157 HydrophobicContact CG1-CE2 4.01Å; V83-F157 HydrophobicContact CG1-CZ 3.39Å; P85-F157 HydrophobicContact CG-CE2 4.39Å; P85-F157 HydrophobicContact CG-CZ 3.92Å; A153-F157 VanDerWaalsContact O-CB 3.31Å; A153-F157 WeakPolarHBondContact O-CB 3.36Å; A153-F157 PolarHBondContact O-N 3.47Å; F157-F159 VanDerWaalsContact C-N 3.31Å; F157-F159 PolarHBondContact O-N 3.35Å; F157-L160 PolarHBondContact O-N 2.97Å; F157-N161 HydrophobicContact CE1-CB 4.38Å; F157-N161 HydrophobicContact CZ-CB 4.3Å; F157-N161 VanDerWaalsContact O-CB 3.24Å; F157-N161 WeakPolarHBondContact O-CB 3.49Å; F157-N161 PolarHBondContact O-N 2.92Å; F157-V167 HydrophobicContact CD2-CG1 4.02Å; F157-V167 HydrophobicContact CD2-CG2 4Å; F157-V167 HydrophobicContact CE2-CG1 3.93Å; F157-A169 HydrophobicContact CB-CB 4.16Å; F157-A169 HydrophobicContact CD2-CB 3.58Å; F157-A169 HydrophobicContact CE2-CB 4.25Å; F157-A169 HydrophobicContact CG-CB 3.95Å
158	N	96.9	Very high	95.9	Very high	36 Å²	36	47.9 Å²	47.9	19%	0.193	24%	0.242	C	C	.	.	H	α-helix	trans	-58	-43.1	180	-76.1	-14.3	0	0	0	111.8	L61 I62 C154 A155 S162	L61-N158 HydrophobicContact CD2-CB 4.06Å; I62-N158 PolarHBondContact N-OD1 2.84Å; I62-N158 PolarHBondContact O-ND2 2.73Å; C154-N158 WeakPolarHBondContact O-CB 3.42Å; C154-N158 PolarHBondContact O-N 3.41Å; C154-N158 PolarHBondContact O-ND2 2.87Å; A155-N158 PolarHBondContact O-N 2.89Å; N158-S162 WeakPolarHBondContact O-CB 3.45Å; N158-S162 PolarHBondContact O-N 2.81Å; N158-S162 PolarHBondContact O-OG 3.45Å
159	F	96.6	Very high	95.8	Very high	123 Å²	123	46 Å²	46	54%	0.539	23%	0.233	S	C	.	.	H	α-helix	trans	-60.7	-56.5	176.1	175.2	-105.3	0	0	0	111.4	A155 T156 F157 N161 S162 E163	A155-F159 WeakPolarHBondContact O-CB 3.34Å; A155-F159 PolarHBondContact O-N 3.37Å; T156-F159 PolarHBondContact O-N 3.01Å; F157-F159 VanDerWaalsContact C-N 3.31Å; F157-F159 PolarHBondContact O-N 3.35Å; F159-N161 VanDerWaalsContact C-N 3.29Å; F159-N161 PolarHBondContact O-N 2.91Å; F159-S162 PolarHBondContact O-N 3.19Å; F159-S162 VanDerWaalsContact O-N 3.1Å; F159-S162 PolarHBondContact O-OG 2.89Å; F159-E163 HydrophobicContact CE1-CG 4.31Å; F159-E163 HydrophobicContact CE2-CG 4.05Å; F159-E163 HydrophobicContact CZ-CG 3.94Å; F159-E163 PolarHBondContact O-N 3.41Å
160	L	95.1	Very high	95.8	Very high	25 Å²	25	44.6 Å²	44.6	13%	0.131	23%	0.226	C	C	.	.	H	α-helix	trans	-59.1	-38.1	-179.3	-69.2	172	0	0	0	112.8	I118 V120 T156 F157 E163 R164 R165 V167	I118-L160 HydrophobicContact CD1-CD1 4.06Å; I118-L160 HydrophobicContact CD1-CD2 4.04Å; I118-L160 HydrophobicContact CG2-CD1 3.98Å; V120-L160 HydrophobicContact CG2-CD1 4.11Å; T156-L160 HydrophobicContact CG2-CD1 3.91Å; T156-L160 HydrophobicContact CG2-CG 4.48Å; T156-L160 WeakPolarHBondContact O-CB 3.38Å; T156-L160 VanDerWaalsContact O-CG 3.3Å; T156-L160 WeakPolarHBondContact O-CG 3.37Å; T156-L160 PolarHBondContact O-N 3.44Å; F157-L160 PolarHBondContact O-N 2.97Å; L160-E163 CarbonylContact O-C 3.57Å; L160-E163 PolarHBondContact O-N 2.92Å; L160-R164 PolarHBondContact O-N 2.95Å; L160-R165 HydrophobicContact CB-CB 4.29Å; L160-R165 HydrophobicContact CD2-CG 4.13Å; L160-R165 WeakPolarHBondContact O-CB 3.44Å; L160-R165 PolarHBondContact O-N 2.83Å; L160-V167 HydrophobicContact CB-CB 4.01Å; L160-V167 HydrophobicContact CB-CG1 3.89Å; L160-V167 HydrophobicContact CB-CG2 4.02Å; L160-V167 HydrophobicContact CD1-CG2 3.83Å
161	N	93.4	Very high	95.8	Very high	13 Å²	13	44.6 Å²	44.6	7%	0.07	23%	0.226	C	C	.	.	H	α-helix	trans	-71.7	-34.7	177.8	-176	55.8	0	0	0	112.4	G59 I60 F157 F159 E163 R164 V167	G59-N161 PolarHBondContact O-ND2 3.31Å; I60-N161 PolarHBondContact N-ND2 2.97Å; I60-N161 PolarHBondContact O-ND2 3.44Å; F157-N161 HydrophobicContact CE1-CB 4.38Å; F157-N161 HydrophobicContact CZ-CB 4.3Å; F157-N161 VanDerWaalsContact O-CB 3.24Å; F157-N161 WeakPolarHBondContact O-CB 3.49Å; F157-N161 PolarHBondContact O-N 2.92Å; F159-N161 VanDerWaalsContact C-N 3.29Å; F159-N161 PolarHBondContact O-N 2.91Å; N161-E163 VanDerWaalsContact C-N 3.35Å; N161-R164 PolarHBondContact O-N 3.48Å; N161-R164 VanDerWaalsContact O-N 3.16Å; N161-V167 HydrophobicContact CB-CG1 3.84Å
162	S	92.3	Very high	95.9	Very high	56 Å²	56	43.4 Å²	43.4	39%	0.392	22%	0.217	S	C	.	.	H	α-helix	trans	-64.6	-39.6	171.9	74.9	0	0	0	0	111.9	N158 F159 R164	N158-S162 WeakPolarHBondContact O-CB 3.45Å; N158-S162 PolarHBondContact O-N 2.81Å; N158-S162 PolarHBondContact O-OG 3.45Å; F159-S162 PolarHBondContact O-N 3.19Å; F159-S162 VanDerWaalsContact O-N 3.1Å; F159-S162 PolarHBondContact O-OG 2.89Å; S162-R164 PolarHBondContact O-N 2.99Å; S162-R164 VanDerWaalsContact O-N 3.13Å; S162-R164 PolarHBondContact O-NH1 2.89Å
163	E	93.3	Very high	95.8	Very high	119 Å²	119	39.9 Å²	39.9	56%	0.556	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.4	8.6	171.9	-68.6	-63.1	148.8	0	0	114.3	F159 L160 N161 R165	F159-E163 HydrophobicContact CE1-CG 4.31Å; F159-E163 HydrophobicContact CE2-CG 4.05Å; F159-E163 HydrophobicContact CZ-CG 3.94Å; F159-E163 PolarHBondContact O-N 3.41Å; L160-E163 CarbonylContact O-C 3.57Å; L160-E163 PolarHBondContact O-N 2.92Å; N161-E163 VanDerWaalsContact C-N 3.35Å; E163-R165 HydrophobicContact CB-CG 4.42Å; E163-R165 PolarHBondContact O-N 3.44Å; E163-R165 VanDerWaalsContact O-N 3.11Å
164	R	89.8	Confident	95.7	Very high	145 Å²	145	40.6 Å²	40.6	55%	0.547	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	25.9	179.9	-54.1	-62.9	-173.6	-109.4	-10.1	114.5	H57 L160 N161 S162	H57-R164 VanDerWaalsContact O-CZ 3.22Å; H57-R164 PolarHBondContact O-NH1 3.02Å; H57-R164 PolarHBondContact O-NH2 3.38Å; L160-R164 PolarHBondContact O-N 2.95Å; N161-R164 PolarHBondContact O-N 3.48Å; N161-R164 VanDerWaalsContact O-N 3.16Å; S162-R164 PolarHBondContact O-N 2.99Å; S162-R164 VanDerWaalsContact O-N 3.13Å; S162-R164 PolarHBondContact O-NH1 2.89Å
165	R	91.9	Very high	95.3	Very high	110 Å²	110	44.5 Å²	44.5	42%	0.415	23%	0.231	S	C	.	.			trans	-69.2	147.7	169.5	-65.1	-58.3	-53.5	-94.2	1.1	109.9	E117 L160 E163 V167	E117-R165 IonicContact OE2-CZ 3.61Å; E117-R165 IonicContact OE2-NE 3.65Å; E117-R165 IonicContact OE2-NH2 2.72Å; E117-R165 PolarHBondContact OE2-NH2 2.88Å; L160-R165 HydrophobicContact CB-CB 4.29Å; L160-R165 HydrophobicContact CD2-CG 4.13Å; L160-R165 WeakPolarHBondContact O-CB 3.44Å; L160-R165 PolarHBondContact O-N 2.83Å; E163-R165 HydrophobicContact CB-CG 4.42Å; E163-R165 PolarHBondContact O-N 3.44Å; E163-R165 VanDerWaalsContact O-N 3.11Å; R165-V167 VanDerWaalsContact C-N 3.28Å; R165-V167 PolarHBondContact O-N 3.03Å
166	L	91.4	Very high	94.5	Very high	80 Å²	80	50.3 Å²	50.3	42%	0.419	24%	0.242	S	C	.	.			trans	-72.2	87.2	168.4	-61.2	178.5	0	0	0	108.2	S116 E117 I118	S116-L166 CarbonylContact C-O 3.53Å; S116-L166 WeakPolarHBondContact CA-O 3.3Å; E117-L166 HydrophobicContact CB-CB 4.31Å; E117-L166 HydrophobicContact CG-CB 4.02Å; E117-L166 HydrophobicContact CG-CD1 4.13Å; E117-L166 PolarHBondContact N-O 3.19Å; I118-L166 PolarHBondContact N-O 2.91Å; I118-L166 VanDerWaalsContact N-O 3.11Å
167	V	94.4	Very high	92.8	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.024	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	137.2	-175.6	66.1	0	0	0	0	111.4	P85 I118 V120 F157 L160 N161 R165	P85-V167 WeakPolarHBondContact CD-O 3.42Å; I118-V167 HydrophobicContact CB-CG2 4.21Å; I118-V167 HydrophobicContact CG2-CG2 4.32Å; I118-V167 CarbonylContact O-C 3.5Å; I118-V167 WeakPolarHBondContact O-CA 3.48Å; V120-V167 HydrophobicContact CG2-CG2 3.91Å; F157-V167 HydrophobicContact CD2-CG1 4.02Å; F157-V167 HydrophobicContact CD2-CG2 4Å; F157-V167 HydrophobicContact CE2-CG1 3.93Å; L160-V167 HydrophobicContact CB-CB 4.01Å; L160-V167 HydrophobicContact CB-CG1 3.89Å; L160-V167 HydrophobicContact CB-CG2 4.02Å; L160-V167 HydrophobicContact CD1-CG2 3.83Å; N161-V167 HydrophobicContact CB-CG1 3.84Å; R165-V167 VanDerWaalsContact C-N 3.28Å; R165-V167 PolarHBondContact O-N 3.03Å
168	A	96.1	Very high	90.6	Very high	1 Å²	1	62.7 Å²	62.7	1%	0.008	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	159.1	167	0	0	0	0	0	110.1	V83 M84 F107 I118 L119 V120	V83-A168 CarbonylContact O-C 3.53Å; V83-A168 VanDerWaalsContact O-CA 3.27Å; V83-A168 WeakPolarHBondContact O-CA 3.47Å; M84-A168 HydrophobicContact CG-CB 3.73Å; F107-A168 HydrophobicContact CD1-CB 3.8Å; F107-A168 HydrophobicContact CE1-CB 4.21Å; I118-A168 PolarHBondContact O-N 3.13Å; L119-A168 WeakPolarHBondContact CA-O 3.46Å; L119-A168 HydrophobicContact CD1-CB 4.04Å; V120-A168 PolarHBondContact N-O 2.94Å
169	A	97.6	Very high	88.3	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	137.4	170.7	0	0	0	0	0	112.4	A82 V83 F107 V120 F157 L171	A82-A169 CarbonylContact C-O 3.56Å; A82-A169 WeakPolarHBondContact CA-O 3.42Å; V83-A169 HydrophobicContact CB-CB 4.39Å; V83-A169 PolarHBondContact N-O 3.11Å; V83-A169 PolarHBondContact O-N 2.79Å; F107-A169 WeakPolarHBondContact CE1-O 3.43Å; V120-A169 HydrophobicContact CB-CB 4.43Å; V120-A169 CarbonylContact O-C 3.6Å; V120-A169 WeakPolarHBondContact O-CA 3.49Å; F157-A169 HydrophobicContact CB-CB 4.16Å; F157-A169 HydrophobicContact CD2-CB 3.58Å; F157-A169 HydrophobicContact CE2-CB 4.25Å; F157-A169 HydrophobicContact CG-CB 3.95Å; A169-L171 HydrophobicContact CB-CD1 4.19Å; A169-L171 HydrophobicContact CB-CD2 4.07Å; A169-L171 HydrophobicContact CB-CG 3.95Å
170	G	97.9	Very high	86.2	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	115.4	166	0	0	0	0	0	108.9	W91 V120 L121 G122	W91-G170 VanDerWaalsContact CZ3-C 3.47Å; V120-G170 PolarHBondContact O-N 3.25Å; L121-G170 CarbonylContact C-O 3.56Å; L121-G170 WeakPolarHBondContact CA-O 3.46Å; G122-G170 PolarHBondContact N-O 3.46Å
171	L	98.4	Very high	84	Confident	0 Å²	0	73.2 Å²	73.2	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	122.9	-166	-58.1	172.6	0	0	0	111.3	I62 F70 P80 C81 V83 A153 A169	I62-L171 HydrophobicContact CD1-CD1 3.48Å; I62-L171 VanDerWaalsContact CD1-CD1 3.48Å; F70-L171 HydrophobicContact CD1-CD1 4.48Å; F70-L171 HydrophobicContact CE1-CB 4.08Å; F70-L171 HydrophobicContact CE1-CD1 4.23Å; F70-L171 HydrophobicContact CE2-CB 3.88Å; F70-L171 HydrophobicContact CZ-CB 3.51Å; F70-L171 HydrophobicContact CZ-CD1 4.45Å; P80-L171 CarbonylContact C-O 3.42Å; P80-L171 WeakPolarHBondContact CA-O 3.44Å; P80-L171 WeakPolarHBondContact CB-O 3.45Å; C81-L171 PolarHBondContact N-O 2.88Å; C81-L171 PolarHBondContact O-N 3.02Å; V83-L171 HydrophobicContact CG2-CD1 4.17Å; A153-L171 HydrophobicContact CB-CD2 3.84Å; A169-L171 HydrophobicContact CB-CD1 4.19Å; A169-L171 HydrophobicContact CB-CD2 4.07Å; A169-L171 HydrophobicContact CB-CG 3.95Å
172	I	98.2	Very high	82	Confident	13 Å²	13	79.3 Å²	79.3	7%	0.067	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	130.4	168.8	-58.5	177.2	0	0	0	107.7	P80 W91 V93 S95 I99 G122 T150	P80-I172 HydrophobicContact CB-CG1 4.38Å; P80-I172 HydrophobicContact CG-CG2 4.34Å; W91-I172 HydrophobicContact CZ3-CG1 4.11Å; V93-I172 HydrophobicContact CG2-CD1 4.22Å; V93-I172 HydrophobicContact CG2-CG1 4.03Å; S95-I172 VanDerWaalsContact C-CD1 3.44Å; S95-I172 WeakPolarHBondContact O-CD1 3.1Å; I99-I172 HydrophobicContact CD1-CD1 4.27Å; G122-I172 PolarHBondContact O-N 3.05Å; T150-I172 WeakPolarHBondContact CB-O 3.4Å; T150-I172 WeakPolarHBondContact CG2-O 3.47Å; T150-I172 PolarHBondContact OG1-O 2.58Å
173	P	97.7	Very high	79.8	Confident	13 Å²	13	85.6 Å²	85.6	8%	0.084	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-61.1	142.5	178.7	-18.7	31	0	0	0	111	S66 F70 G79 S175	S66-P173 WeakPolarHBondContact O-CB 3.33Å; F70-P173 HydrophobicContact CE2-CB 4.39Å; F70-P173 HydrophobicContact CE2-CG 3.85Å; F70-P173 HydrophobicContact CZ-CB 4.41Å; F70-P173 HydrophobicContact CZ-CG 4.3Å; G79-P173 VanDerWaalsContact C-CG 3.43Å; G79-P173 WeakPolarHBondContact O-CG 3.36Å; P173-S175 PolarHBondContact O-N 2.85Å
174	P	95.8	Very high	77.4	Confident	15 Å²	15	89.1 Å²	89.1	10%	0.097	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-69.5	127.9	176.5	28.8	-32.5	0	0	0	110.4	Y65 P67 S125	Y65-P174 HydrophobicContact CD2-CG 3.56Å; Y65-P174 HydrophobicContact CE2-CG 4.06Å; Y65-P174 HydrophobicContact CG-CG 4.42Å; P67-P174 VanDerWaalsContact CA-O 3.24Å; P67-P174 WeakPolarHBondContact CA-O 3.43Å; P67-P174 WeakPolarHBondContact CB-O 3.43Å; P67-P174 WeakPolarHBondContact CG-O 3.39Å; S125-P174 WeakPolarHBondContact OG-CA 3.15Å
175	S	89.9	Confident	75.2	Confident	87 Å²	87	88.7 Å²	88.7	61%	0.608	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-57.4	153.2	170	-57.3	0	0	0	0	111.9	S125 P173 S177	S125-S175 PolarHBondContact OG-N 3.38Å; S125-S175 PolarHBondContact OG-O 3.02Å; P173-S175 PolarHBondContact O-N 2.85Å; S175-S177 PolarHBondContact O-N 3.1Å
176	Y	81.8	Confident	73.1	Confident	181 Å²	181	92.9 Å²	92.9	71%	0.71	47%	0.474	S	S	*	.			trans	-54.6	110.6	173.1	-74.1	-86	0	0	0	111.7	P67 R178	P67-Y176 HydrophobicContact CB-CD2 3.67Å; P67-Y176 HydrophobicContact CB-CE1 4.39Å; P67-Y176 HydrophobicContact CB-CE2 3.46Å; P67-Y176 VanDerWaalsContact CB-CE2 3.46Å; P67-Y176 HydrophobicContact CB-CG 4.22Å; P67-Y176 HydrophobicContact CG-CD1 3.85Å; P67-Y176 HydrophobicContact CG-CD2 3.83Å; P67-Y176 HydrophobicContact CG-CE1 3.83Å; P67-Y176 HydrophobicContact CG-CE2 3.8Å; P67-Y176 HydrophobicContact CG-CG 3.85Å; Y176-R178 PolarHBondContact O-N 2.76Å; Y176-R178 VanDerWaalsContact O-N 3.1Å
177	S	62.3	Low	71.1	Confident	84 Å²	84	94.2 Å²	94.2	59%	0.587	49%	0.49	S	S	*	.			trans	-71.8	99.9	169.4	-65	0	0	0	0	109.8	S175 A179	S175-S177 PolarHBondContact O-N 3.1Å; S177-A179 PolarHBondContact O-N 3.18Å
178	R	51.3	Low	68.7	Low	211 Å²	211	97.3 Å²	97.3	80%	0.796	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-65.4	-2.4	176.3	-150.2	176.9	-165.7	142.9	4.7	114.1	Y176 L180	Y176-R178 PolarHBondContact O-N 2.76Å; Y176-R178 VanDerWaalsContact O-N 3.1Å; R178-L180 PolarHBondContact O-N 3.24Å
179	A	49.4	Very low	66.7	Low	92 Å²	92	104.2 Å²	104.2	76%	0.76	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-77.7	7.3	-175.6	0	0	0	0	0	115.3	S177	S177-A179 PolarHBondContact O-N 3.18Å
180	L	51.3	Low	64.6	Low	163 Å²	163	109.6 Å²	109.6	85%	0.853	60%	0.597	S	S	*	*	G	3₁₀ helix	trans	-102.7	1.6	174.9	-65.7	179.3	0	0	0	113.7	R178	R178-L180 PolarHBondContact O-N 3.24Å
181	E	50.6	Low	62.3	Low	151 Å²	151	122.7 Å²	122.7	71%	0.706	65%	0.654	S	S	*	*			trans	-93.3	98	165.7	-70.4	177.7	167.3	0	0	109.3
182	V	51.1	Low	60.5	Low	141 Å²	141	128.9 Å²	128.9	86%	0.855	69%	0.686	S	S	*	*			trans	160.7	96.3	146.6	160.2	0	0	0	0	108.9
183	K	45.1	Very low	58.5	Low	188 Å²	188	134.9 Å²	134.9	82%	0.817	72%	0.719	S	S	*	*			trans	-178.3	75.8	142.7	-102.6	-177.6	-179.8	-171.4	0	107.7
184	Q	42.7	Very low	56.3	Low	193 Å²	193	141.7 Å²	141.7	90%	0.902	75%	0.754	S	S	*	*			trans	-96.3	130.1	149.5	-79.6	-176.1	-22.6	0	0	106	E186	Q184-E186 PolarHBondContact O-N 3.38Å
185	D	44.3	Very low	54	Low	136 Å²	136	149.2 Å²	149.2	73%	0.727	79%	0.793	S	S	*	*			trans	-74.2	118.6	-170.1	-56.2	-67.5	0	0	0	110.9	S187	D185-S187 PolarHBondContact O-N 2.99Å
186	E	48.5	Very low	51.7	Low	198 Å²	198	153.1 Å²	153.1	93%	0.925	81%	0.805	S	S	*	*			trans	-76.8	73.3	158.9	-71.4	-156.3	145.8	0	0	109.5	Q184 G188	Q184-E186 PolarHBondContact O-N 3.38Å; E186-G188 PolarHBondContact O-N 3.04Å
187	S	48.5	Very low	49.7	Very low	108 Å²	108	151.2 Å²	151.2	76%	0.755	81%	0.811	S	S	*	*			trans	-83.3	61.9	156.6	46.9	0	0	0	0	109.6	D185 D189	D185-S187 PolarHBondContact O-N 2.99Å; S187-D189 PolarHBondContact O-N 3.19Å
188	G	45.3	Very low	48.8	Very low	69 Å²	69	156 Å²	156	71%	0.711	83%	0.827	S	S	*	*			trans	-68.5	96.1	173.6	0	0	0	0	0	111.1	E186 S190	E186-G188 PolarHBondContact O-N 3.04Å; G188-S190 PolarHBondContact O-N 3.49Å
189	D	52.6	Low	48.6	Very low	146 Å²	146	151.8 Å²	151.8	78%	0.781	83%	0.829	S	S	*	*			trans	-53	132.2	165.8	179.8	32.2	0	0	0	110.4	S187	S187-D189 PolarHBondContact O-N 3.19Å
190	S	53.7	Low	48.6	Very low	113 Å²	113	156.8 Å²	156.8	79%	0.79	84%	0.835	S	S	*	*			trans	-154.8	124.4	171.2	-79.5	0	0	0	0	110.4	G188	G188-S190 PolarHBondContact O-N 3.49Å
191	K	49.2	Very low	48.3	Very low	275 Å²	275	156.2 Å²	156.2	100%	1.196	83%	0.833	S	S	*	*			trans	-64.9	0	-176.5	-69.6	169.6	173	171.1	0	114.3

Retrieved 191 of 191 residues in 115.3 ms (Link to these results)

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