A0A087XJ33_POEFO Loading...

Tubulin folding cofactor E-like a

AlphaFold DB , UniProt , Accession A0A087XJ33, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 477 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34	Very low	31	Very low	237 Å²	237	154.2 Å²	154.2	100%	1.167	83%	0.826	S	S	*	*				0	133.4	0	-136	177.8	-148.4	0	0	106.9
2	I	33.8	Very low	30.7	Very low	153 Å²	153	148 Å²	148	79%	0.785	83%	0.826	S	S	*	*			trans	85.9	93.4	168.9	-46.4	178.6	0	0	0	116.2
3	I	30.3	Very low	30.7	Very low	145 Å²	145	147 Å²	147	74%	0.744	83%	0.826	S	S	*	*			trans	-61.5	145.6	152.6	-66.1	161.4	0	0	0	109
4	S	30.9	Very low	30.6	Very low	114 Å²	114	144.6 Å²	144.6	80%	0.797	82%	0.823	S	S	*	*			trans	-142.5	118	154.5	32.4	0	0	0	0	110.1
5	D	32.5	Very low	30.5	Very low	140 Å²	140	144.9 Å²	144.9	75%	0.749	82%	0.821	S	S	*	*			trans	-66.1	155.7	164.7	-67	-52.6	0	0	0	111
6	I	33.4	Very low	30.6	Very low	176 Å²	176	151.2 Å²	151.2	90%	0.903	83%	0.828	S	S	*	*			trans	-156.1	137.5	138.9	-93.6	144.8	0	0	0	109.7
7	N	29.2	Very low	30.5	Very low	132 Å²	132	148.5 Å²	148.5	71%	0.706	82%	0.822	S	S	*	*			trans	-79.9	174.3	-179.7	-87.6	-42	0	0	0	114.8
8	H	29.8	Very low	30.6	Very low	168 Å²	168	147.4 Å²	147.4	78%	0.778	82%	0.823	S	S	*	*			trans	90.7	140.6	153.8	-67.5	-28.9	0	0	0	115.7
9	T	29.3	Very low	30.5	Very low	126 Å²	126	146.6 Å²	146.6	77%	0.773	82%	0.822	S	S	*	*			cis	-170.4	163.7	7.3	12	0	0	0	0	109.5
10	H	28.5	Very low	30.3	Very low	188 Å²	188	148.5 Å²	148.5	87%	0.87	82%	0.824	S	S	*	*			trans	-39.8	142.7	173	-83.1	-63.4	0	0	0	119.4
11	S	29.5	Very low	30.3	Very low	117 Å²	117	151 Å²	151	82%	0.818	83%	0.826	S	S	*	*				-179.2	124.8	126.2	45.9	0	0	0	0	106.9
12	G	27.7	Very low	29.9	Very low	80 Å²	80	148.1 Å²	148.1	83%	0.825	81%	0.81	S	S	*	*				108.1	69.7	60.3	0	0	0	0	0	107.9
13	V	30.4	Very low	29.6	Very low	135 Å²	135	150.1 Å²	150.1	82%	0.818	82%	0.816	S	S	*	*			trans	-107.8	118.7	173.9	178.2	0	0	0	0	108.4	D15	V13-D15 PolarHBondContact O-N 3.24Å
14	S	29	Very low	29.4	Very low	113 Å²	113	152.3 Å²	152.3	79%	0.79	82%	0.823	S	S	*	*			trans	-79.3	103.8	175.8	50.6	0	0	0	0	110.3
15	D	29.7	Very low	29.1	Very low	149 Å²	149	153.8 Å²	153.8	80%	0.797	83%	0.827	S	S	*	*			trans	-82.3	123.2	165.4	-101.7	-31.7	0	0	0	109.9	V13	V13-D15 PolarHBondContact O-N 3.24Å
16	R	31.2	Very low	28.9	Very low	246 Å²	246	152 Å²	152	93%	0.928	83%	0.833	S	S	*	*			trans	-101	106.8	165.7	-83.5	-172	177.3	-171.5	0.7	108.9
17	S	29	Very low	28.4	Very low	105 Å²	105	151.4 Å²	151.4	73%	0.734	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-76.8	147	168	-26.5	0	0	0	0	110.6
18	P	31.9	Very low	28.2	Very low	129 Å²	129	151.2 Å²	151.2	84%	0.838	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-85	144.7	168.8	1.1	17.2	0	0	0	112
19	V	29.7	Very low	28	Very low	133 Å²	133	146.2 Å²	146.2	81%	0.806	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-68.1	127.1	-172.3	170.6	0	0	0	0	112.8
20	Q	26.5	Very low	27.9	Very low	184 Å²	184	149.7 Å²	149.7	86%	0.86	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-70.6	133	162.9	-75.5	173.7	-27.7	0	0	110.6
21	K	29.3	Very low	27.9	Very low	200 Å²	200	148.6 Å²	148.6	87%	0.87	84%	0.838	S	S	*	*			trans	-109.2	115.2	160.2	-84.4	-175.1	177.7	178.7	0	109.4
22	Q	25.6	Very low	27.9	Very low	178 Å²	178	152 Å²	152	83%	0.832	84%	0.839	S	S	*	*			trans	-65.3	136.9	167.7	-69.1	170.4	-14.8	0	0	110.1
23	H	27.7	Very low	27.9	Very low	195 Å²	195	154.3 Å²	154.3	90%	0.903	84%	0.839	S	S	*	*			trans	-129.4	131	153.8	-100.3	33.4	0	0	0	109.5
24	Q	27.5	Very low	27.7	Very low	191 Å²	191	154.6 Å²	154.6	89%	0.893	84%	0.836	S	S	*	*			trans	-72.5	148.2	-172.9	-79	166	-22.9	0	0	112.1
25	T	24.4	Very low	27.7	Very low	144 Å²	144	155.3 Å²	155.3	88%	0.883	84%	0.836	S	S	*	*			trans	-67.6	140.4	166	39.5	0	0	0	0	111.6
26	A	26.7	Very low	27.4	Very low	104 Å²	104	151.8 Å²	151.8	86%	0.86	83%	0.834	S	S	*	*			trans	-143.2	120.4	157.1	0	0	0	0	0	109
27	D	24	Very low	27.3	Very low	163 Å²	163	146.2 Å²	146.2	87%	0.872	83%	0.833	S	S	*	*			trans	-88.6	137.5	171.8	-177.7	16.4	0	0	0	108.6
28	C	25.1	Very low	27.2	Very low	127 Å²	127	146 Å²	146	86%	0.858	84%	0.837	S	S	*	*			trans	169.6	138.7	134.9	-152.8	0	0	0	0	111.6
29	G	26	Very low	27	Very low	64 Å²	64	149.3 Å²	149.3	66%	0.66	84%	0.842	S	S	*	*			trans	119.2	88	137.7	0	0	0	0	0	117.7
30	H	26.7	Very low	27	Very low	199 Å²	199	152.3 Å²	152.3	92%	0.921	85%	0.847	S	S	*	*			trans	-62.6	123.6	156.4	-81.6	15.4	0	0	0	111.7
31	I	28.2	Very low	27	Very low	164 Å²	164	152.6 Å²	152.6	84%	0.841	85%	0.849	S	S	*	*			trans	-144.6	120	156.6	-58.9	-177.1	0	0	0	109.2
32	K	29.6	Very low	26.9	Very low	189 Å²	189	148 Å²	148	82%	0.822	85%	0.848	S	S	*	*			trans	-65.8	157.6	166.7	-78.6	-178.9	171.4	-175.5	0	111.1
33	P	28.3	Very low	26.9	Very low	129 Å²	129	144 Å²	144	84%	0.838	85%	0.846	S	S	*	*			trans	-132	151.5	130.6	30.7	-15.9	0	0	0	113.8
34	D	24.8	Very low	27.1	Very low	140 Å²	140	141.4 Å²	141.4	75%	0.749	84%	0.843	S	S	*	*			trans	-81.1	150.2	-179.1	-111.4	-28.2	0	0	0	113
35	T	28.9	Very low	27	Very low	129 Å²	129	141.3 Å²	141.3	79%	0.791	84%	0.842	S	S	*	*			trans	59.1	118.8	144.8	60.9	0	0	0	0	121.6
36	G	25	Very low	27.4	Very low	74 Å²	74	142.8 Å²	142.8	76%	0.763	84%	0.839	S	S	*	*				109.4	99	115.7	0	0	0	0	0	117.8
37	S	28	Very low	27.6	Very low	129 Å²	129	143.2 Å²	143.2	90%	0.902	84%	0.836	S	S	*	*				-174.9	131.2	125.7	25.4	0	0	0	0	109.6
38	A	27.6	Very low	28.1	Very low	100 Å²	100	141.9 Å²	141.9	83%	0.826	83%	0.833	S	S	*	*			trans	-80.3	134.1	-176.9	0	0	0	0	0	110.8
39	E	27.9	Very low	28.7	Very low	199 Å²	199	141.3 Å²	141.3	93%	0.93	82%	0.82	S	S	*	*			trans	-127.7	134.4	152.1	-75.8	-172.8	160.5	0	0	107.8
40	E	28.8	Very low	29.2	Very low	197 Å²	197	146.6 Å²	146.6	92%	0.921	83%	0.827	S	S	*	*			trans	-98.7	100.6	-156.3	-167.4	174.2	-161.8	0	0	108.7
41	E	27.1	Very low	29.8	Very low	190 Å²	190	142 Å²	142	89%	0.888	82%	0.815	S	S	*	*			trans	-103.1	117	167.9	-90.5	-170.7	157.9	0	0	109.8	A43	E41-A43 PolarHBondContact O-N 3.31Å; E41-A43 VanDerWaalsContact O-N 3.09Å
42	A	28	Very low	30.4	Very low	104 Å²	104	139.1 Å²	139.1	86%	0.86	81%	0.807	S	S	*	*			trans	-68	101.6	179.5	0	0	0	0	0	111
43	A	25.2	Very low	31.1	Very low	94 Å²	94	139.6 Å²	139.6	78%	0.777	81%	0.812	S	S	*	*			trans	-76	122	168.2	0	0	0	0	0	110.4	E41 Q45	E41-A43 PolarHBondContact O-N 3.31Å; E41-A43 VanDerWaalsContact O-N 3.09Å; A43-Q45 PolarHBondContact O-N 3.26Å
44	V	30.3	Very low	31.9	Very low	139 Å²	139	140.4 Å²	140.4	84%	0.842	81%	0.809	S	S	*	*			trans	-68.2	113.7	162.2	175.5	0	0	0	0	107	E46	V44-E46 PolarHBondContact O-N 2.85Å; V44-E46 VanDerWaalsContact O-N 3.12Å
45	Q	26.2	Very low	33.1	Very low	190 Å²	190	145.8 Å²	145.8	89%	0.888	82%	0.819	S	S	*	*			trans	-77.5	94.1	-178.7	-137	168.1	-0.5	0	0	108.9	A43 S47	A43-Q45 PolarHBondContact O-N 3.26Å; Q45-S47 PolarHBondContact O-N 3.27Å
46	E	32.2	Very low	34.7	Very low	175 Å²	175	147.4 Å²	147.4	82%	0.818	82%	0.817	S	S	*	*			trans	-69.9	114.1	159.3	-79.7	-176	159.6	0	0	107.8	V44 V48	V44-E46 PolarHBondContact O-N 2.85Å; V44-E46 VanDerWaalsContact O-N 3.12Å; E46-V48 PolarHBondContact O-N 3.26Å
47	S	31.3	Very low	37.2	Very low	112 Å²	112	145.4 Å²	145.4	78%	0.783	80%	0.797	S	S	*	*			trans	-70.4	100.2	177.1	58.2	0	0	0	0	109.6	Q45 M49	Q45-S47 PolarHBondContact O-N 3.27Å; S47-M49 PolarHBondContact O-N 3.15Å; S47-M49 VanDerWaalsContact O-N 3.16Å
48	V	35.9	Very low	40.3	Very low	136 Å²	136	141.3 Å²	141.3	82%	0.824	76%	0.762	S	S	*	*			trans	-67.8	106.4	164.1	-179.5	0	0	0	0	107.1	E46 E50	E46-V48 PolarHBondContact O-N 3.26Å; V48-E50 PolarHBondContact O-N 3.24Å
49	M	37.3	Very low	43.6	Very low	115 Å²	115	136.8 Å²	136.8	57%	0.567	72%	0.724	S	S	*	*			trans	-74.9	111	176.2	-166.8	-177.7	-91.5	0	0	107.8	S47	S47-M49 PolarHBondContact O-N 3.15Å; S47-M49 VanDerWaalsContact O-N 3.16Å
50	E	35.4	Very low	46.9	Very low	175 Å²	175	127.3 Å²	127.3	82%	0.818	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-63.9	132.2	172.6	-76.2	-169.9	157.6	0	0	109.9	V48	V48-E50 PolarHBondContact O-N 3.24Å
51	P	40.3	Very low	50	Low	103 Å²	103	118.5 Å²	118.5	67%	0.669	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-76.5	136.9	-177.2	29.1	-31.7	0	0	0	110.9
52	P	40.6	Very low	53.2	Low	102 Å²	102	113.3 Å²	113.3	66%	0.662	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-68	136.1	171.3	27.8	-31.4	0	0	0	110.3	D54	P52-D54 PolarHBondContact O-N 2.8Å
53	E	44.8	Very low	56.3	Low	199 Å²	199	108.5 Å²	108.5	93%	0.93	58%	0.575	S	S	*	*			trans	-68.6	88.8	169.9	-70.8	-173.4	154.6	0	0	109.6
54	D	44.2	Very low	59.4	Low	146 Å²	146	104 Å²	104	78%	0.781	54%	0.538	S	S	*	.			trans	-141.1	140.9	164.2	-128.2	-20.9	0	0	0	112.8	P52 E56	P52-D54 PolarHBondContact O-N 2.8Å; D54-E56 PolarHBondContact O-N 2.8Å; D54-E56 VanDerWaalsContact O-N 3.1Å
55	R	49.9	Very low	62.2	Low	253 Å²	253	100 Å²	100	96%	0.955	51%	0.512	S	S	*	.	S	Bend	trans	-77.3	11.9	-163.4	-81.2	-179.2	172.3	-178.5	-1.8	115.5
56	E	62.2	Low	65.1	Low	163 Å²	163	94.6 Å²	94.6	76%	0.762	49%	0.486	S	S	*	.	S	Bend	trans	-115.3	117.1	170.1	-76.9	-176	167.8	0	0	109	D54	D54-E56 PolarHBondContact O-N 2.8Å; D54-E56 VanDerWaalsContact O-N 3.1Å
57	G	78	Confident	67.7	Low	32 Å²	32	89.7 Å²	89.7	33%	0.33	46%	0.462	S	S	.	.	P	Polyproline II helix	trans	-63.2	149.1	-178.4	0	0	0	0	0	112.7	S114 K115	G57-S114 VanDerWaalsContact C-OG 3.27Å; G57-S114 WeakPolarHBondContact CA-OG 3.43Å; G57-K115 WeakPolarHBondContact O-CE 3.31Å; G57-K115 PolarHBondContact O-NZ 3.04Å; G57-K115 VanDerWaalsContact O-NZ 3.12Å
58	R	94	Very high	70.1	Confident	44 Å²	44	85.1 Å²	85.1	17%	0.166	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	140.1	-171.1	-61.8	177.7	70.3	-174.4	11.1	111.5	E62 V63 E66 C111 I113 S114	R58-E62 WeakPolarHBondContact CA-OE2 3.45Å; R58-V63 HydrophobicContact CB-CG2 4.22Å; R58-E66 IonicContact CZ-OE1 2.84Å; R58-E66 IonicContact CZ-OE2 2.63Å; R58-E66 IonicContact NH2-OE1 3.83Å; R58-E66 PolarHBondContact NH2-OE1 2.97Å; R58-E66 IonicContact NH2-OE2 2.67Å; R58-E66 PolarHBondContact NH2-OE2 2.84Å; R58-C111 WeakPolarHBondContact CD-O 3.47Å; R58-C111 PolarHBondContact NH1-O 2.86Å; R58-I113 WeakPolarHBondContact O-CA 3.45Å; R58-S114 PolarHBondContact O-N 3.34Å
59	S	96.5	Very high	72.2	Confident	5 Å²	5	79.8 Å²	79.8	4%	0.035	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	152.7	173.8	71.5	0	0	0	0	112.5	V61 E62 V63 K115	S59-V61 PolarHBondContact O-N 2.88Å; S59-E62 WeakPolarHBondContact CB-OE1 3.48Å; S59-E62 PolarHBondContact N-OE2 2.81Å; S59-E62 PolarHBondContact O-N 3.04Å; S59-E62 WeakPolarHBondContact OG-CB 3.49Å; S59-E62 WeakPolarHBondContact OG-CG 3.34Å; S59-E62 PolarHBondContact OG-N 2.78Å; S59-E62 VanDerWaalsContact OG-N 3.09Å; S59-E62 PolarHBondContact OG-OE1 2.93Å; S59-V63 WeakPolarHBondContact O-CG2 3.4Å; S59-V63 PolarHBondContact O-N 2.79Å; S59-K115 CarbonylContact C-O 3.3Å; S59-K115 VanDerWaalsContact CA-O 3.29Å; S59-K115 WeakPolarHBondContact CA-O 3.47Å
60	F	96.6	Very high	73.6	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-57.8	-40	172.5	171.2	-85.7	0	0	0	111.2	V63 I64 L108 I113 K115 A116 I122 L132 L134 I148 I152	F60-V63 PolarHBondContact O-N 3.42Å; F60-I64 HydrophobicContact CD1-CD1 3.85Å; F60-I64 HydrophobicContact CD1-CG1 4.39Å; F60-I64 HydrophobicContact CE1-CD1 3.13Å; F60-I64 HydrophobicContact CE1-CG1 4.07Å; F60-I64 HydrophobicContact CE2-CD1 4.25Å; F60-I64 HydrophobicContact CZ-CD1 3.39Å; F60-I64 HydrophobicContact CZ-CG1 4.25Å; F60-I64 PolarHBondContact O-N 3.08Å; F60-L108 HydrophobicContact CD2-CD1 3.77Å; F60-L108 HydrophobicContact CE2-CD1 3.44Å; F60-L108 VanDerWaalsContact CE2-CD1 3.44Å; F60-L108 HydrophobicContact CZ-CD1 4.1Å; F60-I113 HydrophobicContact CB-CG2 4.01Å; F60-I113 HydrophobicContact CD2-CD1 4.23Å; F60-K115 PolarHBondContact N-O 3.43Å; F60-A116 WeakPolarHBondContact CB-O 3.36Å; F60-A116 PolarHBondContact N-O 2.99Å; F60-I122 HydrophobicContact CD1-CD1 3.91Å; F60-I122 HydrophobicContact CD1-CG1 3.79Å; F60-I122 HydrophobicContact CD1-CG2 4.39Å; F60-I122 HydrophobicContact CE1-CB 4.44Å; F60-I122 HydrophobicContact CE1-CD1 4.37Å; F60-I122 HydrophobicContact CE1-CG1 4Å; F60-I122 HydrophobicContact CE1-CG2 3.81Å; F60-L132 HydrophobicContact CE2-CD1 3.92Å; F60-L132 HydrophobicContact CE2-CD2 4.03Å; F60-L132 HydrophobicContact CZ-CD1 4.45Å; F60-L132 HydrophobicContact CZ-CD2 4.43Å; F60-L134 HydrophobicContact CD2-CD2 3.83Å; F60-L134 HydrophobicContact CE2-CD2 3.99Å; F60-I148 HydrophobicContact CB-CD1 3.87Å; F60-I148 HydrophobicContact CB-CG1 4.23Å; F60-I148 HydrophobicContact CD1-CG2 4.48Å; F60-I148 HydrophobicContact CD2-CD1 4.03Å; F60-I148 HydrophobicContact CD2-CG1 4.43Å; F60-I148 HydrophobicContact CD2-CG2 3.98Å; F60-I148 HydrophobicContact CE1-CG2 4.29Å; F60-I148 HydrophobicContact CE2-CG2 3.77Å; F60-I148 HydrophobicContact CG-CD1 4.08Å; F60-I148 HydrophobicContact CG-CG1 4.22Å; F60-I148 HydrophobicContact CG-CG2 4.32Å; F60-I148 HydrophobicContact CZ-CG2 3.93Å; F60-I152 HydrophobicContact CZ-CD1 4.36Å
61	V	94.1	Very high	75.1	Confident	11 Å²	11	74.7 Å²	74.7	7%	0.067	38%	0.376	C	S	.	.	H	α-helix	trans	-62.4	-45.7	175.7	172.3	0	0	0	0	112.1	S59 V63 I64 N65 A116 E121 I122 F125	S59-V61 PolarHBondContact O-N 2.88Å; V61-V63 PolarHBondContact O-N 3.31Å; V61-I64 PolarHBondContact O-N 2.79Å; V61-N65 WeakPolarHBondContact CG1-ND2 3.29Å; V61-N65 WeakPolarHBondContact O-CB 3.49Å; V61-N65 PolarHBondContact O-N 3.25Å; V61-N65 PolarHBondContact O-ND2 2.93Å; V61-A116 PolarHBondContact N-O 3.34Å; V61-E121 HydrophobicContact CG1-CB 4.24Å; V61-E121 WeakPolarHBondContact CG1-OE2 3.2Å; V61-E121 HydrophobicContact CG2-CB 4.26Å; V61-I122 HydrophobicContact CG2-CD1 4.19Å; V61-I122 HydrophobicContact CG2-CG1 3.52Å; V61-F125 HydrophobicContact CG1-CE2 4.41Å
62	E	93.6	Very high	76.1	Confident	81 Å²	81	74.1 Å²	74.1	38%	0.379	37%	0.367	S	S	.	.	H	α-helix	trans	-56.9	-50	174.7	-77.6	149.6	-138.8	0	0	111	R58 S59 I64 N65 E66	R58-E62 WeakPolarHBondContact CA-OE2 3.45Å; S59-E62 WeakPolarHBondContact CB-OE1 3.48Å; S59-E62 PolarHBondContact N-OE2 2.81Å; S59-E62 PolarHBondContact O-N 3.04Å; S59-E62 WeakPolarHBondContact OG-CB 3.49Å; S59-E62 WeakPolarHBondContact OG-CG 3.34Å; S59-E62 PolarHBondContact OG-N 2.78Å; S59-E62 VanDerWaalsContact OG-N 3.09Å; S59-E62 PolarHBondContact OG-OE1 2.93Å; E62-I64 VanDerWaalsContact C-N 3.33Å; E62-I64 PolarHBondContact O-N 2.65Å; E62-N65 PolarHBondContact O-N 2.94Å; E62-E66 WeakPolarHBondContact O-CG 3.41Å; E62-E66 PolarHBondContact O-N 3.21Å
63	V	93.8	Very high	76.9	Confident	3 Å²	3	74.3 Å²	74.3	2%	0.018	36%	0.358	C	S	.	.	H	α-helix	trans	-63.8	-38.6	-178.5	172.7	0	0	0	0	111.8	R58 S59 F60 V61 K67 L108 C111 I113	R58-V63 HydrophobicContact CB-CG2 4.22Å; S59-V63 WeakPolarHBondContact O-CG2 3.4Å; S59-V63 PolarHBondContact O-N 2.79Å; F60-V63 PolarHBondContact O-N 3.42Å; V61-V63 PolarHBondContact O-N 3.31Å; V63-K67 WeakPolarHBondContact O-CB 3.43Å; V63-K67 PolarHBondContact O-N 3.05Å; V63-L108 HydrophobicContact CG1-CD2 3.83Å; V63-C111 HydrophobicContact CB-CB 4.46Å; V63-C111 HydrophobicContact CG1-CB 3.53Å; V63-C111 HydrophobicContact CG2-CB 4.08Å; V63-I113 HydrophobicContact CB-CD1 4.18Å; V63-I113 HydrophobicContact CB-CG1 4.06Å; V63-I113 HydrophobicContact CG1-CD1 4.11Å; V63-I113 HydrophobicContact CG1-CG1 4.31Å; V63-I113 HydrophobicContact CG2-CD1 4.32Å; V63-I113 HydrophobicContact CG2-CG1 3.66Å
64	I	90.7	Very high	77	Confident	1 Å²	1	69.5 Å²	69.5	1%	0.005	34%	0.344	C	S	.	.	H	α-helix	trans	-61.6	-49.8	174.1	-82.5	-171.7	0	0	0	110.9	F60 V61 E62 E66 K67 Y68 L100 L102 L106 L108 F125	F60-I64 HydrophobicContact CD1-CD1 3.85Å; F60-I64 HydrophobicContact CD1-CG1 4.39Å; F60-I64 HydrophobicContact CE1-CD1 3.13Å; F60-I64 HydrophobicContact CE1-CG1 4.07Å; F60-I64 HydrophobicContact CE2-CD1 4.25Å; F60-I64 HydrophobicContact CZ-CD1 3.39Å; F60-I64 HydrophobicContact CZ-CG1 4.25Å; F60-I64 PolarHBondContact O-N 3.08Å; V61-I64 PolarHBondContact O-N 2.79Å; E62-I64 VanDerWaalsContact C-N 3.33Å; E62-I64 PolarHBondContact O-N 2.65Å; I64-E66 VanDerWaalsContact C-N 3.31Å; I64-E66 PolarHBondContact O-N 3.06Å; I64-K67 PolarHBondContact O-N 2.99Å; I64-Y68 WeakPolarHBondContact O-CB 3.32Å; I64-Y68 PolarHBondContact O-N 3.09Å; I64-L100 HydrophobicContact CG2-CD1 3.72Å; I64-L102 HydrophobicContact CD1-CD2 4.21Å; I64-L102 HydrophobicContact CG2-CD2 3.92Å; I64-L106 HydrophobicContact CD1-CD1 3.99Å; I64-L108 HydrophobicContact CD1-CD1 4.36Å; I64-L108 HydrophobicContact CG1-CD1 3.8Å; I64-F125 HydrophobicContact CG2-CD2 3.9Å
65	N	88.4	Confident	76.9	Confident	54 Å²	54	71.6 Å²	71.6	29%	0.289	34%	0.342	S	S	.	.	H	α-helix	trans	-61.1	-43.6	-178.2	-81.3	-53	0	0	0	110.8	V61 E62 S69 L100	V61-N65 WeakPolarHBondContact CG1-ND2 3.29Å; V61-N65 WeakPolarHBondContact O-CB 3.49Å; V61-N65 PolarHBondContact O-N 3.25Å; V61-N65 PolarHBondContact O-ND2 2.93Å; E62-N65 PolarHBondContact O-N 2.94Å; N65-S69 WeakPolarHBondContact O-CA 3.34Å; N65-S69 WeakPolarHBondContact O-CB 3.4Å; N65-S69 PolarHBondContact O-N 2.93Å; N65-S69 VanDerWaalsContact O-N 3.11Å; N65-L100 WeakPolarHBondContact OD1-CD1 3.25Å
66	E	88.1	Confident	76.9	Confident	76 Å²	76	70.2 Å²	70.2	36%	0.355	34%	0.337	S	S	.	.	H	α-helix	trans	-65.5	-55.9	176.1	-71.7	180	-130.5	0	0	111.6	R58 E62 I64 Y68 N72	R58-E66 IonicContact CZ-OE1 2.84Å; R58-E66 IonicContact CZ-OE2 2.63Å; R58-E66 IonicContact NH2-OE1 3.83Å; R58-E66 PolarHBondContact NH2-OE1 2.97Å; R58-E66 IonicContact NH2-OE2 2.67Å; R58-E66 PolarHBondContact NH2-OE2 2.84Å; E62-E66 WeakPolarHBondContact O-CG 3.41Å; E62-E66 PolarHBondContact O-N 3.21Å; I64-E66 VanDerWaalsContact C-N 3.31Å; I64-E66 PolarHBondContact O-N 3.06Å; E66-Y68 PolarHBondContact O-N 2.83Å; E66-N72 PolarHBondContact O-ND2 3.4Å
67	K	86.3	Confident	76	Confident	73 Å²	73	73.9 Å²	73.9	32%	0.317	34%	0.344	S	S	.	.	H	α-helix	trans	-65.9	-40.1	-171.5	-170	171.7	-172.8	166	0	112.1	V63 I64 F73 V107 L108	V63-K67 WeakPolarHBondContact O-CB 3.43Å; V63-K67 PolarHBondContact O-N 3.05Å; I64-K67 PolarHBondContact O-N 2.99Å; K67-F73 WeakPolarHBondContact O-CE2 3.33Å; K67-V107 WeakPolarHBondContact CE-O 3.46Å; K67-V107 PolarHBondContact NZ-O 2.83Å; K67-L108 HydrophobicContact CD-CD2 3.76Å
68	Y	82.3	Confident	74.5	Confident	15 Å²	15	74.8 Å²	74.8	6%	0.059	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	13.9	-174.6	-59.9	-79.7	0	0	0	114	I64 E66 F73 L100 L102 P103 L106 V107 L108	I64-Y68 WeakPolarHBondContact O-CB 3.32Å; I64-Y68 PolarHBondContact O-N 3.09Å; E66-Y68 PolarHBondContact O-N 2.83Å; Y68-F73 HydrophobicContact CD1-CE2 4.07Å; Y68-L100 WeakPolarHBondContact O-CD2 3.5Å; Y68-L102 HydrophobicContact CD2-CD2 3.97Å; Y68-L102 HydrophobicContact CE2-CD2 4.41Å; Y68-L102 HydrophobicContact CG-CD2 4.23Å; Y68-L102 HydrophobicContact CG-CG 4.39Å; Y68-P103 HydrophobicContact CE1-CG 4.1Å; Y68-L106 HydrophobicContact CE1-CD2 4.47Å; Y68-L106 HydrophobicContact CE2-CD2 4.02Å; Y68-V107 PolarHBondContact OH-N 2.84Å; Y68-V107 PolarHBondContact OH-O 2.78Å; Y68-L108 HydrophobicContact CE2-CD2 3.74Å
69	S	79.3	Confident	72.1	Confident	25 Å²	25	79.5 Å²	79.5	18%	0.175	39%	0.389	C	S	.	.			trans	-58	141.2	171.1	171.8	0	0	0	0	111	N65 E71 N72 F73	N65-S69 WeakPolarHBondContact O-CA 3.34Å; N65-S69 WeakPolarHBondContact O-CB 3.4Å; N65-S69 PolarHBondContact O-N 2.93Å; N65-S69 VanDerWaalsContact O-N 3.11Å; S69-E71 PolarHBondContact O-N 3.18Å; S69-E71 VanDerWaalsContact O-N 3.11Å; S69-E71 PolarHBondContact OG-N 3.26Å; S69-N72 PolarHBondContact O-N 3.07Å; S69-F73 PolarHBondContact O-N 2.82Å
70	P	67.3	Low	69.9	Low	47 Å²	47	80.3 Å²	80.3	31%	0.305	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50	-32	169.9	-28.8	35	0	0	0	114.7	N72 F73 R99	P70-N72 VanDerWaalsContact C-N 3.28Å; P70-N72 PolarHBondContact O-N 3.04Å; P70-F73 CarbonylContact O-C 3.35Å; P70-F73 PolarHBondContact O-N 2.9Å; P70-R99 WeakPolarHBondContact CD-O 3.47Å; P70-R99 WeakPolarHBondContact CG-O 3.42Å
71	E	65.6	Low	67.8	Low	135 Å²	135	86.3 Å²	86.3	63%	0.631	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-28.8	-177.7	-61.7	-173.3	173.9	0	0	111.7	S69 K97	S69-E71 PolarHBondContact O-N 3.18Å; S69-E71 VanDerWaalsContact O-N 3.11Å; S69-E71 PolarHBondContact OG-N 3.26Å; E71-K97 IonicContact OE1-NZ 3.13Å
72	N	61.5	Low	65.9	Low	92 Å²	92	87.4 Å²	87.4	49%	0.492	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-8.4	177.4	-69.2	-21.2	0	0	0	113.1	E66 S69 P70 P74	E66-N72 PolarHBondContact O-ND2 3.4Å; S69-N72 PolarHBondContact O-N 3.07Å; P70-N72 VanDerWaalsContact C-N 3.28Å; P70-N72 PolarHBondContact O-N 3.04Å; N72-P74 VanDerWaalsContact C-CD 3.43Å; N72-P74 WeakPolarHBondContact O-CD 2.77Å
73	F	58.4	Low	64.1	Low	105 Å²	105	84.6 Å²	84.6	46%	0.461	43%	0.43	S	S	.	.			trans	-123.6	70.2	174	-80.7	-84.7	0	0	0	111.7	K67 Y68 S69 P70 Y75	K67-F73 WeakPolarHBondContact O-CE2 3.33Å; Y68-F73 HydrophobicContact CD1-CE2 4.07Å; S69-F73 PolarHBondContact O-N 2.82Å; P70-F73 CarbonylContact O-C 3.35Å; P70-F73 PolarHBondContact O-N 2.9Å; F73-Y75 PolarHBondContact O-N 3.36Å
74	P	46.2	Very low	62	Low	99 Å²	99	88.3 Å²	88.3	64%	0.643	45%	0.453	S	S	*	.			trans	-66.4	-6.7	-175.9	22.7	-31.2	0	0	0	114.9	N72	N72-P74 VanDerWaalsContact C-CD 3.43Å; N72-P74 WeakPolarHBondContact O-CD 2.77Å
75	Y	41.9	Very low	60.2	Low	189 Å²	189	90 Å²	90	74%	0.741	46%	0.463	S	S	*	.	S	Bend	trans	-134.5	119.8	179.1	-68.3	-82.8	0	0	0	112	F73 R77	F73-Y75 PolarHBondContact O-N 3.36Å; Y75-R77 VanDerWaalsContact C-N 3.31Å; Y75-R77 PolarHBondContact O-N 2.85Å
76	R	49.3	Very low	58	Low	225 Å²	225	93 Å²	93	85%	0.849	48%	0.483	S	S	*	.			trans	-56.2	88.6	166.2	-63.3	-171.3	-168.9	-156.9	5.6	110.4
77	R	43.8	Very low	55.8	Low	240 Å²	240	92.6 Å²	92.6	91%	0.906	49%	0.487	S	S	*	.			trans	-142.8	82.4	167.5	-75.5	-165.5	-178	-175.5	2.5	109.9	Y75	Y75-R77 VanDerWaalsContact C-N 3.31Å; Y75-R77 PolarHBondContact O-N 2.85Å
78	G	45.8	Very low	53.7	Low	50 Å²	50	96.5 Å²	96.5	52%	0.515	52%	0.517	S	S	.	.	S	Bend	trans	167	147.6	168.9	0	0	0	0	0	111	G80	G78-G80 PolarHBondContact O-N 2.86Å
79	P	45.3	Very low	51.8	Low	143 Å²	143	99.7 Å²	99.7	93%	0.929	55%	0.547	S	S	*	.			trans	-75.9	42.5	-176.6	34.8	-36.5	0	0	0	112.7
80	G	50.5	Low	50.2	Low	22 Å²	22	102.1 Å²	102.1	23%	0.227	58%	0.576	C	S	.	*			trans	-74.8	145.1	173.1	0	0	0	0	0	111.2	G78 N101	G78-G80 PolarHBondContact O-N 2.86Å; G80-N101 VanDerWaalsContact CA-OD1 3.3Å; G80-N101 WeakPolarHBondContact CA-OD1 3.36Å; G80-N101 PolarHBondContact O-OD1 2.62Å; G80-N101 VanDerWaalsContact O-OD1 3.05Å
81	M	51.9	Low	48.8	Very low	126 Å²	126	107.6 Å²	107.6	62%	0.621	60%	0.601	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.7	124.1	171.7	-73.6	-70.6	-75.2	0	0	108.3	V83 N101 L102	M81-V83 PolarHBondContact O-N 2.93Å; M81-N101 PolarHBondContact O-OD1 2.67Å; M81-L102 PolarHBondContact N-O 2.76Å; M81-L102 VanDerWaalsContact N-O 3.15Å; M81-L102 PolarHBondContact O-N 3.48Å; M81-L102 VanDerWaalsContact O-N 3.11Å
82	G	54.4	Low	47.6	Very low	35 Å²	35	110.7 Å²	110.7	36%	0.361	62%	0.616	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.6	95.2	174.3	0	0	0	0	0	110.6	R99 L100	G82-R99 PolarHBondContact O-NH2 3.27Å; G82-L100 CarbonylContact C-O 3.33Å
83	V	55.9	Low	46.9	Very low	21 Å²	21	108.1 Å²	108.1	13%	0.127	61%	0.611	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.7	131.4	173.3	-176.2	0	0	0	0	108.9	M81 R99 L100 L102 F125	M81-V83 PolarHBondContact O-N 2.93Å; V83-R99 CarbonylContact O-C 3.13Å; V83-R99 WeakPolarHBondContact O-CA 3.41Å; V83-L100 PolarHBondContact N-O 2.93Å; V83-L100 PolarHBondContact O-N 3.31Å; V83-L102 HydrophobicContact CB-CD1 4.07Å; V83-L102 HydrophobicContact CG2-CB 4.37Å; V83-L102 HydrophobicContact CG2-CD1 3.78Å; V83-F125 HydrophobicContact CG1-CD1 4.15Å
84	V	49.9	Very low	45.9	Very low	82 Å²	82	106.5 Å²	106.5	50%	0.497	61%	0.612	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.4	116.8	175.6	-174.9	0	0	0	0	108.1	V86 D98 R99	V84-V86 HydrophobicContact CG1-CG2 4.26Å; V84-D98 CarbonylContact C-O 3.47Å; V84-R99 HydrophobicContact CB-CG 4.38Å; V84-R99 HydrophobicContact CG1-CG 4.28Å; V84-R99 HydrophobicContact CG2-CG 4Å
85	V	51.8	Low	45.7	Very low	36 Å²	36	106.5 Å²	106.5	22%	0.218	61%	0.612	C	S	.	*	P	Polyproline II helix	trans	-74.5	122.8	167.3	-168.8	0	0	0	0	107	D98 L100 F125	V85-D98 WeakPolarHBondContact CA-O 3.38Å; V85-D98 HydrophobicContact CB-CB 4.15Å; V85-D98 WeakPolarHBondContact CB-O 3.11Å; V85-D98 PolarHBondContact N-O 2.64Å; V85-D98 VanDerWaalsContact O-CB 3.28Å; V85-D98 WeakPolarHBondContact O-CB 3.47Å; V85-L100 HydrophobicContact CG2-CD1 4.26Å; V85-L100 HydrophobicContact CG2-CG 4.09Å; V85-F125 HydrophobicContact CB-CE1 4.28Å; V85-F125 HydrophobicContact CG1-CE1 4.09Å; V85-F125 HydrophobicContact CG1-CZ 4.15Å; V85-F125 HydrophobicContact CG2-CD1 4.45Å; V85-F125 HydrophobicContact CG2-CE1 3.57Å; V85-F125 HydrophobicContact CG2-CZ 3.94Å
86	V	42.6	Very low	45.5	Very low	118 Å²	118	104 Å²	104	72%	0.715	61%	0.609	S	S	*	*			trans	-110.7	110.9	170	-176.6	0	0	0	0	106.6	V84 T88	V84-V86 HydrophobicContact CG1-CG2 4.26Å; V86-T88 PolarHBondContact O-N 3.49Å
87	P	41.1	Very low	45.2	Very low	67 Å²	67	100 Å²	100	44%	0.435	60%	0.598	S	S	.	*			trans	-63.1	130.5	-176.8	-20.5	30.3	0	0	0	112	A89	P87-A89 VanDerWaalsContact C-N 3.26Å; P87-A89 PolarHBondContact O-N 2.84Å
88	T	43.3	Very low	45.7	Very low	154 Å²	154	90.8 Å²	90.8	95%	0.945	57%	0.567	S	S	*	*	S	Bend	trans	-76.7	-10.3	179.2	-32.4	0	0	0	0	113.2	V86	V86-T88 PolarHBondContact O-N 3.49Å
89	A	41.5	Very low	46.3	Very low	83 Å²	83	93.8 Å²	93.8	69%	0.686	56%	0.562	S	S	*	*	S	Bend	trans	-132.4	131.2	175.1	0	0	0	0	0	109.6	P87	P87-A89 VanDerWaalsContact C-N 3.26Å; P87-A89 PolarHBondContact O-N 2.84Å
90	G	46.9	Very low	47.4	Very low	76 Å²	76	87.3 Å²	87.3	78%	0.784	52%	0.52	S	S	*	.			trans	-62.8	134.2	-157.8	0	0	0	0	0	116.2
91	L	36.1	Very low	48.3	Very low	161 Å²	161	88.9 Å²	88.9	84%	0.843	52%	0.523	S	S	*	.				-168.1	123.6	129.2	-96.5	151.4	0	0	0	105.9	G93	L91-G93 VanDerWaalsContact C-N 3.34Å; L91-G93 PolarHBondContact O-N 3.11Å
92	Q	42	Very low	49.6	Very low	201 Å²	201	82.9 Å²	82.9	94%	0.939	49%	0.494	S	S	*	.			trans	-67	90.4	178.4	-76.9	-93.5	-4.4	0	0	109.5
93	G	45.2	Very low	51.2	Low	37 Å²	37	83.2 Å²	83.2	38%	0.381	49%	0.489	S	S	.	.			trans	-75.7	164	164.4	0	0	0	0	0	111.5	L91	L91-G93 VanDerWaalsContact C-N 3.34Å; L91-G93 PolarHBondContact O-N 3.11Å
94	S	38	Very low	52.8	Low	71 Å²	71	84.7 Å²	84.7	50%	0.497	50%	0.501	S	S	.	.			trans	-60.1	131.4	176	176.7	0	0	0	0	110.2	M96 K97	S94-M96 PolarHBondContact O-N 3.13Å; S94-K97 PolarHBondContact O-N 3.48Å
95	P	41.8	Very low	54.9	Low	99 Å²	99	83.6 Å²	83.6	64%	0.643	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	1.9	-175.4	24.1	-33.9	0	0	0	115.1	R99	P95-R99 VanDerWaalsContact O-CD 3.29Å; P95-R99 WeakPolarHBondContact O-CD 3.36Å; P95-R99 WeakPolarHBondContact O-CG 3.42Å
96	M	38.7	Very low	56.9	Low	136 Å²	136	81.9 Å²	81.9	67%	0.67	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-19.4	172.8	-61.8	-167.5	87.3	0	0	113.9	S94	S94-M96 PolarHBondContact O-N 3.13Å
97	K	43.3	Very low	59.4	Low	143 Å²	143	79.1 Å²	79.1	62%	0.622	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-26.8	176.7	-83.5	-167.3	166.3	-159.8	0	112.7	E71 S94 R99	E71-K97 IonicContact OE1-NZ 3.13Å; S94-K97 PolarHBondContact O-N 3.48Å; K97-R99 VanDerWaalsContact C-N 3.35Å; K97-R99 PolarHBondContact O-N 3.44Å
98	D	52.9	Low	62	Low	46 Å²	46	75.9 Å²	75.9	25%	0.246	45%	0.446	C	S	.	.	S	Bend	trans	-97.9	34.8	-175.1	-52.5	-39.1	0	0	0	111.7	V84 V85	V84-D98 CarbonylContact C-O 3.47Å; V85-D98 WeakPolarHBondContact CA-O 3.38Å; V85-D98 HydrophobicContact CB-CB 4.15Å; V85-D98 WeakPolarHBondContact CB-O 3.11Å; V85-D98 PolarHBondContact N-O 2.64Å; V85-D98 VanDerWaalsContact O-CB 3.28Å; V85-D98 WeakPolarHBondContact O-CB 3.47Å
99	R	60	Low	64.5	Low	113 Å²	113	71.8 Å²	71.8	43%	0.426	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	99.5	-177.9	-66.6	-169.9	67.9	178.7	5.2	112.5	P70 G82 V83 V84 P95 K97	P70-R99 WeakPolarHBondContact CD-O 3.47Å; P70-R99 WeakPolarHBondContact CG-O 3.42Å; G82-R99 PolarHBondContact O-NH2 3.27Å; V83-R99 CarbonylContact O-C 3.13Å; V83-R99 WeakPolarHBondContact O-CA 3.41Å; V84-R99 HydrophobicContact CB-CG 4.38Å; V84-R99 HydrophobicContact CG1-CG 4.28Å; V84-R99 HydrophobicContact CG2-CG 4Å; P95-R99 VanDerWaalsContact O-CD 3.29Å; P95-R99 WeakPolarHBondContact O-CD 3.36Å; P95-R99 WeakPolarHBondContact O-CG 3.42Å; K97-R99 VanDerWaalsContact C-N 3.35Å; K97-R99 PolarHBondContact O-N 3.44Å
100	L	67.6	Low	67	Low	6 Å²	6	70.3 Å²	70.3	3%	0.031	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	135.9	172.1	-60.6	175.5	0	0	0	110.1	I64 N65 Y68 G82 V83 V85 L102 F125	I64-L100 HydrophobicContact CG2-CD1 3.72Å; N65-L100 WeakPolarHBondContact OD1-CD1 3.25Å; Y68-L100 WeakPolarHBondContact O-CD2 3.5Å; G82-L100 CarbonylContact C-O 3.33Å; V83-L100 PolarHBondContact N-O 2.93Å; V83-L100 PolarHBondContact O-N 3.31Å; V85-L100 HydrophobicContact CG2-CD1 4.26Å; V85-L100 HydrophobicContact CG2-CG 4.09Å; L100-L102 HydrophobicContact CB-CD1 3.42Å; L100-L102 VanDerWaalsContact CB-CD1 3.42Å; L100-L102 HydrophobicContact CB-CG 4.2Å; L100-L102 HydrophobicContact CD1-CD1 3.97Å; L100-L102 HydrophobicContact CG-CD1 4.38Å; L100-F125 HydrophobicContact CD1-CD1 4.15Å; L100-F125 HydrophobicContact CD1-CD2 3.87Å; L100-F125 HydrophobicContact CD1-CE1 4.2Å; L100-F125 HydrophobicContact CD1-CE2 3.89Å; L100-F125 HydrophobicContact CD1-CG 4.01Å; L100-F125 HydrophobicContact CD1-CZ 4.06Å
101	N	69.8	Low	69.4	Low	56 Å²	56	67.7 Å²	67.7	30%	0.299	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	92.2	173.2	-170.1	21.8	0	0	0	109.6	G80 M81	G80-N101 VanDerWaalsContact CA-OD1 3.3Å; G80-N101 WeakPolarHBondContact CA-OD1 3.36Å; G80-N101 PolarHBondContact O-OD1 2.62Å; G80-N101 VanDerWaalsContact O-OD1 3.05Å; M81-N101 PolarHBondContact O-OD1 2.67Å
102	L	79.8	Confident	72.2	Confident	0 Å²	0	61 Å²	61	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	122.5	-173.8	-73	126.1	0	0	0	110.6	I64 Y68 M81 V83 L100 L106 F125 H128	I64-L102 HydrophobicContact CD1-CD2 4.21Å; I64-L102 HydrophobicContact CG2-CD2 3.92Å; Y68-L102 HydrophobicContact CD2-CD2 3.97Å; Y68-L102 HydrophobicContact CE2-CD2 4.41Å; Y68-L102 HydrophobicContact CG-CD2 4.23Å; Y68-L102 HydrophobicContact CG-CG 4.39Å; M81-L102 PolarHBondContact N-O 2.76Å; M81-L102 VanDerWaalsContact N-O 3.15Å; M81-L102 PolarHBondContact O-N 3.48Å; M81-L102 VanDerWaalsContact O-N 3.11Å; V83-L102 HydrophobicContact CB-CD1 4.07Å; V83-L102 HydrophobicContact CG2-CB 4.37Å; V83-L102 HydrophobicContact CG2-CD1 3.78Å; L100-L102 HydrophobicContact CB-CD1 3.42Å; L100-L102 VanDerWaalsContact CB-CD1 3.42Å; L100-L102 HydrophobicContact CB-CG 4.2Å; L100-L102 HydrophobicContact CD1-CD1 3.97Å; L100-L102 HydrophobicContact CG-CD1 4.38Å; L102-L106 HydrophobicContact CB-CD2 4.31Å; L102-L106 HydrophobicContact CD2-CD1 3.97Å; L102-L106 HydrophobicContact CD2-CD2 3.63Å; L102-L106 HydrophobicContact CD2-CG 4.47Å; L102-F125 HydrophobicContact CD1-CB 4Å; L102-H128 PolarHBondContact O-NE2 2.75Å
103	P	86.4	Confident	74.8	Confident	42 Å²	42	51.4 Å²	51.4	27%	0.273	31%	0.305	S	S	.	.			trans	-68.3	165.5	167.5	28.7	-32.5	0	0	0	111.4	Y68 V105 L106	Y68-P103 HydrophobicContact CE1-CG 4.1Å; P103-V105 VanDerWaalsContact CG-O 3.25Å; P103-V105 WeakPolarHBondContact CG-O 3.49Å; P103-V105 PolarHBondContact O-N 2.54Å; P103-L106 HydrophobicContact CG-CD2 4.1Å; P103-L106 WeakPolarHBondContact O-CD2 3.31Å
104	S	90.1	Very high	77.3	Confident	52 Å²	52	51.2 Å²	51.2	36%	0.364	30%	0.298	S	S	.	.	S	Bend	trans	-72	-12	171.9	58	0	0	0	0	113.2	H128 I130 E131	S104-H128 WeakPolarHBondContact CB-O 3.41Å; S104-I130 PolarHBondContact O-N 2.87Å; S104-E131 PolarHBondContact O-N 3.08Å; S104-E131 VanDerWaalsContact O-N 3.15Å
105	V	93.4	Very high	80.1	Confident	58 Å²	58	51.1 Å²	51.1	35%	0.352	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	105.9	175.8	178.5	0	0	0	0	108	P103 V107 E131	P103-V105 VanDerWaalsContact CG-O 3.25Å; P103-V105 WeakPolarHBondContact CG-O 3.49Å; P103-V105 PolarHBondContact O-N 2.54Å; V105-V107 HydrophobicContact CG1-CG2 4.35Å; V105-E131 CarbonylContact C-O 3.45Å; V105-E131 WeakPolarHBondContact CA-O 3.29Å; V105-E131 HydrophobicContact CB-CB 4.22Å; V105-E131 HydrophobicContact CG1-CB 3.93Å; V105-E131 HydrophobicContact CG2-CB 3.96Å; V105-E131 HydrophobicContact CG2-CG 3.99Å
106	L	94.3	Very high	82.7	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	118.1	179.1	-64.3	-171.2	0	0	0	110.3	I64 Y68 L102 P103 V129 E131 L132 D133	I64-L106 HydrophobicContact CD1-CD1 3.99Å; Y68-L106 HydrophobicContact CE1-CD2 4.47Å; Y68-L106 HydrophobicContact CE2-CD2 4.02Å; L102-L106 HydrophobicContact CB-CD2 4.31Å; L102-L106 HydrophobicContact CD2-CD1 3.97Å; L102-L106 HydrophobicContact CD2-CD2 3.63Å; L102-L106 HydrophobicContact CD2-CG 4.47Å; P103-L106 HydrophobicContact CG-CD2 4.1Å; P103-L106 WeakPolarHBondContact O-CD2 3.31Å; L106-V129 HydrophobicContact CB-CG1 4.43Å; L106-V129 HydrophobicContact CD1-CB 4.48Å; L106-V129 HydrophobicContact CD1-CG1 4.09Å; L106-V129 HydrophobicContact CD1-CG2 3.65Å; L106-V129 HydrophobicContact CD2-CG2 4.35Å; L106-V129 HydrophobicContact CG-CB 4.5Å; L106-V129 HydrophobicContact CG-CG1 3.89Å; L106-V129 HydrophobicContact CG-CG2 3.72Å; L106-E131 PolarHBondContact N-O 3.23Å; L106-L132 HydrophobicContact CB-CD1 3.78Å; L106-L132 WeakPolarHBondContact O-CA 3.26Å; L106-D133 PolarHBondContact O-N 3.38Å
107	V	94.9	Very high	85.4	Confident	60 Å²	60	41.5 Å²	41.5	36%	0.364	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	108.2	173.6	-178.6	0	0	0	0	108.2	K67 Y68 V105 N109	K67-V107 WeakPolarHBondContact CE-O 3.46Å; K67-V107 PolarHBondContact NZ-O 2.83Å; Y68-V107 PolarHBondContact OH-N 2.84Å; Y68-V107 PolarHBondContact OH-O 2.78Å; V105-V107 HydrophobicContact CG1-CG2 4.35Å; V107-N109 WeakPolarHBondContact CG1-OD1 3.49Å
108	L	95.6	Very high	87.8	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.234	C	C	.	.			trans	-126.9	31.4	-177.6	-64.3	-178.8	0	0	0	111.1	F60 V63 I64 K67 Y68 I113 L132 D133 L134 N137	F60-L108 HydrophobicContact CD2-CD1 3.77Å; F60-L108 HydrophobicContact CE2-CD1 3.44Å; F60-L108 VanDerWaalsContact CE2-CD1 3.44Å; F60-L108 HydrophobicContact CZ-CD1 4.1Å; V63-L108 HydrophobicContact CG1-CD2 3.83Å; I64-L108 HydrophobicContact CD1-CD1 4.36Å; I64-L108 HydrophobicContact CG1-CD1 3.8Å; K67-L108 HydrophobicContact CD-CD2 3.76Å; Y68-L108 HydrophobicContact CE2-CD2 3.74Å; L108-I113 HydrophobicContact CB-CD1 3.95Å; L108-I113 HydrophobicContact CD1-CD1 4.22Å; L108-L132 HydrophobicContact CD1-CD1 4.31Å; L108-D133 CarbonylContact C-O 3.44Å; L108-D133 WeakPolarHBondContact CA-O 3.16Å; L108-D133 PolarHBondContact N-O 2.75Å; L108-L134 HydrophobicContact CB-CD2 4.04Å; L108-L134 HydrophobicContact CD1-CD2 4.37Å; L108-N137 PolarHBondContact O-ND2 3.07Å
109	N	95.4	Very high	89.7	Confident	68 Å²	68	40.6 Å²	40.6	36%	0.364	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	147.7	178.7	69.7	-57.6	0	0	0	111.6	V107 C111 D133 S135	V107-N109 WeakPolarHBondContact CG1-OD1 3.49Å; N109-C111 PolarHBondContact O-N 2.85Å; N109-C111 VanDerWaalsContact O-N 3.12Å; N109-C111 PolarHBondContact O-SG 3.07Å; N109-D133 PolarHBondContact N-O 3Å; N109-S135 CarbonylContact C-O 3.45Å; N109-S135 WeakPolarHBondContact CA-O 3.47Å; N109-S135 WeakPolarHBondContact CB-O 3.16Å; N109-S135 WeakPolarHBondContact CB-OG 3.37Å
110	G	95.8	Very high	91.3	Very high	52 Å²	52	38.5 Å²	38.5	54%	0.536	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.9	14.3	172.5	0	0	0	0	0	115.1	S135 H136	G110-S135 PolarHBondContact N-O 3.41Å; G110-H136 WeakPolarHBondContact CA-O 2.93Å; G110-H136 PolarHBondContact N-O 3.38Å
111	C	95.3	Very high	92.4	Very high	21 Å²	21	41.6 Å²	41.6	14%	0.142	26%	0.263	C	S	.	.	S	Bend	trans	-90.1	-2.3	-171.7	-67.2	0	0	0	0	113.6	R58 V63 N109 I113 N137	R58-C111 WeakPolarHBondContact CD-O 3.47Å; R58-C111 PolarHBondContact NH1-O 2.86Å; V63-C111 HydrophobicContact CB-CB 4.46Å; V63-C111 HydrophobicContact CG1-CB 3.53Å; V63-C111 HydrophobicContact CG2-CB 4.08Å; N109-C111 PolarHBondContact O-N 2.85Å; N109-C111 VanDerWaalsContact O-N 3.12Å; N109-C111 PolarHBondContact O-SG 3.07Å; C111-I113 VanDerWaalsContact C-N 3.33Å; C111-I113 HydrophobicContact CB-CD1 4.28Å; C111-I113 HydrophobicContact CB-CG1 4.11Å; C111-N137 PolarHBondContact N-OD1 2.89Å
112	G	95.7	Very high	93.6	Very high	19 Å²	19	38.9 Å²	38.9	20%	0.196	25%	0.248	C	C	.	.			trans	73.4	22.3	-179	0	0	0	0	0	114.1	S114 N137	G112-S114 PolarHBondContact O-N 3.22Å; G112-N137 PolarHBondContact N-OD1 2.83Å
113	I	97.4	Very high	94.2	Very high	0 Å²	0	41 Å²	41	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	130.1	179.1	-60.1	168.3	0	0	0	109.3	R58 F60 V63 L108 C111 L134 N137 N138 L139	R58-I113 WeakPolarHBondContact O-CA 3.45Å; F60-I113 HydrophobicContact CB-CG2 4.01Å; F60-I113 HydrophobicContact CD2-CD1 4.23Å; V63-I113 HydrophobicContact CB-CD1 4.18Å; V63-I113 HydrophobicContact CB-CG1 4.06Å; V63-I113 HydrophobicContact CG1-CD1 4.11Å; V63-I113 HydrophobicContact CG1-CG1 4.31Å; V63-I113 HydrophobicContact CG2-CD1 4.32Å; V63-I113 HydrophobicContact CG2-CG1 3.66Å; L108-I113 HydrophobicContact CB-CD1 3.95Å; L108-I113 HydrophobicContact CD1-CD1 4.22Å; C111-I113 VanDerWaalsContact C-N 3.33Å; C111-I113 HydrophobicContact CB-CD1 4.28Å; C111-I113 HydrophobicContact CB-CG1 4.11Å; I113-L134 HydrophobicContact CD1-CD2 3.71Å; I113-N137 HydrophobicContact CB-CB 4.2Å; I113-N137 PolarHBondContact N-OD1 3.4Å; I113-N138 CarbonylContact O-C 3.34Å; I113-N138 VanDerWaalsContact O-C 3.3Å; I113-N138 WeakPolarHBondContact O-CA 3.29Å; I113-N138 PolarHBondContact O-N 2.93Å; I113-L139 HydrophobicContact CG2-CD2 4.04Å; I113-L139 PolarHBondContact O-N 3.02Å
114	S	96.5	Very high	94.3	Very high	33 Å²	33	42 Å²	42	23%	0.231	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	-12.8	175.5	72.2	0	0	0	0	114	G57 R58 G112	G57-S114 VanDerWaalsContact C-OG 3.27Å; G57-S114 WeakPolarHBondContact CA-OG 3.43Å; R58-S114 PolarHBondContact O-N 3.34Å; G112-S114 PolarHBondContact O-N 3.22Å
115	K	96.8	Very high	94.1	Very high	69 Å²	69	39.7 Å²	39.7	30%	0.3	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	161.2	-177.1	65.7	-168.9	-177	-161.2	0	111.2	G57 S59 F60 E144	G57-K115 WeakPolarHBondContact O-CE 3.31Å; G57-K115 PolarHBondContact O-NZ 3.04Å; G57-K115 VanDerWaalsContact O-NZ 3.12Å; S59-K115 CarbonylContact C-O 3.3Å; S59-K115 VanDerWaalsContact CA-O 3.29Å; S59-K115 WeakPolarHBondContact CA-O 3.47Å; F60-K115 PolarHBondContact N-O 3.43Å; K115-E144 HydrophobicContact CB-CG 4.29Å
116	A	96.8	Very high	94	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	24%	0.244	C	C	.	.			trans	-71.6	-49	-179	0	0	0	0	0	112.4	F60 V61 I122 E144 K147 I148	F60-A116 WeakPolarHBondContact CB-O 3.36Å; F60-A116 PolarHBondContact N-O 2.99Å; V61-A116 PolarHBondContact N-O 3.34Å; A116-I122 HydrophobicContact CB-CD1 3.98Å; A116-E144 WeakPolarHBondContact CB-OE2 3.48Å; A116-E144 PolarHBondContact N-OE2 3.47Å; A116-K147 HydrophobicContact CB-CB 3.77Å; A116-K147 HydrophobicContact CB-CD 4.27Å; A116-I148 HydrophobicContact CB-CD1 4.32Å; A116-I148 HydrophobicContact CB-CG1 3.64Å
117	G	94.6	Very high	93.8	Very high	34 Å²	34	39.1 Å²	39.1	35%	0.351	26%	0.262	S	S	.	.			trans	86.7	-155	-165.3	0	0	0	0	0	111.7	Q119	G117-Q119 PolarHBondContact O-N 2.93Å
118	D	93.8	Very high	93.5	Very high	84 Å²	84	38.7 Å²	38.7	45%	0.449	26%	0.256	S	S	.	.			trans	-71.6	115.3	-178.2	-169.4	-24.8	0	0	0	111.7	A120 E121 I122	D118-A120 VanDerWaalsContact C-N 3.3Å; D118-A120 PolarHBondContact O-N 2.96Å; D118-A120 WeakPolarHBondContact OD1-CB 3.39Å; D118-A120 PolarHBondContact OD1-N 3.09Å; D118-E121 HydrophobicContact CB-CB 4.2Å; D118-E121 HydrophobicContact CB-CG 4Å; D118-E121 WeakPolarHBondContact O-CB 3.46Å; D118-E121 PolarHBondContact O-N 3.21Å; D118-I122 WeakPolarHBondContact O-CG1 3.36Å; D118-I122 PolarHBondContact O-N 3.09Å; D118-I122 VanDerWaalsContact O-N 3.11Å
119	Q	94.6	Very high	93.5	Very high	86 Å²	86	38.7 Å²	38.7	40%	0.402	26%	0.256	S	S	.	.	H	α-helix	trans	-63.3	-32.9	-178.6	-160.1	175.1	6.6	0	0	113.3	G117 E121 I122 A123 K147 S150 S151	G117-Q119 PolarHBondContact O-N 2.93Å; Q119-E121 VanDerWaalsContact C-N 3.32Å; Q119-I122 PolarHBondContact O-N 3.3Å; Q119-A123 WeakPolarHBondContact O-CB 3.17Å; Q119-A123 PolarHBondContact O-N 2.75Å; Q119-K147 PolarHBondContact NE2-O 2.75Å; Q119-S150 PolarHBondContact NE2-OG 3.49Å; Q119-S151 WeakPolarHBondContact CG-OG 2.99Å; Q119-S151 PolarHBondContact NE2-OG 3.14Å; Q119-S151 VanDerWaalsContact NE2-OG 3.12Å
120	A	92.5	Very high	93.5	Very high	68 Å²	68	38.4 Å²	38.4	56%	0.562	25%	0.254	S	S	*	.	H	α-helix	trans	-67.9	-36.1	177.7	0	0	0	0	0	111.2	D118 A124	D118-A120 VanDerWaalsContact C-N 3.3Å; D118-A120 PolarHBondContact O-N 2.96Å; D118-A120 WeakPolarHBondContact OD1-CB 3.39Å; D118-A120 PolarHBondContact OD1-N 3.09Å; A120-A124 WeakPolarHBondContact O-CB 3.45Å; A120-A124 PolarHBondContact O-N 2.8Å
121	E	91.1	Very high	93.6	Very high	71 Å²	71	39.4 Å²	39.4	33%	0.332	25%	0.245	S	C	.	.	H	α-helix	trans	-67.9	-44.5	173.8	-68.3	-169.3	-161.1	0	0	111.3	V61 D118 Q119 A123 A124 F125	V61-E121 HydrophobicContact CG1-CB 4.24Å; V61-E121 WeakPolarHBondContact CG1-OE2 3.2Å; V61-E121 HydrophobicContact CG2-CB 4.26Å; D118-E121 HydrophobicContact CB-CB 4.2Å; D118-E121 HydrophobicContact CB-CG 4Å; D118-E121 WeakPolarHBondContact O-CB 3.46Å; D118-E121 PolarHBondContact O-N 3.21Å; Q119-E121 VanDerWaalsContact C-N 3.32Å; E121-A123 VanDerWaalsContact C-N 3.31Å; E121-A123 PolarHBondContact O-N 2.95Å; E121-A124 PolarHBondContact O-N 3.5Å; E121-A124 VanDerWaalsContact O-N 3.16Å; E121-F125 HydrophobicContact CB-CD2 4.34Å; E121-F125 HydrophobicContact CB-CE2 3.81Å; E121-F125 HydrophobicContact CB-CZ 3.98Å; E121-F125 HydrophobicContact CG-CZ 4.3Å; E121-F125 WeakPolarHBondContact O-CB 3.45Å; E121-F125 WeakPolarHBondContact O-CD1 3.49Å; E121-F125 WeakPolarHBondContact O-CD2 3.19Å; E121-F125 WeakPolarHBondContact O-CG 3.49Å; E121-F125 PolarHBondContact O-N 2.85Å
122	I	93.9	Very high	93.8	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-55.6	-48.9	174.8	-59.1	173.8	0	0	0	110.3	F60 V61 A116 D118 Q119 A124 F125 C126 I148 I152	F60-I122 HydrophobicContact CD1-CD1 3.91Å; F60-I122 HydrophobicContact CD1-CG1 3.79Å; F60-I122 HydrophobicContact CD1-CG2 4.39Å; F60-I122 HydrophobicContact CE1-CB 4.44Å; F60-I122 HydrophobicContact CE1-CD1 4.37Å; F60-I122 HydrophobicContact CE1-CG1 4Å; F60-I122 HydrophobicContact CE1-CG2 3.81Å; V61-I122 HydrophobicContact CG2-CD1 4.19Å; V61-I122 HydrophobicContact CG2-CG1 3.52Å; A116-I122 HydrophobicContact CB-CD1 3.98Å; D118-I122 WeakPolarHBondContact O-CG1 3.36Å; D118-I122 PolarHBondContact O-N 3.09Å; D118-I122 VanDerWaalsContact O-N 3.11Å; Q119-I122 PolarHBondContact O-N 3.3Å; I122-A124 VanDerWaalsContact C-N 3.31Å; I122-A124 PolarHBondContact O-N 2.97Å; I122-F125 PolarHBondContact O-N 2.94Å; I122-C126 HydrophobicContact CG2-CB 4.47Å; I122-C126 VanDerWaalsContact O-CB 3.23Å; I122-C126 WeakPolarHBondContact O-CB 3.16Å; I122-C126 PolarHBondContact O-N 2.96Å; I122-I148 HydrophobicContact CD1-CG1 4.16Å; I122-I152 HydrophobicContact CG2-CG1 4.23Å
123	A	92.6	Very high	93.9	Very high	44 Å²	44	39.1 Å²	39.1	36%	0.364	24%	0.237	S	C	.	.	H	α-helix	trans	-61.8	-39	180	0	0	0	0	0	112.4	Q119 E121 A127 S151	Q119-A123 WeakPolarHBondContact O-CB 3.17Å; Q119-A123 PolarHBondContact O-N 2.75Å; E121-A123 VanDerWaalsContact C-N 3.31Å; E121-A123 PolarHBondContact O-N 2.95Å; A123-A127 PolarHBondContact O-N 3.28Å; A123-S151 WeakPolarHBondContact CA-O 3.43Å
124	A	88.1	Confident	94	Very high	62 Å²	62	39.1 Å²	39.1	51%	0.512	24%	0.237	S	C	.	.	H	α-helix	trans	-68.5	-39.2	176.4	0	0	0	0	0	112.5	A120 E121 I122	A120-A124 WeakPolarHBondContact O-CB 3.45Å; A120-A124 PolarHBondContact O-N 2.8Å; E121-A124 PolarHBondContact O-N 3.5Å; E121-A124 VanDerWaalsContact O-N 3.16Å; I122-A124 VanDerWaalsContact C-N 3.31Å; I122-A124 PolarHBondContact O-N 2.97Å
125	F	87.3	Confident	94.1	Very high	4 Å²	4	37.9 Å²	37.9	2%	0.018	23%	0.229	C	C	.	.	H	α-helix	trans	-79.8	-33.3	-176.1	-60	-15.1	0	0	0	113.2	V61 I64 V83 V85 L100 L102 E121 I122 H128	V61-F125 HydrophobicContact CG1-CE2 4.41Å; I64-F125 HydrophobicContact CG2-CD2 3.9Å; V83-F125 HydrophobicContact CG1-CD1 4.15Å; V85-F125 HydrophobicContact CB-CE1 4.28Å; V85-F125 HydrophobicContact CG1-CE1 4.09Å; V85-F125 HydrophobicContact CG1-CZ 4.15Å; V85-F125 HydrophobicContact CG2-CD1 4.45Å; V85-F125 HydrophobicContact CG2-CE1 3.57Å; V85-F125 HydrophobicContact CG2-CZ 3.94Å; L100-F125 HydrophobicContact CD1-CD1 4.15Å; L100-F125 HydrophobicContact CD1-CD2 3.87Å; L100-F125 HydrophobicContact CD1-CE1 4.2Å; L100-F125 HydrophobicContact CD1-CE2 3.89Å; L100-F125 HydrophobicContact CD1-CG 4.01Å; L100-F125 HydrophobicContact CD1-CZ 4.06Å; L102-F125 HydrophobicContact CD1-CB 4Å; E121-F125 HydrophobicContact CB-CD2 4.34Å; E121-F125 HydrophobicContact CB-CE2 3.81Å; E121-F125 HydrophobicContact CB-CZ 3.98Å; E121-F125 HydrophobicContact CG-CZ 4.3Å; E121-F125 WeakPolarHBondContact O-CB 3.45Å; E121-F125 WeakPolarHBondContact O-CD1 3.49Å; E121-F125 WeakPolarHBondContact O-CD2 3.19Å; E121-F125 WeakPolarHBondContact O-CG 3.49Å; E121-F125 PolarHBondContact O-N 2.85Å; I122-F125 PolarHBondContact O-N 2.94Å; F125-H128 PolarHBondContact O-CE1 2.87Å; F125-H128 VanDerWaalsContact O-CE1 3.31Å
126	C	90.9	Very high	94.1	Very high	0 Å²	0	40 Å²	40	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-113.6	13.5	-165.4	-59.7	0	0	0	0	114.1	I122 H128 V129 I152	I122-C126 HydrophobicContact CG2-CB 4.47Å; I122-C126 VanDerWaalsContact O-CB 3.23Å; I122-C126 WeakPolarHBondContact O-CB 3.16Å; I122-C126 PolarHBondContact O-N 2.96Å; C126-H128 PolarHBondContact O-N 3.44Å; C126-H128 VanDerWaalsContact O-N 3.12Å; C126-V129 HydrophobicContact CB-CB 4.13Å; C126-V129 HydrophobicContact CB-CG2 3.83Å; C126-V129 WeakPolarHBondContact O-CB 3.18Å; C126-V129 PolarHBondContact O-N 2.87Å; C126-I152 HydrophobicContact CB-CD1 4.09Å; C126-I152 HydrophobicContact CB-CG1 3.68Å; C126-I152 HydrophobicContact CB-CG2 4.36Å
127	A	90.4	Very high	94.2	Very high	46 Å²	46	40.1 Å²	40.1	38%	0.38	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-30.6	-179	0	0	0	0	0	114.1	A123 N154	A123-A127 PolarHBondContact O-N 3.28Å; A127-N154 PolarHBondContact O-ND2 2.92Å
128	H	89.3	Confident	94.3	Very high	51 Å²	51	42.6 Å²	42.6	24%	0.236	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	2.3	178.5	65.1	-75	0	0	0	114.2	L102 S104 F125 C126	L102-H128 PolarHBondContact O-NE2 2.75Å; S104-H128 WeakPolarHBondContact CB-O 3.41Å; F125-H128 PolarHBondContact O-CE1 2.87Å; F125-H128 VanDerWaalsContact O-CE1 3.31Å; C126-H128 PolarHBondContact O-N 3.44Å; C126-H128 VanDerWaalsContact O-N 3.12Å
129	V	94.3	Very high	94.4	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.224	C	C	.	.			trans	-77.6	135	-178.3	174.8	0	0	0	0	109.8	L106 C126 E131 I152 N154 L155	L106-V129 HydrophobicContact CB-CG1 4.43Å; L106-V129 HydrophobicContact CD1-CB 4.48Å; L106-V129 HydrophobicContact CD1-CG1 4.09Å; L106-V129 HydrophobicContact CD1-CG2 3.65Å; L106-V129 HydrophobicContact CD2-CG2 4.35Å; L106-V129 HydrophobicContact CG-CB 4.5Å; L106-V129 HydrophobicContact CG-CG1 3.89Å; L106-V129 HydrophobicContact CG-CG2 3.72Å; C126-V129 HydrophobicContact CB-CB 4.13Å; C126-V129 HydrophobicContact CB-CG2 3.83Å; C126-V129 WeakPolarHBondContact O-CB 3.18Å; C126-V129 PolarHBondContact O-N 2.87Å; V129-E131 WeakPolarHBondContact CG1-O 3.21Å; V129-I152 HydrophobicContact CB-CG2 3.81Å; V129-I152 HydrophobicContact CG1-CG2 4.03Å; V129-I152 WeakPolarHBondContact O-CG2 3.19Å; V129-N154 CarbonylContact O-C 3.58Å; V129-L155 HydrophobicContact CG1-CD1 4.47Å
130	I	96.4	Very high	94.4	Very high	63 Å²	63	40 Å²	40	32%	0.323	23%	0.231	S	C	.	.			trans	-117.7	-34.5	-175.9	-58.3	170.7	0	0	0	110.6	S104 N154 E156 F157	S104-I130 PolarHBondContact O-N 2.87Å; I130-N154 WeakPolarHBondContact CA-O 3.48Å; I130-E156 HydrophobicContact CG2-CB 4.05Å; I130-E156 HydrophobicContact CG2-CG 4.11Å; I130-E156 PolarHBondContact O-N 2.78Å; I130-F157 PolarHBondContact O-N 3.09Å; I130-F157 VanDerWaalsContact O-N 3.17Å
131	E	98.2	Very high	94.5	Very high	73 Å²	73	39.9 Å²	39.9	34%	0.341	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	135	-179.6	-52.8	-168.6	169.5	0	0	110.4	S104 V105 L106 V129 F157	S104-E131 PolarHBondContact O-N 3.08Å; S104-E131 VanDerWaalsContact O-N 3.15Å; V105-E131 CarbonylContact C-O 3.45Å; V105-E131 WeakPolarHBondContact CA-O 3.29Å; V105-E131 HydrophobicContact CB-CB 4.22Å; V105-E131 HydrophobicContact CG1-CB 3.93Å; V105-E131 HydrophobicContact CG2-CB 3.96Å; V105-E131 HydrophobicContact CG2-CG 3.99Å; L106-E131 PolarHBondContact N-O 3.23Å; V129-E131 WeakPolarHBondContact CG1-O 3.21Å; E131-F157 HydrophobicContact CB-CB 3.92Å; E131-F157 HydrophobicContact CB-CD1 3.94Å; E131-F157 HydrophobicContact CB-CG 4.34Å; E131-F157 HydrophobicContact CG-CB 3.78Å; E131-F157 HydrophobicContact CG-CD1 4.5Å; E131-F157 HydrophobicContact CG-CG 4.46Å
132	L	98.4	Very high	94.8	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	120.7	179.9	177.7	59	0	0	0	111.1	F60 L106 L108 L134 I148 I152 L155 F157 L158 N159	F60-L132 HydrophobicContact CE2-CD1 3.92Å; F60-L132 HydrophobicContact CE2-CD2 4.03Å; F60-L132 HydrophobicContact CZ-CD1 4.45Å; F60-L132 HydrophobicContact CZ-CD2 4.43Å; L106-L132 HydrophobicContact CB-CD1 3.78Å; L106-L132 WeakPolarHBondContact O-CA 3.26Å; L108-L132 HydrophobicContact CD1-CD1 4.31Å; L132-L134 HydrophobicContact CD1-CD2 4.14Å; L132-L134 HydrophobicContact CD1-CG 4.03Å; L132-L134 HydrophobicContact CD2-CD1 3.71Å; L132-L134 HydrophobicContact CD2-CG 4Å; L132-L134 HydrophobicContact CG-CD1 4.1Å; L132-L134 HydrophobicContact CG-CD2 4.46Å; L132-L134 HydrophobicContact CG-CG 3.83Å; L132-I148 HydrophobicContact CD2-CG2 3.92Å; L132-I152 HydrophobicContact CD2-CD1 3.65Å; L132-L155 HydrophobicContact CB-CD1 3.55Å; L132-F157 PolarHBondContact N-O 3.25Å; L132-L158 HydrophobicContact CB-CD1 4.31Å; L132-L158 HydrophobicContact CD2-CD1 4.22Å; L132-L158 HydrophobicContact CG-CD1 4.25Å; L132-L158 WeakPolarHBondContact O-CA 3.49Å; L132-N159 PolarHBondContact O-N 3.19Å
133	D	98.4	Very high	94.9	Very high	33 Å²	33	39.5 Å²	39.5	18%	0.176	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	111.7	170.7	-164.3	-28.4	0	0	0	111.1	L106 L108 N109 S135 N159	L106-D133 PolarHBondContact O-N 3.38Å; L108-D133 CarbonylContact C-O 3.44Å; L108-D133 WeakPolarHBondContact CA-O 3.16Å; L108-D133 PolarHBondContact N-O 2.75Å; N109-D133 PolarHBondContact N-O 3Å; D133-S135 WeakPolarHBondContact OD1-CB 3.26Å; D133-S135 PolarHBondContact OD1-N 3.07Å; D133-S135 PolarHBondContact OD1-OG 3.49Å; D133-N159 HydrophobicContact CB-CB 4.38Å; D133-N159 PolarHBondContact OD1-ND2 2.86Å; D133-N159 PolarHBondContact OD2-ND2 3.08Å
134	L	98.5	Very high	95.1	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.208	C	C	.	.			trans	-114.1	21	175.1	-68.9	172.9	0	0	0	111.8	F60 L108 I113 L132 N137 L139 I148 L158 N159 L160 N163	F60-L134 HydrophobicContact CD2-CD2 3.83Å; F60-L134 HydrophobicContact CE2-CD2 3.99Å; L108-L134 HydrophobicContact CB-CD2 4.04Å; L108-L134 HydrophobicContact CD1-CD2 4.37Å; I113-L134 HydrophobicContact CD1-CD2 3.71Å; L132-L134 HydrophobicContact CD1-CD2 4.14Å; L132-L134 HydrophobicContact CD1-CG 4.03Å; L132-L134 HydrophobicContact CD2-CD1 3.71Å; L132-L134 HydrophobicContact CD2-CG 4Å; L132-L134 HydrophobicContact CG-CD1 4.1Å; L132-L134 HydrophobicContact CG-CD2 4.46Å; L132-L134 HydrophobicContact CG-CG 3.83Å; L134-N137 VanDerWaalsContact C-ND2 3.26Å; L134-N137 PolarHBondContact O-ND2 3.46Å; L134-L139 HydrophobicContact CB-CD1 4.09Å; L134-L139 HydrophobicContact CD1-CD1 4.06Å; L134-I148 HydrophobicContact CD1-CD1 4.38Å; L134-I148 HydrophobicContact CD1-CG2 4.41Å; L134-L158 HydrophobicContact CD1-CD1 4.38Å; L134-N159 CarbonylContact C-O 3.47Å; L134-N159 WeakPolarHBondContact CA-O 3.27Å; L134-N159 PolarHBondContact N-O 2.8Å; L134-L160 HydrophobicContact CB-CD2 4.1Å; L134-L160 HydrophobicContact CD1-CD2 4.17Å; L134-N163 PolarHBondContact O-ND2 3.05Å
135	S	98.6	Very high	95.6	Very high	8 Å²	8	36 Å²	36	6%	0.056	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	155.2	-178.7	61.1	0	0	0	0	113	N109 G110 D133 N137 N159 S161	N109-S135 CarbonylContact C-O 3.45Å; N109-S135 WeakPolarHBondContact CA-O 3.47Å; N109-S135 WeakPolarHBondContact CB-O 3.16Å; N109-S135 WeakPolarHBondContact CB-OG 3.37Å; G110-S135 PolarHBondContact N-O 3.41Å; D133-S135 WeakPolarHBondContact OD1-CB 3.26Å; D133-S135 PolarHBondContact OD1-N 3.07Å; D133-S135 PolarHBondContact OD1-OG 3.49Å; S135-N137 VanDerWaalsContact C-N 3.29Å; S135-N137 PolarHBondContact O-N 3.44Å; S135-N137 PolarHBondContact O-ND2 3.43Å; S135-N159 PolarHBondContact N-O 3.09Å; S135-S161 CarbonylContact C-O 3.53Å; S135-S161 WeakPolarHBondContact CA-O 3.34Å; S135-S161 VanDerWaalsContact CB-O 3.27Å; S135-S161 WeakPolarHBondContact CB-O 3.28Å
136	H	97.9	Very high	96.1	Very high	113 Å²	113	36.7 Å²	36.7	52%	0.523	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.4	40	178.8	-60.7	-89.9	0	0	0	113.6	G110 S161 S162	G110-H136 WeakPolarHBondContact CA-O 2.93Å; G110-H136 PolarHBondContact N-O 3.38Å; H136-S161 PolarHBondContact N-O 2.62Å; H136-S162 PolarHBondContact CE1-OG 3.01Å; H136-S162 VanDerWaalsContact CE1-OG 3.23Å; H136-S162 WeakPolarHBondContact ND1-CB 3.37Å
137	N	97.9	Very high	96.4	Very high	3 Å²	3	40.4 Å²	40.4	2%	0.016	21%	0.205	C	C	.	.	S	Bend	trans	-110.9	-174.4	173.5	-79.1	-64.1	0	0	0	110.5	L108 C111 G112 I113 L134 S135 L139 N163 P164	L108-N137 PolarHBondContact O-ND2 3.07Å; C111-N137 PolarHBondContact N-OD1 2.89Å; G112-N137 PolarHBondContact N-OD1 2.83Å; I113-N137 HydrophobicContact CB-CB 4.2Å; I113-N137 PolarHBondContact N-OD1 3.4Å; L134-N137 VanDerWaalsContact C-ND2 3.26Å; L134-N137 PolarHBondContact O-ND2 3.46Å; S135-N137 VanDerWaalsContact C-N 3.29Å; S135-N137 PolarHBondContact O-N 3.44Å; S135-N137 PolarHBondContact O-ND2 3.43Å; N137-L139 HydrophobicContact CB-CG 4.44Å; N137-N163 WeakPolarHBondContact CA-OD1 3.41Å; N137-N163 VanDerWaalsContact CB-OD1 3.23Å; N137-N163 WeakPolarHBondContact CB-OD1 3.25Å; N137-N163 PolarHBondContact N-OD1 3.47Å; N137-N163 PolarHBondContact O-OD1 2.96Å; N137-P164 WeakPolarHBondContact O-CD 3.48Å
138	N	96.8	Very high	96.7	Very high	86 Å²	86	38.2 Å²	38.2	46%	0.46	19%	0.187	S	C	.	.			trans	-106.6	30.4	-176.8	-62.5	-24	0	0	0	111.4	I113 Q140	I113-N138 CarbonylContact O-C 3.34Å; I113-N138 VanDerWaalsContact O-C 3.3Å; I113-N138 WeakPolarHBondContact O-CA 3.29Å; I113-N138 PolarHBondContact O-N 2.93Å; N138-Q140 PolarHBondContact O-N 3.18Å
139	L	96.4	Very high	97.1	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.177	C	C	.	.			trans	-74.6	119	179.8	-64	163.1	0	0	0	109.8	I113 L134 N137 I145 I148 L160 N163 P164 L165	I113-L139 HydrophobicContact CG2-CD2 4.04Å; I113-L139 PolarHBondContact O-N 3.02Å; L134-L139 HydrophobicContact CB-CD1 4.09Å; L134-L139 HydrophobicContact CD1-CD1 4.06Å; N137-L139 HydrophobicContact CB-CG 4.44Å; L139-I145 HydrophobicContact CB-CD1 4.13Å; L139-I145 HydrophobicContact CB-CG1 4.14Å; L139-I145 HydrophobicContact CD1-CG1 4.27Å; L139-I145 HydrophobicContact CD2-CG1 4.27Å; L139-I145 HydrophobicContact CG-CG1 4.47Å; L139-I148 HydrophobicContact CD2-CD1 4.49Å; L139-L160 HydrophobicContact CD1-CD2 4.08Å; L139-N163 HydrophobicContact CB-CB 4.28Å; L139-N163 VanDerWaalsContact CB-OD1 3.32Å; L139-N163 WeakPolarHBondContact CB-OD1 3.04Å; L139-N163 PolarHBondContact N-OD1 3.4Å; L139-P164 WeakPolarHBondContact O-CD 3.33Å; L139-L165 VanDerWaalsContact O-CD2 3.28Å; L139-L165 WeakPolarHBondContact O-CD2 3.44Å
140	Q	95.1	Very high	97.2	Very high	116 Å²	116	39 Å²	39	54%	0.542	20%	0.198	S	C	.	.			trans	-124.1	-3.8	179.6	-62.4	-178.7	19.8	0	0	112.3	N138 P164 T168	N138-Q140 PolarHBondContact O-N 3.18Å; Q140-P164 HydrophobicContact CG-CB 4.06Å; Q140-P164 HydrophobicContact CG-CG 3.59Å; Q140-P164 WeakPolarHBondContact CG-O 3.46Å; Q140-T168 WeakPolarHBondContact O-CG2 3.44Å
141	D	94.9	Very high	97.2	Very high	64 Å²	64	36.5 Å²	36.5	34%	0.342	19%	0.186	S	C	.	.			trans	-123.6	114	-169.4	-174.2	-26.5	0	0	0	109.1	Q143 E144 I145	D141-Q143 PolarHBondContact O-N 2.96Å; D141-Q143 WeakPolarHBondContact OD1-CA 3.49Å; D141-Q143 WeakPolarHBondContact OD1-CB 3.43Å; D141-Q143 PolarHBondContact OD1-N 3.5Å; D141-Q143 PolarHBondContact OD1-OE1 3.28Å; D141-E144 HydrophobicContact CB-CB 4.13Å; D141-E144 HydrophobicContact CB-CG 3.96Å; D141-E144 PolarHBondContact O-N 2.68Å; D141-E144 PolarHBondContact OD1-N 3.4Å; D141-I145 WeakPolarHBondContact O-CG1 3.41Å; D141-I145 PolarHBondContact O-N 2.85Å
142	W	96.9	Very high	97.1	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-64.9	-27.2	178.6	-74.6	108.2	0	0	0	112.6	I145 S146 L160 L165 T168 L170 C174 F178 L186 I191 T195 L199	W142-I145 HydrophobicContact CD2-CD1 4.37Å; W142-I145 HydrophobicContact CE3-CB 4.49Å; W142-I145 HydrophobicContact CE3-CD1 3.93Å; W142-I145 HydrophobicContact CE3-CG2 4.49Å; W142-I145 HydrophobicContact CZ3-CD1 4.26Å; W142-I145 PolarHBondContact O-N 3.35Å; W142-S146 VanDerWaalsContact O-CB 3.23Å; W142-S146 WeakPolarHBondContact O-CB 3.38Å; W142-S146 PolarHBondContact O-N 3.34Å; W142-S146 PolarHBondContact O-OG 3.36Å; W142-L160 HydrophobicContact CZ3-CD1 4.28Å; W142-L165 HydrophobicContact CH2-CD1 3.83Å; W142-L165 HydrophobicContact CZ2-CB 4.36Å; W142-L165 HydrophobicContact CZ2-CD1 3.83Å; W142-L165 HydrophobicContact CZ2-CD2 4.47Å; W142-L165 HydrophobicContact CZ2-CG 4.45Å; W142-T168 VanDerWaalsContact CD1-OG1 3.31Å; W142-T168 PolarHBondContact NE1-OG1 3.27Å; W142-L170 HydrophobicContact CB-CD1 3.8Å; W142-L170 HydrophobicContact CD2-CB 4.24Å; W142-L170 HydrophobicContact CD2-CD1 3.71Å; W142-L170 HydrophobicContact CD2-CG 4.46Å; W142-L170 HydrophobicContact CE3-CD1 3.83Å; W142-L170 HydrophobicContact CG-CB 4.1Å; W142-L170 HydrophobicContact CG-CD1 3.7Å; W142-C174 HydrophobicContact CB-CB 4.48Å; W142-F178 HydrophobicContact CE3-CE2 4.46Å; W142-F178 HydrophobicContact CE3-CZ 4Å; W142-F178 HydrophobicContact CZ3-CE1 4.45Å; W142-F178 AromaticContact CZ3-CZ 3.83Å; W142-F178 HydrophobicContact CZ3-CZ 3.83Å; W142-L186 HydrophobicContact CH2-CD2 4.22Å; W142-I191 HydrophobicContact CZ2-CG2 3.95Å; W142-T195 HydrophobicContact CZ2-CG2 3.89Å; W142-L199 HydrophobicContact CH2-CD1 4.39Å
143	Q	96.2	Very high	96.8	Very high	62 Å²	62	35.5 Å²	35.5	29%	0.29	19%	0.186	S	C	.	.	H	α-helix	trans	-67.5	-43.6	174.9	-67.8	70.4	-2.7	0	0	109.4	D141 S146 K147 E171	D141-Q143 PolarHBondContact O-N 2.96Å; D141-Q143 WeakPolarHBondContact OD1-CA 3.49Å; D141-Q143 WeakPolarHBondContact OD1-CB 3.43Å; D141-Q143 PolarHBondContact OD1-N 3.5Å; D141-Q143 PolarHBondContact OD1-OE1 3.28Å; Q143-S146 WeakPolarHBondContact CA-OG 3.47Å; Q143-S146 PolarHBondContact O-N 3.47Å; Q143-S146 PolarHBondContact O-OG 3.12Å; Q143-K147 WeakPolarHBondContact O-CG 3.39Å; Q143-K147 PolarHBondContact O-N 3.26Å; Q143-E171 VanDerWaalsContact NE2-CD 3.28Å; Q143-E171 PolarHBondContact NE2-OE2 2.82Å
144	E	96.7	Very high	96.6	Very high	33 Å²	33	38 Å²	38	15%	0.154	20%	0.199	C	C	.	.	H	α-helix	trans	-64.2	-42.8	174.1	-67.4	-58.6	127.1	0	0	112.1	K115 A116 D141 S146 K147 I148	K115-E144 HydrophobicContact CB-CG 4.29Å; A116-E144 WeakPolarHBondContact CB-OE2 3.48Å; A116-E144 PolarHBondContact N-OE2 3.47Å; D141-E144 HydrophobicContact CB-CB 4.13Å; D141-E144 HydrophobicContact CB-CG 3.96Å; D141-E144 PolarHBondContact O-N 2.68Å; D141-E144 PolarHBondContact OD1-N 3.4Å; E144-S146 VanDerWaalsContact C-N 3.32Å; E144-S146 PolarHBondContact O-N 2.99Å; E144-K147 PolarHBondContact O-N 3.42Å; E144-K147 IonicContact OE1-NZ 2.86Å; E144-K147 PolarHBondContact OE1-NZ 3.15Å; E144-I148 PolarHBondContact O-N 2.97Å
145	I	97.7	Very high	96.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61	-44.2	174.8	-61.8	165.4	0	0	0	110.3	L139 D141 W142 K147 I148 V149 L160 L165 F178	L139-I145 HydrophobicContact CB-CD1 4.13Å; L139-I145 HydrophobicContact CB-CG1 4.14Å; L139-I145 HydrophobicContact CD1-CG1 4.27Å; L139-I145 HydrophobicContact CD2-CG1 4.27Å; L139-I145 HydrophobicContact CG-CG1 4.47Å; D141-I145 WeakPolarHBondContact O-CG1 3.41Å; D141-I145 PolarHBondContact O-N 2.85Å; W142-I145 HydrophobicContact CD2-CD1 4.37Å; W142-I145 HydrophobicContact CE3-CB 4.49Å; W142-I145 HydrophobicContact CE3-CD1 3.93Å; W142-I145 HydrophobicContact CE3-CG2 4.49Å; W142-I145 HydrophobicContact CZ3-CD1 4.26Å; W142-I145 PolarHBondContact O-N 3.35Å; I145-K147 VanDerWaalsContact C-N 3.31Å; I145-K147 PolarHBondContact O-N 2.81Å; I145-I148 PolarHBondContact O-N 3.11Å; I145-I148 VanDerWaalsContact O-N 3.13Å; I145-V149 HydrophobicContact CG2-CG2 4.04Å; I145-V149 WeakPolarHBondContact O-CG2 3.39Å; I145-V149 PolarHBondContact O-N 3.26Å; I145-L160 HydrophobicContact CG2-CD1 4.06Å; I145-L160 HydrophobicContact CG2-CD2 4.2Å; I145-L165 HydrophobicContact CD1-CD2 3.64Å; I145-F178 HydrophobicContact CG2-CE1 4.15Å; I145-F178 HydrophobicContact CG2-CZ 3.66Å
146	S	97.4	Very high	96.5	Very high	18 Å²	18	42 Å²	42	13%	0.126	22%	0.217	C	C	.	.	H	α-helix	trans	-62.5	-36.1	-180	77.9	0	0	0	0	112.5	W142 Q143 E144 I148 V149 S150	W142-S146 VanDerWaalsContact O-CB 3.23Å; W142-S146 WeakPolarHBondContact O-CB 3.38Å; W142-S146 PolarHBondContact O-N 3.34Å; W142-S146 PolarHBondContact O-OG 3.36Å; Q143-S146 WeakPolarHBondContact CA-OG 3.47Å; Q143-S146 PolarHBondContact O-N 3.47Å; Q143-S146 PolarHBondContact O-OG 3.12Å; E144-S146 VanDerWaalsContact C-N 3.32Å; E144-S146 PolarHBondContact O-N 2.99Å; S146-I148 VanDerWaalsContact C-N 3.35Å; S146-V149 PolarHBondContact O-N 3.27Å; S146-S150 WeakPolarHBondContact O-CB 3.44Å; S146-S150 PolarHBondContact O-N 2.88Å; S146-S150 PolarHBondContact O-OG 2.89Å
147	K	97.4	Very high	96.6	Very high	78 Å²	78	38.4 Å²	38.4	34%	0.339	20%	0.2	S	C	.	.	H	α-helix	trans	-62.3	-42	174.1	-71.3	170	-171.7	172.1	0	111.5	A116 Q119 Q143 E144 I145 S150 S151	A116-K147 HydrophobicContact CB-CB 3.77Å; A116-K147 HydrophobicContact CB-CD 4.27Å; Q119-K147 PolarHBondContact NE2-O 2.75Å; Q143-K147 WeakPolarHBondContact O-CG 3.39Å; Q143-K147 PolarHBondContact O-N 3.26Å; E144-K147 PolarHBondContact O-N 3.42Å; E144-K147 IonicContact OE1-NZ 2.86Å; E144-K147 PolarHBondContact OE1-NZ 3.15Å; I145-K147 VanDerWaalsContact C-N 3.31Å; I145-K147 PolarHBondContact O-N 2.81Å; K147-S150 PolarHBondContact O-OG 2.9Å; K147-S151 WeakPolarHBondContact O-CB 3.46Å; K147-S151 PolarHBondContact O-OG 2.87Å
148	I	97.7	Very high	96.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-64.4	-56.5	176	-60.3	167.7	0	0	0	109.4	F60 A116 I122 L132 L134 L139 E144 I145 S146 S150 S151 I152	F60-I148 HydrophobicContact CB-CD1 3.87Å; F60-I148 HydrophobicContact CB-CG1 4.23Å; F60-I148 HydrophobicContact CD1-CG2 4.48Å; F60-I148 HydrophobicContact CD2-CD1 4.03Å; F60-I148 HydrophobicContact CD2-CG1 4.43Å; F60-I148 HydrophobicContact CD2-CG2 3.98Å; F60-I148 HydrophobicContact CE1-CG2 4.29Å; F60-I148 HydrophobicContact CE2-CG2 3.77Å; F60-I148 HydrophobicContact CG-CD1 4.08Å; F60-I148 HydrophobicContact CG-CG1 4.22Å; F60-I148 HydrophobicContact CG-CG2 4.32Å; F60-I148 HydrophobicContact CZ-CG2 3.93Å; A116-I148 HydrophobicContact CB-CD1 4.32Å; A116-I148 HydrophobicContact CB-CG1 3.64Å; I122-I148 HydrophobicContact CD1-CG1 4.16Å; L132-I148 HydrophobicContact CD2-CG2 3.92Å; L134-I148 HydrophobicContact CD1-CD1 4.38Å; L134-I148 HydrophobicContact CD1-CG2 4.41Å; L139-I148 HydrophobicContact CD2-CD1 4.49Å; E144-I148 PolarHBondContact O-N 2.97Å; I145-I148 PolarHBondContact O-N 3.11Å; I145-I148 VanDerWaalsContact O-N 3.13Å; S146-I148 VanDerWaalsContact C-N 3.35Å; I148-S150 PolarHBondContact O-N 3.22Å; I148-S151 PolarHBondContact O-N 3.49Å; I148-S151 VanDerWaalsContact O-N 3.15Å; I148-I152 HydrophobicContact CG2-CD1 4.1Å; I148-I152 WeakPolarHBondContact O-CG1 3.03Å
149	V	97.3	Very high	96.7	Very high	4 Å²	4	35 Å²	35	2%	0.024	18%	0.182	C	C	.	.	H	α-helix	trans	-63.2	-45.1	-172.2	177.6	0	0	0	0	111.9	I145 S146 S151 I152 L155 L158 A177 F178	I145-V149 HydrophobicContact CG2-CG2 4.04Å; I145-V149 WeakPolarHBondContact O-CG2 3.39Å; I145-V149 PolarHBondContact O-N 3.26Å; S146-V149 PolarHBondContact O-N 3.27Å; V149-S151 PolarHBondContact O-N 3.38Å; V149-S151 VanDerWaalsContact O-N 3.16Å; V149-I152 PolarHBondContact O-N 3.17Å; V149-I152 VanDerWaalsContact O-N 3.11Å; V149-L155 HydrophobicContact CG1-CD2 4.06Å; V149-L155 HydrophobicContact CG2-CD2 4.43Å; V149-L158 HydrophobicContact CG2-CD2 3.68Å; V149-A177 WeakPolarHBondContact CG1-O 3.45Å; V149-F178 HydrophobicContact CG1-CD1 4.14Å; V149-F178 HydrophobicContact CG1-CG 4.3Å; V149-F178 HydrophobicContact CG2-CD1 4.4Å; V149-F178 HydrophobicContact CG2-CE1 3.99Å; V149-F178 HydrophobicContact CG2-CZ 4.31Å
150	S	96.1	Very high	96.8	Very high	64 Å²	64	35 Å²	35	45%	0.448	18%	0.182	S	C	.	.	H	α-helix	trans	-64.1	-20.2	179.2	59	0	0	0	0	113.9	Q119 S146 K147 I148	Q119-S150 PolarHBondContact NE2-OG 3.49Å; S146-S150 WeakPolarHBondContact O-CB 3.44Å; S146-S150 PolarHBondContact O-N 2.88Å; S146-S150 PolarHBondContact O-OG 2.89Å; K147-S150 PolarHBondContact O-OG 2.9Å; I148-S150 PolarHBondContact O-N 3.22Å
151	S	96.4	Very high	97	Very high	9 Å²	9	30 Å²	30	6%	0.063	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-3.6	179.6	-53.5	0	0	0	0	113.3	Q119 A123 K147 I148 V149 P153	Q119-S151 WeakPolarHBondContact CG-OG 2.99Å; Q119-S151 PolarHBondContact NE2-OG 3.14Å; Q119-S151 VanDerWaalsContact NE2-OG 3.12Å; A123-S151 WeakPolarHBondContact CA-O 3.43Å; K147-S151 WeakPolarHBondContact O-CB 3.46Å; K147-S151 PolarHBondContact O-OG 2.87Å; I148-S151 PolarHBondContact O-N 3.49Å; I148-S151 VanDerWaalsContact O-N 3.15Å; V149-S151 PolarHBondContact O-N 3.38Å; V149-S151 VanDerWaalsContact O-N 3.16Å; S151-P153 VanDerWaalsContact O-CD 3.3Å; S151-P153 WeakPolarHBondContact O-CD 3.4Å
152	I	95.8	Very high	97.2	Very high	4 Å²	4	28.1 Å²	28.1	2%	0.021	15%	0.152	C	C	.	.			trans	-113.4	86.6	179.9	-53.9	177.6	0	0	0	107.9	F60 I122 C126 V129 L132 I148 V149 N154 L155	F60-I152 HydrophobicContact CZ-CD1 4.36Å; I122-I152 HydrophobicContact CG2-CG1 4.23Å; C126-I152 HydrophobicContact CB-CD1 4.09Å; C126-I152 HydrophobicContact CB-CG1 3.68Å; C126-I152 HydrophobicContact CB-CG2 4.36Å; V129-I152 HydrophobicContact CB-CG2 3.81Å; V129-I152 HydrophobicContact CG1-CG2 4.03Å; V129-I152 WeakPolarHBondContact O-CG2 3.19Å; L132-I152 HydrophobicContact CD2-CD1 3.65Å; I148-I152 HydrophobicContact CG2-CD1 4.1Å; I148-I152 WeakPolarHBondContact O-CG1 3.03Å; V149-I152 PolarHBondContact O-N 3.17Å; V149-I152 VanDerWaalsContact O-N 3.11Å; I152-N154 PolarHBondContact O-N 3.37Å; I152-N154 VanDerWaalsContact O-N 3.13Å; I152-L155 HydrophobicContact CB-CB 4.14Å; I152-L155 HydrophobicContact CG2-CB 3.81Å; I152-L155 HydrophobicContact CG2-CD1 4.01Å; I152-L155 HydrophobicContact CG2-CG 4.44Å; I152-L155 WeakPolarHBondContact O-CB 3.47Å; I152-L155 PolarHBondContact O-N 3.03Å
153	P	92.7	Very high	97.2	Very high	48 Å²	48	28.2 Å²	28.2	31%	0.312	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-23.3	-166.9	25.2	-35.1	0	0	0	113.7	S151 R180	S151-P153 VanDerWaalsContact O-CD 3.3Å; S151-P153 WeakPolarHBondContact O-CD 3.4Å; P153-R180 WeakPolarHBondContact O-CD 3.38Å; P153-R180 PolarHBondContact O-NH1 3.47Å
154	N	94.4	Very high	97.2	Very high	87 Å²	87	28 Å²	28	47%	0.465	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.7	19.7	-175.9	-60	-52.5	0	0	0	112.8	A127 V129 I130 I152 E156	A127-N154 PolarHBondContact O-ND2 2.92Å; V129-N154 CarbonylContact O-C 3.58Å; I130-N154 WeakPolarHBondContact CA-O 3.48Å; I152-N154 PolarHBondContact O-N 3.37Å; I152-N154 VanDerWaalsContact O-N 3.13Å; N154-E156 PolarHBondContact O-N 2.84Å
155	L	97.6	Very high	97.2	Very high	3 Å²	3	26.5 Å²	26.5	2%	0.016	15%	0.149	C	C	.	.			trans	-71	111.5	-175.3	-166	73	0	0	0	112.2	V129 L132 V149 I152 F157 L158 R180 V181	V129-L155 HydrophobicContact CG1-CD1 4.47Å; L132-L155 HydrophobicContact CB-CD1 3.55Å; V149-L155 HydrophobicContact CG1-CD2 4.06Å; V149-L155 HydrophobicContact CG2-CD2 4.43Å; I152-L155 HydrophobicContact CB-CB 4.14Å; I152-L155 HydrophobicContact CG2-CB 3.81Å; I152-L155 HydrophobicContact CG2-CD1 4.01Å; I152-L155 HydrophobicContact CG2-CG 4.44Å; I152-L155 WeakPolarHBondContact O-CB 3.47Å; I152-L155 PolarHBondContact O-N 3.03Å; L155-F157 WeakPolarHBondContact CD1-O 3.43Å; L155-L158 HydrophobicContact CD2-CB 4.18Å; L155-L158 HydrophobicContact CD2-CD1 4.34Å; L155-L158 HydrophobicContact CD2-CD2 4.48Å; L155-R180 CarbonylContact O-C 3.5Å; L155-V181 HydrophobicContact CD2-CG2 4.41Å
156	E	98.1	Very high	96.9	Very high	89 Å²	89	28.7 Å²	28.7	42%	0.416	17%	0.168	S	C	.	.			trans	-102.7	-32	176.8	-66	-172	-160	0	0	112.3	I130 N154 R182 R183	I130-E156 HydrophobicContact CG2-CB 4.05Å; I130-E156 HydrophobicContact CG2-CG 4.11Å; I130-E156 PolarHBondContact O-N 2.78Å; N154-E156 PolarHBondContact O-N 2.84Å; E156-R182 PolarHBondContact O-N 3.41Å; E156-R183 PolarHBondContact O-N 3.12Å
157	F	98.7	Very high	96.2	Very high	36 Å²	36	31.9 Å²	31.9	16%	0.158	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	129.1	178.8	175.4	-98.7	0	0	0	111.7	I130 E131 L132 L155 N159 R183 V185	I130-F157 PolarHBondContact O-N 3.09Å; I130-F157 VanDerWaalsContact O-N 3.17Å; E131-F157 HydrophobicContact CB-CB 3.92Å; E131-F157 HydrophobicContact CB-CD1 3.94Å; E131-F157 HydrophobicContact CB-CG 4.34Å; E131-F157 HydrophobicContact CG-CB 3.78Å; E131-F157 HydrophobicContact CG-CD1 4.5Å; E131-F157 HydrophobicContact CG-CG 4.46Å; L132-F157 PolarHBondContact N-O 3.25Å; L155-F157 WeakPolarHBondContact CD1-O 3.43Å; F157-N159 HydrophobicContact CE1-CB 3.81Å; F157-N159 HydrophobicContact CZ-CB 3.84Å; F157-R183 WeakPolarHBondContact CA-O 3.47Å; F157-R183 HydrophobicContact CD2-CB 3.8Å; F157-R183 HydrophobicContact CD2-CG 3.5Å; F157-R183 VanDerWaalsContact CD2-CG 3.5Å; F157-R183 HydrophobicContact CE2-CG 3.73Å; F157-V185 HydrophobicContact CE2-CG2 3.64Å; F157-V185 HydrophobicContact CZ-CG2 3.9Å
158	L	98.8	Very high	95.7	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	124.6	174.3	178.8	60.6	0	0	0	111.1	L132 L134 V149 L155 L160 F178 V181 R183 L184 V185	L132-L158 HydrophobicContact CB-CD1 4.31Å; L132-L158 HydrophobicContact CD2-CD1 4.22Å; L132-L158 HydrophobicContact CG-CD1 4.25Å; L132-L158 WeakPolarHBondContact O-CA 3.49Å; L134-L158 HydrophobicContact CD1-CD1 4.38Å; V149-L158 HydrophobicContact CG2-CD2 3.68Å; L155-L158 HydrophobicContact CD2-CB 4.18Å; L155-L158 HydrophobicContact CD2-CD1 4.34Å; L155-L158 HydrophobicContact CD2-CD2 4.48Å; L158-L160 HydrophobicContact CD1-CD2 4.35Å; L158-L160 HydrophobicContact CD1-CG 4.18Å; L158-L160 HydrophobicContact CD2-CD1 3.86Å; L158-L160 HydrophobicContact CD2-CG 4.16Å; L158-L160 HydrophobicContact CG-CD1 4.21Å; L158-L160 HydrophobicContact CG-CG 3.98Å; L158-F178 HydrophobicContact CD2-CD1 3.78Å; L158-F178 HydrophobicContact CD2-CE1 3.51Å; L158-V181 HydrophobicContact CB-CG1 4.35Å; L158-V181 HydrophobicContact CB-CG2 4.47Å; L158-R183 PolarHBondContact N-O 3.46Å; L158-L184 HydrophobicContact CB-CD1 4.13Å; L158-L184 HydrophobicContact CD2-CD1 4.07Å; L158-L184 HydrophobicContact CG-CD1 4.15Å; L158-V185 PolarHBondContact O-N 2.71Å
159	N	98.8	Very high	95.4	Very high	19 Å²	19	35.3 Å²	35.3	10%	0.102	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	117.2	171.4	-176.4	9.3	0	0	0	111	L132 D133 L134 S135 F157 S161 V185	L132-N159 PolarHBondContact O-N 3.19Å; D133-N159 HydrophobicContact CB-CB 4.38Å; D133-N159 PolarHBondContact OD1-ND2 2.86Å; D133-N159 PolarHBondContact OD2-ND2 3.08Å; L134-N159 CarbonylContact C-O 3.47Å; L134-N159 WeakPolarHBondContact CA-O 3.27Å; L134-N159 PolarHBondContact N-O 2.8Å; S135-N159 PolarHBondContact N-O 3.09Å; F157-N159 HydrophobicContact CE1-CB 3.81Å; F157-N159 HydrophobicContact CZ-CB 3.84Å; N159-S161 VanDerWaalsContact OD1-CB 3.22Å; N159-S161 WeakPolarHBondContact OD1-CB 3.44Å; N159-S161 PolarHBondContact OD1-N 2.86Å; N159-S161 PolarHBondContact OD1-OG 2.9Å; N159-V185 HydrophobicContact CB-CB 4.11Å; N159-V185 HydrophobicContact CB-CG2 4.36Å
160	L	98.7	Very high	95.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	23%	0.232	C	C	.	.			trans	-115.3	14.1	177.6	-71.3	169.7	0	0	0	112	L134 L139 W142 I145 L158 N163 F178 V185 L186 T189	L134-L160 HydrophobicContact CB-CD2 4.1Å; L134-L160 HydrophobicContact CD1-CD2 4.17Å; L139-L160 HydrophobicContact CD1-CD2 4.08Å; W142-L160 HydrophobicContact CZ3-CD1 4.28Å; I145-L160 HydrophobicContact CG2-CD1 4.06Å; I145-L160 HydrophobicContact CG2-CD2 4.2Å; L158-L160 HydrophobicContact CD1-CD2 4.35Å; L158-L160 HydrophobicContact CD1-CG 4.18Å; L158-L160 HydrophobicContact CD2-CD1 3.86Å; L158-L160 HydrophobicContact CD2-CG 4.16Å; L158-L160 HydrophobicContact CG-CD1 4.21Å; L158-L160 HydrophobicContact CG-CG 3.98Å; L160-N163 PolarHBondContact O-N 2.86Å; L160-N163 PolarHBondContact O-ND2 3.16Å; L160-F178 HydrophobicContact CD1-CE1 4.24Å; L160-V185 PolarHBondContact N-O 2.86Å; L160-L186 HydrophobicContact CB-CD2 3.89Å; L160-L186 HydrophobicContact CD1-CD2 4.03Å; L160-T189 WeakPolarHBondContact O-CG2 3.43Å
161	S	98.8	Very high	95.2	Very high	9 Å²	9	36 Å²	36	6%	0.063	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	147.1	-174	-57.5	0	0	0	0	112.9	S135 H136 N159 N163 V185 N187	S135-S161 CarbonylContact C-O 3.53Å; S135-S161 WeakPolarHBondContact CA-O 3.34Å; S135-S161 VanDerWaalsContact CB-O 3.27Å; S135-S161 WeakPolarHBondContact CB-O 3.28Å; H136-S161 PolarHBondContact N-O 2.62Å; N159-S161 VanDerWaalsContact OD1-CB 3.22Å; N159-S161 WeakPolarHBondContact OD1-CB 3.44Å; N159-S161 PolarHBondContact OD1-N 2.86Å; N159-S161 PolarHBondContact OD1-OG 2.9Å; S161-N163 PolarHBondContact O-N 2.75Å; S161-N163 PolarHBondContact O-ND2 3.41Å; S161-V185 WeakPolarHBondContact OG-CG1 3.38Å; S161-N187 CarbonylContact C-O 3.49Å; S161-N187 WeakPolarHBondContact CA-O 3.48Å; S161-N187 WeakPolarHBondContact CB-O 3.42Å; S161-N187 PolarHBondContact OG-N 2.75Å
162	S	98.3	Very high	95	Very high	26 Å²	26	38.9 Å²	38.9	18%	0.182	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	32.7	177.1	-53.4	0	0	0	0	114.1	H136 N187 N188	H136-S162 PolarHBondContact CE1-OG 3.01Å; H136-S162 VanDerWaalsContact CE1-OG 3.23Å; H136-S162 WeakPolarHBondContact ND1-CB 3.37Å; S162-N187 PolarHBondContact N-O 3.48Å; S162-N188 VanDerWaalsContact CA-O 3.29Å; S162-N188 WeakPolarHBondContact CA-O 3.35Å; S162-N188 PolarHBondContact N-O 2.85Å; S162-N188 PolarHBondContact OG-ND2 3.43Å
163	N	98.2	Very high	94.7	Very high	3 Å²	3	44.1 Å²	44.1	2%	0.016	27%	0.27	C	S	.	.			trans	-100	143.1	164.4	-78.1	-84.9	0	0	0	109.9	L134 N137 L139 L160 S161 L165	L134-N163 PolarHBondContact O-ND2 3.05Å; N137-N163 WeakPolarHBondContact CA-OD1 3.41Å; N137-N163 VanDerWaalsContact CB-OD1 3.23Å; N137-N163 WeakPolarHBondContact CB-OD1 3.25Å; N137-N163 PolarHBondContact N-OD1 3.47Å; N137-N163 PolarHBondContact O-OD1 2.96Å; L139-N163 HydrophobicContact CB-CB 4.28Å; L139-N163 VanDerWaalsContact CB-OD1 3.32Å; L139-N163 WeakPolarHBondContact CB-OD1 3.04Å; L139-N163 PolarHBondContact N-OD1 3.4Å; L160-N163 PolarHBondContact O-N 2.86Å; L160-N163 PolarHBondContact O-ND2 3.16Å; S161-N163 PolarHBondContact O-N 2.75Å; S161-N163 PolarHBondContact O-ND2 3.41Å; N163-L165 HydrophobicContact CB-CD1 4.42Å; N163-L165 HydrophobicContact CB-CD2 4.5Å; N163-L165 HydrophobicContact CB-CG 4.09Å; N163-L165 PolarHBondContact O-N 3.37Å
164	P	95.9	Very high	94.8	Very high	59 Å²	59	42 Å²	42	38%	0.383	26%	0.256	S	S	.	.			trans	-75.4	67.5	-177.3	22.1	-22.5	0	0	0	113.2	N137 L139 Q140 A166	N137-P164 WeakPolarHBondContact O-CD 3.48Å; L139-P164 WeakPolarHBondContact O-CD 3.33Å; Q140-P164 HydrophobicContact CG-CB 4.06Å; Q140-P164 HydrophobicContact CG-CG 3.59Å; Q140-P164 WeakPolarHBondContact CG-O 3.46Å; P164-A166 VanDerWaalsContact C-N 3.33Å
165	L	96.1	Very high	94.8	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	23%	0.234	C	C	.	.			trans	-87.7	0.1	-177.9	-58	174.5	0	0	0	113.5	L139 W142 I145 N163 G167 T168 L186 T189 I191	L139-L165 VanDerWaalsContact O-CD2 3.28Å; L139-L165 WeakPolarHBondContact O-CD2 3.44Å; W142-L165 HydrophobicContact CH2-CD1 3.83Å; W142-L165 HydrophobicContact CZ2-CB 4.36Å; W142-L165 HydrophobicContact CZ2-CD1 3.83Å; W142-L165 HydrophobicContact CZ2-CD2 4.47Å; W142-L165 HydrophobicContact CZ2-CG 4.45Å; I145-L165 HydrophobicContact CD1-CD2 3.64Å; N163-L165 HydrophobicContact CB-CD1 4.42Å; N163-L165 HydrophobicContact CB-CD2 4.5Å; N163-L165 HydrophobicContact CB-CG 4.09Å; N163-L165 PolarHBondContact O-N 3.37Å; L165-G167 PolarHBondContact O-N 2.86Å; L165-T168 PolarHBondContact O-N 3.49Å; L165-T168 PolarHBondContact O-OG1 3.36Å; L165-L186 HydrophobicContact CD1-CD2 4.3Å; L165-T189 HydrophobicContact CD1-CG2 4.04Å; L165-I191 HydrophobicContact CB-CG2 3.54Å; L165-I191 HydrophobicContact CD1-CG2 4.11Å; L165-I191 HydrophobicContact CG-CG2 4.48Å
166	A	92.3	Very high	94.6	Very high	46 Å²	46	43.5 Å²	43.5	38%	0.38	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	131.8	179	0	0	0	0	0	112.2	P164 T168 T189 Q190	P164-A166 VanDerWaalsContact C-N 3.33Å; A166-T168 PolarHBondContact O-N 3.4Å; A166-T168 VanDerWaalsContact O-N 3.16Å; A166-T189 PolarHBondContact N-O 2.98Å; A166-Q190 HydrophobicContact CB-CB 3.87Å
167	G	82.5	Confident	94.4	Very high	85 Å²	85	40.3 Å²	40.3	88%	0.876	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.3	0.8	175.3	0	0	0	0	0	115.7	L165	L165-G167 PolarHBondContact O-N 2.86Å
168	T	87.7	Confident	94.3	Very high	35 Å²	35	38.6 Å²	38.6	22%	0.215	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-84.2	134.1	177.2	66.4	0	0	0	0	109.4	Q140 W142 L165 A166	Q140-T168 WeakPolarHBondContact O-CG2 3.44Å; W142-T168 VanDerWaalsContact CD1-OG1 3.31Å; W142-T168 PolarHBondContact NE1-OG1 3.27Å; L165-T168 PolarHBondContact O-N 3.49Å; L165-T168 PolarHBondContact O-OG1 3.36Å; A166-T168 PolarHBondContact O-N 3.4Å; A166-T168 VanDerWaalsContact O-N 3.16Å
169	T	90.7	Very high	94.1	Very high	115 Å²	115	40.9 Å²	40.9	71%	0.706	26%	0.258	S	S	*	.	P	Polyproline II helix	trans	-91	117.2	-179.7	-59	0	0	0	0	109.4	E171	T169-E171 PolarHBondContact O-N 3.46Å
170	L	94.4	Very high	93.9	Very high	8 Å²	8	46.6 Å²	46.6	4%	0.042	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-74.4	119.4	169.3	177	63.9	0	0	0	109.2	W142 C174 A175 T195 L198 L199	W142-L170 HydrophobicContact CB-CD1 3.8Å; W142-L170 HydrophobicContact CD2-CB 4.24Å; W142-L170 HydrophobicContact CD2-CD1 3.71Å; W142-L170 HydrophobicContact CD2-CG 4.46Å; W142-L170 HydrophobicContact CE3-CD1 3.83Å; W142-L170 HydrophobicContact CG-CB 4.1Å; W142-L170 HydrophobicContact CG-CD1 3.7Å; L170-C174 HydrophobicContact CD1-CB 3.71Å; L170-A175 HydrophobicContact CD1-CB 4.35Å; L170-A175 HydrophobicContact CD2-CB 3.96Å; L170-A175 HydrophobicContact CG-CB 4.2Å; L170-T195 HydrophobicContact CB-CG2 3.88Å; L170-T195 HydrophobicContact CD2-CG2 3.94Å; L170-L198 HydrophobicContact CB-CD2 4.1Å; L170-L198 HydrophobicContact CD2-CB 4.45Å; L170-L198 HydrophobicContact CD2-CD2 3.98Å; L170-L198 HydrophobicContact CD2-CG 4.24Å; L170-L198 HydrophobicContact CG-CD2 3.78Å; L170-L198 WeakPolarHBondContact O-CD2 3.46Å; L170-L199 HydrophobicContact CD2-CD1 4.36Å; L170-L199 HydrophobicContact CD2-CD2 3.53Å; L170-L199 HydrophobicContact CD2-CG 3.56Å
171	E	93.9	Very high	93.8	Very high	74 Å²	74	46.6 Å²	46.6	35%	0.346	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-82.7	147.5	173	-60	-176.9	134.9	0	0	110.8	Q143 T169 Q173 C174 A175	Q143-E171 VanDerWaalsContact NE2-CD 3.28Å; Q143-E171 PolarHBondContact NE2-OE2 2.82Å; T169-E171 PolarHBondContact O-N 3.46Å; E171-Q173 VanDerWaalsContact C-N 3.31Å; E171-Q173 HydrophobicContact CB-CG 4.23Å; E171-Q173 PolarHBondContact O-N 3.13Å; E171-Q173 PolarHBondContact OE2-NE2 3.41Å; E171-C174 WeakPolarHBondContact O-CB 3.16Å; E171-C174 PolarHBondContact O-N 3.26Å; E171-A175 PolarHBondContact O-N 3.32Å; E171-A175 VanDerWaalsContact O-N 3.14Å
172	P	91.8	Very high	93.8	Very high	70 Å²	70	50.7 Å²	50.7	46%	0.455	29%	0.292	S	S	.	.	H	α-helix	trans	-54	-42.6	179.6	-28	35.7	0	0	0	113.9	C174 A175 E176 L198	P172-C174 PolarHBondContact O-N 3.31Å; P172-A175 WeakPolarHBondContact O-CB 3.38Å; P172-A175 PolarHBondContact O-N 2.64Å; P172-E176 PolarHBondContact O-N 3.39Å; P172-L198 HydrophobicContact CG-CD1 4.36Å
173	Q	90.9	Very high	93.8	Very high	114 Å²	114	53.8 Å²	53.8	53%	0.533	30%	0.3	S	S	.	.	H	α-helix	trans	-59.5	-32.8	176.8	58.9	-93.9	15.2	0	0	113.5	E171	E171-Q173 VanDerWaalsContact C-N 3.31Å; E171-Q173 HydrophobicContact CB-CG 4.23Å; E171-Q173 PolarHBondContact O-N 3.13Å; E171-Q173 PolarHBondContact OE2-NE2 3.41Å
174	C	94.6	Very high	93.9	Very high	4 Å²	4	53.7 Å²	53.7	3%	0.027	30%	0.299	C	S	.	.	H	α-helix	trans	-75	-35.3	177.6	-63.5	0	0	0	0	110.5	W142 L170 E171 P172 E176 A177 F178	W142-C174 HydrophobicContact CB-CB 4.48Å; L170-C174 HydrophobicContact CD1-CB 3.71Å; E171-C174 WeakPolarHBondContact O-CB 3.16Å; E171-C174 PolarHBondContact O-N 3.26Å; P172-C174 PolarHBondContact O-N 3.31Å; C174-E176 VanDerWaalsContact C-N 3.32Å; C174-E176 PolarHBondContact O-N 3.26Å; C174-A177 VanDerWaalsContact O-CB 3.28Å; C174-A177 WeakPolarHBondContact O-CB 3.38Å; C174-A177 PolarHBondContact O-N 3.2Å; C174-F178 WeakPolarHBondContact O-CD2 3.21Å; C174-F178 VanDerWaalsContact O-CE2 3.31Å; C174-F178 WeakPolarHBondContact O-CE2 3.5Å
175	A	94.1	Very high	94	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-65.9	-33	178.7	0	0	0	0	0	112.5	L170 E171 P172 A177 F178 L198 N202	L170-A175 HydrophobicContact CD1-CB 4.35Å; L170-A175 HydrophobicContact CD2-CB 3.96Å; L170-A175 HydrophobicContact CG-CB 4.2Å; E171-A175 PolarHBondContact O-N 3.32Å; E171-A175 VanDerWaalsContact O-N 3.14Å; P172-A175 WeakPolarHBondContact O-CB 3.38Å; P172-A175 PolarHBondContact O-N 2.64Å; A175-A177 PolarHBondContact O-N 2.73Å; A175-F178 WeakPolarHBondContact O-CD2 3.36Å; A175-F178 PolarHBondContact O-N 3.4Å; A175-F178 VanDerWaalsContact O-N 3.12Å; A175-L198 HydrophobicContact CB-CG 4.17Å; A175-N202 HydrophobicContact CB-CB 3.75Å
176	E	93.3	Very high	94.1	Very high	120 Å²	120	51.5 Å²	51.5	56%	0.561	29%	0.285	S	S	*	.	G	3₁₀ helix	trans	-60.3	-27	176.2	-69.4	179.2	-173.2	0	0	113.3	P172 C174 F178 S179	P172-E176 PolarHBondContact O-N 3.39Å; C174-E176 VanDerWaalsContact C-N 3.32Å; C174-E176 PolarHBondContact O-N 3.26Å; E176-F178 PolarHBondContact O-N 3.43Å; E176-F178 VanDerWaalsContact O-N 3.15Å; E176-S179 VanDerWaalsContact O-CB 3.3Å; E176-S179 WeakPolarHBondContact O-CB 3.28Å; E176-S179 PolarHBondContact O-N 3.31Å; E176-S179 VanDerWaalsContact O-N 3.16Å; E176-S179 PolarHBondContact O-OG 3.32Å
177	A	95.3	Very high	94.4	Very high	22 Å²	22	50.9 Å²	50.9	18%	0.182	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-59	-27.3	177.1	0	0	0	0	0	112.4	V149 C174 A175 S179	V149-A177 WeakPolarHBondContact CG1-O 3.45Å; C174-A177 VanDerWaalsContact O-CB 3.28Å; C174-A177 WeakPolarHBondContact O-CB 3.38Å; C174-A177 PolarHBondContact O-N 3.2Å; A175-A177 PolarHBondContact O-N 2.73Å; A177-S179 VanDerWaalsContact C-N 3.3Å; A177-S179 PolarHBondContact O-N 3.36Å
178	F	96	Very high	95.2	Very high	1 Å²	1	50 Å²	50	0%	0.004	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-86.6	4.5	-176.1	-60.1	-102.8	0	0	0	113.3	W142 I145 V149 L158 L160 C174 A175 E176 R180 V181 L199 I203	W142-F178 HydrophobicContact CE3-CE2 4.46Å; W142-F178 HydrophobicContact CE3-CZ 4Å; W142-F178 HydrophobicContact CZ3-CE1 4.45Å; W142-F178 AromaticContact CZ3-CZ 3.83Å; W142-F178 HydrophobicContact CZ3-CZ 3.83Å; I145-F178 HydrophobicContact CG2-CE1 4.15Å; I145-F178 HydrophobicContact CG2-CZ 3.66Å; V149-F178 HydrophobicContact CG1-CD1 4.14Å; V149-F178 HydrophobicContact CG1-CG 4.3Å; V149-F178 HydrophobicContact CG2-CD1 4.4Å; V149-F178 HydrophobicContact CG2-CE1 3.99Å; V149-F178 HydrophobicContact CG2-CZ 4.31Å; L158-F178 HydrophobicContact CD2-CD1 3.78Å; L158-F178 HydrophobicContact CD2-CE1 3.51Å; L160-F178 HydrophobicContact CD1-CE1 4.24Å; C174-F178 WeakPolarHBondContact O-CD2 3.21Å; C174-F178 VanDerWaalsContact O-CE2 3.31Å; C174-F178 WeakPolarHBondContact O-CE2 3.5Å; A175-F178 WeakPolarHBondContact O-CD2 3.36Å; A175-F178 PolarHBondContact O-N 3.4Å; A175-F178 VanDerWaalsContact O-N 3.12Å; E176-F178 PolarHBondContact O-N 3.43Å; E176-F178 VanDerWaalsContact O-N 3.15Å; F178-R180 PolarHBondContact O-N 2.78Å; F178-V181 HydrophobicContact CB-CG2 4.32Å; F178-V181 HydrophobicContact CD1-CG2 4.48Å; F178-V181 WeakPolarHBondContact O-CB 3.42Å; F178-V181 WeakPolarHBondContact O-CG2 3.19Å; F178-V181 PolarHBondContact O-N 3.18Å; F178-L199 HydrophobicContact CD2-CD2 4.26Å; F178-L199 HydrophobicContact CE2-CD2 4.46Å; F178-L199 HydrophobicContact CG-CD2 4.35Å; F178-I203 HydrophobicContact CB-CD1 3.7Å; F178-I203 HydrophobicContact CB-CG1 3.59Å; F178-I203 HydrophobicContact CG-CD1 4.46Å; F178-I203 WeakPolarHBondContact O-CG2 3.46Å
179	S	93.8	Very high	95.7	Very high	48 Å²	48	48.5 Å²	48.5	34%	0.336	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-20.6	-169.7	50.7	0	0	0	0	116.6	E176 A177 P204	E176-S179 VanDerWaalsContact O-CB 3.3Å; E176-S179 WeakPolarHBondContact O-CB 3.28Å; E176-S179 PolarHBondContact O-N 3.31Å; E176-S179 VanDerWaalsContact O-N 3.16Å; E176-S179 PolarHBondContact O-OG 3.32Å; A177-S179 VanDerWaalsContact C-N 3.3Å; A177-S179 PolarHBondContact O-N 3.36Å; S179-P204 WeakPolarHBondContact O-CD 3.44Å
180	R	94	Very high	95.9	Very high	138 Å²	138	47.8 Å²	47.8	52%	0.521	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99	-9.4	179.8	-59.5	-178.3	-175.1	-172.3	2.3	114	P153 L155 F178 R182	P153-R180 WeakPolarHBondContact O-CD 3.38Å; P153-R180 PolarHBondContact O-NH1 3.47Å; L155-R180 CarbonylContact O-C 3.5Å; F178-R180 PolarHBondContact O-N 2.78Å; R180-R182 PolarHBondContact O-N 3.27Å
181	V	97.9	Very high	96.1	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.006	23%	0.228	C	C	.	.			trans	-69.4	132.4	-177.5	177.8	0	0	0	0	109.6	L155 L158 F178 R183 L184 I203	L155-V181 HydrophobicContact CD2-CG2 4.41Å; L158-V181 HydrophobicContact CB-CG1 4.35Å; L158-V181 HydrophobicContact CB-CG2 4.47Å; F178-V181 HydrophobicContact CB-CG2 4.32Å; F178-V181 HydrophobicContact CD1-CG2 4.48Å; F178-V181 WeakPolarHBondContact O-CB 3.42Å; F178-V181 WeakPolarHBondContact O-CG2 3.19Å; F178-V181 PolarHBondContact O-N 3.18Å; V181-R183 WeakPolarHBondContact CG1-O 3.48Å; V181-L184 HydrophobicContact CG1-CB 4.08Å; V181-I203 HydrophobicContact CB-CG2 4.27Å; V181-I203 WeakPolarHBondContact O-CG2 3.3Å
182	R	98.5	Very high	96.1	Very high	94 Å²	94	46.8 Å²	46.8	36%	0.355	23%	0.231	S	C	.	.	S	Bend	trans	-107.4	-33.1	176.9	-66.9	-175.2	166.4	177.6	-4.2	112.5	E156 R180 E205 E207 E208	E156-R182 PolarHBondContact O-N 3.41Å; R180-R182 PolarHBondContact O-N 3.27Å; R182-E205 HydrophobicContact CG-CB 4.11Å; R182-E205 IonicContact CZ-OE2 3.96Å; R182-E205 VanDerWaalsContact CZ-OE2 3.3Å; R182-E205 IonicContact NE-OE2 2.68Å; R182-E205 PolarHBondContact NE-OE2 3.25Å; R182-E205 IonicContact NH2-OE2 2.71Å; R182-E205 PolarHBondContact NH2-OE2 3.29Å; R182-E207 PolarHBondContact O-N 3.37Å; R182-E208 PolarHBondContact O-N 2.87Å
183	R	98.8	Very high	96.3	Very high	91 Å²	91	44.1 Å²	44.1	34%	0.343	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	116.8	177.3	179.6	178.6	-53.5	135.5	-1	109.9	E156 F157 L158 V181 E208 F210	E156-R183 PolarHBondContact O-N 3.12Å; F157-R183 WeakPolarHBondContact CA-O 3.47Å; F157-R183 HydrophobicContact CD2-CB 3.8Å; F157-R183 HydrophobicContact CD2-CG 3.5Å; F157-R183 VanDerWaalsContact CD2-CG 3.5Å; F157-R183 HydrophobicContact CE2-CG 3.73Å; L158-R183 PolarHBondContact N-O 3.46Å; V181-R183 WeakPolarHBondContact CG1-O 3.48Å; R183-E208 WeakPolarHBondContact CA-O 3.43Å; R183-E208 HydrophobicContact CB-CB 4.24Å; R183-E208 HydrophobicContact CG-CB 3.99Å; R183-E208 IonicContact CZ-OE1 2.77Å; R183-E208 IonicContact CZ-OE2 3.12Å; R183-E208 IonicContact NE-OE1 3.63Å; R183-E208 PolarHBondContact NE-OE1 3.01Å; R183-E208 IonicContact NE-OE2 3.84Å; R183-E208 PolarHBondContact NE-OE2 3.24Å; R183-E208 IonicContact NH2-OE1 2.95Å; R183-E208 PolarHBondContact NH2-OE1 3.24Å; R183-E208 IonicContact NH2-OE2 2.71Å; R183-E208 PolarHBondContact NH2-OE2 3.06Å; R183-F210 HydrophobicContact CG-CD2 4.42Å; R183-F210 HydrophobicContact CG-CE2 3.83Å
184	L	98.8	Very high	96.4	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	124.8	-177.8	-177.3	57.9	0	0	0	111	L158 V181 L186 L199 I203 L206 E208 L209 F210	L158-L184 HydrophobicContact CB-CD1 4.13Å; L158-L184 HydrophobicContact CD2-CD1 4.07Å; L158-L184 HydrophobicContact CG-CD1 4.15Å; V181-L184 HydrophobicContact CG1-CB 4.08Å; L184-L186 HydrophobicContact CD1-CD1 4.29Å; L184-L186 HydrophobicContact CD1-CG 4.22Å; L184-L186 HydrophobicContact CD2-CD1 3.58Å; L184-L186 HydrophobicContact CD2-CG 4.38Å; L184-L186 HydrophobicContact CG-CD1 3.68Å; L184-L186 HydrophobicContact CG-CG 3.98Å; L184-L199 HydrophobicContact CD2-CD1 4.24Å; L184-I203 HydrophobicContact CD2-CD1 3.8Å; L184-L206 HydrophobicContact CB-CD1 3.84Å; L184-E208 PolarHBondContact N-O 2.98Å; L184-L209 HydrophobicContact CB-CD1 4.24Å; L184-L209 HydrophobicContact CD2-CD1 4.38Å; L184-L209 HydrophobicContact CG-CD1 4.35Å; L184-F210 PolarHBondContact O-N 3.23Å
185	V	98.9	Very high	96.5	Very high	13 Å²	13	44 Å²	44	8%	0.079	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	117.3	179.7	-165.6	0	0	0	0	110.1	F157 L158 N159 L160 S161 N187 F210	F157-V185 HydrophobicContact CE2-CG2 3.64Å; F157-V185 HydrophobicContact CZ-CG2 3.9Å; L158-V185 PolarHBondContact O-N 2.71Å; N159-V185 HydrophobicContact CB-CB 4.11Å; N159-V185 HydrophobicContact CB-CG2 4.36Å; L160-V185 PolarHBondContact N-O 2.86Å; S161-V185 WeakPolarHBondContact OG-CG1 3.38Å; V185-N187 WeakPolarHBondContact CG1-ND2 3.39Å; V185-F210 HydrophobicContact CB-CB 4.28Å; V185-F210 HydrophobicContact CG1-CB 3.77Å; V185-F210 HydrophobicContact CG1-CG 4.32Å; V185-F210 HydrophobicContact CG2-CB 4.41Å; V185-F210 HydrophobicContact CG2-CD2 3.86Å; V185-F210 HydrophobicContact CG2-CE2 4.5Å; V185-F210 HydrophobicContact CG2-CG 4.28Å
186	L	98.6	Very high	96.6	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.005	22%	0.216	C	C	.	.			trans	-130.1	36	-174.5	-72.3	161	0	0	0	110.9	W142 L160 L165 L184 T189 I191 L199 L209 F210 L211 N214	W142-L186 HydrophobicContact CH2-CD2 4.22Å; L160-L186 HydrophobicContact CB-CD2 3.89Å; L160-L186 HydrophobicContact CD1-CD2 4.03Å; L165-L186 HydrophobicContact CD1-CD2 4.3Å; L184-L186 HydrophobicContact CD1-CD1 4.29Å; L184-L186 HydrophobicContact CD1-CG 4.22Å; L184-L186 HydrophobicContact CD2-CD1 3.58Å; L184-L186 HydrophobicContact CD2-CG 4.38Å; L184-L186 HydrophobicContact CG-CD1 3.68Å; L184-L186 HydrophobicContact CG-CG 3.98Å; L186-T189 HydrophobicContact CB-CG2 4.49Å; L186-T189 HydrophobicContact CD2-CG2 4.42Å; L186-T189 PolarHBondContact O-OG1 3.17Å; L186-I191 HydrophobicContact CB-CD1 3.97Å; L186-I191 HydrophobicContact CD1-CD1 3.65Å; L186-I191 HydrophobicContact CD2-CD1 4.21Å; L186-I191 HydrophobicContact CG-CD1 4.16Å; L186-L199 HydrophobicContact CD1-CD1 3.76Å; L186-L209 HydrophobicContact CD1-CD1 4.37Å; L186-F210 CarbonylContact C-O 3.48Å; L186-F210 PolarHBondContact N-O 3.18Å; L186-L211 HydrophobicContact CB-CD2 3.97Å; L186-L211 HydrophobicContact CD1-CD2 4.48Å; L186-N214 PolarHBondContact O-ND2 2.79Å
187	N	98.8	Very high	96.6	Very high	34 Å²	34	38.9 Å²	38.9	18%	0.182	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	142.1	-178.1	-59.4	-27.5	0	0	0	110.8	S161 S162 V185 T189 F210 L211 C212	S161-N187 CarbonylContact C-O 3.49Å; S161-N187 WeakPolarHBondContact CA-O 3.48Å; S161-N187 WeakPolarHBondContact CB-O 3.42Å; S161-N187 PolarHBondContact OG-N 2.75Å; S162-N187 PolarHBondContact N-O 3.48Å; V185-N187 WeakPolarHBondContact CG1-ND2 3.39Å; N187-T189 VanDerWaalsContact C-N 3.27Å; N187-T189 PolarHBondContact O-N 3.08Å; N187-F210 WeakPolarHBondContact OD1-CB 3.44Å; N187-F210 PolarHBondContact OD1-O 3.22Å; N187-L211 PolarHBondContact OD1-N 3.24Å; N187-C212 CarbonylContact C-O 3.57Å; N187-C212 WeakPolarHBondContact CA-O 3.44Å; N187-C212 HydrophobicContact CB-CB 4.25Å; N187-C212 WeakPolarHBondContact OD1-CB 3.24Å; N187-C212 PolarHBondContact OD1-N 2.91Å
188	N	98.6	Very high	96.6	Very high	67 Å²	67	39.5 Å²	39.5	36%	0.358	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	44.6	175.9	-172.5	44.1	0	0	0	113	S162 C212 L213 N214	S162-N188 VanDerWaalsContact CA-O 3.29Å; S162-N188 WeakPolarHBondContact CA-O 3.35Å; S162-N188 PolarHBondContact N-O 2.85Å; S162-N188 PolarHBondContact OG-ND2 3.43Å; N188-C212 PolarHBondContact N-O 3.39Å; N188-L213 WeakPolarHBondContact CA-O 3.43Å; N188-L213 HydrophobicContact CB-CB 3.98Å; N188-N214 PolarHBondContact N-OD1 2.92Å
189	T	98.1	Very high	96.5	Very high	2 Å²	2	39.6 Å²	39.6	1%	0.012	19%	0.192	C	C	.	.			trans	-111.6	-15.3	178.3	58.5	0	0	0	0	112.7	L160 L165 A166 L186 N187 I191 N214	L160-T189 WeakPolarHBondContact O-CG2 3.43Å; L165-T189 HydrophobicContact CD1-CG2 4.04Å; A166-T189 PolarHBondContact N-O 2.98Å; L186-T189 HydrophobicContact CB-CG2 4.49Å; L186-T189 HydrophobicContact CD2-CG2 4.42Å; L186-T189 PolarHBondContact O-OG1 3.17Å; N187-T189 VanDerWaalsContact C-N 3.27Å; N187-T189 PolarHBondContact O-N 3.08Å; T189-I191 PolarHBondContact O-N 3.32Å; T189-I191 WeakPolarHBondContact OG1-CG2 3.12Å; T189-N214 PolarHBondContact N-OD1 2.88Å; T189-N214 PolarHBondContact OG1-OD1 3.24Å
190	Q	96.1	Very high	96.6	Very high	100 Å²	100	37.7 Å²	37.7	47%	0.467	18%	0.178	S	C	.	.			trans	55.3	27	-177.4	-59	169.8	16.7	0	0	113.2	A166 N214	A166-Q190 HydrophobicContact CB-CB 3.87Å; Q190-N214 PolarHBondContact N-OD1 3.44Å
191	I	96.9	Very high	96.5	Very high	4 Å²	4	35.2 Å²	35.2	2%	0.021	17%	0.173	C	C	.	.			trans	-65.3	145.5	174.3	63.2	176.6	0	0	0	110.3	W142 L165 L186 T189 T195 V196 L211 Y216	W142-I191 HydrophobicContact CZ2-CG2 3.95Å; L165-I191 HydrophobicContact CB-CG2 3.54Å; L165-I191 HydrophobicContact CD1-CG2 4.11Å; L165-I191 HydrophobicContact CG-CG2 4.48Å; L186-I191 HydrophobicContact CB-CD1 3.97Å; L186-I191 HydrophobicContact CD1-CD1 3.65Å; L186-I191 HydrophobicContact CD2-CD1 4.21Å; L186-I191 HydrophobicContact CG-CD1 4.16Å; T189-I191 PolarHBondContact O-N 3.32Å; T189-I191 WeakPolarHBondContact OG1-CG2 3.12Å; I191-T195 HydrophobicContact CB-CG2 4.35Å; I191-V196 HydrophobicContact CD1-CG2 3.76Å; I191-V196 HydrophobicContact CG1-CG2 4.15Å; I191-L211 HydrophobicContact CD1-CD2 4.17Å; I191-Y216 VanDerWaalsContact CG1-OH 3.29Å; I191-Y216 WeakPolarHBondContact CG1-OH 3.32Å; I191-Y216 WeakPolarHBondContact O-CE1 3.49Å; I191-Y216 PolarHBondContact O-OH 3.41Å
192	S	95.4	Very high	96.3	Very high	57 Å²	57	37 Å²	37	40%	0.399	18%	0.182	S	C	.	.			trans	-69.1	155.9	176.8	68	0	0	0	0	111.9	D194 T195 V196	S192-D194 PolarHBondContact O-N 3.39Å; S192-T195 VanDerWaalsContact O-CB 3.31Å; S192-T195 WeakPolarHBondContact O-CB 3.29Å; S192-T195 PolarHBondContact O-N 3.24Å; S192-T195 VanDerWaalsContact O-N 3.09Å; S192-T195 PolarHBondContact OG-N 3.23Å; S192-T195 PolarHBondContact OG-OG1 2.76Å; S192-V196 PolarHBondContact O-N 3.07Å
193	W	95.3	Very high	96.2	Very high	14 Å²	14	32.5 Å²	32.5	5%	0.053	17%	0.165	C	C	.	.	H	α-helix	trans	-62.4	-31.7	174.1	-162.5	-89.4	0	0	0	112.5	T195 V196 M197 L211 Y216 V219 S220 I234 F248 M251	W193-T195 VanDerWaalsContact C-N 3.26Å; W193-T195 PolarHBondContact O-N 3.49Å; W193-V196 WeakPolarHBondContact O-CA 3.48Å; W193-V196 WeakPolarHBondContact O-CB 3.49Å; W193-V196 PolarHBondContact O-N 3.3Å; W193-V196 VanDerWaalsContact O-N 3.12Å; W193-M197 WeakPolarHBondContact O-CG 3.35Å; W193-M197 PolarHBondContact O-N 2.95Å; W193-L211 HydrophobicContact CH2-CD1 4.13Å; W193-L211 HydrophobicContact CZ3-CD1 3.96Å; W193-Y216 HydrophobicContact CE3-CD1 4.09Å; W193-Y216 HydrophobicContact CE3-CD2 4.18Å; W193-Y216 HydrophobicContact CE3-CE1 4.1Å; W193-Y216 HydrophobicContact CE3-CE2 4.14Å; W193-Y216 HydrophobicContact CE3-CG 4.16Å; W193-Y216 HydrophobicContact CZ3-CD2 4.05Å; W193-Y216 HydrophobicContact CZ3-CE2 4.09Å; W193-Y216 HydrophobicContact CZ3-CG 4.39Å; W193-V219 HydrophobicContact CD2-CB 4.34Å; W193-V219 HydrophobicContact CD2-CG1 4.12Å; W193-V219 HydrophobicContact CD2-CG2 4.02Å; W193-V219 HydrophobicContact CE3-CG2 4.05Å; W193-V219 HydrophobicContact CG-CG1 4.41Å; W193-V219 HydrophobicContact CH2-CG2 4.18Å; W193-V219 HydrophobicContact CZ2-CG1 3.86Å; W193-V219 HydrophobicContact CZ2-CG2 4.15Å; W193-V219 HydrophobicContact CZ3-CG2 4.13Å; W193-S220 VanDerWaalsContact CD1-OG 3.29Å; W193-I234 HydrophobicContact CH2-CD1 4.04Å; W193-I234 HydrophobicContact CZ3-CD1 3.68Å; W193-F248 HydrophobicContact CH2-CD1 4.2Å; W193-F248 AromaticContact CH2-CE1 3.43Å; W193-F248 HydrophobicContact CH2-CE1 3.43Å; W193-F248 VanDerWaalsContact CH2-CE1 3.43Å; W193-F248 HydrophobicContact CH2-CZ 4.21Å; W193-F248 HydrophobicContact CZ2-CD1 4.11Å; W193-F248 AromaticContact CZ2-CE1 3.65Å; W193-F248 HydrophobicContact CZ2-CE1 3.65Å; W193-F248 HydrophobicContact CZ3-CE1 4.33Å; W193-M251 HydrophobicContact CZ2-CE 3.77Å
194	D	93.3	Very high	95.8	Very high	106 Å²	106	32.2 Å²	32.2	57%	0.567	18%	0.175	S	C	*	.	H	α-helix	trans	-64.2	-33.6	175.3	-60.2	-36.3	0	0	0	111.9	S192 M197 L198 S220	S192-D194 PolarHBondContact O-N 3.39Å; D194-M197 PolarHBondContact O-N 3.31Å; D194-L198 PolarHBondContact O-N 3.01Å; D194-S220 PolarHBondContact OD1-OG 3.33Å
195	T	95.4	Very high	95.7	Very high	10 Å²	10	36.2 Å²	36.2	6%	0.061	19%	0.194	C	C	.	.	H	α-helix	trans	-65.4	-43.9	171.9	-56.5	0	0	0	0	110.9	W142 L170 I191 S192 W193 M197 L198 L199	W142-T195 HydrophobicContact CZ2-CG2 3.89Å; L170-T195 HydrophobicContact CB-CG2 3.88Å; L170-T195 HydrophobicContact CD2-CG2 3.94Å; I191-T195 HydrophobicContact CB-CG2 4.35Å; S192-T195 VanDerWaalsContact O-CB 3.31Å; S192-T195 WeakPolarHBondContact O-CB 3.29Å; S192-T195 PolarHBondContact O-N 3.24Å; S192-T195 VanDerWaalsContact O-N 3.09Å; S192-T195 PolarHBondContact OG-N 3.23Å; S192-T195 PolarHBondContact OG-OG1 2.76Å; W193-T195 VanDerWaalsContact C-N 3.26Å; W193-T195 PolarHBondContact O-N 3.49Å; T195-M197 VanDerWaalsContact C-N 3.3Å; T195-M197 PolarHBondContact O-N 3.38Å; T195-L198 PolarHBondContact O-N 2.81Å; T195-L199 HydrophobicContact CG2-CD1 4.29Å; T195-L199 WeakPolarHBondContact O-CG 3.3Å; T195-L199 PolarHBondContact O-N 2.97Å
196	V	96.2	Very high	95.6	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.012	19%	0.19	C	C	.	.	H	α-helix	trans	-57.4	-45.7	173.6	176.6	0	0	0	0	110.4	I191 S192 W193 L198 L199 T200 L209 L211	I191-V196 HydrophobicContact CD1-CG2 3.76Å; I191-V196 HydrophobicContact CG1-CG2 4.15Å; S192-V196 PolarHBondContact O-N 3.07Å; W193-V196 WeakPolarHBondContact O-CA 3.48Å; W193-V196 WeakPolarHBondContact O-CB 3.49Å; W193-V196 PolarHBondContact O-N 3.3Å; W193-V196 VanDerWaalsContact O-N 3.12Å; V196-L198 PolarHBondContact O-N 2.86Å; V196-L199 PolarHBondContact O-N 2.95Å; V196-T200 HydrophobicContact CG1-CG2 4.32Å; V196-T200 VanDerWaalsContact O-CG2 3.32Å; V196-T200 WeakPolarHBondContact O-CG2 3.27Å; V196-T200 PolarHBondContact O-N 3.49Å; V196-T200 PolarHBondContact O-OG1 2.84Å; V196-L209 HydrophobicContact CG1-CD2 3.99Å; V196-L211 HydrophobicContact CG1-CD1 3.9Å; V196-L211 HydrophobicContact CG2-CD1 4.09Å; V196-L211 HydrophobicContact CG2-CD2 3.82Å
197	M	94.1	Very high	95.6	Very high	11 Å²	11	38.5 Å²	38.5	5%	0.054	20%	0.204	C	C	.	.	H	α-helix	trans	-62.5	-45.3	178.5	-70.6	-49.8	-43.3	0	0	112.1	W193 D194 T195 L199 T200 Q201 S222 M251	W193-M197 WeakPolarHBondContact O-CG 3.35Å; W193-M197 PolarHBondContact O-N 2.95Å; D194-M197 PolarHBondContact O-N 3.31Å; T195-M197 VanDerWaalsContact C-N 3.3Å; T195-M197 PolarHBondContact O-N 3.38Å; M197-L199 VanDerWaalsContact C-N 3.3Å; M197-L199 PolarHBondContact O-N 2.97Å; M197-T200 WeakPolarHBondContact CA-OG1 3.39Å; M197-T200 PolarHBondContact O-N 3.16Å; M197-T200 PolarHBondContact O-OG1 3.01Å; M197-Q201 VanDerWaalsContact O-CG 3.26Å; M197-Q201 WeakPolarHBondContact O-CG 3.46Å; M197-Q201 PolarHBondContact O-N 2.84Å; M197-S222 VanDerWaalsContact CE-OG 3.31Å; M197-S222 WeakPolarHBondContact CE-OG 3.36Å; M197-M251 HydrophobicContact CE-SD 4.06Å; M197-M251 HydrophobicContact SD-CE 4.5Å; M197-M251 HydrophobicContact SD-SD 3.37Å
198	L	94.6	Very high	95.6	Very high	34 Å²	34	38.9 Å²	38.9	18%	0.178	20%	0.204	C	C	.	.	H	α-helix	trans	-60.2	-40.8	176.9	-175.9	63.3	0	0	0	111.8	L170 P172 A175 D194 T195 V196 Q201 N202	L170-L198 HydrophobicContact CB-CD2 4.1Å; L170-L198 HydrophobicContact CD2-CB 4.45Å; L170-L198 HydrophobicContact CD2-CD2 3.98Å; L170-L198 HydrophobicContact CD2-CG 4.24Å; L170-L198 HydrophobicContact CG-CD2 3.78Å; L170-L198 WeakPolarHBondContact O-CD2 3.46Å; P172-L198 HydrophobicContact CG-CD1 4.36Å; A175-L198 HydrophobicContact CB-CG 4.17Å; D194-L198 PolarHBondContact O-N 3.01Å; T195-L198 PolarHBondContact O-N 2.81Å; V196-L198 PolarHBondContact O-N 2.86Å; L198-Q201 PolarHBondContact O-N 3.21Å; L198-N202 WeakPolarHBondContact CD1-ND2 3.48Å; L198-N202 PolarHBondContact O-N 3.02Å; L198-N202 PolarHBondContact O-ND2 2.82Å
199	L	95.5	Very high	95.6	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.016	19%	0.188	C	C	.	.	H	α-helix	trans	-61.7	-52.5	173.7	-72.1	166	0	0	0	111.1	W142 L170 F178 L184 L186 T195 V196 M197 Q201 N202 I203	W142-L199 HydrophobicContact CH2-CD1 4.39Å; L170-L199 HydrophobicContact CD2-CD1 4.36Å; L170-L199 HydrophobicContact CD2-CD2 3.53Å; L170-L199 HydrophobicContact CD2-CG 3.56Å; F178-L199 HydrophobicContact CD2-CD2 4.26Å; F178-L199 HydrophobicContact CE2-CD2 4.46Å; F178-L199 HydrophobicContact CG-CD2 4.35Å; L184-L199 HydrophobicContact CD2-CD1 4.24Å; L186-L199 HydrophobicContact CD1-CD1 3.76Å; T195-L199 HydrophobicContact CG2-CD1 4.29Å; T195-L199 WeakPolarHBondContact O-CG 3.3Å; T195-L199 PolarHBondContact O-N 2.97Å; V196-L199 PolarHBondContact O-N 2.95Å; M197-L199 VanDerWaalsContact C-N 3.3Å; M197-L199 PolarHBondContact O-N 2.97Å; L199-Q201 PolarHBondContact O-N 3.21Å; L199-Q201 VanDerWaalsContact O-N 3.11Å; L199-N202 CarbonylContact O-C 3.45Å; L199-N202 PolarHBondContact O-N 3.4Å; L199-I203 HydrophobicContact CB-CD1 4.01Å; L199-I203 HydrophobicContact CD2-CD1 4.13Å; L199-I203 WeakPolarHBondContact O-CB 3.29Å; L199-I203 WeakPolarHBondContact O-CG1 3.32Å; L199-I203 PolarHBondContact O-N 3.29Å
200	T	94.7	Very high	95.7	Very high	8 Å²	8	37.5 Å²	37.5	5%	0.049	20%	0.195	C	C	.	.	H	α-helix	trans	-62	-23.7	-178.5	61	0	0	0	0	113.8	V196 M197 L206 L209 F252	V196-T200 HydrophobicContact CG1-CG2 4.32Å; V196-T200 VanDerWaalsContact O-CG2 3.32Å; V196-T200 WeakPolarHBondContact O-CG2 3.27Å; V196-T200 PolarHBondContact O-N 3.49Å; V196-T200 PolarHBondContact O-OG1 2.84Å; M197-T200 WeakPolarHBondContact CA-OG1 3.39Å; M197-T200 PolarHBondContact O-N 3.16Å; M197-T200 PolarHBondContact O-OG1 3.01Å; T200-L206 HydrophobicContact CG2-CD2 4Å; T200-L209 HydrophobicContact CG2-CD2 4.18Å; T200-F252 HydrophobicContact CG2-CE1 4.16Å
201	Q	92.9	Very high	95.8	Very high	87 Å²	87	32.8 Å²	32.8	41%	0.407	17%	0.173	S	C	.	.	H	α-helix	trans	-79	-26.9	174.5	-71.7	172.9	7.5	0	0	113.3	M197 L198 L199 V224	M197-Q201 VanDerWaalsContact O-CG 3.26Å; M197-Q201 WeakPolarHBondContact O-CG 3.46Å; M197-Q201 PolarHBondContact O-N 2.84Å; L198-Q201 PolarHBondContact O-N 3.21Å; L199-Q201 PolarHBondContact O-N 3.21Å; L199-Q201 VanDerWaalsContact O-N 3.11Å; Q201-V224 HydrophobicContact CG-CB 4.11Å; Q201-V224 HydrophobicContact CG-CG1 3.99Å
202	N	93.9	Very high	95.9	Very high	38 Å²	38	33 Å²	33	20%	0.203	18%	0.175	C	C	.	.	H	α-helix	trans	-106.5	-1.9	-176.3	-69.6	-77.6	0	0	0	113.7	A175 L198 L199 P204	A175-N202 HydrophobicContact CB-CB 3.75Å; L198-N202 WeakPolarHBondContact CD1-ND2 3.48Å; L198-N202 PolarHBondContact O-N 3.02Å; L198-N202 PolarHBondContact O-ND2 2.82Å; L199-N202 CarbonylContact O-C 3.45Å; L199-N202 PolarHBondContact O-N 3.4Å; N202-P204 WeakPolarHBondContact O-CD 3.49Å
203	I	94.7	Very high	96	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.			trans	-112.3	81.9	176	-53.6	170	0	0	0	109	F178 V181 L184 L199 E205 L206	F178-I203 HydrophobicContact CB-CD1 3.7Å; F178-I203 HydrophobicContact CB-CG1 3.59Å; F178-I203 HydrophobicContact CG-CD1 4.46Å; F178-I203 WeakPolarHBondContact O-CG2 3.46Å; V181-I203 HydrophobicContact CB-CG2 4.27Å; V181-I203 WeakPolarHBondContact O-CG2 3.3Å; L184-I203 HydrophobicContact CD2-CD1 3.8Å; L199-I203 HydrophobicContact CB-CD1 4.01Å; L199-I203 HydrophobicContact CD2-CD1 4.13Å; L199-I203 WeakPolarHBondContact O-CB 3.29Å; L199-I203 WeakPolarHBondContact O-CG1 3.32Å; L199-I203 PolarHBondContact O-N 3.29Å; I203-E205 PolarHBondContact O-N 2.88Å; I203-L206 HydrophobicContact CB-CB 4.09Å; I203-L206 HydrophobicContact CG2-CB 3.66Å; I203-L206 HydrophobicContact CG2-CD1 4.2Å; I203-L206 HydrophobicContact CG2-CG 4.43Å; I203-L206 WeakPolarHBondContact O-CB 3.32Å; I203-L206 PolarHBondContact O-N 3.43Å
204	P	91.9	Very high	96.2	Very high	84 Å²	84	34 Å²	34	55%	0.545	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-16.4	-172.3	28.3	-37.2	0	0	0	114.1	S179 N202 T228	S179-P204 WeakPolarHBondContact O-CD 3.44Å; N202-P204 WeakPolarHBondContact O-CD 3.49Å; P204-T228 WeakPolarHBondContact O-CG2 3.33Å
205	E	95.1	Very high	96.3	Very high	86 Å²	86	35.5 Å²	35.5	40%	0.402	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	9.6	178.9	-63	-164.6	-152.3	0	0	113.6	R182 I203 E207	R182-E205 HydrophobicContact CG-CB 4.11Å; R182-E205 IonicContact CZ-OE2 3.96Å; R182-E205 VanDerWaalsContact CZ-OE2 3.3Å; R182-E205 IonicContact NE-OE2 2.68Å; R182-E205 PolarHBondContact NE-OE2 3.25Å; R182-E205 IonicContact NH2-OE2 2.71Å; R182-E205 PolarHBondContact NH2-OE2 3.29Å; I203-E205 PolarHBondContact O-N 2.88Å; E205-E207 WeakPolarHBondContact O-CG 3.28Å; E205-E207 PolarHBondContact O-N 2.64Å; E205-E207 VanDerWaalsContact O-N 3.14Å
206	L	98.1	Very high	96.4	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	18%	0.18	C	C	.	.			trans	-63.3	117.6	-175.7	-170.2	66.6	0	0	0	111.2	L184 T200 I203 L209 T228 L229	L184-L206 HydrophobicContact CB-CD1 3.84Å; T200-L206 HydrophobicContact CG2-CD2 4Å; I203-L206 HydrophobicContact CB-CB 4.09Å; I203-L206 HydrophobicContact CG2-CB 3.66Å; I203-L206 HydrophobicContact CG2-CD1 4.2Å; I203-L206 HydrophobicContact CG2-CG 4.43Å; I203-L206 WeakPolarHBondContact O-CB 3.32Å; I203-L206 PolarHBondContact O-N 3.43Å; L206-L209 HydrophobicContact CD2-CB 4.37Å; L206-L209 HydrophobicContact CD2-CD2 4.38Å; L206-T228 CarbonylContact O-C 3.57Å; L206-T228 VanDerWaalsContact O-CB 3.24Å; L206-T228 WeakPolarHBondContact O-CB 3.24Å; L206-T228 PolarHBondContact O-OG1 2.84Å; L206-L229 HydrophobicContact CD2-CD1 3.96Å; L206-L229 HydrophobicContact CG-CD1 3.84Å; L206-L229 WeakPolarHBondContact O-CA 3.38Å; L206-L229 PolarHBondContact O-N 2.74Å; L206-L229 VanDerWaalsContact O-N 3.14Å
207	E	98.7	Very high	96.4	Very high	61 Å²	61	39.1 Å²	39.1	29%	0.285	20%	0.204	S	C	.	.			trans	-106.8	-34.1	179	-58.3	-159.8	148.4	0	0	112.4	R182 E205 R230 L231	R182-E207 PolarHBondContact O-N 3.37Å; E205-E207 WeakPolarHBondContact O-CG 3.28Å; E205-E207 PolarHBondContact O-N 2.64Å; E205-E207 VanDerWaalsContact O-N 3.14Å; E207-R230 VanDerWaalsContact CD-NH1 3.3Å; E207-R230 PolarHBondContact O-N 3.21Å; E207-R230 IonicContact OE1-CZ 2.75Å; E207-R230 IonicContact OE1-NH1 3.41Å; E207-R230 PolarHBondContact OE1-NH1 3.06Å; E207-R230 IonicContact OE1-NH2 3.82Å; E207-R230 IonicContact OE2-NH1 3.61Å; E207-R230 PolarHBondContact OE2-NH1 2.75Å; E207-L231 PolarHBondContact O-N 2.77Å
208	E	98.9	Very high	96.4	Very high	42 Å²	42	42.1 Å²	42.1	20%	0.196	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	129.2	-175.3	-56.3	-175.2	-153.5	0	0	112	R182 R183 L184 F210 L231	R182-E208 PolarHBondContact O-N 2.87Å; R183-E208 WeakPolarHBondContact CA-O 3.43Å; R183-E208 HydrophobicContact CB-CB 4.24Å; R183-E208 HydrophobicContact CG-CB 3.99Å; R183-E208 IonicContact CZ-OE1 2.77Å; R183-E208 IonicContact CZ-OE2 3.12Å; R183-E208 IonicContact NE-OE1 3.63Å; R183-E208 PolarHBondContact NE-OE1 3.01Å; R183-E208 IonicContact NE-OE2 3.84Å; R183-E208 PolarHBondContact NE-OE2 3.24Å; R183-E208 IonicContact NH2-OE1 2.95Å; R183-E208 PolarHBondContact NH2-OE1 3.24Å; R183-E208 IonicContact NH2-OE2 2.71Å; R183-E208 PolarHBondContact NH2-OE2 3.06Å; L184-E208 PolarHBondContact N-O 2.98Å; E208-F210 HydrophobicContact CB-CE2 3.89Å; E208-L231 WeakPolarHBondContact CA-O 3.48Å; E208-L231 HydrophobicContact CB-CB 4.3Å; E208-L231 HydrophobicContact CG-CB 4Å
209	L	98.9	Very high	96.4	Very high	3 Å²	3	40.6 Å²	40.6	2%	0.016	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	127.7	-177.3	-179.6	59.7	0	0	0	111.1	L184 L186 V196 T200 L206 L211 L229 L231 L232 H233	L184-L209 HydrophobicContact CB-CD1 4.24Å; L184-L209 HydrophobicContact CD2-CD1 4.38Å; L184-L209 HydrophobicContact CG-CD1 4.35Å; L186-L209 HydrophobicContact CD1-CD1 4.37Å; V196-L209 HydrophobicContact CG1-CD2 3.99Å; T200-L209 HydrophobicContact CG2-CD2 4.18Å; L206-L209 HydrophobicContact CD2-CB 4.37Å; L206-L209 HydrophobicContact CD2-CD2 4.38Å; L209-L211 HydrophobicContact CD1-CD2 4.36Å; L209-L211 HydrophobicContact CD1-CG 4.19Å; L209-L211 HydrophobicContact CD2-CD1 3.81Å; L209-L211 HydrophobicContact CD2-CG 4.33Å; L209-L211 HydrophobicContact CG-CD1 3.97Å; L209-L211 HydrophobicContact CG-CG 3.95Å; L209-L229 HydrophobicContact CB-CD1 3.63Å; L209-L229 HydrophobicContact CB-CD2 4.35Å; L209-L231 PolarHBondContact N-O 2.95Å; L209-L232 HydrophobicContact CB-CD1 4.38Å; L209-L232 HydrophobicContact CD2-CD1 4.26Å; L209-L232 HydrophobicContact CG-CD1 4.31Å; L209-H233 PolarHBondContact O-N 2.81Å
210	F	98.9	Very high	96.2	Very high	37 Å²	37	42.5 Å²	42.5	16%	0.162	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	124	-179.5	-56.6	-105.1	0	0	0	110.2	R183 L184 V185 L186 N187 E208 L231 H233	R183-F210 HydrophobicContact CG-CD2 4.42Å; R183-F210 HydrophobicContact CG-CE2 3.83Å; L184-F210 PolarHBondContact O-N 3.23Å; V185-F210 HydrophobicContact CB-CB 4.28Å; V185-F210 HydrophobicContact CG1-CB 3.77Å; V185-F210 HydrophobicContact CG1-CG 4.32Å; V185-F210 HydrophobicContact CG2-CB 4.41Å; V185-F210 HydrophobicContact CG2-CD2 3.86Å; V185-F210 HydrophobicContact CG2-CE2 4.5Å; V185-F210 HydrophobicContact CG2-CG 4.28Å; L186-F210 CarbonylContact C-O 3.48Å; L186-F210 PolarHBondContact N-O 3.18Å; N187-F210 WeakPolarHBondContact OD1-CB 3.44Å; N187-F210 PolarHBondContact OD1-O 3.22Å; E208-F210 HydrophobicContact CB-CE2 3.89Å; F210-L231 HydrophobicContact CE1-CD2 4.05Å; F210-L231 HydrophobicContact CE2-CD2 4.33Å; F210-L231 HydrophobicContact CZ-CD2 3.86Å; F210-H233 CarbonylContact C-O 3.44Å; F210-H233 WeakPolarHBondContact CA-O 3.38Å; F210-H233 HydrophobicContact CB-CB 4.48Å; F210-H233 HydrophobicContact CD1-CB 3.54Å; F210-H233 AromaticContact CD1-CG 3.86Å; F210-H233 AromaticContact CD1-ND1 3.48Å; F210-H233 WeakPolarHBondContact CD1-ND1 3.28Å; F210-H233 HydrophobicContact CE1-CB 4.02Å; F210-H233 AromaticContact CE1-ND1 3.71Å; F210-H233 HydrophobicContact CG-CB 4.19Å
211	L	98.8	Very high	95.7	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.261	C	S	.	.			trans	-138.2	30.3	-168	-73.8	176.9	0	0	0	111.6	L186 N187 I191 W193 V196 L209 N214 Y216 L232 H233 I234 N237	L186-L211 HydrophobicContact CB-CD2 3.97Å; L186-L211 HydrophobicContact CD1-CD2 4.48Å; N187-L211 PolarHBondContact OD1-N 3.24Å; I191-L211 HydrophobicContact CD1-CD2 4.17Å; W193-L211 HydrophobicContact CH2-CD1 4.13Å; W193-L211 HydrophobicContact CZ3-CD1 3.96Å; V196-L211 HydrophobicContact CG1-CD1 3.9Å; V196-L211 HydrophobicContact CG2-CD1 4.09Å; V196-L211 HydrophobicContact CG2-CD2 3.82Å; L209-L211 HydrophobicContact CD1-CD2 4.36Å; L209-L211 HydrophobicContact CD1-CG 4.19Å; L209-L211 HydrophobicContact CD2-CD1 3.81Å; L209-L211 HydrophobicContact CD2-CG 4.33Å; L209-L211 HydrophobicContact CG-CD1 3.97Å; L209-L211 HydrophobicContact CG-CG 3.95Å; L211-N214 VanDerWaalsContact C-ND2 3.3Å; L211-N214 WeakPolarHBondContact CA-ND2 3.43Å; L211-N214 PolarHBondContact O-ND2 3.01Å; L211-N214 VanDerWaalsContact O-ND2 3.15Å; L211-Y216 HydrophobicContact CB-CE2 4.08Å; L211-Y216 HydrophobicContact CD1-CE2 4.45Å; L211-Y216 HydrophobicContact CD2-CE2 4.38Å; L211-L232 HydrophobicContact CD1-CD1 4.13Å; L211-H233 PolarHBondContact N-O 2.93Å; L211-I234 HydrophobicContact CB-CG1 4.33Å; L211-N237 PolarHBondContact O-ND2 3.12Å
212	C	98.8	Very high	95.2	Very high	10 Å²	10	43.4 Å²	43.4	7%	0.068	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	152.8	-177.9	-53.7	0	0	0	0	111.7	N187 N188 N214 H233 T235	N187-C212 CarbonylContact C-O 3.57Å; N187-C212 WeakPolarHBondContact CA-O 3.44Å; N187-C212 HydrophobicContact CB-CB 4.25Å; N187-C212 WeakPolarHBondContact OD1-CB 3.24Å; N187-C212 PolarHBondContact OD1-N 2.91Å; N188-C212 PolarHBondContact N-O 3.39Å; C212-N214 VanDerWaalsContact C-N 3.31Å; C212-N214 PolarHBondContact O-N 2.95Å; C212-H233 PolarHBondContact SG-CD2 3.37Å; C212-T235 CarbonylContact C-O 3.42Å; C212-T235 WeakPolarHBondContact CA-O 3.31Å; C212-T235 VanDerWaalsContact CB-O 3.25Å; C212-T235 WeakPolarHBondContact CB-O 3.22Å; C212-T235 PolarHBondContact SG-N 3.19Å
213	L	98.2	Very high	94.6	Very high	84 Å²	84	47.6 Å²	47.6	44%	0.44	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.1	35.3	173.3	-60	161.7	0	0	0	114.1	N188 T235 D236	N188-L213 WeakPolarHBondContact CA-O 3.43Å; N188-L213 HydrophobicContact CB-CB 3.98Å; L213-T235 PolarHBondContact N-O 3.42Å; L213-T235 VanDerWaalsContact N-O 3.09Å; L213-D236 VanDerWaalsContact CA-O 3.29Å; L213-D236 WeakPolarHBondContact CA-O 3.4Å; L213-D236 HydrophobicContact CD2-CB 3.41Å; L213-D236 VanDerWaalsContact CD2-CB 3.41Å; L213-D236 HydrophobicContact CG-CB 3.92Å; L213-D236 PolarHBondContact N-O 3.25Å
214	N	98	Very high	94.3	Very high	8 Å²	8	50.8 Å²	50.8	4%	0.043	30%	0.304	C	S	.	.	S	Bend	trans	-108.5	9.6	179.6	-76.4	-46.3	0	0	0	113.3	L186 N188 T189 Q190 L211 C212 Y216 N237	L186-N214 PolarHBondContact O-ND2 2.79Å; N188-N214 PolarHBondContact N-OD1 2.92Å; T189-N214 PolarHBondContact N-OD1 2.88Å; T189-N214 PolarHBondContact OG1-OD1 3.24Å; Q190-N214 PolarHBondContact N-OD1 3.44Å; L211-N214 VanDerWaalsContact C-ND2 3.3Å; L211-N214 WeakPolarHBondContact CA-ND2 3.43Å; L211-N214 PolarHBondContact O-ND2 3.01Å; L211-N214 VanDerWaalsContact O-ND2 3.15Å; C212-N214 VanDerWaalsContact C-N 3.31Å; C212-N214 PolarHBondContact O-N 2.95Å; N214-Y216 HydrophobicContact CB-CD2 3.73Å; N214-Y216 HydrophobicContact CB-CE1 4.19Å; N214-Y216 HydrophobicContact CB-CE2 3.27Å; N214-Y216 HydrophobicContact CB-CG 4.36Å; N214-Y216 PolarHBondContact O-N 3.22Å; N214-Y216 VanDerWaalsContact O-N 3.13Å; N214-N237 VanDerWaalsContact C-OD1 3.28Å; N214-N237 WeakPolarHBondContact CA-OD1 3.47Å; N214-N237 PolarHBondContact N-OD1 3.14Å; N214-N237 VanDerWaalsContact N-OD1 3.14Å
215	E	96.4	Very high	94.4	Very high	136 Å²	136	49.1 Å²	49.1	64%	0.636	30%	0.297	S	S	*	.			trans	59.3	23.4	175.6	-54.7	177.7	-166.3	0	0	114.4	S217 N237	E215-S217 PolarHBondContact O-N 2.89Å; E215-S217 VanDerWaalsContact O-N 3.11Å; E215-N237 PolarHBondContact N-OD1 2.9Å
216	Y	97.5	Very high	94.4	Very high	15 Å²	15	45.2 Å²	45.2	6%	0.059	28%	0.28	C	S	.	.			trans	-63.1	117.7	-179.8	-63.9	-52.6	0	0	0	111.4	I191 W193 L211 N214 I234 N237 S238 L239	I191-Y216 VanDerWaalsContact CG1-OH 3.29Å; I191-Y216 WeakPolarHBondContact CG1-OH 3.32Å; I191-Y216 WeakPolarHBondContact O-CE1 3.49Å; I191-Y216 PolarHBondContact O-OH 3.41Å; W193-Y216 HydrophobicContact CE3-CD1 4.09Å; W193-Y216 HydrophobicContact CE3-CD2 4.18Å; W193-Y216 HydrophobicContact CE3-CE1 4.1Å; W193-Y216 HydrophobicContact CE3-CE2 4.14Å; W193-Y216 HydrophobicContact CE3-CG 4.16Å; W193-Y216 HydrophobicContact CZ3-CD2 4.05Å; W193-Y216 HydrophobicContact CZ3-CE2 4.09Å; W193-Y216 HydrophobicContact CZ3-CG 4.39Å; L211-Y216 HydrophobicContact CB-CE2 4.08Å; L211-Y216 HydrophobicContact CD1-CE2 4.45Å; L211-Y216 HydrophobicContact CD2-CE2 4.38Å; N214-Y216 HydrophobicContact CB-CD2 3.73Å; N214-Y216 HydrophobicContact CB-CE1 4.19Å; N214-Y216 HydrophobicContact CB-CE2 3.27Å; N214-Y216 HydrophobicContact CB-CG 4.36Å; N214-Y216 PolarHBondContact O-N 3.22Å; N214-Y216 VanDerWaalsContact O-N 3.13Å; Y216-I234 HydrophobicContact CD2-CD1 3.89Å; Y216-I234 HydrophobicContact CD2-CG1 4.2Å; Y216-N237 VanDerWaalsContact CD2-OD1 3.25Å; Y216-N237 WeakPolarHBondContact CD2-OD1 3.04Å; Y216-N237 PolarHBondContact N-OD1 2.84Å; Y216-S238 CarbonylContact O-C 3.49Å; Y216-S238 VanDerWaalsContact O-CA 3.26Å; Y216-S238 WeakPolarHBondContact O-CA 3.35Å; Y216-S238 PolarHBondContact O-N 3.49Å; Y216-L239 PolarHBondContact O-N 3.43Å
217	S	95.7	Very high	94.3	Very high	74 Å²	74	48.9 Å²	48.9	52%	0.517	30%	0.303	S	S	.	.			trans	-105.8	-18.1	171.7	54.4	0	0	0	0	113.1	E215 S238	E215-S217 PolarHBondContact O-N 2.89Å; E215-S217 VanDerWaalsContact O-N 3.11Å; S217-S238 WeakPolarHBondContact CA-O 3.34Å
218	S	95.2	Very high	94.2	Very high	73 Å²	73	48.1 Å²	48.1	51%	0.51	30%	0.303	S	S	.	.			trans	-150.3	162.3	176.3	62.7	0	0	0	0	111.3	E244	S218-E244 WeakPolarHBondContact CA-OE2 3.4Å
219	V	94.2	Very high	94.2	Very high	3 Å²	3	46.1 Å²	46.1	2%	0.018	29%	0.294	C	S	.	.			trans	-130.6	126.2	-171.5	164.8	0	0	0	0	107.9	W193 L239 E244 K247 F248 M251	W193-V219 HydrophobicContact CD2-CB 4.34Å; W193-V219 HydrophobicContact CD2-CG1 4.12Å; W193-V219 HydrophobicContact CD2-CG2 4.02Å; W193-V219 HydrophobicContact CE3-CG2 4.05Å; W193-V219 HydrophobicContact CG-CG1 4.41Å; W193-V219 HydrophobicContact CH2-CG2 4.18Å; W193-V219 HydrophobicContact CZ2-CG1 3.86Å; W193-V219 HydrophobicContact CZ2-CG2 4.15Å; W193-V219 HydrophobicContact CZ3-CG2 4.13Å; V219-L239 HydrophobicContact CG2-CD2 4.16Å; V219-E244 PolarHBondContact N-OE2 3.01Å; V219-K247 HydrophobicContact CB-CD 4.06Å; V219-K247 HydrophobicContact CG1-CB 3.88Å; V219-K247 HydrophobicContact CG1-CD 3.86Å; V219-K247 WeakPolarHBondContact O-CD 3.42Å; V219-K247 PolarHBondContact O-NZ 3.09Å; V219-F248 HydrophobicContact CB-CE1 4.48Å; V219-F248 HydrophobicContact CG1-CE1 4.14Å; V219-F248 HydrophobicContact CG2-CE1 3.64Å; V219-F248 HydrophobicContact CG2-CZ 3.97Å; V219-M251 HydrophobicContact CG1-CE 3.58Å
220	S	90.9	Very high	94.2	Very high	43 Å²	43	52.2 Å²	52.2	30%	0.301	32%	0.316	S	S	.	.			trans	-73.7	135.3	173.3	48.6	0	0	0	0	109.9	W193 D194	W193-S220 VanDerWaalsContact CD1-OG 3.29Å; D194-S220 PolarHBondContact OD1-OG 3.33Å
221	A	83.4	Confident	94.2	Very high	82 Å²	82	51.9 Å²	51.9	68%	0.678	32%	0.316	S	S	*	.			trans	-71.5	139.8	175.9	0	0	0	0	0	109.7
222	S	83.4	Confident	94.2	Very high	31 Å²	31	51.9 Å²	51.9	22%	0.217	32%	0.316	C	S	.	.			trans	-119	143.6	173.4	-165.3	0	0	0	0	111.6	M197 V224	M197-S222 VanDerWaalsContact CE-OG 3.31Å; M197-S222 WeakPolarHBondContact CE-OG 3.36Å; S222-V224 VanDerWaalsContact C-N 3.32Å; S222-V224 PolarHBondContact OG-N 2.81Å
223	S	81.2	Confident	94.2	Very high	126 Å²	126	53.4 Å²	53.4	88%	0.881	32%	0.322	S	S	*	.	S	Bend	trans	-81.4	-14.1	170.9	54.6	0	0	0	0	112.8
224	V	88.6	Confident	94.2	Very high	68 Å²	68	49.4 Å²	49.4	41%	0.412	30%	0.301	S	S	.	.	S	Bend	trans	-103.2	119.1	-178.4	-173.4	0	0	0	0	108.8	Q201 S222	Q201-V224 HydrophobicContact CG-CB 4.11Å; Q201-V224 HydrophobicContact CG-CG1 3.99Å; S222-V224 VanDerWaalsContact C-N 3.32Å; S222-V224 PolarHBondContact OG-N 2.81Å
225	A	93.1	Very high	94.3	Very high	48 Å²	48	49.7 Å²	49.7	40%	0.397	30%	0.303	S	S	.	.			trans	-84.5	147.8	175.6	0	0	0	0	0	111.1	P227 M251 P253	A225-P227 VanDerWaalsContact O-CD 3.28Å; A225-P227 WeakPolarHBondContact O-CD 3.19Å; A225-M251 CarbonylContact C-O 3.08Å; A225-M251 WeakPolarHBondContact CA-O 3.47Å; A225-P253 HydrophobicContact CB-CG 4.31Å
226	C	95.4	Very high	94.4	Very high	5 Å²	5	46.5 Å²	46.5	3%	0.034	29%	0.29	C	S	.	.			trans	-104.9	91.2	166.3	-179.9	0	0	0	0	108	T228 M251 F252	C226-T228 PolarHBondContact O-N 3.4Å; C226-T228 PolarHBondContact SG-OG1 2.89Å; C226-M251 PolarHBondContact N-O 3.47Å; C226-F252 HydrophobicContact CB-CD1 3.95Å; C226-F252 HydrophobicContact CB-CE1 4.08Å
227	P	96.1	Very high	94.4	Very high	77 Å²	77	46.1 Å²	46.1	50%	0.5	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-4.9	-173.4	33.4	-37.8	0	0	0	113.4	A225 P253 S254	A225-P227 VanDerWaalsContact O-CD 3.28Å; A225-P227 WeakPolarHBondContact O-CD 3.19Å; P227-P253 HydrophobicContact CB-CG 4.29Å; P227-S254 WeakPolarHBondContact O-CB 3.38Å; P227-S254 PolarHBondContact O-OG 2.86Å
228	T	97.7	Very high	94.5	Very high	45 Å²	45	45 Å²	45	28%	0.276	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-23.2	179.4	53	0	0	0	0	112.7	P204 L206 C226 R230	P204-T228 WeakPolarHBondContact O-CG2 3.33Å; L206-T228 CarbonylContact O-C 3.57Å; L206-T228 VanDerWaalsContact O-CB 3.24Å; L206-T228 WeakPolarHBondContact O-CB 3.24Å; L206-T228 PolarHBondContact O-OG1 2.84Å; C226-T228 PolarHBondContact O-N 3.4Å; C226-T228 PolarHBondContact SG-OG1 2.89Å; T228-R230 PolarHBondContact O-N 3.44Å
229	L	98.6	Very high	94.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	26%	0.257	C	S	.	.			trans	-66.9	121.6	-176.9	-164.7	76.2	0	0	0	110.8	L206 L209 L232 F252 S254 L255	L206-L229 HydrophobicContact CD2-CD1 3.96Å; L206-L229 HydrophobicContact CG-CD1 3.84Å; L206-L229 WeakPolarHBondContact O-CA 3.38Å; L206-L229 PolarHBondContact O-N 2.74Å; L206-L229 VanDerWaalsContact O-N 3.14Å; L209-L229 HydrophobicContact CB-CD1 3.63Å; L209-L229 HydrophobicContact CB-CD2 4.35Å; L229-L232 HydrophobicContact CD2-CB 4.35Å; L229-F252 HydrophobicContact CB-CB 4.45Å; L229-F252 HydrophobicContact CB-CD1 4.05Å; L229-F252 HydrophobicContact CB-CG 4.41Å; L229-F252 HydrophobicContact CD2-CB 4.24Å; L229-F252 HydrophobicContact CD2-CD1 3.53Å; L229-F252 HydrophobicContact CD2-CD2 3.86Å; L229-F252 HydrophobicContact CD2-CE1 3.77Å; L229-F252 HydrophobicContact CD2-CE2 4.07Å; L229-F252 HydrophobicContact CD2-CG 3.59Å; L229-F252 HydrophobicContact CD2-CZ 4.03Å; L229-F252 HydrophobicContact CG-CD1 4.42Å; L229-S254 CarbonylContact O-C 3.59Å; L229-L255 HydrophobicContact CD2-CD1 4.43Å; L229-L255 PolarHBondContact O-N 2.78Å
230	R	98.7	Very high	94.6	Very high	132 Å²	132	45.6 Å²	45.6	50%	0.498	28%	0.276	S	S	.	.			trans	-109.3	-31.9	-179.8	-67.4	-178.7	180	134.5	6.4	112.3	E207 T228 D256 T257	E207-R230 VanDerWaalsContact CD-NH1 3.3Å; E207-R230 PolarHBondContact O-N 3.21Å; E207-R230 IonicContact OE1-CZ 2.75Å; E207-R230 IonicContact OE1-NH1 3.41Å; E207-R230 PolarHBondContact OE1-NH1 3.06Å; E207-R230 IonicContact OE1-NH2 3.82Å; E207-R230 IonicContact OE2-NH1 3.61Å; E207-R230 PolarHBondContact OE2-NH1 2.75Å; T228-R230 PolarHBondContact O-N 3.44Å; R230-D256 HydrophobicContact CB-CB 4.41Å; R230-D256 WeakPolarHBondContact O-CA 3.5Å; R230-D256 PolarHBondContact O-N 3.15Å; R230-T257 PolarHBondContact O-N 3.31Å
231	L	98.9	Very high	94.9	Very high	29 Å²	29	46.9 Å²	46.9	15%	0.152	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	125	-179.9	-172.9	153.4	0	0	0	110.7	E207 E208 L209 F210 H233 T257	E207-L231 PolarHBondContact O-N 2.77Å; E208-L231 WeakPolarHBondContact CA-O 3.48Å; E208-L231 HydrophobicContact CB-CB 4.3Å; E208-L231 HydrophobicContact CG-CB 4Å; L209-L231 PolarHBondContact N-O 2.95Å; F210-L231 HydrophobicContact CE1-CD2 4.05Å; F210-L231 HydrophobicContact CE2-CD2 4.33Å; F210-L231 HydrophobicContact CZ-CD2 3.86Å; L231-H233 HydrophobicContact CD2-CB 4.02Å; L231-T257 WeakPolarHBondContact CA-O 3.23Å; L231-T257 HydrophobicContact CD1-CG2 3.99Å; L231-T257 HydrophobicContact CG-CG2 3.99Å
232	L	98.9	Very high	95.5	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	121.4	168.9	178.4	61.9	0	0	0	109.1	L209 L211 L229 F248 F252 L255 T257 L258 I259	L209-L232 HydrophobicContact CB-CD1 4.38Å; L209-L232 HydrophobicContact CD2-CD1 4.26Å; L209-L232 HydrophobicContact CG-CD1 4.31Å; L211-L232 HydrophobicContact CD1-CD1 4.13Å; L229-L232 HydrophobicContact CD2-CB 4.35Å; L232-F248 HydrophobicContact CD2-CB 4.42Å; L232-F248 HydrophobicContact CD2-CD1 3.96Å; L232-F248 HydrophobicContact CD2-CD2 4.01Å; L232-F248 HydrophobicContact CD2-CE1 4.23Å; L232-F248 HydrophobicContact CD2-CE2 4.26Å; L232-F248 HydrophobicContact CD2-CG 3.87Å; L232-F248 HydrophobicContact CD2-CZ 4.38Å; L232-F252 HydrophobicContact CD2-CD2 4.15Å; L232-F252 HydrophobicContact CD2-CE2 3.96Å; L232-L255 HydrophobicContact CB-CD1 3.76Å; L232-L255 HydrophobicContact CB-CD2 4.48Å; L232-T257 PolarHBondContact N-O 3.14Å; L232-L258 HydrophobicContact CB-CD1 4.24Å; L232-L258 HydrophobicContact CD2-CD1 4.03Å; L232-L258 HydrophobicContact CG-CD1 4.24Å; L232-I259 PolarHBondContact O-N 3.06Å
233	H	98.9	Very high	96.1	Very high	42 Å²	42	44 Å²	44	19%	0.194	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	115.3	174.3	-167.3	174.1	0	0	0	109.8	L209 F210 L211 C212 L231 T235 I259	L209-H233 PolarHBondContact O-N 2.81Å; F210-H233 CarbonylContact C-O 3.44Å; F210-H233 WeakPolarHBondContact CA-O 3.38Å; F210-H233 HydrophobicContact CB-CB 4.48Å; F210-H233 HydrophobicContact CD1-CB 3.54Å; F210-H233 AromaticContact CD1-CG 3.86Å; F210-H233 AromaticContact CD1-ND1 3.48Å; F210-H233 WeakPolarHBondContact CD1-ND1 3.28Å; F210-H233 HydrophobicContact CE1-CB 4.02Å; F210-H233 AromaticContact CE1-ND1 3.71Å; F210-H233 HydrophobicContact CG-CB 4.19Å; L211-H233 PolarHBondContact N-O 2.93Å; C212-H233 PolarHBondContact SG-CD2 3.37Å; L231-H233 HydrophobicContact CD2-CB 4.02Å; H233-T235 PolarHBondContact CD2-OG1 2.82Å; H233-T235 VanDerWaalsContact NE2-CB 3.34Å; H233-T235 WeakPolarHBondContact NE2-CB 3.35Å; H233-T235 PolarHBondContact NE2-OG1 2.76Å; H233-I259 CarbonylContact C-O 3.6Å; H233-I259 WeakPolarHBondContact CA-O 3.27Å; H233-I259 HydrophobicContact CB-CB 4.34Å; H233-I259 WeakPolarHBondContact CD2-CG2 3.48Å; H233-I259 WeakPolarHBondContact NE2-CG2 3.04Å
234	I	98.6	Very high	96.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.221	C	C	.	.			trans	-135.2	38.4	-173.7	-164.5	162.8	0	0	0	111.4	W193 L211 Y216 N237 L239 F248 I259 M260 N263	W193-I234 HydrophobicContact CH2-CD1 4.04Å; W193-I234 HydrophobicContact CZ3-CD1 3.68Å; L211-I234 HydrophobicContact CB-CG1 4.33Å; Y216-I234 HydrophobicContact CD2-CD1 3.89Å; Y216-I234 HydrophobicContact CD2-CG1 4.2Å; I234-N237 HydrophobicContact CG1-CB 4.3Å; I234-N237 WeakPolarHBondContact CG1-ND2 3.47Å; I234-N237 PolarHBondContact O-ND2 2.93Å; I234-L239 HydrophobicContact CD1-CD1 3.92Å; I234-L239 HydrophobicContact CG1-CD1 4.38Å; I234-L239 HydrophobicContact CG2-CD1 4.41Å; I234-F248 HydrophobicContact CD1-CZ 3.97Å; I234-I259 PolarHBondContact N-O 3.38Å; I234-M260 HydrophobicContact CG2-CB 3.63Å; I234-N263 PolarHBondContact O-ND2 2.91Å
235	T	98.6	Very high	97.1	Very high	15 Å²	15	36 Å²	36	9%	0.092	20%	0.201	C	C	.	.			trans	-66.6	151.1	-179.5	-66.5	0	0	0	0	111.7	C212 L213 H233 N237 A261	C212-T235 CarbonylContact C-O 3.42Å; C212-T235 WeakPolarHBondContact CA-O 3.31Å; C212-T235 VanDerWaalsContact CB-O 3.25Å; C212-T235 WeakPolarHBondContact CB-O 3.22Å; C212-T235 PolarHBondContact SG-N 3.19Å; L213-T235 PolarHBondContact N-O 3.42Å; L213-T235 VanDerWaalsContact N-O 3.09Å; H233-T235 PolarHBondContact CD2-OG1 2.82Å; H233-T235 VanDerWaalsContact NE2-CB 3.34Å; H233-T235 WeakPolarHBondContact NE2-CB 3.35Å; H233-T235 PolarHBondContact NE2-OG1 2.76Å; T235-N237 PolarHBondContact O-ND2 3.45Å; T235-A261 CarbonylContact C-O 3.25Å; T235-A261 WeakPolarHBondContact CA-O 3.27Å; T235-A261 HydrophobicContact CG2-CB 3.92Å; T235-A261 WeakPolarHBondContact CG2-O 3.31Å; T235-A261 PolarHBondContact OG1-N 3.49Å
236	D	98.5	Very high	97.3	Very high	68 Å²	68	34.1 Å²	34.1	36%	0.364	19%	0.186	S	C	.	.	S	Bend	trans	56.5	51.6	-179.7	-63.8	-59.8	0	0	0	112.5	L213 A261 N262	L213-D236 VanDerWaalsContact CA-O 3.29Å; L213-D236 WeakPolarHBondContact CA-O 3.4Å; L213-D236 HydrophobicContact CD2-CB 3.41Å; L213-D236 VanDerWaalsContact CD2-CB 3.41Å; L213-D236 HydrophobicContact CG-CB 3.92Å; L213-D236 PolarHBondContact N-O 3.25Å; D236-A261 PolarHBondContact N-O 2.8Å; D236-N262 WeakPolarHBondContact OD1-CB 3.28Å; D236-N262 VanDerWaalsContact OD1-CG 3.29Å; D236-N262 PolarHBondContact OD1-ND2 3.12Å; D236-N262 PolarHBondContact OD2-ND2 3.01Å
237	N	98.3	Very high	97.3	Very high	8 Å²	8	36.4 Å²	36.4	4%	0.043	20%	0.196	C	C	.	.	S	Bend	trans	-118.8	-173	167.5	-75.9	-81.4	0	0	0	109.1	L211 N214 E215 Y216 I234 T235 N263	L211-N237 PolarHBondContact O-ND2 3.12Å; N214-N237 VanDerWaalsContact C-OD1 3.28Å; N214-N237 WeakPolarHBondContact CA-OD1 3.47Å; N214-N237 PolarHBondContact N-OD1 3.14Å; N214-N237 VanDerWaalsContact N-OD1 3.14Å; E215-N237 PolarHBondContact N-OD1 2.9Å; Y216-N237 VanDerWaalsContact CD2-OD1 3.25Å; Y216-N237 WeakPolarHBondContact CD2-OD1 3.04Å; Y216-N237 PolarHBondContact N-OD1 2.84Å; I234-N237 HydrophobicContact CG1-CB 4.3Å; I234-N237 WeakPolarHBondContact CG1-ND2 3.47Å; I234-N237 PolarHBondContact O-ND2 2.93Å; T235-N237 PolarHBondContact O-ND2 3.45Å; N237-N263 WeakPolarHBondContact CA-OD1 3.03Å; N237-N263 VanDerWaalsContact CB-OD1 3.23Å; N237-N263 WeakPolarHBondContact CB-OD1 3.38Å; N237-N263 PolarHBondContact O-OD1 3.14Å
238	S	96.8	Very high	97.3	Very high	49 Å²	49	32.8 Å²	32.8	34%	0.343	17%	0.172	S	C	.	.			trans	-114.4	33.5	-174.9	-64.8	0	0	0	0	112.8	Y216 S217 H240	Y216-S238 CarbonylContact O-C 3.49Å; Y216-S238 VanDerWaalsContact O-CA 3.26Å; Y216-S238 WeakPolarHBondContact O-CA 3.35Å; Y216-S238 PolarHBondContact O-N 3.49Å; S217-S238 WeakPolarHBondContact CA-O 3.34Å; S238-H240 PolarHBondContact O-CD2 3.09Å; S238-H240 PolarHBondContact O-N 3.22Å; S238-H240 VanDerWaalsContact O-N 3.12Å
239	L	96.6	Very high	97.2	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.161	C	C	.	.			trans	-75.3	103.4	179.7	-62.1	172.6	0	0	0	110.5	Y216 V219 I234 E244 F248 N263 L265	Y216-L239 PolarHBondContact O-N 3.43Å; V219-L239 HydrophobicContact CG2-CD2 4.16Å; I234-L239 HydrophobicContact CD1-CD1 3.92Å; I234-L239 HydrophobicContact CG1-CD1 4.38Å; I234-L239 HydrophobicContact CG2-CD1 4.41Å; L239-E244 HydrophobicContact CD2-CB 4.08Å; L239-F248 HydrophobicContact CD1-CE2 4.04Å; L239-F248 HydrophobicContact CD1-CZ 3.74Å; L239-N263 HydrophobicContact CB-CB 4.32Å; L239-N263 WeakPolarHBondContact CB-OD1 3.22Å; L239-N263 PolarHBondContact N-OD1 3.27Å; L239-N263 VanDerWaalsContact N-OD1 3.1Å; L239-L265 PolarHBondContact O-N 2.71Å
240	H	96.1	Very high	97	Very high	89 Å²	89	34.4 Å²	34.4	41%	0.412	19%	0.186	S	C	.	.			trans	-96.8	-35	-178.6	-64.2	-69.9	0	0	0	114	S238 N264 A266	S238-H240 PolarHBondContact O-CD2 3.09Å; S238-H240 PolarHBondContact O-N 3.22Å; S238-H240 VanDerWaalsContact O-N 3.12Å; H240-N264 WeakPolarHBondContact CA-O 3.48Å; H240-N264 VanDerWaalsContact CE1-CB 3.45Å; H240-N264 WeakPolarHBondContact CE1-CB 3.47Å; H240-N264 PolarHBondContact CE1-ND2 3Å; H240-N264 VanDerWaalsContact CE1-ND2 3.25Å; H240-N264 WeakPolarHBondContact ND1-CB 3.5Å; H240-N264 PolarHBondContact ND1-ND2 2.83Å; H240-N264 VanDerWaalsContact ND1-ND2 3.15Å; H240-N264 PolarHBondContact ND1-O 3.21Å; H240-A266 PolarHBondContact O-N 3.33Å; H240-A266 VanDerWaalsContact O-N 3.13Å
241	D	96.1	Very high	96.8	Very high	70 Å²	70	28.2 Å²	28.2	37%	0.374	16%	0.163	S	C	.	.			trans	-98.9	132.1	-174.4	-168	-13.8	0	0	0	110.9	A243 E244	D241-A243 PolarHBondContact O-N 3.31Å; D241-A243 PolarHBondContact OD1-N 3.06Å; D241-E244 HydrophobicContact CB-CG 4.34Å; D241-E244 WeakPolarHBondContact O-CB 3.42Å; D241-E244 PolarHBondContact O-N 3.11Å; D241-E244 VanDerWaalsContact O-N 3.15Å
242	W	96.1	Very high	96.8	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.008	16%	0.156	C	C	.	.	H	α-helix	trans	-60.4	-29.1	174.5	-173.8	-96.6	0	0	0	112.5	E244 V245 G246 L265 S267 I268 D270 L275 F279 F304	W242-E244 PolarHBondContact O-N 3.37Å; W242-V245 HydrophobicContact CD2-CB 4.37Å; W242-V245 HydrophobicContact CE3-CB 4.17Å; W242-V245 HydrophobicContact CE3-CG1 4.24Å; W242-V245 HydrophobicContact CE3-CG2 4.45Å; W242-V245 HydrophobicContact CH2-CG1 4.08Å; W242-V245 HydrophobicContact CZ2-CG1 4.47Å; W242-V245 HydrophobicContact CZ3-CB 4.4Å; W242-V245 HydrophobicContact CZ3-CG1 3.96Å; W242-V245 CarbonylContact O-C 3.57Å; W242-V245 PolarHBondContact O-N 3.44Å; W242-G246 PolarHBondContact O-N 3Å; W242-L265 HydrophobicContact CB-CD1 4.32Å; W242-L265 HydrophobicContact CE3-CD1 4.01Å; W242-L265 HydrophobicContact CE3-CD2 3.72Å; W242-L265 HydrophobicContact CE3-CG 4.44Å; W242-L265 HydrophobicContact CZ3-CD2 3.82Å; W242-S267 WeakPolarHBondContact CB-O 3.22Å; W242-I268 HydrophobicContact CD2-CB 4.23Å; W242-I268 HydrophobicContact CD2-CG1 4.38Å; W242-I268 HydrophobicContact CD2-CG2 3.84Å; W242-I268 HydrophobicContact CE3-CB 4.1Å; W242-I268 HydrophobicContact CE3-CD1 4.5Å; W242-I268 HydrophobicContact CE3-CG1 3.74Å; W242-I268 HydrophobicContact CE3-CG2 4.03Å; W242-I268 HydrophobicContact CG-CG2 4.48Å; W242-I268 HydrophobicContact CH2-CD1 4.27Å; W242-I268 HydrophobicContact CH2-CG1 4.32Å; W242-I268 HydrophobicContact CH2-CG2 4.03Å; W242-I268 HydrophobicContact CZ2-CG2 3.85Å; W242-I268 HydrophobicContact CZ3-CB 4.36Å; W242-I268 HydrophobicContact CZ3-CD1 3.97Å; W242-I268 HydrophobicContact CZ3-CG1 3.71Å; W242-I268 HydrophobicContact CZ3-CG2 4.12Å; W242-D270 VanDerWaalsContact CD1-OD2 3.29Å; W242-D270 PolarHBondContact NE1-OD2 3.01Å; W242-L275 HydrophobicContact CZ2-CD2 3.5Å; W242-F279 HydrophobicContact CZ2-CE2 4.45Å; W242-F304 AromaticContact CH2-CZ 3.99Å; W242-F304 HydrophobicContact CH2-CZ 3.99Å; W242-F304 HydrophobicContact CZ2-CZ 4.05Å
243	A	95.6	Very high	96.6	Very high	50 Å²	50	29.1 Å²	29.1	41%	0.413	17%	0.17	S	C	.	.	H	α-helix	trans	-57	-32.4	176.8	0	0	0	0	0	112.4	D241 K247	D241-A243 PolarHBondContact O-N 3.31Å; D241-A243 PolarHBondContact OD1-N 3.06Å; A243-K247 WeakPolarHBondContact O-CG 3.41Å
244	E	96.4	Very high	96.6	Very high	28 Å²	28	29.1 Å²	29.1	13%	0.131	18%	0.175	C	C	.	.	H	α-helix	trans	-72.5	-41.9	175.7	-56.1	-54.9	125.3	0	0	111.4	S218 V219 L239 D241 W242 K247	S218-E244 WeakPolarHBondContact CA-OE2 3.4Å; V219-E244 PolarHBondContact N-OE2 3.01Å; L239-E244 HydrophobicContact CD2-CB 4.08Å; D241-E244 HydrophobicContact CB-CG 4.34Å; D241-E244 WeakPolarHBondContact O-CB 3.42Å; D241-E244 PolarHBondContact O-N 3.11Å; D241-E244 VanDerWaalsContact O-N 3.15Å; W242-E244 PolarHBondContact O-N 3.37Å; E244-K247 WeakPolarHBondContact O-CB 3.3Å; E244-K247 PolarHBondContact O-N 3.12Å; E244-K247 IonicContact OE1-NZ 2.9Å; E244-K247 PolarHBondContact OE1-NZ 3.26Å; E244-K247 IonicContact OE2-NZ 3.88Å; E244-K247 PolarHBondContact OE2-NZ 3.38Å
245	V	95.9	Very high	96.6	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-64.7	-40.4	176	-176.2	0	0	0	0	111.2	W242 K247 F248 L258 M260 L265	W242-V245 HydrophobicContact CD2-CB 4.37Å; W242-V245 HydrophobicContact CE3-CB 4.17Å; W242-V245 HydrophobicContact CE3-CG1 4.24Å; W242-V245 HydrophobicContact CE3-CG2 4.45Å; W242-V245 HydrophobicContact CH2-CG1 4.08Å; W242-V245 HydrophobicContact CZ2-CG1 4.47Å; W242-V245 HydrophobicContact CZ3-CB 4.4Å; W242-V245 HydrophobicContact CZ3-CG1 3.96Å; W242-V245 CarbonylContact O-C 3.57Å; W242-V245 PolarHBondContact O-N 3.44Å; V245-K247 PolarHBondContact O-N 2.95Å; V245-F248 HydrophobicContact CB-CD2 4.39Å; V245-F248 HydrophobicContact CB-CE2 4.39Å; V245-F248 HydrophobicContact CG1-CD2 3.96Å; V245-F248 HydrophobicContact CG1-CE2 4.24Å; V245-F248 HydrophobicContact CG2-CE2 4.48Å; V245-F248 VanDerWaalsContact O-CB 3.24Å; V245-F248 WeakPolarHBondContact O-CB 2.94Å; V245-F248 VanDerWaalsContact O-CD2 3.29Å; V245-F248 WeakPolarHBondContact O-CD2 3.47Å; V245-F248 WeakPolarHBondContact O-CG 3.47Å; V245-F248 PolarHBondContact O-N 3.47Å; V245-L258 HydrophobicContact CG1-CD2 4.09Å; V245-M260 HydrophobicContact CG1-SD 4.03Å; V245-M260 HydrophobicContact CG2-CE 3.6Å; V245-M260 HydrophobicContact CG2-SD 4.11Å; V245-L265 HydrophobicContact CG2-CD1 4.16Å
246	G	95.6	Very high	96.6	Very high	8 Å²	8	29.8 Å²	29.8	8%	0.082	18%	0.178	C	C	.	.	H	α-helix	trans	-59.5	-27.4	178.6	0	0	0	0	0	113.5	W242 F248 G249	W242-G246 PolarHBondContact O-N 3Å; G246-F248 PolarHBondContact O-N 2.98Å; G246-G249 PolarHBondContact O-N 2.99Å
247	K	96.4	Very high	96.6	Very high	53 Å²	53	26.9 Å²	26.9	23%	0.23	16%	0.163	C	C	.	.	H	α-helix	trans	-63.4	-31.7	174.7	-64.4	167.3	-167.4	171.9	0	111.7	V219 A243 E244 V245 G249 S250 M251	V219-K247 HydrophobicContact CB-CD 4.06Å; V219-K247 HydrophobicContact CG1-CB 3.88Å; V219-K247 HydrophobicContact CG1-CD 3.86Å; V219-K247 WeakPolarHBondContact O-CD 3.42Å; V219-K247 PolarHBondContact O-NZ 3.09Å; A243-K247 WeakPolarHBondContact O-CG 3.41Å; E244-K247 WeakPolarHBondContact O-CB 3.3Å; E244-K247 PolarHBondContact O-N 3.12Å; E244-K247 IonicContact OE1-NZ 2.9Å; E244-K247 PolarHBondContact OE1-NZ 3.26Å; E244-K247 IonicContact OE2-NZ 3.88Å; E244-K247 PolarHBondContact OE2-NZ 3.38Å; V245-K247 PolarHBondContact O-N 2.95Å; K247-G249 VanDerWaalsContact C-N 3.27Å; K247-G249 PolarHBondContact O-N 3.05Å; K247-S250 PolarHBondContact O-N 3.27Å; K247-M251 HydrophobicContact CB-CE 4.09Å; K247-M251 WeakPolarHBondContact O-CG 3.44Å; K247-M251 PolarHBondContact O-N 2.81Å
248	F	96.9	Very high	96.7	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58.6	-39.8	175.7	-56.1	-32	0	0	0	112	W193 V219 L232 I234 L239 V245 G246 S250 M251 F252 L258 F279	W193-F248 HydrophobicContact CH2-CD1 4.2Å; W193-F248 AromaticContact CH2-CE1 3.43Å; W193-F248 HydrophobicContact CH2-CE1 3.43Å; W193-F248 VanDerWaalsContact CH2-CE1 3.43Å; W193-F248 HydrophobicContact CH2-CZ 4.21Å; W193-F248 HydrophobicContact CZ2-CD1 4.11Å; W193-F248 AromaticContact CZ2-CE1 3.65Å; W193-F248 HydrophobicContact CZ2-CE1 3.65Å; W193-F248 HydrophobicContact CZ3-CE1 4.33Å; V219-F248 HydrophobicContact CB-CE1 4.48Å; V219-F248 HydrophobicContact CG1-CE1 4.14Å; V219-F248 HydrophobicContact CG2-CE1 3.64Å; V219-F248 HydrophobicContact CG2-CZ 3.97Å; L232-F248 HydrophobicContact CD2-CB 4.42Å; L232-F248 HydrophobicContact CD2-CD1 3.96Å; L232-F248 HydrophobicContact CD2-CD2 4.01Å; L232-F248 HydrophobicContact CD2-CE1 4.23Å; L232-F248 HydrophobicContact CD2-CE2 4.26Å; L232-F248 HydrophobicContact CD2-CG 3.87Å; L232-F248 HydrophobicContact CD2-CZ 4.38Å; I234-F248 HydrophobicContact CD1-CZ 3.97Å; L239-F248 HydrophobicContact CD1-CE2 4.04Å; L239-F248 HydrophobicContact CD1-CZ 3.74Å; V245-F248 HydrophobicContact CB-CD2 4.39Å; V245-F248 HydrophobicContact CB-CE2 4.39Å; V245-F248 HydrophobicContact CG1-CD2 3.96Å; V245-F248 HydrophobicContact CG1-CE2 4.24Å; V245-F248 HydrophobicContact CG2-CE2 4.48Å; V245-F248 VanDerWaalsContact O-CB 3.24Å; V245-F248 WeakPolarHBondContact O-CB 2.94Å; V245-F248 VanDerWaalsContact O-CD2 3.29Å; V245-F248 WeakPolarHBondContact O-CD2 3.47Å; V245-F248 WeakPolarHBondContact O-CG 3.47Å; V245-F248 PolarHBondContact O-N 3.47Å; G246-F248 PolarHBondContact O-N 2.98Å; F248-S250 VanDerWaalsContact C-N 3.32Å; F248-S250 PolarHBondContact O-N 3.39Å; F248-M251 HydrophobicContact CD1-CE 3.77Å; F248-M251 HydrophobicContact CE1-CE 4.41Å; F248-M251 PolarHBondContact O-N 2.9Å; F248-F252 HydrophobicContact CB-CD2 4.04Å; F248-F252 HydrophobicContact CB-CE2 4.47Å; F248-F252 HydrophobicContact CD1-CE2 4.14Å; F248-F252 WeakPolarHBondContact O-CA 3.24Å; F248-F252 WeakPolarHBondContact O-CB 3.25Å; F248-F252 WeakPolarHBondContact O-CD2 3.39Å; F248-F252 PolarHBondContact O-N 3.5Å; F248-L258 HydrophobicContact CD2-CD1 4.2Å; F248-F279 HydrophobicContact CB-CE1 4.24Å; F248-F279 HydrophobicContact CB-CZ 4.27Å
249	G	95.2	Very high	96.8	Very high	4 Å²	4	25.9 Å²	25.9	4%	0.041	15%	0.153	C	C	.	.	H	α-helix	trans	-64.8	-36.8	179.9	0	0	0	0	0	113.1	G246 K247 L278	G246-G249 PolarHBondContact O-N 2.99Å; K247-G249 VanDerWaalsContact C-N 3.27Å; K247-G249 PolarHBondContact O-N 3.05Å; G249-L278 CarbonylContact C-O 3.55Å; G249-L278 WeakPolarHBondContact CA-O 3.44Å
250	S	93.7	Very high	96.8	Very high	76 Å²	76	26 Å²	26	53%	0.531	15%	0.153	S	C	.	.	H	α-helix	trans	-70.3	-39.3	174.4	-59.6	0	0	0	0	112.3	K247 F248 L278	K247-S250 PolarHBondContact O-N 3.27Å; F248-S250 VanDerWaalsContact C-N 3.32Å; F248-S250 PolarHBondContact O-N 3.39Å; S250-L278 WeakPolarHBondContact OG-CD2 3.41Å
251	M	95.6	Very high	96.9	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.01	14%	0.137	C	C	.	.	H	α-helix	trans	-78.1	-32.4	-178.1	-65.2	-177.1	-57.7	0	0	112.5	W193 M197 V219 A225 C226 K247 F248 P253	W193-M251 HydrophobicContact CZ2-CE 3.77Å; M197-M251 HydrophobicContact CE-SD 4.06Å; M197-M251 HydrophobicContact SD-CE 4.5Å; M197-M251 HydrophobicContact SD-SD 3.37Å; V219-M251 HydrophobicContact CG1-CE 3.58Å; A225-M251 CarbonylContact C-O 3.08Å; A225-M251 WeakPolarHBondContact CA-O 3.47Å; C226-M251 PolarHBondContact N-O 3.47Å; K247-M251 HydrophobicContact CB-CE 4.09Å; K247-M251 WeakPolarHBondContact O-CG 3.44Å; K247-M251 PolarHBondContact O-N 2.81Å; F248-M251 HydrophobicContact CD1-CE 3.77Å; F248-M251 HydrophobicContact CE1-CE 4.41Å; F248-M251 PolarHBondContact O-N 2.9Å; M251-P253 WeakPolarHBondContact O-CD 3.48Å
252	F	97.3	Very high	97	Very high	1 Å²	1	21.7 Å²	21.7	0%	0.004	14%	0.135	C	C	.	.			trans	-128.6	69.5	-171.3	-46.2	-50.8	0	0	0	110.4	T200 C226 L229 L232 F248 S254 L255	T200-F252 HydrophobicContact CG2-CE1 4.16Å; C226-F252 HydrophobicContact CB-CD1 3.95Å; C226-F252 HydrophobicContact CB-CE1 4.08Å; L229-F252 HydrophobicContact CB-CB 4.45Å; L229-F252 HydrophobicContact CB-CD1 4.05Å; L229-F252 HydrophobicContact CB-CG 4.41Å; L229-F252 HydrophobicContact CD2-CB 4.24Å; L229-F252 HydrophobicContact CD2-CD1 3.53Å; L229-F252 HydrophobicContact CD2-CD2 3.86Å; L229-F252 HydrophobicContact CD2-CE1 3.77Å; L229-F252 HydrophobicContact CD2-CE2 4.07Å; L229-F252 HydrophobicContact CD2-CG 3.59Å; L229-F252 HydrophobicContact CD2-CZ 4.03Å; L229-F252 HydrophobicContact CG-CD1 4.42Å; L232-F252 HydrophobicContact CD2-CD2 4.15Å; L232-F252 HydrophobicContact CD2-CE2 3.96Å; F248-F252 HydrophobicContact CB-CD2 4.04Å; F248-F252 HydrophobicContact CB-CE2 4.47Å; F248-F252 HydrophobicContact CD1-CE2 4.14Å; F248-F252 WeakPolarHBondContact O-CA 3.24Å; F248-F252 WeakPolarHBondContact O-CB 3.25Å; F248-F252 WeakPolarHBondContact O-CD2 3.39Å; F248-F252 PolarHBondContact O-N 3.5Å; F252-S254 PolarHBondContact O-N 3.39Å; F252-S254 VanDerWaalsContact O-N 3.11Å; F252-L255 HydrophobicContact CB-CB 4.15Å; F252-L255 HydrophobicContact CB-CD1 4.4Å; F252-L255 VanDerWaalsContact O-CB 3.23Å; F252-L255 WeakPolarHBondContact O-CB 2.99Å; F252-L255 PolarHBondContact O-N 3.05Å
253	P	96.4	Very high	97	Very high	47 Å²	47	21.6 Å²	21.6	31%	0.305	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-17.4	-172.3	26.3	-36.1	0	0	0	114.5	A225 P227 M251 N281	A225-P253 HydrophobicContact CB-CG 4.31Å; P227-P253 HydrophobicContact CB-CG 4.29Å; M251-P253 WeakPolarHBondContact O-CD 3.48Å; P253-N281 PolarHBondContact O-ND2 3.26Å
254	S	98.1	Very high	96.9	Very high	41 Å²	41	23.5 Å²	23.5	29%	0.287	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97	8.3	177.6	-58.9	0	0	0	0	113.5	P227 L229 F252 D256	P227-S254 WeakPolarHBondContact O-CB 3.38Å; P227-S254 PolarHBondContact O-OG 2.86Å; L229-S254 CarbonylContact O-C 3.59Å; F252-S254 PolarHBondContact O-N 3.39Å; F252-S254 VanDerWaalsContact O-N 3.11Å; S254-D256 PolarHBondContact O-N 3.05Å; S254-D256 VanDerWaalsContact O-N 3.14Å
255	L	98.7	Very high	97	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.01	13%	0.131	C	C	.	.			trans	-58.7	119.7	-176.2	-164.8	71.9	0	0	0	110.7	L229 L232 F252 L258 F279 N281 L282	L229-L255 HydrophobicContact CD2-CD1 4.43Å; L229-L255 PolarHBondContact O-N 2.78Å; L232-L255 HydrophobicContact CB-CD1 3.76Å; L232-L255 HydrophobicContact CB-CD2 4.48Å; F252-L255 HydrophobicContact CB-CB 4.15Å; F252-L255 HydrophobicContact CB-CD1 4.4Å; F252-L255 VanDerWaalsContact O-CB 3.23Å; F252-L255 WeakPolarHBondContact O-CB 2.99Å; F252-L255 PolarHBondContact O-N 3.05Å; L255-L258 HydrophobicContact CD2-CB 4.05Å; L255-L258 HydrophobicContact CD2-CD1 4.34Å; L255-F279 HydrophobicContact CD2-CD1 4.44Å; L255-F279 HydrophobicContact CD2-CE1 4.13Å; L255-N281 CarbonylContact O-C 3.57Å; L255-N281 VanDerWaalsContact O-C 3.25Å; L255-L282 HydrophobicContact CD2-CD1 4.43Å; L255-L282 HydrophobicContact CG-CD1 4.44Å; L255-L282 WeakPolarHBondContact O-CA 3.24Å; L255-L282 PolarHBondContact O-N 3.11Å
256	D	98.7	Very high	97	Very high	27 Å²	27	24.4 Å²	24.4	14%	0.144	15%	0.15	C	C	.	.			trans	-96.8	-38.6	178.8	164.9	-84.6	0	0	0	110.7	R230 S254 R283 R284	R230-D256 HydrophobicContact CB-CB 4.41Å; R230-D256 WeakPolarHBondContact O-CA 3.5Å; R230-D256 PolarHBondContact O-N 3.15Å; S254-D256 PolarHBondContact O-N 3.05Å; S254-D256 VanDerWaalsContact O-N 3.14Å; D256-R283 PolarHBondContact O-N 2.7Å; D256-R283 VanDerWaalsContact OD2-CD 3.25Å; D256-R283 WeakPolarHBondContact OD2-CD 3.35Å; D256-R283 IonicContact OD2-NH1 3.83Å; D256-R284 PolarHBondContact O-N 3.07Å; D256-R284 IonicContact OD1-CZ 3.7Å; D256-R284 IonicContact OD1-NE 3.3Å; D256-R284 PolarHBondContact OD1-NE 2.83Å; D256-R284 IonicContact OD1-NH2 3.32Å; D256-R284 PolarHBondContact OD1-NH2 3.3Å
257	T	98.9	Very high	97	Very high	7 Å²	7	25.5 Å²	25.5	4%	0.043	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	122.8	-173.9	-63.9	0	0	0	0	111	R230 L231 L232 I259 R284	R230-T257 PolarHBondContact O-N 3.31Å; L231-T257 WeakPolarHBondContact CA-O 3.23Å; L231-T257 HydrophobicContact CD1-CG2 3.99Å; L231-T257 HydrophobicContact CG-CG2 3.99Å; L232-T257 PolarHBondContact N-O 3.14Å; T257-I259 HydrophobicContact CG2-CD1 4.07Å; T257-I259 HydrophobicContact CG2-CG1 3.81Å; T257-R284 WeakPolarHBondContact CA-O 3.43Å; T257-R284 HydrophobicContact CG2-CB 4.17Å; T257-R284 PolarHBondContact OG1-NE 3.24Å; T257-R284 PolarHBondContact OG1-NH2 2.77Å
258	L	98.8	Very high	97.1	Very high	1 Å²	1	23 Å²	23	1%	0.005	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	114.6	172.2	177.8	60	0	0	0	109.9	L232 V245 F248 L255 M260 L282 R284 I285 N286	L232-L258 HydrophobicContact CB-CD1 4.24Å; L232-L258 HydrophobicContact CD2-CD1 4.03Å; L232-L258 HydrophobicContact CG-CD1 4.24Å; V245-L258 HydrophobicContact CG1-CD2 4.09Å; F248-L258 HydrophobicContact CD2-CD1 4.2Å; L255-L258 HydrophobicContact CD2-CB 4.05Å; L255-L258 HydrophobicContact CD2-CD1 4.34Å; L258-M260 HydrophobicContact CD2-SD 4.07Å; L258-M260 HydrophobicContact CG-CG 4.4Å; L258-M260 HydrophobicContact CG-SD 4.4Å; L258-L282 HydrophobicContact CB-CD1 3.83Å; L258-R284 PolarHBondContact N-O 3.19Å; L258-I285 HydrophobicContact CB-CG1 4.39Å; L258-I285 HydrophobicContact CD2-CD1 4.42Å; L258-I285 HydrophobicContact CD2-CG1 4.49Å; L258-I285 CarbonylContact O-C 3.59Å; L258-I285 WeakPolarHBondContact O-CA 3.47Å; L258-N286 PolarHBondContact O-N 2.75Å
259	I	98.8	Very high	96.8	Very high	36 Å²	36	28.6 Å²	28.6	19%	0.185	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	110.2	176.4	-54.2	174.2	0	0	0	108.3	L232 H233 I234 T257 N286	L232-I259 PolarHBondContact O-N 3.06Å; H233-I259 CarbonylContact C-O 3.6Å; H233-I259 WeakPolarHBondContact CA-O 3.27Å; H233-I259 HydrophobicContact CB-CB 4.34Å; H233-I259 WeakPolarHBondContact CD2-CG2 3.48Å; H233-I259 WeakPolarHBondContact NE2-CG2 3.04Å; I234-I259 PolarHBondContact N-O 3.38Å; T257-I259 HydrophobicContact CG2-CD1 4.07Å; T257-I259 HydrophobicContact CG2-CG1 3.81Å; I259-N286 HydrophobicContact CB-CB 4.4Å; I259-N286 HydrophobicContact CG1-CB 4.42Å; I259-N286 HydrophobicContact CG2-CB 4.01Å
260	M	98.1	Very high	96.8	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	18%	0.179	C	C	.	.			trans	-135.9	41	-178.2	62.9	175.9	-63.7	0	0	111.3	I234 V245 L258 N263 L265 N286 L287	I234-M260 HydrophobicContact CG2-CB 3.63Å; V245-M260 HydrophobicContact CG1-SD 4.03Å; V245-M260 HydrophobicContact CG2-CE 3.6Å; V245-M260 HydrophobicContact CG2-SD 4.11Å; L258-M260 HydrophobicContact CD2-SD 4.07Å; L258-M260 HydrophobicContact CG-CG 4.4Å; L258-M260 HydrophobicContact CG-SD 4.4Å; M260-N263 HydrophobicContact CE-CB 4.09Å; M260-N263 PolarHBondContact O-ND2 2.84Å; M260-L265 HydrophobicContact CE-CB 4.34Å; M260-L265 HydrophobicContact CE-CD2 4.23Å; M260-N286 CarbonylContact C-O 3.49Å; M260-N286 WeakPolarHBondContact CG-O 3.38Å; M260-N286 PolarHBondContact N-O 3.15Å; M260-L287 HydrophobicContact CE-CD2 4.42Å; M260-L287 HydrophobicContact CG-CD2 3.46Å; M260-L287 VanDerWaalsContact CG-CD2 3.46Å; M260-L287 HydrophobicContact SD-CD2 3.49Å; M260-L287 WeakPolarHBondContact SD-CD2 3.29Å
261	A	98.4	Very high	96.9	Very high	9 Å²	9	30.5 Å²	30.5	7%	0.074	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	156.5	177.7	0	0	0	0	0	111.1	T235 D236 N263 N288	T235-A261 CarbonylContact C-O 3.25Å; T235-A261 WeakPolarHBondContact CA-O 3.27Å; T235-A261 HydrophobicContact CG2-CB 3.92Å; T235-A261 WeakPolarHBondContact CG2-O 3.31Å; T235-A261 PolarHBondContact OG1-N 3.49Å; D236-A261 PolarHBondContact N-O 2.8Å; A261-N263 PolarHBondContact O-N 3.17Å; A261-N263 PolarHBondContact O-ND2 2.66Å; A261-N288 CarbonylContact C-O 3.6Å; A261-N288 VanDerWaalsContact CA-O 3.26Å; A261-N288 WeakPolarHBondContact CA-O 3.5Å; A261-N288 HydrophobicContact CB-CB 3.96Å
262	N	98	Very high	96.9	Very high	61 Å²	61	36.4 Å²	36.4	33%	0.326	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	25.1	179	-51.4	-24.5	0	0	0	113.9	D236 N288 N289	D236-N262 WeakPolarHBondContact OD1-CB 3.28Å; D236-N262 VanDerWaalsContact OD1-CG 3.29Å; D236-N262 PolarHBondContact OD1-ND2 3.12Å; D236-N262 PolarHBondContact OD2-ND2 3.01Å; N262-N288 PolarHBondContact N-O 2.86Å; N262-N289 VanDerWaalsContact OD1-CB 3.25Å; N262-N289 WeakPolarHBondContact OD1-CB 3.25Å; N262-N289 PolarHBondContact OD1-ND2 2.98Å
263	N	96.3	Very high	96.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.232	C	C	.	.			trans	-97.3	134.2	163	-76.5	-93	0	0	0	107.9	I234 N237 L239 M260 A261 L265 S290	I234-N263 PolarHBondContact O-ND2 2.91Å; N237-N263 WeakPolarHBondContact CA-OD1 3.03Å; N237-N263 VanDerWaalsContact CB-OD1 3.23Å; N237-N263 WeakPolarHBondContact CB-OD1 3.38Å; N237-N263 PolarHBondContact O-OD1 3.14Å; L239-N263 HydrophobicContact CB-CB 4.32Å; L239-N263 WeakPolarHBondContact CB-OD1 3.22Å; L239-N263 PolarHBondContact N-OD1 3.27Å; L239-N263 VanDerWaalsContact N-OD1 3.1Å; M260-N263 HydrophobicContact CE-CB 4.09Å; M260-N263 PolarHBondContact O-ND2 2.84Å; A261-N263 PolarHBondContact O-N 3.17Å; A261-N263 PolarHBondContact O-ND2 2.66Å; N263-L265 PolarHBondContact O-N 3.45Å; N263-S290 VanDerWaalsContact O-CA 3.23Å; N263-S290 WeakPolarHBondContact O-CA 3.47Å
264	N	93.4	Very high	97	Very high	89 Å²	89	42 Å²	42	48%	0.476	23%	0.228	S	C	.	.			trans	-83.1	54.1	-178.1	179.3	46.4	0	0	0	112.2	H240 A266 G291	H240-N264 WeakPolarHBondContact CA-O 3.48Å; H240-N264 VanDerWaalsContact CE1-CB 3.45Å; H240-N264 WeakPolarHBondContact CE1-CB 3.47Å; H240-N264 PolarHBondContact CE1-ND2 3Å; H240-N264 VanDerWaalsContact CE1-ND2 3.25Å; H240-N264 WeakPolarHBondContact ND1-CB 3.5Å; H240-N264 PolarHBondContact ND1-ND2 2.83Å; H240-N264 VanDerWaalsContact ND1-ND2 3.15Å; H240-N264 PolarHBondContact ND1-O 3.21Å; N264-A266 PolarHBondContact O-N 3.13Å; N264-G291 WeakPolarHBondContact OD1-CA 3.16Å
265	L	97.3	Very high	96.9	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	21%	0.214	C	C	.	.			trans	-63.8	117.4	175.8	177.4	71.6	0	0	0	109.8	L239 W242 V245 M260 N263 L287 G291 L292	L239-L265 PolarHBondContact O-N 2.71Å; W242-L265 HydrophobicContact CB-CD1 4.32Å; W242-L265 HydrophobicContact CE3-CD1 4.01Å; W242-L265 HydrophobicContact CE3-CD2 3.72Å; W242-L265 HydrophobicContact CE3-CG 4.44Å; W242-L265 HydrophobicContact CZ3-CD2 3.82Å; V245-L265 HydrophobicContact CG2-CD1 4.16Å; M260-L265 HydrophobicContact CE-CB 4.34Å; M260-L265 HydrophobicContact CE-CD2 4.23Å; N263-L265 PolarHBondContact O-N 3.45Å; L265-L287 HydrophobicContact CD2-CD2 4.25Å; L265-G291 CarbonylContact O-C 3.35Å; L265-G291 VanDerWaalsContact O-C 3.24Å; L265-G291 WeakPolarHBondContact O-CA 3.46Å; L265-G291 PolarHBondContact O-N 3.03Å; L265-L292 HydrophobicContact CD2-CD2 4.42Å; L265-L292 HydrophobicContact CG-CD2 4.46Å; L265-L292 PolarHBondContact O-N 2.76Å
266	A	96.3	Very high	96.9	Very high	48 Å²	48	41.6 Å²	41.6	40%	0.397	23%	0.227	S	C	.	.			trans	-83	-34	-170.3	0	0	0	0	0	114.3	H240 N264	H240-A266 PolarHBondContact O-N 3.33Å; H240-A266 VanDerWaalsContact O-N 3.13Å; N264-A266 PolarHBondContact O-N 3.13Å
267	S	96.9	Very high	96.8	Very high	31 Å²	31	48.6 Å²	48.6	22%	0.217	25%	0.251	C	S	.	.			trans	-162.2	163.5	-178.2	59.8	0	0	0	0	110.7	W242 D297	W242-S267 WeakPolarHBondContact CB-O 3.22Å; S267-D297 WeakPolarHBondContact CA-OD1 3.41Å; S267-D297 WeakPolarHBondContact CB-OD1 3.45Å
268	I	96.8	Very high	96.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.254	C	S	.	.			trans	-103.4	116.2	170.1	-57.3	-174.1	0	0	0	106.3	W242 L275 L287 L292 D297 K300 L301	W242-I268 HydrophobicContact CD2-CB 4.23Å; W242-I268 HydrophobicContact CD2-CG1 4.38Å; W242-I268 HydrophobicContact CD2-CG2 3.84Å; W242-I268 HydrophobicContact CE3-CB 4.1Å; W242-I268 HydrophobicContact CE3-CD1 4.5Å; W242-I268 HydrophobicContact CE3-CG1 3.74Å; W242-I268 HydrophobicContact CE3-CG2 4.03Å; W242-I268 HydrophobicContact CG-CG2 4.48Å; W242-I268 HydrophobicContact CH2-CD1 4.27Å; W242-I268 HydrophobicContact CH2-CG1 4.32Å; W242-I268 HydrophobicContact CH2-CG2 4.03Å; W242-I268 HydrophobicContact CZ2-CG2 3.85Å; W242-I268 HydrophobicContact CZ3-CB 4.36Å; W242-I268 HydrophobicContact CZ3-CD1 3.97Å; W242-I268 HydrophobicContact CZ3-CG1 3.71Å; W242-I268 HydrophobicContact CZ3-CG2 4.12Å; I268-L275 HydrophobicContact CG2-CD1 4.12Å; I268-L287 HydrophobicContact CD1-CD1 4.39Å; I268-L292 HydrophobicContact CG1-CD2 4.34Å; I268-D297 HydrophobicContact CG1-CB 4.3Å; I268-D297 PolarHBondContact N-OD1 2.8Å; I268-K300 HydrophobicContact CB-CB 4.37Å; I268-K300 HydrophobicContact CB-CD 3.98Å; I268-K300 HydrophobicContact CG2-CB 3.95Å; I268-K300 HydrophobicContact CG2-CD 3.87Å; I268-K300 WeakPolarHBondContact O-CD 3.19Å; I268-K300 WeakPolarHBondContact O-CE 3.42Å; I268-K300 PolarHBondContact O-NZ 3.05Å; I268-L301 HydrophobicContact CD1-CD2 3.57Å; I268-L301 HydrophobicContact CD1-CG 4.4Å
269	Q	92.3	Very high	96.6	Very high	117 Å²	117	49.3 Å²	49.3	55%	0.547	26%	0.255	S	S	.	.			trans	-96.3	-33.7	-169.6	-66.5	-176.4	20.7	0	0	114.1	K300	Q269-K300 PolarHBondContact O-NZ 3.33Å
270	D	95.1	Very high	96.6	Very high	37 Å²	37	49.7 Å²	49.7	20%	0.198	26%	0.26	C	S	.	.			trans	-62.6	151.4	-173.2	-73.6	-33.5	0	0	0	114	W242 I274 L275	W242-D270 VanDerWaalsContact CD1-OD2 3.29Å; W242-D270 PolarHBondContact NE1-OD2 3.01Å; D270-I274 HydrophobicContact CB-CB 4.08Å; D270-I274 HydrophobicContact CB-CG2 3.85Å; D270-I274 VanDerWaalsContact CG-CG2 3.46Å; D270-L275 HydrophobicContact CB-CD1 4.47Å; D270-L275 HydrophobicContact CB-CD2 3.58Å; D270-L275 HydrophobicContact CB-CG 3.67Å
271	N	95.2	Very high	96.6	Very high	83 Å²	83	52.1 Å²	52.1	44%	0.444	27%	0.273	S	S	.	.			trans	-84	174.3	175	70.2	43.2	0	0	0	111.9	D273 I274 L275	N271-D273 PolarHBondContact O-N 3.19Å; N271-D273 PolarHBondContact OD1-N 3.24Å; N271-D273 VanDerWaalsContact OD1-N 3.09Å; N271-I274 PolarHBondContact O-N 2.92Å; N271-I274 WeakPolarHBondContact OD1-CG1 3.49Å; N271-I274 PolarHBondContact OD1-N 3.49Å; N271-L275 WeakPolarHBondContact O-CG 3.47Å; N271-L275 PolarHBondContact O-N 2.93Å
272	K	95.9	Very high	96.6	Very high	126 Å²	126	51.7 Å²	51.7	55%	0.548	27%	0.269	S	S	.	.	H	α-helix	trans	-53.7	-47.6	-177.3	-176.5	-179	178.3	-176.8	0	113.9	I274 A276 F303	K272-I274 VanDerWaalsContact C-N 3.34Å; K272-I274 PolarHBondContact O-N 2.83Å; K272-A276 VanDerWaalsContact O-CB 3.29Å; K272-A276 WeakPolarHBondContact O-CB 3.49Å; K272-A276 PolarHBondContact O-N 2.81Å; K272-F303 HydrophobicContact CB-CB 4.22Å; K272-F303 HydrophobicContact CB-CD1 4.02Å; K272-F303 HydrophobicContact CB-CD2 3.79Å; K272-F303 HydrophobicContact CB-CE1 4.36Å; K272-F303 HydrophobicContact CB-CE2 4.13Å; K272-F303 HydrophobicContact CB-CG 3.74Å; K272-F303 HydrophobicContact CB-CZ 4.42Å; K272-F303 HydrophobicContact CD-CD1 4.2Å; K272-F303 HydrophobicContact CG-CB 4.03Å; K272-F303 HydrophobicContact CG-CD1 3.87Å; K272-F303 HydrophobicContact CG-CD2 4.41Å; K272-F303 HydrophobicContact CG-CE1 4.48Å; K272-F303 HydrophobicContact CG-CG 3.84Å
273	D	97.1	Very high	96.7	Very high	123 Å²	123	53.1 Å²	53.1	66%	0.658	27%	0.27	S	S	*	.	H	α-helix	trans	-68.9	-36.4	-175	-61.4	-30.7	0	0	0	111.6	N271 R277	N271-D273 PolarHBondContact O-N 3.19Å; N271-D273 PolarHBondContact OD1-N 3.24Å; N271-D273 VanDerWaalsContact OD1-N 3.09Å; D273-R277 VanDerWaalsContact O-CB 3.32Å; D273-R277 WeakPolarHBondContact O-CB 3.48Å; D273-R277 PolarHBondContact O-N 2.96Å
274	I	97.1	Very high	96.8	Very high	44 Å²	44	58 Å²	58	23%	0.226	29%	0.288	C	S	.	.	H	α-helix	trans	-69.3	-50.3	177.3	-63.1	170.1	0	0	0	110.2	D270 N271 K272 A276 R277 L278	D270-I274 HydrophobicContact CB-CB 4.08Å; D270-I274 HydrophobicContact CB-CG2 3.85Å; D270-I274 VanDerWaalsContact CG-CG2 3.46Å; N271-I274 PolarHBondContact O-N 2.92Å; N271-I274 WeakPolarHBondContact OD1-CG1 3.49Å; N271-I274 PolarHBondContact OD1-N 3.49Å; K272-I274 VanDerWaalsContact C-N 3.34Å; K272-I274 PolarHBondContact O-N 2.83Å; I274-A276 PolarHBondContact O-N 3.01Å; I274-R277 PolarHBondContact O-N 2.98Å; I274-L278 HydrophobicContact CG2-CD1 3.64Å; I274-L278 HydrophobicContact CG2-CG 4.12Å; I274-L278 WeakPolarHBondContact O-CB 3.34Å; I274-L278 WeakPolarHBondContact O-CG 3.34Å; I274-L278 PolarHBondContact O-N 2.89Å
275	L	97.3	Very high	97	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.7	-44.3	-179.4	-71.1	-178.7	0	0	0	112.3	W242 I268 D270 N271 R277 L278 F279 K300 F303 F304	W242-L275 HydrophobicContact CZ2-CD2 3.5Å; I268-L275 HydrophobicContact CG2-CD1 4.12Å; D270-L275 HydrophobicContact CB-CD1 4.47Å; D270-L275 HydrophobicContact CB-CD2 3.58Å; D270-L275 HydrophobicContact CB-CG 3.67Å; N271-L275 WeakPolarHBondContact O-CG 3.47Å; N271-L275 PolarHBondContact O-N 2.93Å; L275-R277 VanDerWaalsContact C-N 3.28Å; L275-R277 PolarHBondContact O-N 2.91Å; L275-L278 PolarHBondContact O-N 3Å; L275-F279 PolarHBondContact O-N 2.96Å; L275-K300 HydrophobicContact CD1-CB 4.15Å; L275-F303 HydrophobicContact CB-CB 4.2Å; L275-F303 HydrophobicContact CD1-CB 4.06Å; L275-F303 HydrophobicContact CD1-CD2 4.08Å; L275-F304 HydrophobicContact CB-CD1 4.49Å; L275-F304 HydrophobicContact CB-CE1 4.13Å; L275-F304 HydrophobicContact CD1-CZ 4.28Å; L275-F304 HydrophobicContact CD2-CE1 3.97Å; L275-F304 HydrophobicContact CD2-CZ 3.91Å; L275-F304 HydrophobicContact CG-CE1 4.48Å; L275-F304 HydrophobicContact CG-CZ 4.5Å
276	A	97.3	Very high	97.1	Very high	33 Å²	33	54.8 Å²	54.8	27%	0.273	27%	0.271	S	S	.	.	H	α-helix	trans	-64.1	-33	178.4	0	0	0	0	0	112.8	K272 I274 P280	K272-A276 VanDerWaalsContact O-CB 3.29Å; K272-A276 WeakPolarHBondContact O-CB 3.49Å; K272-A276 PolarHBondContact O-N 2.81Å; I274-A276 PolarHBondContact O-N 3.01Å; A276-P280 WeakPolarHBondContact O-CA 3.44Å
277	R	97.2	Very high	97.2	Very high	174 Å²	174	52.6 Å²	52.6	66%	0.657	25%	0.252	S	S	*	.	H	α-helix	trans	-76.6	-41.1	176.8	-176.9	-179.4	65	-137	-2.7	112.6	D273 I274 L275	D273-R277 VanDerWaalsContact O-CB 3.32Å; D273-R277 WeakPolarHBondContact O-CB 3.48Å; D273-R277 PolarHBondContact O-N 2.96Å; I274-R277 PolarHBondContact O-N 2.98Å; L275-R277 VanDerWaalsContact C-N 3.28Å; L275-R277 PolarHBondContact O-N 2.91Å
278	L	96.6	Very high	97.3	Very high	20 Å²	20	52.1 Å²	52.1	11%	0.105	25%	0.248	C	C	.	.	H	α-helix	trans	-71.7	-37.5	-178.6	-72.7	178.8	0	0	0	111.9	G249 S250 I274 L275 P280	G249-L278 CarbonylContact C-O 3.55Å; G249-L278 WeakPolarHBondContact CA-O 3.44Å; S250-L278 WeakPolarHBondContact OG-CD2 3.41Å; I274-L278 HydrophobicContact CG2-CD1 3.64Å; I274-L278 HydrophobicContact CG2-CG 4.12Å; I274-L278 WeakPolarHBondContact O-CB 3.34Å; I274-L278 WeakPolarHBondContact O-CG 3.34Å; I274-L278 PolarHBondContact O-N 2.89Å; L275-L278 PolarHBondContact O-N 3Å; L278-P280 VanDerWaalsContact C-CD 3.41Å; L278-P280 WeakPolarHBondContact O-CD 3.44Å
279	F	97.9	Very high	97.3	Very high	4 Å²	4	56.1 Å²	56.1	2%	0.018	27%	0.269	C	S	.	.			trans	-127.8	63	-174.1	-63.8	-79	0	0	0	111.7	W242 F248 L255 L275 N281 L282 F304	W242-F279 HydrophobicContact CZ2-CE2 4.45Å; F248-F279 HydrophobicContact CB-CE1 4.24Å; F248-F279 HydrophobicContact CB-CZ 4.27Å; L255-F279 HydrophobicContact CD2-CD1 4.44Å; L255-F279 HydrophobicContact CD2-CE1 4.13Å; L275-F279 PolarHBondContact O-N 2.96Å; F279-N281 PolarHBondContact O-N 2.79Å; F279-L282 HydrophobicContact CB-CB 3.91Å; F279-L282 HydrophobicContact CB-CD2 4.29Å; F279-L282 HydrophobicContact CD1-CD2 4.34Å; F279-L282 HydrophobicContact CG-CD2 4.4Å; F279-F304 HydrophobicContact CB-CD1 3.69Å; F279-F304 HydrophobicContact CB-CE1 3.75Å; F279-F304 HydrophobicContact CD2-CD1 4.48Å; F279-F304 AromaticContact CD2-CE1 3.69Å; F279-F304 HydrophobicContact CD2-CE1 3.69Å; F279-F304 HydrophobicContact CG-CD1 4.39Å; F279-F304 AromaticContact CG-CE1 3.95Å; F279-F304 HydrophobicContact CG-CE1 3.95Å
280	P	97.8	Very high	97.6	Very high	44 Å²	44	50.7 Å²	50.7	29%	0.286	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-19.5	-173.8	29.8	-36.2	0	0	0	113.5	A276 L278 K306	A276-P280 WeakPolarHBondContact O-CA 3.44Å; L278-P280 VanDerWaalsContact C-CD 3.41Å; L278-P280 WeakPolarHBondContact O-CD 3.44Å; P280-K306 WeakPolarHBondContact O-CE 3.35Å
281	N	98.4	Very high	97.7	Very high	52 Å²	52	49.3 Å²	49.3	28%	0.278	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.4	2	-175.6	-66.2	-58.3	0	0	0	114	P253 L255 F279 R283 K306	P253-N281 PolarHBondContact O-ND2 3.26Å; L255-N281 CarbonylContact O-C 3.57Å; L255-N281 VanDerWaalsContact O-C 3.25Å; F279-N281 PolarHBondContact O-N 2.79Å; N281-R283 PolarHBondContact O-N 2.98Å; N281-K306 PolarHBondContact OD1-NZ 3.49Å
282	L	98.8	Very high	97.8	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.217	C	C	.	.			trans	-68.7	118.6	-175.1	-170.7	73.7	0	0	0	110.5	L255 L258 F279 I285 F304 K306 L307	L255-L282 HydrophobicContact CD2-CD1 4.43Å; L255-L282 HydrophobicContact CG-CD1 4.44Å; L255-L282 WeakPolarHBondContact O-CA 3.24Å; L255-L282 PolarHBondContact O-N 3.11Å; L258-L282 HydrophobicContact CB-CD1 3.83Å; F279-L282 HydrophobicContact CB-CB 3.91Å; F279-L282 HydrophobicContact CB-CD2 4.29Å; F279-L282 HydrophobicContact CD1-CD2 4.34Å; F279-L282 HydrophobicContact CG-CD2 4.4Å; L282-I285 HydrophobicContact CD2-CB 4.37Å; L282-I285 HydrophobicContact CD2-CD1 4.22Å; L282-F304 HydrophobicContact CD2-CD1 4.1Å; L282-F304 HydrophobicContact CD2-CE1 4.18Å; L282-F304 HydrophobicContact CD2-CG 4.37Å; L282-K306 CarbonylContact O-C 3.24Å; L282-K306 VanDerWaalsContact O-C 3.28Å; L282-L307 HydrophobicContact CG-CD1 4.48Å; L282-L307 WeakPolarHBondContact O-CA 3.29Å; L282-L307 PolarHBondContact O-N 3.46Å
283	R	98.8	Very high	97.9	Very high	91 Å²	91	43.3 Å²	43.3	34%	0.343	21%	0.212	S	C	.	.			trans	-108.8	-29.5	-179.4	-68.3	176.8	73.2	-123.3	-1	111.9	D256 N281 K306 E308 E309	D256-R283 PolarHBondContact O-N 2.7Å; D256-R283 VanDerWaalsContact OD2-CD 3.25Å; D256-R283 WeakPolarHBondContact OD2-CD 3.35Å; D256-R283 IonicContact OD2-NH1 3.83Å; N281-R283 PolarHBondContact O-N 2.98Å; R283-K306 WeakPolarHBondContact CA-O 3.36Å; R283-K306 HydrophobicContact CG-CB 4.06Å; R283-K306 WeakPolarHBondContact CG-O 3.25Å; R283-E308 HydrophobicContact CB-CG 4.16Å; R283-E308 HydrophobicContact CG-CG 4.35Å; R283-E308 IonicContact CZ-OE1 3.78Å; R283-E308 IonicContact CZ-OE2 2.75Å; R283-E308 VanDerWaalsContact NE-CD 3.32Å; R283-E308 IonicContact NE-OE1 3.03Å; R283-E308 PolarHBondContact NE-OE1 3.15Å; R283-E308 IonicContact NE-OE2 2.81Å; R283-E308 IonicContact NH2-OE1 3.95Å; R283-E308 PolarHBondContact NH2-OE1 3.1Å; R283-E308 IonicContact NH2-OE2 3.59Å; R283-E308 PolarHBondContact NH2-OE2 2.77Å; R283-E308 PolarHBondContact O-N 3.15Å; R283-E309 PolarHBondContact O-N 3.22Å
284	R	98.9	Very high	97.8	Very high	103 Å²	103	44.7 Å²	44.7	39%	0.389	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	125.5	-174.4	-56.6	-179.8	-86.8	-178.8	-2	110.8	D256 T257 L258 E309	D256-R284 PolarHBondContact O-N 3.07Å; D256-R284 IonicContact OD1-CZ 3.7Å; D256-R284 IonicContact OD1-NE 3.3Å; D256-R284 PolarHBondContact OD1-NE 2.83Å; D256-R284 IonicContact OD1-NH2 3.32Å; D256-R284 PolarHBondContact OD1-NH2 3.3Å; T257-R284 WeakPolarHBondContact CA-O 3.43Å; T257-R284 HydrophobicContact CG2-CB 4.17Å; T257-R284 PolarHBondContact OG1-NE 3.24Å; T257-R284 PolarHBondContact OG1-NH2 2.77Å; L258-R284 PolarHBondContact N-O 3.19Å; R284-E309 WeakPolarHBondContact CA-O 3.49Å; R284-E309 HydrophobicContact CB-CB 4.19Å; R284-E309 HydrophobicContact CG-CB 3.81Å
285	I	98.8	Very high	97.8	Very high	3 Å²	3	44 Å²	44	2%	0.015	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	131.8	174.8	-160	175	0	0	0	111	L258 L282 L287 L307 E309 V310 R311	L258-I285 HydrophobicContact CB-CG1 4.39Å; L258-I285 HydrophobicContact CD2-CD1 4.42Å; L258-I285 HydrophobicContact CD2-CG1 4.49Å; L258-I285 CarbonylContact O-C 3.59Å; L258-I285 WeakPolarHBondContact O-CA 3.47Å; L282-I285 HydrophobicContact CD2-CB 4.37Å; L282-I285 HydrophobicContact CD2-CD1 4.22Å; I285-L287 HydrophobicContact CD1-CD1 3.95Å; I285-L287 HydrophobicContact CD1-CD2 3.99Å; I285-L287 HydrophobicContact CD1-CG 3.98Å; I285-L287 HydrophobicContact CG1-CD1 4.44Å; I285-L287 HydrophobicContact CG1-CD2 4.09Å; I285-L287 HydrophobicContact CG1-CG 3.98Å; I285-L307 HydrophobicContact CB-CD1 4.13Å; I285-L307 HydrophobicContact CG2-CD1 3.82Å; I285-L307 HydrophobicContact CG2-CD2 4.3Å; I285-E309 PolarHBondContact N-O 3.08Å; I285-V310 HydrophobicContact CG2-CG1 4.38Å; I285-V310 HydrophobicContact CG2-CG2 4.04Å; I285-V310 WeakPolarHBondContact O-CA 3.22Å; I285-R311 PolarHBondContact O-N 2.77Å
286	N	98.8	Very high	97.6	Very high	18 Å²	18	49.4 Å²	49.4	10%	0.096	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	111.1	173.3	-179.9	1	0	0	0	110.1	L258 I259 M260 N288 R311	L258-N286 PolarHBondContact O-N 2.75Å; I259-N286 HydrophobicContact CB-CB 4.4Å; I259-N286 HydrophobicContact CG1-CB 4.42Å; I259-N286 HydrophobicContact CG2-CB 4.01Å; M260-N286 CarbonylContact C-O 3.49Å; M260-N286 WeakPolarHBondContact CG-O 3.38Å; M260-N286 PolarHBondContact N-O 3.15Å; N286-N288 VanDerWaalsContact OD1-CB 3.25Å; N286-N288 WeakPolarHBondContact OD1-CB 3.36Å; N286-N288 PolarHBondContact OD1-N 3.34Å; N286-R311 HydrophobicContact CB-CB 4.06Å; N286-R311 HydrophobicContact CB-CG 4.37Å; N286-R311 WeakPolarHBondContact OD1-CB 3.26Å
287	L	98.4	Very high	97.6	Very high	1 Å²	1	48 Å²	48	1%	0.005	22%	0.216	C	C	.	.			trans	-117.5	26.1	178.4	-58.1	178.9	0	0	0	110.8	M260 L265 I268 I285 N289 S290 L292 L301 R311 L312	M260-L287 HydrophobicContact CE-CD2 4.42Å; M260-L287 HydrophobicContact CG-CD2 3.46Å; M260-L287 VanDerWaalsContact CG-CD2 3.46Å; M260-L287 HydrophobicContact SD-CD2 3.49Å; M260-L287 WeakPolarHBondContact SD-CD2 3.29Å; L265-L287 HydrophobicContact CD2-CD2 4.25Å; I268-L287 HydrophobicContact CD1-CD1 4.39Å; I285-L287 HydrophobicContact CD1-CD1 3.95Å; I285-L287 HydrophobicContact CD1-CD2 3.99Å; I285-L287 HydrophobicContact CD1-CG 3.98Å; I285-L287 HydrophobicContact CG1-CD1 4.44Å; I285-L287 HydrophobicContact CG1-CD2 4.09Å; I285-L287 HydrophobicContact CG1-CG 3.98Å; L287-N289 PolarHBondContact O-N 3.21Å; L287-S290 VanDerWaalsContact O-CB 3.28Å; L287-S290 WeakPolarHBondContact O-CB 3.34Å; L287-S290 PolarHBondContact O-N 3.26Å; L287-S290 PolarHBondContact O-OG 3.42Å; L287-L292 HydrophobicContact CD1-CD1 4Å; L287-L301 HydrophobicContact CD1-CD2 4.2Å; L287-R311 CarbonylContact C-O 3.58Å; L287-R311 WeakPolarHBondContact CA-O 3.04Å; L287-R311 PolarHBondContact N-O 2.74Å; L287-L312 HydrophobicContact CB-CD2 3.91Å; L287-L312 HydrophobicContact CD1-CD2 4.25Å
288	N	98.6	Very high	97.6	Very high	22 Å²	22	39.8 Å²	39.8	12%	0.118	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	140.7	175.5	-77.8	-3	0	0	0	110.6	A261 N262 N286 S290 R311 L312 Q313	A261-N288 CarbonylContact C-O 3.6Å; A261-N288 VanDerWaalsContact CA-O 3.26Å; A261-N288 WeakPolarHBondContact CA-O 3.5Å; A261-N288 HydrophobicContact CB-CB 3.96Å; N262-N288 PolarHBondContact N-O 2.86Å; N286-N288 VanDerWaalsContact OD1-CB 3.25Å; N286-N288 WeakPolarHBondContact OD1-CB 3.36Å; N286-N288 PolarHBondContact OD1-N 3.34Å; N288-S290 PolarHBondContact O-N 3.18Å; N288-S290 VanDerWaalsContact O-N 3.16Å; N288-R311 PolarHBondContact N-O 3.15Å; N288-R311 VanDerWaalsContact OD1-CB 3.28Å; N288-R311 WeakPolarHBondContact OD1-CB 3.23Å; N288-L312 PolarHBondContact OD1-N 3.36Å; N288-Q313 CarbonylContact C-O 3.28Å; N288-Q313 VanDerWaalsContact CA-O 3.24Å; N288-Q313 WeakPolarHBondContact CA-O 3.33Å; N288-Q313 PolarHBondContact OD1-N 3.12Å
289	N	98.1	Very high	97.5	Very high	83 Å²	83	41.3 Å²	41.3	44%	0.444	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.6	32.2	178.5	-51.5	-41.5	0	0	0	113.2	N262 L287 Q313 G314	N262-N289 VanDerWaalsContact OD1-CB 3.25Å; N262-N289 WeakPolarHBondContact OD1-CB 3.25Å; N262-N289 PolarHBondContact OD1-ND2 2.98Å; L287-N289 PolarHBondContact O-N 3.21Å; N289-Q313 PolarHBondContact N-O 3.43Å; N289-Q313 PolarHBondContact OD1-O 3Å; N289-G314 WeakPolarHBondContact OD1-CA 3.3Å
290	S	97.4	Very high	97.5	Very high	4 Å²	4	43.4 Å²	43.4	3%	0.028	20%	0.201	C	C	.	.			trans	-81.1	165.9	168.3	59.2	0	0	0	0	112.3	N263 L287 N288 L292 I315 P316	N263-S290 VanDerWaalsContact O-CA 3.23Å; N263-S290 WeakPolarHBondContact O-CA 3.47Å; L287-S290 VanDerWaalsContact O-CB 3.28Å; L287-S290 WeakPolarHBondContact O-CB 3.34Å; L287-S290 PolarHBondContact O-N 3.26Å; L287-S290 PolarHBondContact O-OG 3.42Å; N288-S290 PolarHBondContact O-N 3.18Å; N288-S290 VanDerWaalsContact O-N 3.16Å; S290-L292 PolarHBondContact O-N 2.82Å; S290-L292 WeakPolarHBondContact OG-CG 3.23Å; S290-I315 VanDerWaalsContact OG-CG2 3.22Å; S290-I315 WeakPolarHBondContact OG-CG2 3.48Å; S290-P316 WeakPolarHBondContact O-CD 3.15Å
291	G	97.3	Very high	97.5	Very high	7 Å²	7	41.3 Å²	41.3	7%	0.072	19%	0.187	C	C	.	.			trans	-78.6	8.4	-179.7	0	0	0	0	0	114.8	N264 L265 N293	N264-G291 WeakPolarHBondContact OD1-CA 3.16Å; L265-G291 CarbonylContact O-C 3.35Å; L265-G291 VanDerWaalsContact O-C 3.24Å; L265-G291 WeakPolarHBondContact O-CA 3.46Å; L265-G291 PolarHBondContact O-N 3.03Å; G291-N293 PolarHBondContact O-N 3.22Å
292	L	97.9	Very high	97.4	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.188	C	C	.	.			trans	-61.3	123.7	-176.2	-62.3	-178.1	0	0	0	111.6	L265 I268 L287 S290 D297 L312 I315 P316 L317	L265-L292 HydrophobicContact CD2-CD2 4.42Å; L265-L292 HydrophobicContact CG-CD2 4.46Å; L265-L292 PolarHBondContact O-N 2.76Å; I268-L292 HydrophobicContact CG1-CD2 4.34Å; L287-L292 HydrophobicContact CD1-CD1 4Å; S290-L292 PolarHBondContact O-N 2.82Å; S290-L292 WeakPolarHBondContact OG-CG 3.23Å; L292-D297 HydrophobicContact CD2-CB 3.97Å; L292-L312 HydrophobicContact CD1-CD2 4.08Å; L292-I315 HydrophobicContact CB-CB 4.39Å; L292-I315 HydrophobicContact CB-CD1 4.31Å; L292-I315 HydrophobicContact CB-CG2 4.46Å; L292-P316 WeakPolarHBondContact O-CD 3.5Å; L292-L317 WeakPolarHBondContact O-CB 3.41Å; L292-L317 PolarHBondContact O-N 3.26Å
293	N	97.3	Very high	97.3	Very high	84 Å²	84	44.5 Å²	44.5	45%	0.449	20%	0.201	S	C	.	.			trans	-129.1	6.7	-173.4	62.5	48.5	0	0	0	114.1	G291 P316	G291-N293 PolarHBondContact O-N 3.22Å; N293-P316 HydrophobicContact CB-CB 4.22Å
294	R	96.1	Very high	97.3	Very high	151 Å²	151	40.5 Å²	40.5	57%	0.57	19%	0.186	S	C	*	.			trans	-131.5	142.5	-173.9	-83.1	169.5	-164.3	-161.1	2	112	E296 D297	R294-E296 VanDerWaalsContact C-N 3.28Å; R294-E296 VanDerWaalsContact CB-OE2 3.31Å; R294-E296 WeakPolarHBondContact CB-OE2 3.48Å; R294-E296 PolarHBondContact O-N 3.24Å; R294-D297 PolarHBondContact O-N 2.61Å
295	W	95.3	Very high	97.2	Very high	31 Å²	31	39.5 Å²	39.5	12%	0.117	19%	0.193	C	C	.	.	H	α-helix	trans	-69.4	-28.2	176.9	-79.2	110.4	0	0	0	112.1	D297 I298 E299 L317 L318 Y321 L329 M330 Q333	W295-D297 PolarHBondContact O-N 3Å; W295-I298 HydrophobicContact CE3-CB 4.13Å; W295-I298 HydrophobicContact CE3-CG1 3.96Å; W295-I298 HydrophobicContact CE3-CG2 4.41Å; W295-I298 HydrophobicContact CZ3-CG1 4.33Å; W295-I298 HydrophobicContact CZ3-CG2 4.4Å; W295-I298 WeakPolarHBondContact O-CA 3.3Å; W295-I298 WeakPolarHBondContact O-CB 3.45Å; W295-I298 PolarHBondContact O-N 3.09Å; W295-E299 PolarHBondContact O-N 3.5Å; W295-L317 HydrophobicContact CD2-CD1 4.21Å; W295-L317 HydrophobicContact CD2-CD2 3.95Å; W295-L317 HydrophobicContact CD2-CG 4.44Å; W295-L317 HydrophobicContact CE3-CD2 4.04Å; W295-L317 HydrophobicContact CG-CD1 4.06Å; W295-L317 HydrophobicContact CG-CD2 4.34Å; W295-L317 HydrophobicContact CZ3-CD2 4.39Å; W295-L318 HydrophobicContact CH2-CD2 4.19Å; W295-Y321 AromaticContact CZ2-CE2 3.88Å; W295-Y321 HydrophobicContact CZ2-CE2 3.88Å; W295-Y321 AromaticContact CZ2-CZ 3.98Å; W295-Y321 AromaticContact NE1-CZ 3.97Å; W295-Y321 PolarHBondContact NE1-OH 2.87Å; W295-Y321 VanDerWaalsContact NE1-OH 3.09Å; W295-L329 HydrophobicContact CH2-CB 3.55Å; W295-L329 HydrophobicContact CH2-CD1 4.42Å; W295-L329 HydrophobicContact CZ2-CB 3.98Å; W295-L329 HydrophobicContact CZ2-CD1 4.02Å; W295-L329 HydrophobicContact CZ3-CB 4.44Å; W295-M330 HydrophobicContact CH2-CG 4.47Å; W295-M330 HydrophobicContact CZ3-CG 4.45Å; W295-Q333 HydrophobicContact CE3-CG 4Å; W295-Q333 HydrophobicContact CZ3-CB 4.47Å; W295-Q333 HydrophobicContact CZ3-CG 4.05Å
296	E	94.6	Very high	97.2	Very high	112 Å²	112	44.2 Å²	44.2	52%	0.523	21%	0.214	S	C	.	.	H	α-helix	trans	-59.3	-32.7	176.1	-63.1	82.3	175.2	0	0	112.1	R294 E299 K300	R294-E296 VanDerWaalsContact C-N 3.28Å; R294-E296 VanDerWaalsContact CB-OE2 3.31Å; R294-E296 WeakPolarHBondContact CB-OE2 3.48Å; R294-E296 PolarHBondContact O-N 3.24Å; E296-E299 PolarHBondContact O-N 3.45Å; E296-K300 WeakPolarHBondContact O-CG 3.44Å; E296-K300 PolarHBondContact O-N 2.84Å; E296-K300 VanDerWaalsContact O-N 3.12Å
297	D	96.4	Very high	97.2	Very high	5 Å²	5	43.7 Å²	43.7	3%	0.027	21%	0.211	C	C	.	.	H	α-helix	trans	-68.6	-37.9	175	-63.8	-46	0	0	0	111.3	S267 I268 L292 R294 W295 K300	S267-D297 WeakPolarHBondContact CA-OD1 3.41Å; S267-D297 WeakPolarHBondContact CB-OD1 3.45Å; I268-D297 HydrophobicContact CG1-CB 4.3Å; I268-D297 PolarHBondContact N-OD1 2.8Å; L292-D297 HydrophobicContact CD2-CB 3.97Å; R294-D297 PolarHBondContact O-N 2.61Å; W295-D297 PolarHBondContact O-N 3Å; D297-K300 PolarHBondContact O-N 3.03Å
298	I	97.1	Very high	97.2	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-67.3	-40.3	175.9	-48.7	-53.8	0	0	0	110.2	W295 K300 L301 L312 I315 L317 Q333 L334	W295-I298 HydrophobicContact CE3-CB 4.13Å; W295-I298 HydrophobicContact CE3-CG1 3.96Å; W295-I298 HydrophobicContact CE3-CG2 4.41Å; W295-I298 HydrophobicContact CZ3-CG1 4.33Å; W295-I298 HydrophobicContact CZ3-CG2 4.4Å; W295-I298 WeakPolarHBondContact O-CA 3.3Å; W295-I298 WeakPolarHBondContact O-CB 3.45Å; W295-I298 PolarHBondContact O-N 3.09Å; I298-K300 VanDerWaalsContact C-N 3.29Å; I298-K300 PolarHBondContact O-N 2.96Å; I298-L301 VanDerWaalsContact O-CB 3.27Å; I298-L301 WeakPolarHBondContact O-CB 3.45Å; I298-L301 WeakPolarHBondContact O-CG 3.34Å; I298-L301 PolarHBondContact O-N 2.76Å; I298-L301 VanDerWaalsContact O-N 3.12Å; I298-L312 HydrophobicContact CD1-CD1 3.92Å; I298-L312 HydrophobicContact CD1-CD2 4.1Å; I298-I315 HydrophobicContact CD1-CD1 3.98Å; I298-L317 HydrophobicContact CD1-CD2 3.88Å; I298-L317 HydrophobicContact CG1-CD2 3.42Å; I298-L317 VanDerWaalsContact CG1-CD2 3.42Å; I298-Q333 HydrophobicContact CG2-CB 4.48Å; I298-L334 HydrophobicContact CG2-CD1 4.14Å; I298-L334 HydrophobicContact CG2-CD2 4Å; I298-L334 HydrophobicContact CG2-CG 4.06Å; I298-L334 WeakPolarHBondContact O-CD2 3.48Å
299	E	95.3	Very high	97.2	Very high	52 Å²	52	47.4 Å²	47.4	24%	0.243	23%	0.227	C	C	.	.	H	α-helix	trans	-62.1	-36.4	177	-70.5	-179.1	-173.8	0	0	112.2	W295 E296 L301 N302 Q333	W295-E299 PolarHBondContact O-N 3.5Å; E296-E299 PolarHBondContact O-N 3.45Å; E299-L301 PolarHBondContact O-N 2.86Å; E299-N302 VanDerWaalsContact O-CB 3.27Å; E299-N302 WeakPolarHBondContact O-CB 3.39Å; E299-N302 PolarHBondContact O-N 2.94Å; E299-N302 PolarHBondContact O-ND2 2.85Å; E299-Q333 PolarHBondContact OE1-NE2 3.46Å
300	K	96.8	Very high	97.3	Very high	47 Å²	47	43.5 Å²	43.5	20%	0.204	21%	0.206	C	C	.	.	H	α-helix	trans	-62.9	-22.9	175.8	-74.2	174.3	-173.1	-170.7	0	113.3	I268 Q269 L275 E296 D297 I298 N302 F303	I268-K300 HydrophobicContact CB-CB 4.37Å; I268-K300 HydrophobicContact CB-CD 3.98Å; I268-K300 HydrophobicContact CG2-CB 3.95Å; I268-K300 HydrophobicContact CG2-CD 3.87Å; I268-K300 WeakPolarHBondContact O-CD 3.19Å; I268-K300 WeakPolarHBondContact O-CE 3.42Å; I268-K300 PolarHBondContact O-NZ 3.05Å; Q269-K300 PolarHBondContact O-NZ 3.33Å; L275-K300 HydrophobicContact CD1-CB 4.15Å; E296-K300 WeakPolarHBondContact O-CG 3.44Å; E296-K300 PolarHBondContact O-N 2.84Å; E296-K300 VanDerWaalsContact O-N 3.12Å; D297-K300 PolarHBondContact O-N 3.03Å; I298-K300 VanDerWaalsContact C-N 3.29Å; I298-K300 PolarHBondContact O-N 2.96Å; K300-N302 PolarHBondContact O-N 2.95Å; K300-F303 HydrophobicContact CB-CD2 4.19Å; K300-F303 HydrophobicContact CB-CE2 4.34Å; K300-F303 HydrophobicContact CG-CD2 4.07Å; K300-F303 HydrophobicContact CG-CE2 3.8Å; K300-F303 VanDerWaalsContact O-CB 3.27Å; K300-F303 WeakPolarHBondContact O-CB 3.45Å; K300-F303 PolarHBondContact O-N 3.11Å
301	L	97.9	Very high	97.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-62.6	-25.2	172.9	-57.1	-179	0	0	0	112.2	I268 L287 I298 E299 F303 F304 L307 V310 L312 L334	I268-L301 HydrophobicContact CD1-CD2 3.57Å; I268-L301 HydrophobicContact CD1-CG 4.4Å; L287-L301 HydrophobicContact CD1-CD2 4.2Å; I298-L301 VanDerWaalsContact O-CB 3.27Å; I298-L301 WeakPolarHBondContact O-CB 3.45Å; I298-L301 WeakPolarHBondContact O-CG 3.34Å; I298-L301 PolarHBondContact O-N 2.76Å; I298-L301 VanDerWaalsContact O-N 3.12Å; E299-L301 PolarHBondContact O-N 2.86Å; L301-F303 PolarHBondContact O-N 3.47Å; L301-F304 HydrophobicContact CB-CD2 4.49Å; L301-F304 HydrophobicContact CD2-CD2 4.33Å; L301-F304 HydrophobicContact CD2-CE2 3.8Å; L301-F304 VanDerWaalsContact O-CD2 3.3Å; L301-F304 WeakPolarHBondContact O-CD2 3.39Å; L301-F304 PolarHBondContact O-N 3.16Å; L301-L307 HydrophobicContact CB-CD2 3.94Å; L301-L307 WeakPolarHBondContact O-CD2 3.49Å; L301-V310 HydrophobicContact CD1-CG1 3.85Å; L301-V310 HydrophobicContact CD1-CG2 4.46Å; L301-L312 HydrophobicContact CD1-CD1 3.97Å; L301-L312 HydrophobicContact CD1-CD2 4.46Å; L301-L334 HydrophobicContact CB-CD2 3.88Å; L301-L334 HydrophobicContact CD1-CD2 4.34Å
302	N	97	Very high	97.3	Very high	54 Å²	54	47.4 Å²	47.4	29%	0.289	22%	0.218	S	C	.	.	G	3₁₀ helix	trans	-70.5	-8.8	174.3	-63.2	-54.8	0	0	0	113.4	E299 K300 F304 Q333 P335	E299-N302 VanDerWaalsContact O-CB 3.27Å; E299-N302 WeakPolarHBondContact O-CB 3.39Å; E299-N302 PolarHBondContact O-N 2.94Å; E299-N302 PolarHBondContact O-ND2 2.85Å; K300-N302 PolarHBondContact O-N 2.95Å; N302-F304 VanDerWaalsContact C-N 3.35Å; N302-Q333 PolarHBondContact ND2-O 3.34Å; N302-P335 WeakPolarHBondContact OD1-CD 3.19Å
303	F	97.6	Very high	97.3	Very high	65 Å²	65	52.4 Å²	52.4	29%	0.285	24%	0.242	S	C	.	.	G	3₁₀ helix	trans	-85.2	-11.3	178.8	-58.1	-17.8	0	0	0	113	K272 L275 K300 L301	K272-F303 HydrophobicContact CB-CB 4.22Å; K272-F303 HydrophobicContact CB-CD1 4.02Å; K272-F303 HydrophobicContact CB-CD2 3.79Å; K272-F303 HydrophobicContact CB-CE1 4.36Å; K272-F303 HydrophobicContact CB-CE2 4.13Å; K272-F303 HydrophobicContact CB-CG 3.74Å; K272-F303 HydrophobicContact CB-CZ 4.42Å; K272-F303 HydrophobicContact CD-CD1 4.2Å; K272-F303 HydrophobicContact CG-CB 4.03Å; K272-F303 HydrophobicContact CG-CD1 3.87Å; K272-F303 HydrophobicContact CG-CD2 4.41Å; K272-F303 HydrophobicContact CG-CE1 4.48Å; K272-F303 HydrophobicContact CG-CG 3.84Å; L275-F303 HydrophobicContact CB-CB 4.2Å; L275-F303 HydrophobicContact CD1-CB 4.06Å; L275-F303 HydrophobicContact CD1-CD2 4.08Å; K300-F303 HydrophobicContact CB-CD2 4.19Å; K300-F303 HydrophobicContact CB-CE2 4.34Å; K300-F303 HydrophobicContact CG-CD2 4.07Å; K300-F303 HydrophobicContact CG-CE2 3.8Å; K300-F303 VanDerWaalsContact O-CB 3.27Å; K300-F303 WeakPolarHBondContact O-CB 3.45Å; K300-F303 PolarHBondContact O-N 3.11Å; L301-F303 PolarHBondContact O-N 3.47Å
304	F	97.9	Very high	97.2	Very high	7 Å²	7	50.1 Å²	50.1	3%	0.031	24%	0.238	C	C	.	.	S	Bend	trans	-76.6	117.5	170.3	-62.1	-65.5	0	0	0	109.8	W242 L275 F279 L282 L301 N302 K306 L307	W242-F304 AromaticContact CH2-CZ 3.99Å; W242-F304 HydrophobicContact CH2-CZ 3.99Å; W242-F304 HydrophobicContact CZ2-CZ 4.05Å; L275-F304 HydrophobicContact CB-CD1 4.49Å; L275-F304 HydrophobicContact CB-CE1 4.13Å; L275-F304 HydrophobicContact CD1-CZ 4.28Å; L275-F304 HydrophobicContact CD2-CE1 3.97Å; L275-F304 HydrophobicContact CD2-CZ 3.91Å; L275-F304 HydrophobicContact CG-CE1 4.48Å; L275-F304 HydrophobicContact CG-CZ 4.5Å; F279-F304 HydrophobicContact CB-CD1 3.69Å; F279-F304 HydrophobicContact CB-CE1 3.75Å; F279-F304 HydrophobicContact CD2-CD1 4.48Å; F279-F304 AromaticContact CD2-CE1 3.69Å; F279-F304 HydrophobicContact CD2-CE1 3.69Å; F279-F304 HydrophobicContact CG-CD1 4.39Å; F279-F304 AromaticContact CG-CE1 3.95Å; F279-F304 HydrophobicContact CG-CE1 3.95Å; L282-F304 HydrophobicContact CD2-CD1 4.1Å; L282-F304 HydrophobicContact CD2-CE1 4.18Å; L282-F304 HydrophobicContact CD2-CG 4.37Å; L301-F304 HydrophobicContact CB-CD2 4.49Å; L301-F304 HydrophobicContact CD2-CD2 4.33Å; L301-F304 HydrophobicContact CD2-CE2 3.8Å; L301-F304 VanDerWaalsContact O-CD2 3.3Å; L301-F304 WeakPolarHBondContact O-CD2 3.39Å; L301-F304 PolarHBondContact O-N 3.16Å; N302-F304 VanDerWaalsContact C-N 3.35Å; F304-K306 VanDerWaalsContact C-N 3.27Å; F304-K306 PolarHBondContact O-N 2.99Å; F304-L307 HydrophobicContact CB-CB 3.7Å; F304-L307 HydrophobicContact CB-CD2 4.34Å; F304-L307 HydrophobicContact CB-CG 4.49Å; F304-L307 HydrophobicContact CD2-CD2 4Å; F304-L307 PolarHBondContact O-N 3.34Å
305	P	97.7	Very high	97.3	Very high	82 Å²	82	43 Å²	43	53%	0.532	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-22.5	-164.9	25.4	-35.3	0	0	0	114.5
306	K	98.4	Very high	97.5	Very high	103 Å²	103	44.5 Å²	44.5	45%	0.448	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.6	13.8	-176.5	-58.7	-171.3	-170.5	171.2	0	113.2	P280 N281 L282 R283 F304 E308	P280-K306 WeakPolarHBondContact O-CE 3.35Å; N281-K306 PolarHBondContact OD1-NZ 3.49Å; L282-K306 CarbonylContact O-C 3.24Å; L282-K306 VanDerWaalsContact O-C 3.28Å; R283-K306 WeakPolarHBondContact CA-O 3.36Å; R283-K306 HydrophobicContact CG-CB 4.06Å; R283-K306 WeakPolarHBondContact CG-O 3.25Å; F304-K306 VanDerWaalsContact C-N 3.27Å; F304-K306 PolarHBondContact O-N 2.99Å; K306-E308 WeakPolarHBondContact O-CG 3.47Å; K306-E308 PolarHBondContact O-N 2.91Å
307	L	98.7	Very high	97.6	Very high	7 Å²	7	39.9 Å²	39.9	4%	0.037	20%	0.204	C	C	.	.			trans	-69.5	127.9	-173.5	-171.3	73.4	0	0	0	111.8	L282 I285 L301 F304 V310	L282-L307 HydrophobicContact CG-CD1 4.48Å; L282-L307 WeakPolarHBondContact O-CA 3.29Å; L282-L307 PolarHBondContact O-N 3.46Å; I285-L307 HydrophobicContact CB-CD1 4.13Å; I285-L307 HydrophobicContact CG2-CD1 3.82Å; I285-L307 HydrophobicContact CG2-CD2 4.3Å; L301-L307 HydrophobicContact CB-CD2 3.94Å; L301-L307 WeakPolarHBondContact O-CD2 3.49Å; F304-L307 HydrophobicContact CB-CB 3.7Å; F304-L307 HydrophobicContact CB-CD2 4.34Å; F304-L307 HydrophobicContact CB-CG 4.49Å; F304-L307 HydrophobicContact CD2-CD2 4Å; F304-L307 PolarHBondContact O-N 3.34Å; L307-V310 HydrophobicContact CD1-CG2 4.4Å; L307-V310 HydrophobicContact CD2-CG2 3.55Å; L307-V310 HydrophobicContact CG-CG2 3.95Å
308	E	98.2	Very high	97.6	Very high	65 Å²	65	40 Å²	40	30%	0.304	20%	0.204	S	C	.	.			trans	-127.7	-35.2	-173.1	-31.9	-173.6	177.8	0	0	112.7	R283 K306 V337 S338 H339	R283-E308 HydrophobicContact CB-CG 4.16Å; R283-E308 HydrophobicContact CG-CG 4.35Å; R283-E308 IonicContact CZ-OE1 3.78Å; R283-E308 IonicContact CZ-OE2 2.75Å; R283-E308 VanDerWaalsContact NE-CD 3.32Å; R283-E308 IonicContact NE-OE1 3.03Å; R283-E308 PolarHBondContact NE-OE1 3.15Å; R283-E308 IonicContact NE-OE2 2.81Å; R283-E308 IonicContact NH2-OE1 3.95Å; R283-E308 PolarHBondContact NH2-OE1 3.1Å; R283-E308 IonicContact NH2-OE2 3.59Å; R283-E308 PolarHBondContact NH2-OE2 2.77Å; R283-E308 PolarHBondContact O-N 3.15Å; K306-E308 WeakPolarHBondContact O-CG 3.47Å; K306-E308 PolarHBondContact O-N 2.91Å; E308-V337 CarbonylContact O-C 3.48Å; E308-V337 WeakPolarHBondContact O-CA 3.38Å; E308-V337 WeakPolarHBondContact O-CG1 3.47Å; E308-S338 PolarHBondContact O-N 3.12Å; E308-S338 PolarHBondContact O-OG 3.11Å; E308-H339 PolarHBondContact O-N 2.92Å
309	E	98.8	Very high	97.6	Very high	36 Å²	36	45.2 Å²	45.2	17%	0.168	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	128.8	178.1	-170.8	179.1	161.7	0	0	111.2	R283 R284 I285 R311 H339	R283-E309 PolarHBondContact O-N 3.22Å; R284-E309 WeakPolarHBondContact CA-O 3.49Å; R284-E309 HydrophobicContact CB-CB 4.19Å; R284-E309 HydrophobicContact CG-CB 3.81Å; I285-E309 PolarHBondContact N-O 3.08Å; E309-R311 IonicContact OE1-CZ 3.47Å; E309-R311 IonicContact OE1-NE 3.4Å; E309-R311 PolarHBondContact OE1-NE 3.39Å; E309-R311 IonicContact OE1-NH2 3.45Å; E309-R311 PolarHBondContact OE1-NH2 3.38Å; E309-H339 VanDerWaalsContact CA-O 3.3Å; E309-H339 WeakPolarHBondContact CA-O 3.48Å; E309-H339 HydrophobicContact CB-CB 3.99Å; E309-H339 HydrophobicContact CG-CB 3.74Å
310	V	98.8	Very high	97.7	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	134.3	177	177.3	0	0	0	0	110.1	I285 L301 L307 L312 L334 V337 H339 L340 N341	I285-V310 HydrophobicContact CG2-CG1 4.38Å; I285-V310 HydrophobicContact CG2-CG2 4.04Å; I285-V310 WeakPolarHBondContact O-CA 3.22Å; L301-V310 HydrophobicContact CD1-CG1 3.85Å; L301-V310 HydrophobicContact CD1-CG2 4.46Å; L307-V310 HydrophobicContact CD1-CG2 4.4Å; L307-V310 HydrophobicContact CD2-CG2 3.55Å; L307-V310 HydrophobicContact CG-CG2 3.95Å; V310-L312 HydrophobicContact CG1-CD1 3.36Å; V310-L312 HydrophobicContact CG1-CD2 4.47Å; V310-L312 HydrophobicContact CG1-CG 3.53Å; V310-L334 HydrophobicContact CB-CD1 4.44Å; V310-L334 HydrophobicContact CG1-CD1 4.29Å; V310-L334 HydrophobicContact CG2-CD1 4.48Å; V310-V337 HydrophobicContact CB-CG1 4.2Å; V310-V337 HydrophobicContact CB-CG2 4.45Å; V310-V337 HydrophobicContact CG2-CG1 4.15Å; V310-V337 HydrophobicContact CG2-CG2 3.6Å; V310-H339 PolarHBondContact N-O 3.45Å; V310-L340 HydrophobicContact CB-CD1 4.4Å; V310-L340 WeakPolarHBondContact O-CA 3.4Å; V310-N341 PolarHBondContact O-N 3.44Å
311	R	98.7	Very high	97.6	Very high	94 Å²	94	47.9 Å²	47.9	36%	0.355	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	124.1	169.2	-50.6	-171.4	178	-164.4	-0.8	110.5	I285 N286 L287 N288 E309 N341	I285-R311 PolarHBondContact O-N 2.77Å; N286-R311 HydrophobicContact CB-CB 4.06Å; N286-R311 HydrophobicContact CB-CG 4.37Å; N286-R311 WeakPolarHBondContact OD1-CB 3.26Å; L287-R311 CarbonylContact C-O 3.58Å; L287-R311 WeakPolarHBondContact CA-O 3.04Å; L287-R311 PolarHBondContact N-O 2.74Å; N288-R311 PolarHBondContact N-O 3.15Å; N288-R311 VanDerWaalsContact OD1-CB 3.28Å; N288-R311 WeakPolarHBondContact OD1-CB 3.23Å; E309-R311 IonicContact OE1-CZ 3.47Å; E309-R311 IonicContact OE1-NE 3.4Å; E309-R311 PolarHBondContact OE1-NE 3.39Å; E309-R311 IonicContact OE1-NH2 3.45Å; E309-R311 PolarHBondContact OE1-NH2 3.38Å; R311-N341 VanDerWaalsContact CA-OD1 3.31Å; R311-N341 WeakPolarHBondContact CA-OD1 3.35Å
312	L	97.8	Very high	97.5	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.273	C	S	.	.			trans	-140.7	22.3	-171.2	-72.6	164	0	0	0	111.9	L287 N288 L292 I298 L301 V310 I315 L318 M330 L334 N341	L287-L312 HydrophobicContact CB-CD2 3.91Å; L287-L312 HydrophobicContact CD1-CD2 4.25Å; N288-L312 PolarHBondContact OD1-N 3.36Å; L292-L312 HydrophobicContact CD1-CD2 4.08Å; I298-L312 HydrophobicContact CD1-CD1 3.92Å; I298-L312 HydrophobicContact CD1-CD2 4.1Å; L301-L312 HydrophobicContact CD1-CD1 3.97Å; L301-L312 HydrophobicContact CD1-CD2 4.46Å; V310-L312 HydrophobicContact CG1-CD1 3.36Å; V310-L312 HydrophobicContact CG1-CD2 4.47Å; V310-L312 HydrophobicContact CG1-CG 3.53Å; L312-I315 HydrophobicContact CB-CD1 4.18Å; L312-I315 HydrophobicContact CD2-CD1 4.11Å; L312-I315 HydrophobicContact CD2-CG2 4.48Å; L312-I315 WeakPolarHBondContact O-CG1 3.2Å; L312-L318 WeakPolarHBondContact O-CD1 3.26Å; L312-M330 HydrophobicContact CB-SD 4.12Å; L312-M330 HydrophobicContact CD1-SD 4.16Å; L312-L334 HydrophobicContact CD1-CD1 4.43Å; L312-N341 PolarHBondContact N-OD1 2.71Å
313	Q	96.6	Very high	97.3	Very high	104 Å²	104	57.9 Å²	57.9	49%	0.486	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	143.2	177.5	-64.8	-176	-20.1	0	0	110.6	N288 N289 I315 N341	N288-Q313 CarbonylContact C-O 3.28Å; N288-Q313 VanDerWaalsContact CA-O 3.24Å; N288-Q313 WeakPolarHBondContact CA-O 3.33Å; N288-Q313 PolarHBondContact OD1-N 3.12Å; N289-Q313 PolarHBondContact N-O 3.43Å; N289-Q313 PolarHBondContact OD1-O 3Å; Q313-I315 VanDerWaalsContact C-N 3.29Å; Q313-I315 PolarHBondContact O-N 2.76Å; Q313-N341 HydrophobicContact CG-CB 3.98Å; Q313-N341 WeakPolarHBondContact CG-OD1 3.33Å; Q313-N341 PolarHBondContact N-OD1 3.4Å
314	G	96.3	Very high	97.1	Very high	36 Å²	36	57.9 Å²	57.9	37%	0.371	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	75	7.9	172.6	0	0	0	0	0	116.2	N289	N289-G314 WeakPolarHBondContact OD1-CA 3.3Å
315	I	97.9	Very high	97.1	Very high	1 Å²	1	60.1 Å²	60.1	1%	0.005	32%	0.32	C	S	.	.			trans	-72.1	144	172	69.1	176.2	0	0	0	111.5	S290 L292 I298 L312 Q313 L317 L318	S290-I315 VanDerWaalsContact OG-CG2 3.22Å; S290-I315 WeakPolarHBondContact OG-CG2 3.48Å; L292-I315 HydrophobicContact CB-CB 4.39Å; L292-I315 HydrophobicContact CB-CD1 4.31Å; L292-I315 HydrophobicContact CB-CG2 4.46Å; I298-I315 HydrophobicContact CD1-CD1 3.98Å; L312-I315 HydrophobicContact CB-CD1 4.18Å; L312-I315 HydrophobicContact CD2-CD1 4.11Å; L312-I315 HydrophobicContact CD2-CG2 4.48Å; L312-I315 WeakPolarHBondContact O-CG1 3.2Å; Q313-I315 VanDerWaalsContact C-N 3.29Å; Q313-I315 PolarHBondContact O-N 2.76Å; I315-L317 VanDerWaalsContact C-N 3.25Å; I315-L317 HydrophobicContact CD1-CB 3.94Å; I315-L317 HydrophobicContact CD1-CD2 4.19Å; I315-L317 HydrophobicContact CG1-CB 4.11Å; I315-L317 PolarHBondContact O-N 3Å; I315-L318 HydrophobicContact CD1-CD1 4.1Å; I315-L318 HydrophobicContact CD1-CG 3.94Å; I315-L318 HydrophobicContact CG1-CB 4.23Å; I315-L318 HydrophobicContact CG1-CD1 3.81Å; I315-L318 HydrophobicContact CG1-CG 3.65Å; I315-L318 PolarHBondContact O-N 2.9Å; I315-L318 VanDerWaalsContact O-N 3.15Å
316	P	98.1	Very high	97	Very high	63 Å²	63	59.8 Å²	59.8	41%	0.409	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-53.1	-37.3	178.6	-29.6	34.2	0	0	0	114.6	S290 L292 N293 L318 Q319	S290-P316 WeakPolarHBondContact O-CD 3.15Å; L292-P316 WeakPolarHBondContact O-CD 3.5Å; N293-P316 HydrophobicContact CB-CB 4.22Å; P316-L318 PolarHBondContact O-N 3.01Å; P316-L318 VanDerWaalsContact O-N 3.1Å; P316-Q319 WeakPolarHBondContact O-CB 3.32Å; P316-Q319 PolarHBondContact O-N 2.88Å; P316-Q319 VanDerWaalsContact O-N 3.15Å
317	L	97.7	Very high	97	Very high	15 Å²	15	57.5 Å²	57.5	8%	0.079	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-50.2	-37.9	178.4	176	64.4	0	0	0	112.9	L292 W295 I298 I315 P320 Y321	L292-L317 WeakPolarHBondContact O-CB 3.41Å; L292-L317 PolarHBondContact O-N 3.26Å; W295-L317 HydrophobicContact CD2-CD1 4.21Å; W295-L317 HydrophobicContact CD2-CD2 3.95Å; W295-L317 HydrophobicContact CD2-CG 4.44Å; W295-L317 HydrophobicContact CE3-CD2 4.04Å; W295-L317 HydrophobicContact CG-CD1 4.06Å; W295-L317 HydrophobicContact CG-CD2 4.34Å; W295-L317 HydrophobicContact CZ3-CD2 4.39Å; I298-L317 HydrophobicContact CD1-CD2 3.88Å; I298-L317 HydrophobicContact CG1-CD2 3.42Å; I298-L317 VanDerWaalsContact CG1-CD2 3.42Å; I315-L317 VanDerWaalsContact C-N 3.25Å; I315-L317 HydrophobicContact CD1-CB 3.94Å; I315-L317 HydrophobicContact CD1-CD2 4.19Å; I315-L317 HydrophobicContact CG1-CB 4.11Å; I315-L317 PolarHBondContact O-N 3Å; L317-P320 WeakPolarHBondContact O-CD 3.47Å; L317-Y321 WeakPolarHBondContact O-CE2 3.31Å
318	L	96.7	Very high	96.9	Very high	7 Å²	7	58.9 Å²	58.9	4%	0.037	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-87.7	-12.2	-171.3	-64.2	-179	0	0	0	113.5	W295 L312 I315 P316 P320 Y321 R326 M330	W295-L318 HydrophobicContact CH2-CD2 4.19Å; L312-L318 WeakPolarHBondContact O-CD1 3.26Å; I315-L318 HydrophobicContact CD1-CD1 4.1Å; I315-L318 HydrophobicContact CD1-CG 3.94Å; I315-L318 HydrophobicContact CG1-CB 4.23Å; I315-L318 HydrophobicContact CG1-CD1 3.81Å; I315-L318 HydrophobicContact CG1-CG 3.65Å; I315-L318 PolarHBondContact O-N 2.9Å; I315-L318 VanDerWaalsContact O-N 3.15Å; P316-L318 PolarHBondContact O-N 3.01Å; P316-L318 VanDerWaalsContact O-N 3.1Å; L318-P320 VanDerWaalsContact C-CD 3.45Å; L318-Y321 PolarHBondContact O-N 3.06Å; L318-R326 HydrophobicContact CB-CG 4.01Å; L318-R326 HydrophobicContact CD2-CB 4.46Å; L318-R326 HydrophobicContact CD2-CG 4.36Å; L318-R326 VanDerWaalsContact O-CZ 3.29Å; L318-R326 PolarHBondContact O-NE 2.91Å; L318-R326 PolarHBondContact O-NH2 3.25Å; L318-M330 HydrophobicContact CD1-CE 3.77Å; L318-M330 HydrophobicContact CD1-SD 3.67Å; L318-M330 HydrophobicContact CD2-CE 4.49Å; L318-M330 HydrophobicContact CD2-CG 4.19Å; L318-M330 HydrophobicContact CD2-SD 4.27Å
319	Q	96.3	Very high	96.9	Very high	111 Å²	111	55.8 Å²	55.8	52%	0.519	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-41.4	-173.8	-66.7	-64.8	-13.1	0	0	114.4	P316 Y321 R326	P316-Q319 WeakPolarHBondContact O-CB 3.32Å; P316-Q319 PolarHBondContact O-N 2.88Å; P316-Q319 VanDerWaalsContact O-N 3.15Å; Q319-Y321 PolarHBondContact O-N 3Å; Q319-R326 PolarHBondContact O-NH2 2.87Å
320	P	96.9	Very high	96.9	Very high	109 Å²	109	54.3 Å²	54.3	71%	0.708	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-20.4	-178.8	-22.4	35.5	0	0	0	114.9	L317 L318	L317-P320 WeakPolarHBondContact O-CD 3.47Å; L318-P320 VanDerWaalsContact C-CD 3.45Å
321	Y	95.6	Very high	96.8	Very high	46 Å²	46	54.4 Å²	54.4	18%	0.18	28%	0.283	C	S	.	.	S	Bend	trans	-93.2	152	-171.6	-58.7	-79.2	0	0	0	112.2	W295 L317 L318 Q319 E325 R326 L329 H360	W295-Y321 AromaticContact CZ2-CE2 3.88Å; W295-Y321 HydrophobicContact CZ2-CE2 3.88Å; W295-Y321 AromaticContact CZ2-CZ 3.98Å; W295-Y321 AromaticContact NE1-CZ 3.97Å; W295-Y321 PolarHBondContact NE1-OH 2.87Å; W295-Y321 VanDerWaalsContact NE1-OH 3.09Å; L317-Y321 WeakPolarHBondContact O-CE2 3.31Å; L318-Y321 PolarHBondContact O-N 3.06Å; Q319-Y321 PolarHBondContact O-N 3Å; Y321-E325 HydrophobicContact CD1-CB 4.25Å; Y321-R326 VanDerWaalsContact O-CZ 3.26Å; Y321-R326 PolarHBondContact O-NE 3.16Å; Y321-R326 PolarHBondContact O-NH2 3.25Å; Y321-L329 HydrophobicContact CD1-CD1 3.46Å; Y321-L329 VanDerWaalsContact CD1-CD1 3.46Å; Y321-L329 HydrophobicContact CE1-CD1 3.34Å; Y321-L329 HydrophobicContact CE2-CD1 4.49Å; Y321-L329 HydrophobicContact CG-CD1 4.09Å; Y321-H360 AromaticContact CE1-NE2 3.94Å
322	T	96.1	Very high	96.8	Very high	79 Å²	79	50 Å²	50	49%	0.485	27%	0.266	S	S	.	.			trans	-68.7	163.5	168.4	64.4	0	0	0	0	111.8	A324 E325 R326	T322-A324 PolarHBondContact O-N 3.02Å; T322-E325 WeakPolarHBondContact CB-OE2 3.42Å; T322-E325 VanDerWaalsContact CG2-OE2 3.32Å; T322-E325 WeakPolarHBondContact CG2-OE2 3.46Å; T322-E325 PolarHBondContact N-OE2 3.25Å; T322-E325 PolarHBondContact O-N 2.95Å; T322-E325 WeakPolarHBondContact OG1-CB 3.48Å; T322-E325 VanDerWaalsContact OG1-CD 3.26Å; T322-E325 VanDerWaalsContact OG1-CG 3.28Å; T322-E325 WeakPolarHBondContact OG1-CG 3.2Å; T322-E325 PolarHBondContact OG1-N 2.91Å; T322-E325 PolarHBondContact OG1-OE2 3.11Å; T322-R326 WeakPolarHBondContact O-CG 3.16Å; T322-R326 PolarHBondContact O-N 2.97Å
323	K	93	Very high	96.8	Very high	186 Å²	186	50 Å²	50	81%	0.809	27%	0.267	S	S	*	.	H	α-helix	trans	-54.7	-40.2	178.4	-175.1	179.9	177.7	-177.9	0	112.9	R327	K323-R327 PolarHBondContact O-N 3.31Å
324	A	93.6	Very high	96.8	Very high	64 Å²	64	45.1 Å²	45.1	53%	0.529	24%	0.244	S	C	.	.	H	α-helix	trans	-69.3	-47.4	179.1	0	0	0	0	0	111.5	T322 R326 R327 N328	T322-A324 PolarHBondContact O-N 3.02Å; A324-R326 PolarHBondContact O-N 3.16Å; A324-R327 PolarHBondContact O-N 3.28Å; A324-N328 PolarHBondContact O-N 3.04Å
325	E	96.3	Very high	96.8	Very high	54 Å²	54	45.8 Å²	45.8	25%	0.252	24%	0.241	S	C	.	.	H	α-helix	trans	-59.1	-47.9	176.4	-75.7	165.3	147.7	0	0	112.2	Y321 T322 R327 N328 L329 F356	Y321-E325 HydrophobicContact CD1-CB 4.25Å; T322-E325 WeakPolarHBondContact CB-OE2 3.42Å; T322-E325 VanDerWaalsContact CG2-OE2 3.32Å; T322-E325 WeakPolarHBondContact CG2-OE2 3.46Å; T322-E325 PolarHBondContact N-OE2 3.25Å; T322-E325 PolarHBondContact O-N 2.95Å; T322-E325 WeakPolarHBondContact OG1-CB 3.48Å; T322-E325 VanDerWaalsContact OG1-CD 3.26Å; T322-E325 VanDerWaalsContact OG1-CG 3.28Å; T322-E325 WeakPolarHBondContact OG1-CG 3.2Å; T322-E325 PolarHBondContact OG1-N 2.91Å; T322-E325 PolarHBondContact OG1-OE2 3.11Å; E325-R327 VanDerWaalsContact C-N 3.26Å; E325-R327 PolarHBondContact O-N 3.02Å; E325-N328 PolarHBondContact O-N 3.31Å; E325-L329 HydrophobicContact CB-CD1 4.44Å; E325-L329 WeakPolarHBondContact O-CB 3.48Å; E325-L329 VanDerWaalsContact O-CG 3.24Å; E325-L329 WeakPolarHBondContact O-CG 3.08Å; E325-L329 PolarHBondContact O-N 3.13Å; E325-F356 HydrophobicContact CG-CE1 4.28Å; E325-F356 HydrophobicContact CG-CZ 3.74Å
326	R	97.1	Very high	96.7	Very high	76 Å²	76	50 Å²	50	29%	0.287	27%	0.271	S	S	.	.	H	α-helix	trans	-50.2	-50.2	177.9	-70.9	172.9	-166.7	-170.2	-2.9	110.8	L318 Q319 Y321 T322 A324 M330	L318-R326 HydrophobicContact CB-CG 4.01Å; L318-R326 HydrophobicContact CD2-CB 4.46Å; L318-R326 HydrophobicContact CD2-CG 4.36Å; L318-R326 VanDerWaalsContact O-CZ 3.29Å; L318-R326 PolarHBondContact O-NE 2.91Å; L318-R326 PolarHBondContact O-NH2 3.25Å; Q319-R326 PolarHBondContact O-NH2 2.87Å; Y321-R326 VanDerWaalsContact O-CZ 3.26Å; Y321-R326 PolarHBondContact O-NE 3.16Å; Y321-R326 PolarHBondContact O-NH2 3.25Å; T322-R326 WeakPolarHBondContact O-CG 3.16Å; T322-R326 PolarHBondContact O-N 2.97Å; A324-R326 PolarHBondContact O-N 3.16Å; R326-M330 HydrophobicContact CB-CE 4.22Å; R326-M330 WeakPolarHBondContact O-CB 3.45Å; R326-M330 WeakPolarHBondContact O-CE 3.45Å; R326-M330 VanDerWaalsContact O-CG 3.29Å; R326-M330 WeakPolarHBondContact O-CG 3.47Å; R326-M330 PolarHBondContact O-N 2.81Å; R326-M330 VanDerWaalsContact O-N 3.16Å
327	R	97.5	Very high	96.7	Very high	55 Å²	55	47.3 Å²	47.3	21%	0.208	25%	0.253	C	S	.	.	H	α-helix	trans	-67.2	-49.5	-177.9	-176.7	168.3	176.5	79.4	2.7	111.6	K323 A324 E325 L329 M330 I331 L340 S343 V344 E349	K323-R327 PolarHBondContact O-N 3.31Å; A324-R327 PolarHBondContact O-N 3.28Å; E325-R327 VanDerWaalsContact C-N 3.26Å; E325-R327 PolarHBondContact O-N 3.02Å; R327-L329 PolarHBondContact O-N 3.44Å; R327-M330 PolarHBondContact O-N 2.86Å; R327-I331 HydrophobicContact CG-CD1 3.63Å; R327-I331 HydrophobicContact CG-CG1 4.36Å; R327-I331 WeakPolarHBondContact O-CB 3.47Å; R327-I331 VanDerWaalsContact O-CG1 3.27Å; R327-I331 WeakPolarHBondContact O-CG1 3.46Å; R327-I331 PolarHBondContact O-N 3.29Å; R327-L340 HydrophobicContact CG-CD2 4.49Å; R327-S343 PolarHBondContact NH1-OG 3.46Å; R327-V344 PolarHBondContact NH2-O 3.02Å; R327-V344 VanDerWaalsContact NH2-O 3.09Å; R327-E349 IonicContact CZ-OE1 3.47Å; R327-E349 IonicContact CZ-OE2 3.38Å; R327-E349 IonicContact NE-OE1 3.3Å; R327-E349 PolarHBondContact NE-OE1 2.99Å; R327-E349 IonicContact NH2-OE1 2.76Å; R327-E349 PolarHBondContact NH2-OE1 2.63Å; R327-E349 IonicContact NH2-OE2 2.81Å; R327-E349 PolarHBondContact NH2-OE2 3.12Å
328	N	97.9	Very high	96.7	Very high	35 Å²	35	48.4 Å²	48.4	19%	0.187	26%	0.262	C	S	.	.	H	α-helix	trans	-62	-45.7	-178.9	-73.1	-17.1	0	0	0	112.3	A324 E325 M330 I331 A332 A353 F356	A324-N328 PolarHBondContact O-N 3.04Å; E325-N328 PolarHBondContact O-N 3.31Å; N328-M330 PolarHBondContact O-N 3.15Å; N328-I331 PolarHBondContact O-N 3.28Å; N328-A332 WeakPolarHBondContact O-CB 3.42Å; N328-A332 PolarHBondContact O-N 2.92Å; N328-A353 HydrophobicContact CB-CB 4.19Å; N328-F356 HydrophobicContact CB-CB 4.33Å; N328-F356 HydrophobicContact CB-CD1 3.53Å; N328-F356 HydrophobicContact CB-CE1 4.08Å; N328-F356 HydrophobicContact CB-CG 3.95Å
329	L	97.6	Very high	96.8	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-63.5	-43.4	179.8	-66.5	173.2	0	0	0	111.7	W295 Y321 E325 R327 A332 Q333 F356 F357 H360	W295-L329 HydrophobicContact CH2-CB 3.55Å; W295-L329 HydrophobicContact CH2-CD1 4.42Å; W295-L329 HydrophobicContact CZ2-CB 3.98Å; W295-L329 HydrophobicContact CZ2-CD1 4.02Å; W295-L329 HydrophobicContact CZ3-CB 4.44Å; Y321-L329 HydrophobicContact CD1-CD1 3.46Å; Y321-L329 VanDerWaalsContact CD1-CD1 3.46Å; Y321-L329 HydrophobicContact CE1-CD1 3.34Å; Y321-L329 HydrophobicContact CE2-CD1 4.49Å; Y321-L329 HydrophobicContact CG-CD1 4.09Å; E325-L329 HydrophobicContact CB-CD1 4.44Å; E325-L329 WeakPolarHBondContact O-CB 3.48Å; E325-L329 VanDerWaalsContact O-CG 3.24Å; E325-L329 WeakPolarHBondContact O-CG 3.08Å; E325-L329 PolarHBondContact O-N 3.13Å; R327-L329 PolarHBondContact O-N 3.44Å; L329-A332 PolarHBondContact O-N 3.22Å; L329-Q333 WeakPolarHBondContact O-CB 3.28Å; L329-Q333 WeakPolarHBondContact O-CG 3.44Å; L329-Q333 PolarHBondContact O-N 3.31Å; L329-F356 HydrophobicContact CD2-CD1 4.45Å; L329-F356 HydrophobicContact CD2-CE1 4.13Å; L329-F356 HydrophobicContact CG-CE1 4.28Å; L329-F357 HydrophobicContact CD2-CD2 3.73Å; L329-F357 HydrophobicContact CD2-CE2 4.22Å; L329-H360 HydrophobicContact CD2-CB 4.29Å
330	M	97.6	Very high	96.9	Very high	5 Å²	5	46.2 Å²	46.2	3%	0.025	25%	0.252	C	S	.	.	H	α-helix	trans	-63.9	-46.3	175.8	-76.9	-173	-73.4	0	0	112.5	W295 L312 L318 R326 R327 N328 A332 Q333 L334 L340	W295-M330 HydrophobicContact CH2-CG 4.47Å; W295-M330 HydrophobicContact CZ3-CG 4.45Å; L312-M330 HydrophobicContact CB-SD 4.12Å; L312-M330 HydrophobicContact CD1-SD 4.16Å; L318-M330 HydrophobicContact CD1-CE 3.77Å; L318-M330 HydrophobicContact CD1-SD 3.67Å; L318-M330 HydrophobicContact CD2-CE 4.49Å; L318-M330 HydrophobicContact CD2-CG 4.19Å; L318-M330 HydrophobicContact CD2-SD 4.27Å; R326-M330 HydrophobicContact CB-CE 4.22Å; R326-M330 WeakPolarHBondContact O-CB 3.45Å; R326-M330 WeakPolarHBondContact O-CE 3.45Å; R326-M330 VanDerWaalsContact O-CG 3.29Å; R326-M330 WeakPolarHBondContact O-CG 3.47Å; R326-M330 PolarHBondContact O-N 2.81Å; R326-M330 VanDerWaalsContact O-N 3.16Å; R327-M330 PolarHBondContact O-N 2.86Å; N328-M330 PolarHBondContact O-N 3.15Å; M330-A332 VanDerWaalsContact C-N 3.29Å; M330-A332 PolarHBondContact O-N 3.11Å; M330-Q333 PolarHBondContact O-N 3.18Å; M330-L334 WeakPolarHBondContact O-CB 3.49Å; M330-L334 WeakPolarHBondContact O-CG 3.19Å; M330-L334 PolarHBondContact O-N 2.95Å; M330-L340 HydrophobicContact CB-CD1 4.42Å; M330-L340 HydrophobicContact CB-CD2 3.68Å; M330-L340 HydrophobicContact CE-CD2 4.12Å; M330-L340 HydrophobicContact SD-CD1 4.12Å; M330-L340 HydrophobicContact SD-CD2 4.38Å
331	I	98.4	Very high	97	Very high	3 Å²	3	42.7 Å²	42.7	2%	0.015	23%	0.227	C	C	.	.	H	α-helix	trans	-60.3	-43	178.8	-71.2	170.9	0	0	0	110.6	R327 N328 L334 L340 V345 E349 R350 A353	R327-I331 HydrophobicContact CG-CD1 3.63Å; R327-I331 HydrophobicContact CG-CG1 4.36Å; R327-I331 WeakPolarHBondContact O-CB 3.47Å; R327-I331 VanDerWaalsContact O-CG1 3.27Å; R327-I331 WeakPolarHBondContact O-CG1 3.46Å; R327-I331 PolarHBondContact O-N 3.29Å; N328-I331 PolarHBondContact O-N 3.28Å; I331-L334 PolarHBondContact O-N 2.78Å; I331-L340 HydrophobicContact CD1-CD2 4.45Å; I331-L340 HydrophobicContact CG1-CD2 3.68Å; I331-V345 HydrophobicContact CD1-CG1 4.03Å; I331-V345 HydrophobicContact CD1-CG2 4.1Å; I331-V345 HydrophobicContact CG1-CG1 4.1Å; I331-V345 HydrophobicContact CG1-CG2 3.99Å; I331-V345 HydrophobicContact CG2-CG1 3.7Å; I331-E349 HydrophobicContact CD1-CG 3.86Å; I331-R350 HydrophobicContact CG2-CB 4.14Å; I331-R350 HydrophobicContact CG2-CG 4.1Å; I331-A353 HydrophobicContact CB-CB 3.81Å; I331-A353 HydrophobicContact CG2-CB 3.58Å
332	A	97.8	Very high	97	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.9	-40.3	177.5	0	0	0	0	0	111.9	N328 L329 M330 E354 F357 R372	N328-A332 WeakPolarHBondContact O-CB 3.42Å; N328-A332 PolarHBondContact O-N 2.92Å; L329-A332 PolarHBondContact O-N 3.22Å; M330-A332 VanDerWaalsContact C-N 3.29Å; M330-A332 PolarHBondContact O-N 3.11Å; A332-E354 HydrophobicContact CB-CG 4.41Å; A332-F357 HydrophobicContact CB-CB 3.47Å; A332-F357 VanDerWaalsContact CB-CB 3.47Å; A332-F357 HydrophobicContact CB-CD2 3.56Å; A332-F357 HydrophobicContact CB-CE2 4.47Å; A332-F357 HydrophobicContact CB-CG 3.69Å; A332-R372 VanDerWaalsContact O-CZ 3.27Å; A332-R372 PolarHBondContact O-NE 3.29Å; A332-R372 PolarHBondContact O-NH2 3.34Å
333	Q	96.9	Very high	97	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.009	24%	0.235	C	C	.	.	H	α-helix	trans	-75	-20.4	179.5	-77.5	-75.9	49.7	0	0	114.5	W295 I298 E299 N302 L329 M330 P335 F357 R372	W295-Q333 HydrophobicContact CE3-CG 4Å; W295-Q333 HydrophobicContact CZ3-CB 4.47Å; W295-Q333 HydrophobicContact CZ3-CG 4.05Å; I298-Q333 HydrophobicContact CG2-CB 4.48Å; E299-Q333 PolarHBondContact OE1-NE2 3.46Å; N302-Q333 PolarHBondContact ND2-O 3.34Å; L329-Q333 WeakPolarHBondContact O-CB 3.28Å; L329-Q333 WeakPolarHBondContact O-CG 3.44Å; L329-Q333 PolarHBondContact O-N 3.31Å; M330-Q333 PolarHBondContact O-N 3.18Å; Q333-P335 VanDerWaalsContact C-CD 3.43Å; Q333-P335 WeakPolarHBondContact O-CD 3.42Å; Q333-F357 HydrophobicContact CG-CE2 3.68Å; Q333-F357 HydrophobicContact CG-CZ 4.19Å; Q333-R372 VanDerWaalsContact OE1-CG 3.23Å
334	L	97.6	Very high	97.3	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	22%	0.221	C	C	.	.			trans	-116.4	73.1	-176.2	-63.3	172.3	0	0	0	111.5	I298 L301 V310 L312 M330 I331 S336 V337 R350	I298-L334 HydrophobicContact CG2-CD1 4.14Å; I298-L334 HydrophobicContact CG2-CD2 4Å; I298-L334 HydrophobicContact CG2-CG 4.06Å; I298-L334 WeakPolarHBondContact O-CD2 3.48Å; L301-L334 HydrophobicContact CB-CD2 3.88Å; L301-L334 HydrophobicContact CD1-CD2 4.34Å; V310-L334 HydrophobicContact CB-CD1 4.44Å; V310-L334 HydrophobicContact CG1-CD1 4.29Å; V310-L334 HydrophobicContact CG2-CD1 4.48Å; L312-L334 HydrophobicContact CD1-CD1 4.43Å; M330-L334 WeakPolarHBondContact O-CB 3.49Å; M330-L334 WeakPolarHBondContact O-CG 3.19Å; M330-L334 PolarHBondContact O-N 2.95Å; I331-L334 PolarHBondContact O-N 2.78Å; L334-S336 VanDerWaalsContact C-N 3.28Å; L334-S336 PolarHBondContact O-N 3.04Å; L334-V337 HydrophobicContact CB-CB 3.92Å; L334-V337 HydrophobicContact CB-CG2 3.74Å; L334-V337 HydrophobicContact CD1-CG2 4.27Å; L334-V337 HydrophobicContact CD2-CG2 4.47Å; L334-V337 HydrophobicContact CG-CG2 4.38Å; L334-V337 PolarHBondContact O-N 3.37Å; L334-R350 PolarHBondContact O-NH1 3.39Å
335	P	96.1	Very high	97.5	Very high	49 Å²	49	34 Å²	34	32%	0.318	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-31.9	-173.7	18.7	-32.5	0	0	0	115.2	N302 Q333 R350	N302-P335 WeakPolarHBondContact OD1-CD 3.19Å; Q333-P335 VanDerWaalsContact C-CD 3.43Å; Q333-P335 WeakPolarHBondContact O-CD 3.42Å; P335-R350 PolarHBondContact O-NH1 3.17Å; P335-R350 VanDerWaalsContact O-NH1 3.16Å
336	S	96	Very high	97.6	Very high	90 Å²	90	35 Å²	35	63%	0.629	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-14.7	-176	-52.9	0	0	0	0	113.9	L334 S338	L334-S336 VanDerWaalsContact C-N 3.28Å; L334-S336 PolarHBondContact O-N 3.04Å; S336-S338 PolarHBondContact O-N 3.39Å
337	V	98.2	Very high	97.7	Very high	6 Å²	6	38 Å²	38	4%	0.036	23%	0.231	C	C	.	.			trans	-78.1	115.8	-172.5	170.5	0	0	0	0	110.4	E308 V310 L334 H339 R350	E308-V337 CarbonylContact O-C 3.48Å; E308-V337 WeakPolarHBondContact O-CA 3.38Å; E308-V337 WeakPolarHBondContact O-CG1 3.47Å; V310-V337 HydrophobicContact CB-CG1 4.2Å; V310-V337 HydrophobicContact CB-CG2 4.45Å; V310-V337 HydrophobicContact CG2-CG1 4.15Å; V310-V337 HydrophobicContact CG2-CG2 3.6Å; L334-V337 HydrophobicContact CB-CB 3.92Å; L334-V337 HydrophobicContact CB-CG2 3.74Å; L334-V337 HydrophobicContact CD1-CG2 4.27Å; L334-V337 HydrophobicContact CD2-CG2 4.47Å; L334-V337 HydrophobicContact CG-CG2 4.38Å; L334-V337 PolarHBondContact O-N 3.37Å; V337-H339 WeakPolarHBondContact CG1-O 3.11Å; V337-R350 PolarHBondContact O-NH2 3.45Å
338	S	98.3	Very high	97.7	Very high	39 Å²	39	39 Å²	39	27%	0.273	25%	0.246	S	C	.	.	S	Bend	trans	-89.9	-18.8	179.5	64.2	0	0	0	0	113.4	E308 S336 V345	E308-S338 PolarHBondContact O-N 3.12Å; E308-S338 PolarHBondContact O-OG 3.11Å; S336-S338 PolarHBondContact O-N 3.39Å; S338-V345 PolarHBondContact O-N 2.71Å
339	H	98.6	Very high	97.7	Very high	70 Å²	70	39.4 Å²	39.4	32%	0.324	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	120.6	178.4	-67	72	0	0	0	110.5	E308 E309 V310 V337 S343	E308-H339 PolarHBondContact O-N 2.92Å; E309-H339 VanDerWaalsContact CA-O 3.3Å; E309-H339 WeakPolarHBondContact CA-O 3.48Å; E309-H339 HydrophobicContact CB-CB 3.99Å; E309-H339 HydrophobicContact CG-CB 3.74Å; V310-H339 PolarHBondContact N-O 3.45Å; V337-H339 WeakPolarHBondContact CG1-O 3.11Å; H339-S343 CarbonylContact C-O 3.55Å; H339-S343 WeakPolarHBondContact CA-O 3.36Å
340	L	98.6	Very high	97.7	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	122.6	179.4	-178.1	66.2	0	0	0	109.9	V310 R327 M330 I331 G342 S343 V345	V310-L340 HydrophobicContact CB-CD1 4.4Å; V310-L340 WeakPolarHBondContact O-CA 3.4Å; R327-L340 HydrophobicContact CG-CD2 4.49Å; M330-L340 HydrophobicContact CB-CD1 4.42Å; M330-L340 HydrophobicContact CB-CD2 3.68Å; M330-L340 HydrophobicContact CE-CD2 4.12Å; M330-L340 HydrophobicContact SD-CD1 4.12Å; M330-L340 HydrophobicContact SD-CD2 4.38Å; I331-L340 HydrophobicContact CD1-CD2 4.45Å; I331-L340 HydrophobicContact CG1-CD2 3.68Å; L340-G342 PolarHBondContact O-N 2.85Å; L340-S343 PolarHBondContact N-O 3.16Å; L340-S343 PolarHBondContact O-N 3.25Å; L340-S343 VanDerWaalsContact O-N 3.08Å; L340-S343 PolarHBondContact O-OG 2.82Å; L340-V345 HydrophobicContact CB-CG2 3.89Å
341	N	97.6	Very high	97.7	Very high	35 Å²	35	44.2 Å²	44.2	19%	0.187	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.9	41	178.8	-63.5	-43	0	0	0	113.3	V310 R311 L312 Q313 S343	V310-N341 PolarHBondContact O-N 3.44Å; R311-N341 VanDerWaalsContact CA-OD1 3.31Å; R311-N341 WeakPolarHBondContact CA-OD1 3.35Å; L312-N341 PolarHBondContact N-OD1 2.71Å; Q313-N341 HydrophobicContact CG-CB 3.98Å; Q313-N341 WeakPolarHBondContact CG-OD1 3.33Å; Q313-N341 PolarHBondContact N-OD1 3.4Å; N341-S343 VanDerWaalsContact C-N 3.33Å; N341-S343 PolarHBondContact O-N 3.37Å
342	G	95.8	Very high	97.7	Very high	49 Å²	49	48.3 Å²	48.3	51%	0.505	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	80	6.9	178.5	0	0	0	0	0	115.5	L340	L340-G342 PolarHBondContact O-N 2.85Å
343	S	97.4	Very high	97.7	Very high	46 Å²	46	48.3 Å²	48.3	32%	0.322	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	141	177.1	56.8	0	0	0	0	111.3	R327 H339 L340 N341	R327-S343 PolarHBondContact NH1-OG 3.46Å; H339-S343 CarbonylContact C-O 3.55Å; H339-S343 WeakPolarHBondContact CA-O 3.36Å; L340-S343 PolarHBondContact N-O 3.16Å; L340-S343 PolarHBondContact O-N 3.25Å; L340-S343 VanDerWaalsContact O-N 3.08Å; L340-S343 PolarHBondContact O-OG 2.82Å; N341-S343 VanDerWaalsContact C-N 3.33Å; N341-S343 PolarHBondContact O-N 3.37Å
344	V	98.3	Very high	97.8	Very high	87 Å²	87	48.4 Å²	48.4	53%	0.527	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	142.8	175.7	-177.8	0	0	0	0	109.6	R327	R327-V344 PolarHBondContact NH2-O 3.02Å; R327-V344 VanDerWaalsContact NH2-O 3.09Å
345	V	98.5	Very high	97.7	Very high	11 Å²	11	51.5 Å²	51.5	7%	0.067	30%	0.302	C	S	.	.			trans	-102.9	111.1	169.7	180	0	0	0	0	108	I331 S338 L340 E349 R350	I331-V345 HydrophobicContact CD1-CG1 4.03Å; I331-V345 HydrophobicContact CD1-CG2 4.1Å; I331-V345 HydrophobicContact CG1-CG1 4.1Å; I331-V345 HydrophobicContact CG1-CG2 3.99Å; I331-V345 HydrophobicContact CG2-CG1 3.7Å; S338-V345 PolarHBondContact O-N 2.71Å; L340-V345 HydrophobicContact CB-CG2 3.89Å; V345-E349 WeakPolarHBondContact CA-OE2 3.37Å; V345-R350 HydrophobicContact CG1-CB 4.24Å
346	T	98.4	Very high	97.7	Very high	75 Å²	75	52 Å²	52	46%	0.46	30%	0.3	S	S	.	.			trans	-80.4	159.1	178.8	68.5	0	0	0	0	111.4	S348 E349 R350	T346-S348 VanDerWaalsContact C-N 3.34Å; T346-S348 PolarHBondContact O-N 3.11Å; T346-E349 PolarHBondContact N-OE2 3.4Å; T346-E349 PolarHBondContact O-N 2.82Å; T346-E349 WeakPolarHBondContact OG1-CB 3.4Å; T346-E349 PolarHBondContact OG1-N 3.25Å; T346-R350 WeakPolarHBondContact O-CB 3.04Å; T346-R350 PolarHBondContact O-N 3.15Å
347	D	97.9	Very high	97.8	Very high	138 Å²	138	47.8 Å²	47.8	74%	0.738	27%	0.27	S	S	*	.	H	α-helix	trans	-61.3	-41.9	177.9	-67.1	-30.3	0	0	0	112.2	R350 E351	D347-R350 PolarHBondContact O-N 2.98Å; D347-E351 WeakPolarHBondContact O-CB 3.46Å; D347-E351 PolarHBondContact O-N 3.39Å
348	S	97.8	Very high	97.7	Very high	75 Å²	75	47.5 Å²	47.5	52%	0.524	27%	0.268	S	S	.	.	H	α-helix	trans	-60.6	-47	175.3	-177	0	0	0	0	111.4	T346 R350 E351 D352	T346-S348 VanDerWaalsContact C-N 3.34Å; T346-S348 PolarHBondContact O-N 3.11Å; S348-R350 VanDerWaalsContact C-N 3.3Å; S348-R350 PolarHBondContact O-N 3.43Å; S348-E351 WeakPolarHBondContact O-CB 3.45Å; S348-E351 PolarHBondContact O-N 3.41Å; S348-D352 PolarHBondContact O-N 2.82Å
349	E	97.9	Very high	97.5	Very high	44 Å²	44	49 Å²	49	21%	0.206	27%	0.268	C	S	.	.	H	α-helix	trans	-62.7	-39.2	177.8	176.6	178.9	-145.6	0	0	111.7	R327 I331 V345 T346 D352 A353	R327-E349 IonicContact CZ-OE1 3.47Å; R327-E349 IonicContact CZ-OE2 3.38Å; R327-E349 IonicContact NE-OE1 3.3Å; R327-E349 PolarHBondContact NE-OE1 2.99Å; R327-E349 IonicContact NH2-OE1 2.76Å; R327-E349 PolarHBondContact NH2-OE1 2.63Å; R327-E349 IonicContact NH2-OE2 2.81Å; R327-E349 PolarHBondContact NH2-OE2 3.12Å; I331-E349 HydrophobicContact CD1-CG 3.86Å; V345-E349 WeakPolarHBondContact CA-OE2 3.37Å; T346-E349 PolarHBondContact N-OE2 3.4Å; T346-E349 PolarHBondContact O-N 2.82Å; T346-E349 WeakPolarHBondContact OG1-CB 3.4Å; T346-E349 PolarHBondContact OG1-N 3.25Å; E349-D352 PolarHBondContact O-N 2.63Å; E349-A353 WeakPolarHBondContact O-CB 3.19Å; E349-A353 PolarHBondContact O-N 2.66Å
350	R	98.4	Very high	97.2	Very high	29 Å²	29	49 Å²	49	11%	0.109	27%	0.267	C	S	.	.	H	α-helix	trans	-63.2	-44.8	175.9	-174.6	179.2	-54.7	-76.8	-2.8	111.4	I331 L334 P335 V337 V345 T346 D347 S348 D352 A353 E354	I331-R350 HydrophobicContact CG2-CB 4.14Å; I331-R350 HydrophobicContact CG2-CG 4.1Å; L334-R350 PolarHBondContact O-NH1 3.39Å; P335-R350 PolarHBondContact O-NH1 3.17Å; P335-R350 VanDerWaalsContact O-NH1 3.16Å; V337-R350 PolarHBondContact O-NH2 3.45Å; V345-R350 HydrophobicContact CG1-CB 4.24Å; T346-R350 WeakPolarHBondContact O-CB 3.04Å; T346-R350 PolarHBondContact O-N 3.15Å; D347-R350 PolarHBondContact O-N 2.98Å; S348-R350 VanDerWaalsContact C-N 3.3Å; S348-R350 PolarHBondContact O-N 3.43Å; R350-D352 VanDerWaalsContact C-N 3.33Å; R350-D352 PolarHBondContact O-N 2.88Å; R350-A353 PolarHBondContact O-N 3.47Å; R350-E354 HydrophobicContact CG-CG 4.34Å; R350-E354 WeakPolarHBondContact O-CB 3.22Å; R350-E354 VanDerWaalsContact O-CG 3.28Å; R350-E354 WeakPolarHBondContact O-CG 3.35Å; R350-E354 PolarHBondContact O-N 3.4Å
351	E	98	Very high	97	Very high	78 Å²	78	50.2 Å²	50.2	36%	0.364	27%	0.272	S	S	.	.	H	α-helix	trans	-59.4	-46.3	176.9	-155.2	-175.6	146.6	0	0	110.9	D347 S348 E354 R355 Y380	D347-E351 WeakPolarHBondContact O-CB 3.46Å; D347-E351 PolarHBondContact O-N 3.39Å; S348-E351 WeakPolarHBondContact O-CB 3.45Å; S348-E351 PolarHBondContact O-N 3.41Å; E351-E354 PolarHBondContact O-N 2.85Å; E351-R355 VanDerWaalsContact CG-NH1 3.29Å; E351-R355 WeakPolarHBondContact O-CG 3.27Å; E351-R355 PolarHBondContact O-N 3.32Å; E351-R355 IonicContact OE1-CZ 3.68Å; E351-R355 IonicContact OE1-NH1 3.03Å; E351-R355 PolarHBondContact OE1-NH1 2.87Å; E351-R355 IonicContact OE1-NH2 2.64Å; E351-R355 PolarHBondContact OE1-NH2 2.66Å; E351-Y380 HydrophobicContact CG-CE1 3.9Å
352	D	97.4	Very high	96.5	Very high	89 Å²	89	51.3 Å²	51.3	48%	0.476	28%	0.278	S	S	.	.	H	α-helix	trans	-63.4	-43.5	176.9	-70.6	-25.4	0	0	0	112.3	S348 E349 R350 R355 F356	S348-D352 PolarHBondContact O-N 2.82Å; E349-D352 PolarHBondContact O-N 2.63Å; R350-D352 VanDerWaalsContact C-N 3.33Å; R350-D352 PolarHBondContact O-N 2.88Å; D352-R355 PolarHBondContact O-N 2.83Å; D352-F356 VanDerWaalsContact O-CB 3.26Å; D352-F356 WeakPolarHBondContact O-CB 3.06Å; D352-F356 PolarHBondContact O-N 2.93Å
353	A	98.3	Very high	96.1	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-64.2	-42.5	177	0	0	0	0	0	112.3	N328 I331 E349 R350 F356 F357	N328-A353 HydrophobicContact CB-CB 4.19Å; I331-A353 HydrophobicContact CB-CB 3.81Å; I331-A353 HydrophobicContact CG2-CB 3.58Å; E349-A353 WeakPolarHBondContact O-CB 3.19Å; E349-A353 PolarHBondContact O-N 2.66Å; R350-A353 PolarHBondContact O-N 3.47Å; A353-F356 WeakPolarHBondContact O-CB 2.91Å; A353-F356 PolarHBondContact O-N 2.85Å; A353-F357 WeakPolarHBondContact O-CB 3.41Å; A353-F357 PolarHBondContact O-N 2.85Å
354	E	98	Very high	95.8	Very high	4 Å²	4	56.3 Å²	56.3	2%	0.019	29%	0.292	C	S	.	.	H	α-helix	trans	-65.8	-39.8	176.4	-74.1	-178.8	159.6	0	0	111.7	A332 R350 E351 F357 I358 R372 L376 K379 Y380	A332-E354 HydrophobicContact CB-CG 4.41Å; R350-E354 HydrophobicContact CG-CG 4.34Å; R350-E354 WeakPolarHBondContact O-CB 3.22Å; R350-E354 VanDerWaalsContact O-CG 3.28Å; R350-E354 WeakPolarHBondContact O-CG 3.35Å; R350-E354 PolarHBondContact O-N 3.4Å; E351-E354 PolarHBondContact O-N 2.85Å; E354-F357 WeakPolarHBondContact O-CB 3.34Å; E354-F357 PolarHBondContact O-N 3.01Å; E354-I358 PolarHBondContact O-N 2.84Å; E354-I358 VanDerWaalsContact O-N 3.15Å; E354-R372 IonicContact OE1-CZ 3.74Å; E354-R372 IonicContact OE1-NH2 2.75Å; E354-R372 PolarHBondContact OE1-NH2 3.28Å; E354-L376 HydrophobicContact CB-CD1 4.11Å; E354-L376 HydrophobicContact CB-CD2 3.85Å; E354-L376 HydrophobicContact CG-CD1 4.26Å; E354-L376 HydrophobicContact CG-CD2 3.69Å; E354-K379 IonicContact OE1-NZ 2.67Å; E354-K379 IonicContact OE2-NZ 2.62Å; E354-K379 PolarHBondContact OE2-NZ 2.86Å; E354-Y380 HydrophobicContact CB-CE2 3.66Å; E354-Y380 HydrophobicContact CG-CE2 4.47Å; E354-Y380 WeakPolarHBondContact OE2-CE2 3.49Å; E354-Y380 VanDerWaalsContact OE2-CZ 3.27Å; E354-Y380 PolarHBondContact OE2-OH 2.72Å
355	R	96.9	Very high	95.4	Very high	66 Å²	66	55.6 Å²	55.6	25%	0.249	29%	0.289	C	S	.	.	H	α-helix	trans	-67.6	-40	172.7	-70.3	-171.4	175.7	107.6	7.2	112.4	E351 D352 F357 I358 R359 L383	E351-R355 VanDerWaalsContact CG-NH1 3.29Å; E351-R355 WeakPolarHBondContact O-CG 3.27Å; E351-R355 PolarHBondContact O-N 3.32Å; E351-R355 IonicContact OE1-CZ 3.68Å; E351-R355 IonicContact OE1-NH1 3.03Å; E351-R355 PolarHBondContact OE1-NH1 2.87Å; E351-R355 IonicContact OE1-NH2 2.64Å; E351-R355 PolarHBondContact OE1-NH2 2.66Å; D352-R355 PolarHBondContact O-N 2.83Å; R355-F357 VanDerWaalsContact C-N 3.27Å; R355-F357 PolarHBondContact O-N 3.21Å; R355-I358 PolarHBondContact O-N 3.4Å; R355-R359 WeakPolarHBondContact O-CG 3.12Å; R355-R359 PolarHBondContact O-N 3.28Å; R355-R359 VanDerWaalsContact O-N 3.12Å; R355-L383 HydrophobicContact CB-CD1 3.69Å; R355-L383 HydrophobicContact CG-CD1 3.7Å
356	F	96.3	Very high	94.8	Very high	60 Å²	60	62.6 Å²	62.6	26%	0.263	32%	0.321	S	S	.	.	H	α-helix	trans	-57.4	-44.7	172.9	176.7	-87	0	0	0	110.4	E325 N328 L329 D352 A353 I358 R359 H360	E325-F356 HydrophobicContact CG-CE1 4.28Å; E325-F356 HydrophobicContact CG-CZ 3.74Å; N328-F356 HydrophobicContact CB-CB 4.33Å; N328-F356 HydrophobicContact CB-CD1 3.53Å; N328-F356 HydrophobicContact CB-CE1 4.08Å; N328-F356 HydrophobicContact CB-CG 3.95Å; L329-F356 HydrophobicContact CD2-CD1 4.45Å; L329-F356 HydrophobicContact CD2-CE1 4.13Å; L329-F356 HydrophobicContact CG-CE1 4.28Å; D352-F356 VanDerWaalsContact O-CB 3.26Å; D352-F356 WeakPolarHBondContact O-CB 3.06Å; D352-F356 PolarHBondContact O-N 2.93Å; A353-F356 WeakPolarHBondContact O-CB 2.91Å; A353-F356 PolarHBondContact O-N 2.85Å; F356-I358 PolarHBondContact O-N 2.91Å; F356-R359 PolarHBondContact O-N 3.15Å; F356-R359 VanDerWaalsContact O-N 3.13Å; F356-H360 HydrophobicContact CE1-CB 4.2Å; F356-H360 WeakPolarHBondContact O-CB 3.17Å; F356-H360 PolarHBondContact O-N 2.96Å
357	F	96.8	Very high	94.3	Very high	0 Å²	0	69 Å²	69	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-59.9	-45	178.1	-170.2	-84.5	0	0	0	112.4	L329 A332 Q333 A353 E354 R355 R359 H360 Y361 P370 R372 L376	L329-F357 HydrophobicContact CD2-CD2 3.73Å; L329-F357 HydrophobicContact CD2-CE2 4.22Å; A332-F357 HydrophobicContact CB-CB 3.47Å; A332-F357 VanDerWaalsContact CB-CB 3.47Å; A332-F357 HydrophobicContact CB-CD2 3.56Å; A332-F357 HydrophobicContact CB-CE2 4.47Å; A332-F357 HydrophobicContact CB-CG 3.69Å; Q333-F357 HydrophobicContact CG-CE2 3.68Å; Q333-F357 HydrophobicContact CG-CZ 4.19Å; A353-F357 WeakPolarHBondContact O-CB 3.41Å; A353-F357 PolarHBondContact O-N 2.85Å; E354-F357 WeakPolarHBondContact O-CB 3.34Å; E354-F357 PolarHBondContact O-N 3.01Å; R355-F357 VanDerWaalsContact C-N 3.27Å; R355-F357 PolarHBondContact O-N 3.21Å; F357-R359 VanDerWaalsContact C-N 3.3Å; F357-R359 PolarHBondContact O-N 3.14Å; F357-H360 WeakPolarHBondContact O-CB 3.25Å; F357-H360 PolarHBondContact O-N 3.09Å; F357-Y361 HydrophobicContact CD1-CD2 4.01Å; F357-Y361 HydrophobicContact CD1-CE2 4.24Å; F357-Y361 HydrophobicContact CD2-CD2 4.49Å; F357-Y361 HydrophobicContact CD2-CE2 4.04Å; F357-Y361 AromaticContact CE1-CD2 3.78Å; F357-Y361 HydrophobicContact CE1-CD2 3.78Å; F357-Y361 AromaticContact CE1-CE2 3.78Å; F357-Y361 HydrophobicContact CE1-CE2 3.78Å; F357-Y361 HydrophobicContact CE2-CD2 4.28Å; F357-Y361 AromaticContact CE2-CE2 3.55Å; F357-Y361 HydrophobicContact CE2-CE2 3.55Å; F357-Y361 HydrophobicContact CG-CD2 4.37Å; F357-Y361 HydrophobicContact CG-CE2 4.37Å; F357-Y361 AromaticContact CZ-CD2 3.94Å; F357-Y361 HydrophobicContact CZ-CD2 3.94Å; F357-Y361 AromaticContact CZ-CE2 3.42Å; F357-Y361 HydrophobicContact CZ-CE2 3.42Å; F357-Y361 VanDerWaalsContact CZ-CE2 3.42Å; F357-Y361 WeakPolarHBondContact O-CD2 3.46Å; F357-Y361 PolarHBondContact O-N 2.94Å; F357-P370 HydrophobicContact CE1-CG 3.86Å; F357-P370 HydrophobicContact CZ-CB 4.44Å; F357-P370 HydrophobicContact CZ-CG 3.6Å; F357-R372 HydrophobicContact CE1-CB 4.25Å; F357-R372 HydrophobicContact CE1-CG 4.25Å; F357-R372 HydrophobicContact CZ-CB 4.26Å; F357-R372 HydrophobicContact CZ-CG 4.36Å; F357-L376 HydrophobicContact CB-CD1 4.06Å; F357-L376 HydrophobicContact CD1-CD1 3.65Å; F357-L376 HydrophobicContact CE1-CD1 4.39Å; F357-L376 HydrophobicContact CG-CD1 4.06Å
358	I	95.9	Very high	93.7	Very high	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-56	-48.7	173.7	-67.6	166.5	0	0	0	110.3	E354 R355 F356 H360 Y361 L362 Y373 L376 I377 Y380 L383	E354-I358 PolarHBondContact O-N 2.84Å; E354-I358 VanDerWaalsContact O-N 3.15Å; R355-I358 PolarHBondContact O-N 3.4Å; F356-I358 PolarHBondContact O-N 2.91Å; I358-H360 VanDerWaalsContact C-N 3.31Å; I358-H360 PolarHBondContact O-N 3.25Å; I358-Y361 PolarHBondContact O-N 3.29Å; I358-L362 PolarHBondContact O-N 3.46Å; I358-Y373 HydrophobicContact CG2-CE2 4.16Å; I358-Y373 WeakPolarHBondContact O-CE2 3.29Å; I358-L376 HydrophobicContact CD1-CB 3.92Å; I358-L376 HydrophobicContact CG1-CB 3.78Å; I358-I377 HydrophobicContact CD1-CD1 4.42Å; I358-I377 HydrophobicContact CG1-CD1 4.29Å; I358-I377 HydrophobicContact CG2-CD1 3.6Å; I358-Y380 HydrophobicContact CD1-CD2 3.93Å; I358-Y380 HydrophobicContact CD1-CG 4.31Å; I358-L383 HydrophobicContact CB-CD1 4.12Å; I358-L383 HydrophobicContact CD1-CD1 3.87Å; I358-L383 HydrophobicContact CD1-CG 4.27Å; I358-L383 HydrophobicContact CG2-CB 4.14Å; I358-L383 HydrophobicContact CG2-CD1 4.17Å; I358-L383 HydrophobicContact CG2-CG 4.16Å
359	R	94.6	Very high	93.3	Very high	71 Å²	71	66.7 Å²	66.7	27%	0.268	32%	0.319	S	S	.	.	H	α-helix	trans	-65.3	-34.8	-178.8	-66.7	-175.7	-172.3	110.8	-3.7	113.1	R355 F356 F357 Y361 L362 L383 E384	R355-R359 WeakPolarHBondContact O-CG 3.12Å; R355-R359 PolarHBondContact O-N 3.28Å; R355-R359 VanDerWaalsContact O-N 3.12Å; F356-R359 PolarHBondContact O-N 3.15Å; F356-R359 VanDerWaalsContact O-N 3.13Å; F357-R359 VanDerWaalsContact C-N 3.3Å; F357-R359 PolarHBondContact O-N 3.14Å; R359-Y361 PolarHBondContact O-N 3.28Å; R359-L362 HydrophobicContact CB-CD1 4.13Å; R359-L362 HydrophobicContact CG-CD1 4.18Å; R359-L362 PolarHBondContact O-N 3.29Å; R359-L383 HydrophobicContact CG-CB 4.42Å; R359-E384 PolarHBondContact NE-O 2.76Å
360	H	93.2	Very high	93	Very high	69 Å²	69	65.5 Å²	65.5	32%	0.319	32%	0.315	S	S	.	.	H	α-helix	trans	-62.1	-31	179.1	-172.1	78.3	0	0	0	112.8	Y321 L329 F356 F357 I358	Y321-H360 AromaticContact CE1-NE2 3.94Å; L329-H360 HydrophobicContact CD2-CB 4.29Å; F356-H360 HydrophobicContact CE1-CB 4.2Å; F356-H360 WeakPolarHBondContact O-CB 3.17Å; F356-H360 PolarHBondContact O-N 2.96Å; F357-H360 WeakPolarHBondContact O-CB 3.25Å; F357-H360 PolarHBondContact O-N 3.09Å; I358-H360 VanDerWaalsContact C-N 3.31Å; I358-H360 PolarHBondContact O-N 3.25Å
361	Y	92.9	Very high	92.5	Very high	28 Å²	28	71.9 Å²	71.9	11%	0.11	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	11.6	-178.6	-73.7	-82.9	0	0	0	113.8	F357 I358 R359 D363 C364 L369 P370 Y373	F357-Y361 HydrophobicContact CD1-CD2 4.01Å; F357-Y361 HydrophobicContact CD1-CE2 4.24Å; F357-Y361 HydrophobicContact CD2-CD2 4.49Å; F357-Y361 HydrophobicContact CD2-CE2 4.04Å; F357-Y361 AromaticContact CE1-CD2 3.78Å; F357-Y361 HydrophobicContact CE1-CD2 3.78Å; F357-Y361 AromaticContact CE1-CE2 3.78Å; F357-Y361 HydrophobicContact CE1-CE2 3.78Å; F357-Y361 HydrophobicContact CE2-CD2 4.28Å; F357-Y361 AromaticContact CE2-CE2 3.55Å; F357-Y361 HydrophobicContact CE2-CE2 3.55Å; F357-Y361 HydrophobicContact CG-CD2 4.37Å; F357-Y361 HydrophobicContact CG-CE2 4.37Å; F357-Y361 AromaticContact CZ-CD2 3.94Å; F357-Y361 HydrophobicContact CZ-CD2 3.94Å; F357-Y361 AromaticContact CZ-CE2 3.42Å; F357-Y361 HydrophobicContact CZ-CE2 3.42Å; F357-Y361 VanDerWaalsContact CZ-CE2 3.42Å; F357-Y361 WeakPolarHBondContact O-CD2 3.46Å; F357-Y361 PolarHBondContact O-N 2.94Å; I358-Y361 PolarHBondContact O-N 3.29Å; R359-Y361 PolarHBondContact O-N 3.28Å; Y361-D363 VanDerWaalsContact C-N 3.31Å; Y361-D363 PolarHBondContact O-N 3.18Å; Y361-C364 HydrophobicContact CD1-CB 3.95Å; Y361-C364 WeakPolarHBondContact O-CB 3.01Å; Y361-C364 PolarHBondContact O-N 3.22Å; Y361-L369 HydrophobicContact CD1-CD2 4.34Å; Y361-L369 HydrophobicContact CG-CD2 4.43Å; Y361-P370 HydrophobicContact CD1-CG 4.4Å; Y361-P370 HydrophobicContact CD2-CG 4.39Å; Y361-P370 HydrophobicContact CE1-CG 4.05Å; Y361-P370 HydrophobicContact CE2-CG 4.06Å; Y361-Y373 HydrophobicContact CG-CD2 4.49Å
362	L	88.8	Confident	92.3	Very high	58 Å²	58	69.7 Å²	69.7	30%	0.304	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-41.5	-178	-81.3	169.3	0	0	0	113.2	I358 R359 C364 P385	I358-L362 PolarHBondContact O-N 3.46Å; R359-L362 HydrophobicContact CB-CD1 4.13Å; R359-L362 HydrophobicContact CG-CD1 4.18Å; R359-L362 PolarHBondContact O-N 3.29Å; L362-C364 VanDerWaalsContact C-N 3.35Å; L362-P385 HydrophobicContact CD1-CG 4.19Å
363	D	87.2	Confident	92.2	Very high	166 Å²	166	66.8 Å²	66.8	89%	0.888	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	5	-177.1	-59	-44	0	0	0	112.9	Y361	Y361-D363 VanDerWaalsContact C-N 3.31Å; Y361-D363 PolarHBondContact O-N 3.18Å
364	C	89.3	Confident	92	Very high	35 Å²	35	70.6 Å²	70.6	24%	0.236	33%	0.333	C	S	.	.	S	Bend	trans	-81.9	134.9	-178.2	-170.3	0	0	0	0	110.6	Y361 L362 E368 L369	Y361-C364 HydrophobicContact CD1-CB 3.95Å; Y361-C364 WeakPolarHBondContact O-CB 3.01Å; Y361-C364 PolarHBondContact O-N 3.22Å; L362-C364 VanDerWaalsContact C-N 3.35Å; C364-E368 VanDerWaalsContact SG-CB 3.59Å; C364-L369 HydrophobicContact CB-CD2 3.87Å
365	P	90.7	Very high	91.8	Very high	71 Å²	71	72.8 Å²	72.8	46%	0.461	35%	0.349	S	S	.	.			trans	-57.4	144.4	176.2	-23.2	33.2	0	0	0	112.3	K367 E368 L369	P365-K367 PolarHBondContact O-N 3.14Å; P365-E368 PolarHBondContact O-N 3.05Å; P365-L369 PolarHBondContact O-N 2.96Å
366	E	86.3	Confident	91.8	Very high	159 Å²	159	69.6 Å²	69.6	74%	0.743	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-56.5	-29.5	-175.4	-170.8	169.8	-159.1	0	0	114.2	E368 L369	E366-E368 VanDerWaalsContact C-N 3.27Å; E366-E368 PolarHBondContact O-N 3.28Å; E366-L369 HydrophobicContact CB-CD1 4.47Å; E366-L369 HydrophobicContact CG-CD1 4.4Å
367	K	87.3	Confident	91.7	Very high	208 Å²	208	68.3 Å²	68.3	90%	0.904	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-72.2	-18.7	178.2	-63.8	179.7	-179.3	177.1	0	114.1	P365	P365-K367 PolarHBondContact O-N 3.14Å
368	E	86.8	Confident	91.7	Very high	135 Å²	135	74.2 Å²	74.2	63%	0.631	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-105.1	-3	-176.4	-66.5	173.5	-155	0	0	111.8	C364 P365 E366	C364-E368 VanDerWaalsContact SG-CB 3.59Å; P365-E368 PolarHBondContact O-N 3.05Å; E366-E368 VanDerWaalsContact C-N 3.27Å; E366-E368 PolarHBondContact O-N 3.28Å
369	L	89.3	Confident	91.7	Very high	30 Å²	30	80.1 Å²	80.1	16%	0.157	39%	0.394	C	S	.	.			trans	-69.3	127.8	179.7	-69	174.5	0	0	0	110.8	Y361 C364 P365 E366 Y373	Y361-L369 HydrophobicContact CD1-CD2 4.34Å; Y361-L369 HydrophobicContact CG-CD2 4.43Å; C364-L369 HydrophobicContact CB-CD2 3.87Å; P365-L369 PolarHBondContact O-N 2.96Å; E366-L369 HydrophobicContact CB-CD1 4.47Å; E366-L369 HydrophobicContact CG-CD1 4.4Å; L369-Y373 HydrophobicContact CB-CD1 4.26Å; L369-Y373 HydrophobicContact CD1-CD1 3.74Å; L369-Y373 HydrophobicContact CD1-CE1 3.65Å; L369-Y373 HydrophobicContact CD2-CD1 3.95Å; L369-Y373 HydrophobicContact CD2-CD2 4.3Å; L369-Y373 HydrophobicContact CD2-CE1 4.09Å; L369-Y373 HydrophobicContact CD2-CE2 4.43Å; L369-Y373 HydrophobicContact CD2-CG 4.05Å; L369-Y373 HydrophobicContact CG-CD1 4.21Å; L369-Y373 HydrophobicContact CG-CE1 4.44Å
370	P	90.3	Very high	91.7	Very high	19 Å²	19	79 Å²	79	12%	0.123	39%	0.39	C	S	.	.			trans	-67.6	150	176.6	26.3	-32.1	0	0	0	110.4	F357 Y361 R372 Y373	F357-P370 HydrophobicContact CE1-CG 3.86Å; F357-P370 HydrophobicContact CZ-CB 4.44Å; F357-P370 HydrophobicContact CZ-CG 3.6Å; Y361-P370 HydrophobicContact CD1-CG 4.4Å; Y361-P370 HydrophobicContact CD2-CG 4.39Å; Y361-P370 HydrophobicContact CE1-CG 4.05Å; Y361-P370 HydrophobicContact CE2-CG 4.06Å; P370-R372 PolarHBondContact O-N 3.39Å; P370-Y373 WeakPolarHBondContact O-CB 3.2Å; P370-Y373 PolarHBondContact O-N 3.42Å
371	F	89.3	Confident	91.7	Very high	164 Å²	164	77.4 Å²	77.4	72%	0.719	39%	0.392	S	S	*	.	H	α-helix	trans	-52.2	-37.2	177.9	174.4	-98	0	0	0	112.2	Y373 H374 S375	F371-Y373 PolarHBondContact O-N 3.19Å; F371-H374 PolarHBondContact O-N 3.12Å; F371-S375 PolarHBondContact O-N 2.73Å
372	R	93.6	Very high	91.5	Very high	32 Å²	32	85 Å²	85	12%	0.121	43%	0.425	C	S	.	.	H	α-helix	trans	-58	-34.5	177.4	-173.2	59.2	168	151.7	6.8	113.2	A332 Q333 E354 F357 P370 H374 S375 L376	A332-R372 VanDerWaalsContact O-CZ 3.27Å; A332-R372 PolarHBondContact O-NE 3.29Å; A332-R372 PolarHBondContact O-NH2 3.34Å; Q333-R372 VanDerWaalsContact OE1-CG 3.23Å; E354-R372 IonicContact OE1-CZ 3.74Å; E354-R372 IonicContact OE1-NH2 2.75Å; E354-R372 PolarHBondContact OE1-NH2 3.28Å; F357-R372 HydrophobicContact CE1-CB 4.25Å; F357-R372 HydrophobicContact CE1-CG 4.25Å; F357-R372 HydrophobicContact CZ-CB 4.26Å; F357-R372 HydrophobicContact CZ-CG 4.36Å; P370-R372 PolarHBondContact O-N 3.39Å; R372-H374 PolarHBondContact O-N 3.5Å; R372-S375 WeakPolarHBondContact O-CB 3.28Å; R372-S375 PolarHBondContact O-N 3.24Å; R372-L376 HydrophobicContact CG-CD1 4.12Å; R372-L376 HydrophobicContact CG-CG 4.31Å; R372-L376 WeakPolarHBondContact O-CG 3.44Å; R372-L376 PolarHBondContact O-N 3.1Å
373	Y	94.4	Very high	91.5	Very high	27 Å²	27	83.7 Å²	83.7	11%	0.106	42%	0.419	C	S	.	.	H	α-helix	trans	-58.2	-48.8	176.6	177.4	-95.6	0	0	0	111.3	I358 Y361 L369 P370 F371 S375 L376 I377	I358-Y373 HydrophobicContact CG2-CE2 4.16Å; I358-Y373 WeakPolarHBondContact O-CE2 3.29Å; Y361-Y373 HydrophobicContact CG-CD2 4.49Å; L369-Y373 HydrophobicContact CB-CD1 4.26Å; L369-Y373 HydrophobicContact CD1-CD1 3.74Å; L369-Y373 HydrophobicContact CD1-CE1 3.65Å; L369-Y373 HydrophobicContact CD2-CD1 3.95Å; L369-Y373 HydrophobicContact CD2-CD2 4.3Å; L369-Y373 HydrophobicContact CD2-CE1 4.09Å; L369-Y373 HydrophobicContact CD2-CE2 4.43Å; L369-Y373 HydrophobicContact CD2-CG 4.05Å; L369-Y373 HydrophobicContact CG-CD1 4.21Å; L369-Y373 HydrophobicContact CG-CE1 4.44Å; P370-Y373 WeakPolarHBondContact O-CB 3.2Å; P370-Y373 PolarHBondContact O-N 3.42Å; F371-Y373 PolarHBondContact O-N 3.19Å; Y373-S375 VanDerWaalsContact C-N 3.31Å; Y373-S375 PolarHBondContact O-N 2.78Å; Y373-L376 PolarHBondContact O-N 3.12Å; Y373-L376 VanDerWaalsContact O-N 3.11Å; Y373-I377 HydrophobicContact CD1-CG1 4Å; Y373-I377 HydrophobicContact CE1-CD1 4.2Å; Y373-I377 HydrophobicContact CE1-CG1 3.6Å; Y373-I377 HydrophobicContact CE2-CD1 4.25Å; Y373-I377 HydrophobicContact CE2-CG1 4.22Å; Y373-I377 HydrophobicContact CG-CG1 4.48Å; Y373-I377 WeakPolarHBondContact O-CG1 3.33Å; Y373-I377 PolarHBondContact O-N 3.04Å
374	H	93.4	Very high	91.4	Very high	81 Å²	81	83.6 Å²	83.6	38%	0.375	41%	0.413	S	S	.	.	H	α-helix	trans	-63.6	-37.5	179.3	-61	-70.4	0	0	0	112.5	F371 R372 L376 T378	F371-H374 PolarHBondContact O-N 3.12Å; R372-H374 PolarHBondContact O-N 3.5Å; H374-L376 VanDerWaalsContact C-N 3.34Å; H374-T378 PolarHBondContact O-N 3.15Å; H374-T378 PolarHBondContact O-OG1 3.32Å
375	S	94.5	Very high	91.1	Very high	49 Å²	49	86.7 Å²	86.7	34%	0.343	43%	0.433	S	S	.	.	H	α-helix	trans	-60.7	-43.2	172.9	173.9	0	0	0	0	111.7	F371 R372 Y373 T378 K379	F371-S375 PolarHBondContact O-N 2.73Å; R372-S375 WeakPolarHBondContact O-CB 3.28Å; R372-S375 PolarHBondContact O-N 3.24Å; Y373-S375 VanDerWaalsContact C-N 3.31Å; Y373-S375 PolarHBondContact O-N 2.78Å; S375-T378 WeakPolarHBondContact O-CB 3.31Å; S375-T378 PolarHBondContact O-N 3.25Å; S375-K379 PolarHBondContact O-N 2.81Å
376	L	96.4	Very high	90.7	Very high	0 Å²	0	89.2 Å²	89.2	0%	0	44%	0.442	C	S	.	.	H	α-helix	trans	-73.1	-37.2	-179.6	-66.8	-179.9	0	0	0	112.9	E354 F357 I358 R372 Y373 H374 T378 K379 Y380	E354-L376 HydrophobicContact CB-CD1 4.11Å; E354-L376 HydrophobicContact CB-CD2 3.85Å; E354-L376 HydrophobicContact CG-CD1 4.26Å; E354-L376 HydrophobicContact CG-CD2 3.69Å; F357-L376 HydrophobicContact CB-CD1 4.06Å; F357-L376 HydrophobicContact CD1-CD1 3.65Å; F357-L376 HydrophobicContact CE1-CD1 4.39Å; F357-L376 HydrophobicContact CG-CD1 4.06Å; I358-L376 HydrophobicContact CD1-CB 3.92Å; I358-L376 HydrophobicContact CG1-CB 3.78Å; R372-L376 HydrophobicContact CG-CD1 4.12Å; R372-L376 HydrophobicContact CG-CG 4.31Å; R372-L376 WeakPolarHBondContact O-CG 3.44Å; R372-L376 PolarHBondContact O-N 3.1Å; Y373-L376 PolarHBondContact O-N 3.12Å; Y373-L376 VanDerWaalsContact O-N 3.11Å; H374-L376 VanDerWaalsContact C-N 3.34Å; L376-T378 VanDerWaalsContact C-N 3.27Å; L376-T378 PolarHBondContact O-N 2.96Å; L376-K379 PolarHBondContact O-N 2.93Å; L376-K379 VanDerWaalsContact O-N 3.08Å; L376-Y380 HydrophobicContact CD2-CE2 4.16Å; L376-Y380 PolarHBondContact O-N 3.37Å
377	I	95.5	Very high	90.1	Very high	33 Å²	33	85.5 Å²	85.5	17%	0.169	44%	0.438	C	S	.	.	H	α-helix	trans	-60.7	-38.8	171.6	-69.6	-65	0	0	0	111.1	I358 Y373 K379 G381 K382	I358-I377 HydrophobicContact CD1-CD1 4.42Å; I358-I377 HydrophobicContact CG1-CD1 4.29Å; I358-I377 HydrophobicContact CG2-CD1 3.6Å; Y373-I377 HydrophobicContact CD1-CG1 4Å; Y373-I377 HydrophobicContact CE1-CD1 4.2Å; Y373-I377 HydrophobicContact CE1-CG1 3.6Å; Y373-I377 HydrophobicContact CE2-CD1 4.25Å; Y373-I377 HydrophobicContact CE2-CG1 4.22Å; Y373-I377 HydrophobicContact CG-CG1 4.48Å; Y373-I377 WeakPolarHBondContact O-CG1 3.33Å; Y373-I377 PolarHBondContact O-N 3.04Å; I377-K379 PolarHBondContact O-N 3.35Å; I377-G381 WeakPolarHBondContact CD1-O 3.47Å; I377-G381 WeakPolarHBondContact O-CA 3.08Å; I377-G381 PolarHBondContact O-N 2.74Å; I377-K382 HydrophobicContact CD1-CG 4.35Å; I377-K382 HydrophobicContact CG2-CG 4.41Å
378	T	95.4	Very high	89.1	Confident	123 Å²	123	85.2 Å²	85.2	76%	0.755	44%	0.44	S	S	*	.	H	α-helix	trans	-63.6	-34	175.7	-55.7	0	0	0	0	111.5	H374 S375 L376	H374-T378 PolarHBondContact O-N 3.15Å; H374-T378 PolarHBondContact O-OG1 3.32Å; S375-T378 WeakPolarHBondContact O-CB 3.31Å; S375-T378 PolarHBondContact O-N 3.25Å; L376-T378 VanDerWaalsContact C-N 3.27Å; L376-T378 PolarHBondContact O-N 2.96Å
379	K	95.6	Very high	88.2	Confident	124 Å²	124	84.8 Å²	84.8	54%	0.539	44%	0.441	S	S	.	.	H	α-helix	trans	-79.4	-44.9	-179.3	-177.1	177.8	173.8	-170.9	0	113.4	E354 S375 L376 I377	E354-K379 IonicContact OE1-NZ 2.67Å; E354-K379 IonicContact OE2-NZ 2.62Å; E354-K379 PolarHBondContact OE2-NZ 2.86Å; S375-K379 PolarHBondContact O-N 2.81Å; L376-K379 PolarHBondContact O-N 2.93Å; L376-K379 VanDerWaalsContact O-N 3.08Å; I377-K379 PolarHBondContact O-N 3.35Å
380	Y	95.4	Very high	86.9	Confident	49 Å²	49	88.2 Å²	88.2	19%	0.192	46%	0.459	C	S	.	.	H	α-helix	trans	-110	-8.8	-170.8	-65	-70.7	0	0	0	114.6	E351 E354 I358 L376	E351-Y380 HydrophobicContact CG-CE1 3.9Å; E354-Y380 HydrophobicContact CB-CE2 3.66Å; E354-Y380 HydrophobicContact CG-CE2 4.47Å; E354-Y380 WeakPolarHBondContact OE2-CE2 3.49Å; E354-Y380 VanDerWaalsContact OE2-CZ 3.27Å; E354-Y380 PolarHBondContact OE2-OH 2.72Å; I358-Y380 HydrophobicContact CD1-CD2 3.93Å; I358-Y380 HydrophobicContact CD1-CG 4.31Å; L376-Y380 HydrophobicContact CD2-CE2 4.16Å; L376-Y380 PolarHBondContact O-N 3.37Å
381	G	92.9	Very high	86	Confident	34 Å²	34	94.6 Å²	94.6	35%	0.351	49%	0.491	S	S	.	.			trans	75.7	-175.9	-167.5	0	0	0	0	0	112.6	I377	I377-G381 WeakPolarHBondContact CD1-O 3.47Å; I377-G381 WeakPolarHBondContact O-CA 3.08Å; I377-G381 PolarHBondContact O-N 2.74Å
382	K	88.8	Confident	85	Confident	187 Å²	187	95.7 Å²	95.7	81%	0.813	49%	0.491	S	S	*	.	P	Polyproline II helix	trans	-77.2	123.4	172.6	-67.3	-174.8	178.9	-174.2	0	108.8	I377	I377-K382 HydrophobicContact CD1-CG 4.35Å; I377-K382 HydrophobicContact CG2-CG 4.41Å
383	L	89.6	Confident	83.8	Confident	32 Å²	32	99.3 Å²	99.3	17%	0.168	52%	0.518	C	S	.	.	P	Polyproline II helix	trans	-94.9	139.6	177.7	-59.6	179.1	0	0	0	110.1	R355 I358 R359	R355-L383 HydrophobicContact CB-CD1 3.69Å; R355-L383 HydrophobicContact CG-CD1 3.7Å; I358-L383 HydrophobicContact CB-CD1 4.12Å; I358-L383 HydrophobicContact CD1-CD1 3.87Å; I358-L383 HydrophobicContact CD1-CG 4.27Å; I358-L383 HydrophobicContact CG2-CB 4.14Å; I358-L383 HydrophobicContact CG2-CD1 4.17Å; I358-L383 HydrophobicContact CG2-CG 4.16Å; R359-L383 HydrophobicContact CG-CB 4.42Å
384	E	84.6	Confident	82.7	Confident	163 Å²	163	104.8 Å²	104.8	76%	0.762	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-74.7	155.2	170.4	-64.2	-170.6	161.4	0	0	111.1	R359	R359-E384 PolarHBondContact NE-O 2.76Å
385	P	83.4	Confident	82.2	Confident	101 Å²	101	105 Å²	105	66%	0.656	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-53.4	147.1	168.8	-23.3	33.2	0	0	0	111.4	L362	L362-P385 HydrophobicContact CD1-CG 4.19Å
386	L	81.6	Confident	81.9	Confident	124 Å²	124	110.5 Å²	110.5	65%	0.649	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-69.3	134.4	173.6	-69	171.8	0	0	0	109.4	E388	L386-E388 PolarHBondContact O-N 2.68Å
387	A	73.2	Confident	81.6	Confident	80 Å²	80	110.6 Å²	110.6	66%	0.661	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-69	126.5	170.4	0	0	0	0	0	109.6	I389	A387-I389 HydrophobicContact CB-CD1 4.4Å; A387-I389 HydrophobicContact CB-CG1 4.09Å; A387-I389 PolarHBondContact O-N 2.75Å; A387-I389 VanDerWaalsContact O-N 3.07Å
388	E	66	Low	81.3	Confident	202 Å²	202	113.5 Å²	113.5	94%	0.944	58%	0.575	S	S	*	*			trans	-73.9	97	168.8	-71.1	-168.5	171.4	0	0	109.1	L386	L386-E388 PolarHBondContact O-N 2.68Å
389	I	68.2	Low	81.1	Confident	127 Å²	127	107.8 Å²	107.8	65%	0.651	54%	0.54	S	S	*	.			trans	-101.9	111.8	175	-54.7	174.8	0	0	0	107.8	A387 L391	A387-I389 HydrophobicContact CB-CD1 4.4Å; A387-I389 HydrophobicContact CB-CG1 4.09Å; A387-I389 PolarHBondContact O-N 2.75Å; A387-I389 VanDerWaalsContact O-N 3.07Å; I389-L391 HydrophobicContact CG2-CD2 3.71Å; I389-L391 HydrophobicContact CG2-CG 4.17Å; I389-L391 PolarHBondContact O-N 2.71Å; I389-L391 VanDerWaalsContact O-N 3.08Å
390	D	62.8	Low	80.9	Confident	101 Å²	101	104.1 Å²	104.1	54%	0.54	53%	0.525	S	S	.	.			trans	-74.4	98.1	172.5	-170	1.2	0	0	0	109.9	R392	D390-R392 PolarHBondContact O-N 3.4Å; D390-R392 WeakPolarHBondContact OD1-CB 3.23Å; D390-R392 WeakPolarHBondContact OD1-CG 3.25Å; D390-R392 IonicContact OD1-CZ 3.53Å; D390-R392 PolarHBondContact OD1-N 3.16Å; D390-R392 IonicContact OD1-NE 3.7Å; D390-R392 PolarHBondContact OD1-NE 2.87Å; D390-R392 IonicContact OD1-NH2 2.75Å; D390-R392 IonicContact OD2-CZ 3.77Å; D390-R392 IonicContact OD2-NE 3.75Å; D390-R392 PolarHBondContact OD2-NE 3.04Å; D390-R392 VanDerWaalsContact OD2-NE 3.12Å; D390-R392 IonicContact OD2-NH2 2.86Å; D390-R392 PolarHBondContact OD2-NH2 3.41Å
391	L	70.4	Confident	80.6	Confident	153 Å²	153	102 Å²	102	80%	0.801	52%	0.517	S	S	*	.			trans	-83.9	4.4	176.6	-62.3	175.3	0	0	0	112.9	I389	I389-L391 HydrophobicContact CG2-CD2 3.71Å; I389-L391 HydrophobicContact CG2-CG 4.17Å; I389-L391 PolarHBondContact O-N 2.71Å; I389-L391 VanDerWaalsContact O-N 3.08Å
392	R	70.1	Confident	80.4	Confident	188 Å²	188	102.6 Å²	102.6	71%	0.709	51%	0.51	S	S	*	.	S	Bend	trans	-62	132.5	177.5	-69.3	177.3	-67.3	-176.7	-0.4	109.4	D390 R394	D390-R392 PolarHBondContact O-N 3.4Å; D390-R392 WeakPolarHBondContact OD1-CB 3.23Å; D390-R392 WeakPolarHBondContact OD1-CG 3.25Å; D390-R392 IonicContact OD1-CZ 3.53Å; D390-R392 PolarHBondContact OD1-N 3.16Å; D390-R392 IonicContact OD1-NE 3.7Å; D390-R392 PolarHBondContact OD1-NE 2.87Å; D390-R392 IonicContact OD1-NH2 2.75Å; D390-R392 IonicContact OD2-CZ 3.77Å; D390-R392 IonicContact OD2-NE 3.75Å; D390-R392 PolarHBondContact OD2-NE 3.04Å; D390-R392 VanDerWaalsContact OD2-NE 3.12Å; D390-R392 IonicContact OD2-NH2 2.86Å; D390-R392 PolarHBondContact OD2-NH2 3.41Å; R392-R394 PolarHBondContact O-N 2.84Å
393	P	66.9	Low	80.2	Confident	108 Å²	108	94.1 Å²	94.1	70%	0.701	48%	0.475	S	S	*	.	P	Polyproline II helix	trans	-55.7	129.4	174.3	-21.2	30.4	0	0	0	109.8	C395	P393-C395 PolarHBondContact O-N 3.2Å; P393-C395 VanDerWaalsContact O-N 3.09Å; P393-C395 PolarHBondContact O-SG 2.99Å
394	R	72.8	Confident	79.8	Confident	142 Å²	142	100.5 Å²	100.5	54%	0.536	50%	0.504	S	S	.	.	P	Polyproline II helix	trans	-59.3	119.2	175.9	-70.2	174	99.2	168	8.7	108.4	R392 L414 D466	R392-R394 PolarHBondContact O-N 2.84Å; R394-L414 HydrophobicContact CB-CD1 4.3Å; R394-L414 WeakPolarHBondContact O-CD1 3.45Å; R394-D466 IonicContact CZ-OD2 3.88Å; R394-D466 VanDerWaalsContact NH2-CG 3.31Å; R394-D466 IonicContact NH2-OD2 3.48Å; R394-D466 PolarHBondContact NH2-OD2 2.88Å
395	C	82.1	Confident	79.5	Confident	86 Å²	86	102 Å²	102	58%	0.581	51%	0.511	S	S	*	.			trans	-99.9	-11.4	-178.1	-65.2	0	0	0	0	112.7	P393 R413 L414	P393-C395 PolarHBondContact O-N 3.2Å; P393-C395 VanDerWaalsContact O-N 3.09Å; P393-C395 PolarHBondContact O-SG 2.99Å; C395-R413 CarbonylContact O-C 3.59Å; C395-R413 WeakPolarHBondContact O-CA 3.23Å; C395-L414 PolarHBondContact O-N 3.03Å
396	R	88.6	Confident	79.3	Confident	164 Å²	164	103.5 Å²	103.5	62%	0.619	51%	0.507	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.1	151.1	179.8	-66.2	-176.6	175.9	-172.9	-1.7	110.1	I412 R413	R396-I412 CarbonylContact C-O 3.59Å; R396-I412 WeakPolarHBondContact CA-O 3.44Å; R396-R413 HydrophobicContact CG-CG 4.37Å
397	A	88.9	Confident	79.6	Confident	2 Å²	2	101.8 Å²	101.8	2%	0.017	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	144.3	171	0	0	0	0	0	110.3	V399 C411 I412 L414 I464 D466	A397-V399 HydrophobicContact CB-CG1 4.37Å; A397-C411 WeakPolarHBondContact O-CA 3.4Å; A397-I412 HydrophobicContact CB-CG1 4.26Å; A397-I412 PolarHBondContact N-O 3.28Å; A397-I412 WeakPolarHBondContact O-CG1 3.38Å; A397-I412 PolarHBondContact O-N 2.98Å; A397-L414 HydrophobicContact CB-CD1 4.29Å; A397-L414 HydrophobicContact CB-CD2 3.94Å; A397-L414 HydrophobicContact CB-CG 4.28Å; A397-I464 HydrophobicContact CB-CG2 4.11Å; A397-D466 WeakPolarHBondContact CA-OD1 3.45Å
398	Q	90.1	Very high	80.2	Confident	94 Å²	94	102.5 Å²	102.5	44%	0.439	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	117	167	-66.7	-68.7	-2.3	0	0	108.8	D466 G467	Q398-D466 PolarHBondContact N-OD1 3.38Å; Q398-D466 WeakPolarHBondContact O-CA 3.28Å; Q398-G467 PolarHBondContact O-N 2.67Å
399	V	91.1	Very high	81.3	Confident	2 Å²	2	99.4 Å²	99.4	1%	0.012	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	151.3	-179	-63	0	0	0	0	111.3	A397 V401 Q409 L410 I412 I464 G468 I470	A397-V399 HydrophobicContact CB-CG1 4.37Å; V399-V401 HydrophobicContact CG2-CG2 4.35Å; V399-Q409 WeakPolarHBondContact O-CA 3.38Å; V399-L410 HydrophobicContact CG2-CB 4.47Å; V399-L410 WeakPolarHBondContact CG2-O 3.42Å; V399-L410 PolarHBondContact N-O 3.27Å; V399-L410 PolarHBondContact O-N 3.09Å; V399-I412 HydrophobicContact CG1-CD1 3.83Å; V399-I412 HydrophobicContact CG1-CG1 4.28Å; V399-I412 HydrophobicContact CG2-CD1 3.84Å; V399-I412 HydrophobicContact CG2-CG1 4.09Å; V399-I412 HydrophobicContact CG2-CG2 3.88Å; V399-I464 HydrophobicContact CG1-CG2 3.66Å; V399-G468 CarbonylContact C-O 3.57Å; V399-G468 VanDerWaalsContact CA-O 3.26Å; V399-G468 WeakPolarHBondContact CA-O 3.5Å; V399-G468 WeakPolarHBondContact CB-O 3.38Å; V399-I470 HydrophobicContact CB-CD1 4.34Å; V399-I470 HydrophobicContact CB-CG1 4.29Å; V399-I470 HydrophobicContact CG1-CD1 4.48Å; V399-I470 HydrophobicContact CG2-CD1 3.82Å; V399-I470 HydrophobicContact CG2-CG1 4.19Å
400	E	91.3	Very high	82.3	Confident	48 Å²	48	94.5 Å²	94.5	22%	0.224	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	118.4	170.7	-78.6	175.9	177.7	0	0	109.7	H402 V407 Q409 K443 G468 E469 I470	E400-H402 PolarHBondContact O-CD2 3.39Å; E400-H402 IonicContact OE2-NE2 3.92Å; E400-V407 HydrophobicContact CB-CG1 4.44Å; E400-Q409 HydrophobicContact CG-CG 3.76Å; E400-Q409 PolarHBondContact OE1-NE2 3.27Å; E400-Q409 VanDerWaalsContact OE1-NE2 3.13Å; E400-K443 IonicContact OE2-NZ 3.25Å; E400-K443 PolarHBondContact OE2-NZ 3.03Å; E400-G468 PolarHBondContact N-O 3.36Å; E400-E469 HydrophobicContact CB-CG 4.14Å; E400-E469 CarbonylContact O-C 3.53Å; E400-E469 VanDerWaalsContact O-CA 3.29Å; E400-E469 WeakPolarHBondContact O-CA 3.16Å; E400-I470 PolarHBondContact O-N 2.66Å
401	V	89.8	Confident	83.6	Confident	3 Å²	3	92 Å²	92	2%	0.018	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	119.7	177.7	-176.3	0	0	0	0	108.8	V399 V407 E408 L410 L425 I470 V472	V399-V401 HydrophobicContact CG2-CG2 4.35Å; V401-V407 WeakPolarHBondContact O-CA 3.34Å; V401-E408 PolarHBondContact N-O 3.36Å; V401-E408 PolarHBondContact O-N 2.93Å; V401-L410 HydrophobicContact CG2-CB 4.01Å; V401-L410 HydrophobicContact CG2-CD2 4.3Å; V401-L425 HydrophobicContact CB-CD2 4.37Å; V401-L425 HydrophobicContact CG1-CD2 3.76Å; V401-L425 HydrophobicContact CG2-CD2 3.8Å; V401-I470 CarbonylContact C-O 3.5Å; V401-I470 VanDerWaalsContact CA-O 3.31Å; V401-I470 WeakPolarHBondContact CA-O 3.36Å; V401-I470 HydrophobicContact CG2-CB 4.48Å; V401-V472 HydrophobicContact CG1-CG2 3.61Å
402	H	88.7	Confident	84.6	Confident	47 Å²	47	84.7 Å²	84.7	22%	0.218	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	122.4	179.6	-70	-119.5	0	0	0	109.6	E400 K406 E469 I470 L471 V472	E400-H402 PolarHBondContact O-CD2 3.39Å; E400-H402 IonicContact OE2-NE2 3.92Å; H402-K406 WeakPolarHBondContact CA-O 3.5Å; H402-E469 IonicContact NE2-OE2 2.62Å; H402-I470 PolarHBondContact N-O 3.16Å; H402-L471 HydrophobicContact CB-CD1 3.9Å; H402-V472 PolarHBondContact O-N 3.32Å
403	C	84.5	Confident	85.6	Confident	9 Å²	9	80.8 Å²	80.8	6%	0.061	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	108.7	175.4	-174.4	0	0	0	0	109.6	E405 K406 V429 V472	C403-E405 PolarHBondContact O-N 3.4Å; C403-K406 PolarHBondContact N-O 3.48Å; C403-K406 WeakPolarHBondContact O-CB 3.26Å; C403-K406 PolarHBondContact O-N 3.07Å; C403-V429 HydrophobicContact CB-CB 4.15Å; C403-V429 HydrophobicContact CB-CG1 3.55Å; C403-V472 HydrophobicContact CB-CB 4.06Å
404	E	81.4	Confident	86.6	Confident	166 Å²	166	76 Å²	76	78%	0.776	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	-115.1	-173.5	-57.9	179.6	169.7	0	0	111.2
405	E	77.6	Confident	87.4	Confident	196 Å²	196	73.5 Å²	73.5	92%	0.916	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	2.4	177.1	-63.1	-173.2	166.7	0	0	113.6	C403	C403-E405 PolarHBondContact O-N 3.4Å
406	K	79.6	Confident	87.8	Confident	132 Å²	132	69.9 Å²	69.9	57%	0.574	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.8	129.2	-176.5	-63.6	-179.5	-178	175.3	0	111.2	H402 C403	H402-K406 WeakPolarHBondContact CA-O 3.5Å; C403-K406 PolarHBondContact N-O 3.48Å; C403-K406 WeakPolarHBondContact O-CB 3.26Å; C403-K406 PolarHBondContact O-N 3.07Å
407	V	86.8	Confident	88.1	Confident	88 Å²	88	63.8 Å²	63.8	53%	0.533	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	124.6	171.7	-174.7	0	0	0	0	108.3	E400 V401	E400-V407 HydrophobicContact CB-CG1 4.44Å; V401-V407 WeakPolarHBondContact O-CA 3.34Å
408	E	86.8	Confident	88.2	Confident	94 Å²	94	63.7 Å²	63.7	44%	0.439	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	135.1	178.3	-166.2	174.9	158.4	0	0	110.6	V401 V428	V401-E408 PolarHBondContact N-O 3.36Å; V401-E408 PolarHBondContact O-N 2.93Å; E408-V428 HydrophobicContact CB-CG1 4.19Å; E408-V428 WeakPolarHBondContact OE2-CG1 3.23Å
409	Q	89.4	Confident	88.2	Confident	137 Å²	137	61.3 Å²	61.3	64%	0.64	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	128.3	175.2	-75.9	-171.3	-4	0	0	110.7	V399 E400	V399-Q409 WeakPolarHBondContact O-CA 3.38Å; E400-Q409 HydrophobicContact CG-CG 3.76Å; E400-Q409 PolarHBondContact OE1-NE2 3.27Å; E400-Q409 VanDerWaalsContact OE1-NE2 3.13Å
410	L	89	Confident	88.2	Confident	24 Å²	24	65.5 Å²	65.5	13%	0.126	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	129.9	-176.1	-169.4	67.8	0	0	0	111.4	V399 V401 I412 Q424 L425	V399-L410 HydrophobicContact CG2-CB 4.47Å; V399-L410 WeakPolarHBondContact CG2-O 3.42Å; V399-L410 PolarHBondContact N-O 3.27Å; V399-L410 PolarHBondContact O-N 3.09Å; V401-L410 HydrophobicContact CG2-CB 4.01Å; V401-L410 HydrophobicContact CG2-CD2 4.3Å; L410-I412 HydrophobicContact CB-CG2 4.37Å; L410-I412 HydrophobicContact CD2-CG2 3.66Å; L410-I412 HydrophobicContact CG-CG2 3.86Å; L410-I412 PolarHBondContact O-N 3.39Å; L410-Q424 HydrophobicContact CD2-CG 4.3Å; L410-L425 HydrophobicContact CD2-CD2 3.78Å
411	C	90.2	Very high	88.2	Confident	48 Å²	48	63.2 Å²	63.2	32%	0.324	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	112.2	166.2	-170.1	0	0	0	0	109.2	A397	A397-C411 WeakPolarHBondContact O-CA 3.4Å
412	I	90.8	Very high	88.2	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	147.1	179.4	64.6	173.6	0	0	0	110.3	R396 A397 V399 L410 L414 L421 L459 I464 I470	R396-I412 CarbonylContact C-O 3.59Å; R396-I412 WeakPolarHBondContact CA-O 3.44Å; A397-I412 HydrophobicContact CB-CG1 4.26Å; A397-I412 PolarHBondContact N-O 3.28Å; A397-I412 WeakPolarHBondContact O-CG1 3.38Å; A397-I412 PolarHBondContact O-N 2.98Å; V399-I412 HydrophobicContact CG1-CD1 3.83Å; V399-I412 HydrophobicContact CG1-CG1 4.28Å; V399-I412 HydrophobicContact CG2-CD1 3.84Å; V399-I412 HydrophobicContact CG2-CG1 4.09Å; V399-I412 HydrophobicContact CG2-CG2 3.88Å; L410-I412 HydrophobicContact CB-CG2 4.37Å; L410-I412 HydrophobicContact CD2-CG2 3.66Å; L410-I412 HydrophobicContact CG-CG2 3.86Å; L410-I412 PolarHBondContact O-N 3.39Å; I412-L414 HydrophobicContact CD1-CD2 4.48Å; I412-L421 HydrophobicContact CB-CD1 4.45Å; I412-L421 HydrophobicContact CG2-CD1 3.72Å; I412-L459 HydrophobicContact CD1-CD1 3.88Å; I412-I464 HydrophobicContact CD1-CD1 4.32Å; I412-I464 HydrophobicContact CD1-CG2 4.13Å; I412-I470 HydrophobicContact CD1-CD1 3.99Å
413	R	90.6	Very high	88.3	Confident	106 Å²	106	68.9 Å²	68.9	40%	0.4	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	136.1	169.7	-51.4	-174.3	-67	146.4	-4.8	109.5	C395 R396 D415 Q416	C395-R413 CarbonylContact O-C 3.59Å; C395-R413 WeakPolarHBondContact O-CA 3.23Å; R396-R413 HydrophobicContact CG-CG 4.37Å; R413-D415 VanDerWaalsContact C-N 3.34Å; R413-D415 WeakPolarHBondContact CB-OD1 3.46Å; R413-D415 IonicContact CZ-OD1 3.37Å; R413-D415 IonicContact CZ-OD2 2.85Å; R413-D415 IonicContact NE-OD1 2.92Å; R413-D415 IonicContact NH1-OD1 2.91Å; R413-D415 PolarHBondContact NH1-OD1 2.94Å; R413-D415 IonicContact NH1-OD2 2.64Å; R413-D415 PolarHBondContact NH1-OD2 2.96Å; R413-Q416 WeakPolarHBondContact O-CG 3.15Å
414	L	89.8	Confident	88.4	Confident	9 Å²	9	71.3 Å²	71.3	5%	0.047	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-14.6	-177.9	-63.3	178.8	0	0	0	112.7	R394 C395 A397 I412 L459 H460 I464	R394-L414 HydrophobicContact CB-CD1 4.3Å; R394-L414 WeakPolarHBondContact O-CD1 3.45Å; C395-L414 PolarHBondContact O-N 3.03Å; A397-L414 HydrophobicContact CB-CD1 4.29Å; A397-L414 HydrophobicContact CB-CD2 3.94Å; A397-L414 HydrophobicContact CB-CG 4.28Å; I412-L414 HydrophobicContact CD1-CD2 4.48Å; L414-L459 HydrophobicContact CD2-CB 4.34Å; L414-L459 PolarHBondContact O-N 3.32Å; L414-H460 HydrophobicContact CB-CB 4.06Å; L414-H460 WeakPolarHBondContact O-CB 3.45Å; L414-H460 PolarHBondContact O-N 3.25Å; L414-H460 PolarHBondContact O-ND1 3.35Å; L414-I464 HydrophobicContact CD2-CB 3.83Å; L414-I464 HydrophobicContact CD2-CG2 4.15Å
415	D	88.4	Confident	88.7	Confident	89 Å²	89	63.4 Å²	63.4	48%	0.476	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-20.5	172.7	66.6	-19	0	0	0	113.1	R413	R413-D415 VanDerWaalsContact C-N 3.34Å; R413-D415 WeakPolarHBondContact CB-OD1 3.46Å; R413-D415 IonicContact CZ-OD1 3.37Å; R413-D415 IonicContact CZ-OD2 2.85Å; R413-D415 IonicContact NE-OD1 2.92Å; R413-D415 IonicContact NH1-OD1 2.91Å; R413-D415 PolarHBondContact NH1-OD1 2.94Å; R413-D415 IonicContact NH1-OD2 2.64Å; R413-D415 PolarHBondContact NH1-OD2 2.96Å
416	Q	91.7	Very high	89.1	Confident	10 Å²	10	59.5 Å²	59.5	5%	0.047	29%	0.291	C	S	.	.	S	Bend	trans	-72.2	155.2	-178.7	87	-168.9	-20	0	0	111.9	R413 E420 A458 L459	R413-Q416 WeakPolarHBondContact O-CG 3.15Å; Q416-E420 WeakPolarHBondContact CA-OE2 3.46Å; Q416-E420 HydrophobicContact CB-CB 4.18Å; Q416-E420 HydrophobicContact CG-CB 4.42Å; Q416-A458 CarbonylContact O-C 3.58Å; Q416-A458 WeakPolarHBondContact O-CA 3.36Å; Q416-L459 HydrophobicContact CG-CD1 3.69Å; Q416-L459 HydrophobicContact CG-CG 4.16Å; Q416-L459 WeakPolarHBondContact O-CG 3.34Å; Q416-L459 PolarHBondContact O-N 3.11Å
417	T	93.4	Very high	89.1	Confident	36 Å²	36	58.9 Å²	58.9	22%	0.221	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-81.1	158.8	175.8	61.3	0	0	0	0	112	A419 E420 L421 N455 R457	T417-A419 PolarHBondContact O-N 3.19Å; T417-E420 PolarHBondContact N-OE2 3.12Å; T417-E420 PolarHBondContact O-N 3.29Å; T417-E420 VanDerWaalsContact O-N 3.09Å; T417-E420 VanDerWaalsContact OG1-CD 3.31Å; T417-E420 VanDerWaalsContact OG1-CG 3.29Å; T417-E420 WeakPolarHBondContact OG1-CG 3.43Å; T417-E420 PolarHBondContact OG1-N 2.98Å; T417-E420 PolarHBondContact OG1-OE2 3.3Å; T417-L421 PolarHBondContact O-N 3.3Å; T417-N455 WeakPolarHBondContact CB-O 3.44Å; T417-R457 WeakPolarHBondContact CA-O 3.42Å
418	V	91.6	Very high	88.7	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-56.7	-33.1	172.5	172.9	0	0	0	0	111.8	L421 K422 L438 L452 R457 L459 Y462	V418-L421 PolarHBondContact O-N 2.85Å; V418-K422 HydrophobicContact CG1-CD 4.42Å; V418-K422 WeakPolarHBondContact O-CG 3.47Å; V418-K422 PolarHBondContact O-N 2.85Å; V418-L438 HydrophobicContact CG1-CD1 4.43Å; V418-L452 HydrophobicContact CG1-CB 3.91Å; V418-L452 WeakPolarHBondContact CG1-O 3.08Å; V418-L452 HydrophobicContact CG2-CB 3.92Å; V418-L452 HydrophobicContact CG2-CD2 4.42Å; V418-R457 PolarHBondContact N-O 3.09Å; V418-L459 HydrophobicContact CG2-CD2 3.86Å; V418-Y462 HydrophobicContact CG2-CE2 3.79Å
419	A	90.4	Very high	88.3	Confident	43 Å²	43	52.1 Å²	52.1	36%	0.355	26%	0.264	S	S	.	.	H	α-helix	trans	-65.5	-42.7	175.3	0	0	0	0	0	112.8	T417 K422 K423 N455	T417-A419 PolarHBondContact O-N 3.19Å; A419-K422 PolarHBondContact O-N 2.85Å; A419-K423 PolarHBondContact O-N 3.36Å; A419-N455 HydrophobicContact CB-CB 4.15Å; A419-N455 WeakPolarHBondContact CB-O 3.47Å; A419-N455 PolarHBondContact N-O 2.98Å
420	E	91.4	Very high	87.8	Confident	90 Å²	90	53.4 Å²	53.4	42%	0.421	27%	0.27	S	S	.	.	H	α-helix	trans	-66.8	-40.2	176.7	-71.2	164	147.1	0	0	111	Q416 T417 K422 K423 Q424	Q416-E420 WeakPolarHBondContact CA-OE2 3.46Å; Q416-E420 HydrophobicContact CB-CB 4.18Å; Q416-E420 HydrophobicContact CG-CB 4.42Å; T417-E420 PolarHBondContact N-OE2 3.12Å; T417-E420 PolarHBondContact O-N 3.29Å; T417-E420 VanDerWaalsContact O-N 3.09Å; T417-E420 VanDerWaalsContact OG1-CD 3.31Å; T417-E420 VanDerWaalsContact OG1-CG 3.29Å; T417-E420 WeakPolarHBondContact OG1-CG 3.43Å; T417-E420 PolarHBondContact OG1-N 2.98Å; T417-E420 PolarHBondContact OG1-OE2 3.3Å; E420-K422 PolarHBondContact O-N 2.88Å; E420-K423 WeakPolarHBondContact O-CB 3.17Å; E420-K423 PolarHBondContact O-N 3.34Å; E420-K423 VanDerWaalsContact O-N 3.14Å; E420-Q424 PolarHBondContact O-N 3.3Å
421	L	91.2	Very high	87.4	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.3	-47.1	171.7	-179.8	64.6	0	0	0	111.4	I412 T417 V418 K423 Q424 L425 L438 L452 L459 I470	I412-L421 HydrophobicContact CB-CD1 4.45Å; I412-L421 HydrophobicContact CG2-CD1 3.72Å; T417-L421 PolarHBondContact O-N 3.3Å; V418-L421 PolarHBondContact O-N 2.85Å; L421-K423 PolarHBondContact O-N 3.44Å; L421-Q424 CarbonylContact O-C 3.5Å; L421-Q424 WeakPolarHBondContact O-CB 3.39Å; L421-Q424 PolarHBondContact O-N 3.06Å; L421-Q424 VanDerWaalsContact O-N 3.09Å; L421-L425 HydrophobicContact CD1-CD1 4.25Å; L421-L425 HydrophobicContact CD1-CG 4.14Å; L421-L425 HydrophobicContact CD2-CD1 4.47Å; L421-L425 HydrophobicContact CG-CD1 3.97Å; L421-L425 HydrophobicContact CG-CG 4.26Å; L421-L425 WeakPolarHBondContact O-CB 3.05Å; L421-L425 VanDerWaalsContact O-CG 3.31Å; L421-L425 WeakPolarHBondContact O-CG 3.5Å; L421-L425 PolarHBondContact O-N 3Å; L421-L438 HydrophobicContact CD2-CD1 3.91Å; L421-L438 HydrophobicContact CG-CD1 4.22Å; L421-L452 HydrophobicContact CD2-CD1 4.06Å; L421-L459 HydrophobicContact CB-CD1 4.15Å; L421-L459 HydrophobicContact CD1-CD1 4.36Å; L421-L459 HydrophobicContact CD2-CD1 3.83Å; L421-L459 HydrophobicContact CD2-CD2 3.88Å; L421-L459 HydrophobicContact CG-CD1 4.33Å; L421-I470 HydrophobicContact CD2-CD1 3.92Å
422	K	89.8	Confident	87	Confident	15 Å²	15	54.8 Å²	54.8	7%	0.065	28%	0.279	C	S	.	.	H	α-helix	trans	-58.2	-37	175.2	-74.8	174.7	-177.8	170.1	0	112.2	V418 A419 E420 L425 K426 T433 L438 N455	V418-K422 HydrophobicContact CG1-CD 4.42Å; V418-K422 WeakPolarHBondContact O-CG 3.47Å; V418-K422 PolarHBondContact O-N 2.85Å; A419-K422 PolarHBondContact O-N 2.85Å; E420-K422 PolarHBondContact O-N 2.88Å; K422-L425 PolarHBondContact O-N 2.92Å; K422-K426 PolarHBondContact O-N 3.5Å; K422-T433 HydrophobicContact CB-CG2 4.25Å; K422-L438 HydrophobicContact CD-CD1 4.38Å; K422-L438 HydrophobicContact CG-CD1 3.52Å; K422-L438 HydrophobicContact CG-CG 4.11Å; K422-N455 PolarHBondContact NZ-OD1 3.27Å
423	K	89.1	Confident	86.5	Confident	155 Å²	155	57 Å²	57	67%	0.674	29%	0.292	S	S	*	.	H	α-helix	trans	-67.5	-39.4	175.9	-171.6	-177.5	177.7	-175.3	0	111.7	A419 E420 L421 K426	A419-K423 PolarHBondContact O-N 3.36Å; E420-K423 WeakPolarHBondContact O-CB 3.17Å; E420-K423 PolarHBondContact O-N 3.34Å; E420-K423 VanDerWaalsContact O-N 3.14Å; L421-K423 PolarHBondContact O-N 3.44Å; K423-K426 WeakPolarHBondContact O-CB 3.43Å; K423-K426 PolarHBondContact O-N 2.9Å
424	Q	87.8	Confident	85.9	Confident	60 Å²	60	57.7 Å²	57.7	28%	0.28	30%	0.304	S	S	.	.	H	α-helix	trans	-66.4	-42.1	173.9	-169.9	-178.2	-1.7	0	0	111.1	L410 E420 L421 K426 T427	L410-Q424 HydrophobicContact CD2-CG 4.3Å; E420-Q424 PolarHBondContact O-N 3.3Å; L421-Q424 CarbonylContact O-C 3.5Å; L421-Q424 WeakPolarHBondContact O-CB 3.39Å; L421-Q424 PolarHBondContact O-N 3.06Å; L421-Q424 VanDerWaalsContact O-N 3.09Å; Q424-K426 VanDerWaalsContact C-N 3.29Å; Q424-K426 PolarHBondContact O-N 3.23Å; Q424-T427 PolarHBondContact O-N 3.13Å; Q424-T427 PolarHBondContact O-OG1 3.36Å
425	L	87.4	Confident	85.5	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-69.4	-24.2	178.8	-68.1	178.7	0	0	0	113	V401 L410 L421 K422 T427 V428 V429 M436 L438 V472	V401-L425 HydrophobicContact CB-CD2 4.37Å; V401-L425 HydrophobicContact CG1-CD2 3.76Å; V401-L425 HydrophobicContact CG2-CD2 3.8Å; L410-L425 HydrophobicContact CD2-CD2 3.78Å; L421-L425 HydrophobicContact CD1-CD1 4.25Å; L421-L425 HydrophobicContact CD1-CG 4.14Å; L421-L425 HydrophobicContact CD2-CD1 4.47Å; L421-L425 HydrophobicContact CG-CD1 3.97Å; L421-L425 HydrophobicContact CG-CG 4.26Å; L421-L425 WeakPolarHBondContact O-CB 3.05Å; L421-L425 VanDerWaalsContact O-CG 3.31Å; L421-L425 WeakPolarHBondContact O-CG 3.5Å; L421-L425 PolarHBondContact O-N 3Å; K422-L425 PolarHBondContact O-N 2.92Å; L425-T427 PolarHBondContact O-N 3.26Å; L425-V428 WeakPolarHBondContact O-CA 3.46Å; L425-V428 WeakPolarHBondContact O-CB 3.38Å; L425-V428 PolarHBondContact O-N 2.85Å; L425-V429 WeakPolarHBondContact O-CG2 3.33Å; L425-V429 PolarHBondContact O-N 3.24Å; L425-M436 HydrophobicContact CB-SD 4.44Å; L425-L438 HydrophobicContact CD1-CD1 3.93Å; L425-L438 HydrophobicContact CD1-CD2 3.55Å; L425-L438 HydrophobicContact CD1-CG 4.42Å; L425-V472 HydrophobicContact CD1-CG2 4.12Å
426	K	85.7	Confident	85.5	Confident	113 Å²	113	54.8 Å²	54.8	49%	0.491	29%	0.292	S	S	.	.	H	α-helix	trans	-52.7	-37.7	175.7	178.8	174.1	-178.6	-172.9	0	113.1	K422 K423 Q424 V428 Q430 L431 T433 M436	K422-K426 PolarHBondContact O-N 3.5Å; K423-K426 WeakPolarHBondContact O-CB 3.43Å; K423-K426 PolarHBondContact O-N 2.9Å; Q424-K426 VanDerWaalsContact C-N 3.29Å; Q424-K426 PolarHBondContact O-N 3.23Å; K426-V428 VanDerWaalsContact C-N 3.3Å; K426-Q430 WeakPolarHBondContact O-CA 3.36Å; K426-Q430 PolarHBondContact O-N 3.24Å; K426-L431 WeakPolarHBondContact CG-O 3.32Å; K426-T433 HydrophobicContact CD-CG2 4.49Å; K426-M436 HydrophobicContact CB-CE 4.19Å
427	T	79	Confident	85.3	Confident	119 Å²	119	59.8 Å²	59.8	73%	0.73	31%	0.31	S	S	*	.	H	α-helix	trans	-73.6	-25.3	178.5	52.5	0	0	0	0	112.6	Q424 L425	Q424-T427 PolarHBondContact O-N 3.13Å; Q424-T427 PolarHBondContact O-OG1 3.36Å; L425-T427 PolarHBondContact O-N 3.26Å
428	V	78.1	Confident	85.2	Confident	26 Å²	26	58.1 Å²	58.1	16%	0.158	30%	0.299	C	S	.	.	H	α-helix	trans	-85.4	-54.1	-178.6	168	0	0	0	0	111.1	E408 L425 K426	E408-V428 HydrophobicContact CB-CG1 4.19Å; E408-V428 WeakPolarHBondContact OE2-CG1 3.23Å; L425-V428 WeakPolarHBondContact O-CA 3.46Å; L425-V428 WeakPolarHBondContact O-CB 3.38Å; L425-V428 PolarHBondContact O-N 2.85Å; K426-V428 VanDerWaalsContact C-N 3.3Å
429	V	79.3	Confident	85.2	Confident	15 Å²	15	60.1 Å²	60.1	9%	0.091	31%	0.307	C	S	.	.	H	α-helix	trans	-94.9	-3.4	-171.3	-53.7	0	0	0	0	114.4	C403 L425 L431 M436 V472	C403-V429 HydrophobicContact CB-CB 4.15Å; C403-V429 HydrophobicContact CB-CG1 3.55Å; L425-V429 WeakPolarHBondContact O-CG2 3.33Å; L425-V429 PolarHBondContact O-N 3.24Å; V429-L431 HydrophobicContact CB-CD1 4.46Å; V429-L431 HydrophobicContact CG2-CB 3.93Å; V429-L431 HydrophobicContact CG2-CD1 4.05Å; V429-L431 HydrophobicContact CG2-CG 4.11Å; V429-L431 PolarHBondContact O-N 3.31Å; V429-M436 HydrophobicContact CG2-CE 3.6Å; V429-M436 HydrophobicContact CG2-SD 3.95Å; V429-V472 HydrophobicContact CG1-CB 4.43Å; V429-V472 HydrophobicContact CG1-CG1 4.43Å; V429-V472 HydrophobicContact CG1-CG2 4.18Å; V429-V472 HydrophobicContact CG2-CG1 4.24Å
430	Q	78.4	Confident	85.2	Confident	163 Å²	163	58.4 Å²	58.4	76%	0.762	29%	0.292	S	S	*	.			trans	54.6	16.2	-177.7	-57.3	-177.1	16.4	0	0	115.7	K426	K426-Q430 WeakPolarHBondContact O-CA 3.36Å; K426-Q430 PolarHBondContact O-N 3.24Å
431	L	80.6	Confident	85	Confident	41 Å²	41	56.4 Å²	56.4	22%	0.215	28%	0.283	C	S	.	.			trans	-91.3	160.2	175	-63.3	167.9	0	0	0	111.3	K426 V429 M436 V472 P474	K426-L431 WeakPolarHBondContact CG-O 3.32Å; V429-L431 HydrophobicContact CB-CD1 4.46Å; V429-L431 HydrophobicContact CG2-CB 3.93Å; V429-L431 HydrophobicContact CG2-CD1 4.05Å; V429-L431 HydrophobicContact CG2-CG 4.11Å; V429-L431 PolarHBondContact O-N 3.31Å; L431-M436 HydrophobicContact CB-CE 3.6Å; L431-M436 HydrophobicContact CB-CG 3.83Å; L431-M436 HydrophobicContact CB-SD 4.45Å; L431-M436 HydrophobicContact CD1-CG 4.22Å; L431-M436 WeakPolarHBondContact O-CE 3.4Å; L431-V472 HydrophobicContact CD1-CG1 4.32Å; L431-P474 HydrophobicContact CD1-CB 4.46Å; L431-P474 HydrophobicContact CD1-CG 4.05Å
432	S	81.6	Confident	84.5	Confident	60 Å²	60	58.4 Å²	58.4	42%	0.42	29%	0.294	S	S	.	.			trans	-75.6	144.4	170	177.9	0	0	0	0	110.7	N434 S435 M436	S432-N434 PolarHBondContact O-N 3.45Å; S432-N434 VanDerWaalsContact O-N 3.07Å; S432-S435 PolarHBondContact N-OG 3.48Å; S432-S435 PolarHBondContact O-N 3.04Å; S432-S435 PolarHBondContact O-OG 2.83Å; S432-M436 WeakPolarHBondContact O-CG 3.38Å
433	T	80.6	Confident	83.7	Confident	46 Å²	46	63 Å²	63	28%	0.282	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-55.8	-30.3	179.6	51.9	0	0	0	0	113	K422 K426	K422-T433 HydrophobicContact CB-CG2 4.25Å; K426-T433 HydrophobicContact CD-CG2 4.49Å
434	N	78.9	Confident	82.7	Confident	122 Å²	122	62.6 Å²	62.6	65%	0.652	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-79.8	-21	179.3	-70.3	-18.1	0	0	0	113.4	S432 K475	S432-N434 PolarHBondContact O-N 3.45Å; S432-N434 VanDerWaalsContact O-N 3.07Å; N434-K475 WeakPolarHBondContact O-CD 3.13Å; N434-K475 WeakPolarHBondContact O-CE 3.19Å; N434-K475 PolarHBondContact O-NZ 3.12Å
435	S	81.6	Confident	81.6	Confident	37 Å²	37	61.9 Å²	61.9	26%	0.259	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-97.3	11.5	-178.8	65.6	0	0	0	0	113.5	S432 P474 K475	S432-S435 PolarHBondContact N-OG 3.48Å; S432-S435 PolarHBondContact O-N 3.04Å; S432-S435 PolarHBondContact O-OG 2.83Å; S435-P474 CarbonylContact O-C 3.54Å; S435-P474 WeakPolarHBondContact O-CA 3.29Å; S435-K475 PolarHBondContact O-N 2.98Å
436	M	86.7	Confident	80.6	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	134.6	177	-60.2	172	-155.4	0	0	111.4	L425 K426 V429 L431 S432 V472	L425-M436 HydrophobicContact CB-SD 4.44Å; K426-M436 HydrophobicContact CB-CE 4.19Å; V429-M436 HydrophobicContact CG2-CE 3.6Å; V429-M436 HydrophobicContact CG2-SD 3.95Å; L431-M436 HydrophobicContact CB-CE 3.6Å; L431-M436 HydrophobicContact CB-CG 3.83Å; L431-M436 HydrophobicContact CB-SD 4.45Å; L431-M436 HydrophobicContact CD1-CG 4.22Å; L431-M436 WeakPolarHBondContact O-CE 3.4Å; S432-M436 WeakPolarHBondContact O-CG 3.38Å; M436-V472 HydrophobicContact CB-CG1 4.15Å; M436-V472 HydrophobicContact CG-CG1 4Å; M436-V472 HydrophobicContact SD-CG1 4.3Å
437	R	88.6	Confident	79.4	Confident	115 Å²	115	69.7 Å²	69.7	43%	0.434	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	135.7	156.5	-65.8	-176.1	-175.9	180	1.1	107.9	Y439 V473 K475	R437-Y439 HydrophobicContact CB-CE2 3.76Å; R437-V473 HydrophobicContact CB-CB 4.45Å; R437-V473 PolarHBondContact N-O 2.71Å; R437-V473 PolarHBondContact O-N 2.83Å; R437-K475 HydrophobicContact CG-CD 4.34Å; R437-K475 HydrophobicContact CG-CG 3.76Å
438	L	91.2	Very high	79.1	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	133.3	-179.5	-57.7	179.6	0	0	0	108.3	V418 L421 K422 L425 L452 I470 L471 V472	V418-L438 HydrophobicContact CG1-CD1 4.43Å; L421-L438 HydrophobicContact CD2-CD1 3.91Å; L421-L438 HydrophobicContact CG-CD1 4.22Å; K422-L438 HydrophobicContact CD-CD1 4.38Å; K422-L438 HydrophobicContact CG-CD1 3.52Å; K422-L438 HydrophobicContact CG-CG 4.11Å; L425-L438 HydrophobicContact CD1-CD1 3.93Å; L425-L438 HydrophobicContact CD1-CD2 3.55Å; L425-L438 HydrophobicContact CD1-CG 4.42Å; L438-L452 HydrophobicContact CB-CB 4.06Å; L438-L452 HydrophobicContact CB-CD1 3.83Å; L438-L452 HydrophobicContact CB-CG 4.3Å; L438-L452 HydrophobicContact CD1-CD1 4.2Å; L438-L452 PolarHBondContact O-N 2.84Å; L438-I470 HydrophobicContact CB-CG2 4.45Å; L438-I470 HydrophobicContact CD2-CG2 4.35Å; L438-L471 CarbonylContact C-O 3.59Å; L438-L471 WeakPolarHBondContact CA-O 2.96Å; L438-V472 HydrophobicContact CD2-CB 4.13Å; L438-V472 HydrophobicContact CD2-CG1 3.89Å; L438-V472 HydrophobicContact CD2-CG2 3.64Å
439	Y	90.9	Very high	79.4	Confident	43 Å²	43	69.3 Å²	69.3	17%	0.169	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	129.9	174.7	-60.9	-92.8	0	0	0	108.7	R437 P449 E450 E451 I470 L471 V473	R437-Y439 HydrophobicContact CB-CE2 3.76Å; Y439-P449 HydrophobicContact CD1-CB 4.21Å; Y439-P449 HydrophobicContact CG-CB 4.38Å; Y439-E450 CarbonylContact C-O 3.53Å; Y439-E450 VanDerWaalsContact CA-O 3.29Å; Y439-E450 WeakPolarHBondContact CA-O 3.31Å; Y439-E451 HydrophobicContact CD1-CB 3.73Å; Y439-E451 HydrophobicContact CD1-CG 4.04Å; Y439-E451 HydrophobicContact CE1-CB 3.54Å; Y439-E451 HydrophobicContact CE1-CG 3.61Å; Y439-I470 CarbonylContact O-C 3.59Å; Y439-I470 WeakPolarHBondContact O-CA 3.36Å; Y439-L471 PolarHBondContact N-O 3.42Å; Y439-L471 PolarHBondContact O-N 3.45Å; Y439-V473 HydrophobicContact CD2-CG2 3.9Å; Y439-V473 HydrophobicContact CE2-CB 4.18Å; Y439-V473 HydrophobicContact CE2-CG2 3.83Å
440	Y	90.8	Very high	79.9	Confident	7 Å²	7	72.9 Å²	72.9	3%	0.027	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	130.4	171	177.4	-116.7	0	0	0	109.2	D442 P449 E450 I464 Q465 E469 I470	Y440-D442 HydrophobicContact CE1-CB 3.85Å; Y440-P449 WeakPolarHBondContact O-CA 3.39Å; Y440-E450 PolarHBondContact N-O 3.31Å; Y440-E450 PolarHBondContact O-N 3.18Å; Y440-I464 HydrophobicContact CD1-CG1 4.03Å; Y440-I464 HydrophobicContact CD2-CD1 4.32Å; Y440-I464 HydrophobicContact CD2-CG1 3.94Å; Y440-I464 HydrophobicContact CD2-CG2 4.23Å; Y440-I464 HydrophobicContact CE1-CB 4.45Å; Y440-I464 HydrophobicContact CE1-CG1 4.05Å; Y440-I464 HydrophobicContact CE2-CB 4.1Å; Y440-I464 HydrophobicContact CE2-CG1 3.96Å; Y440-I464 HydrophobicContact CE2-CG2 3.63Å; Y440-I464 HydrophobicContact CG-CD1 4.45Å; Y440-I464 HydrophobicContact CG-CG1 3.98Å; Y440-I464 WeakPolarHBondContact OH-CA 3.49Å; Y440-Q465 PolarHBondContact OH-N 3.42Å; Y440-E469 CarbonylContact C-O 3.59Å; Y440-E469 WeakPolarHBondContact CA-O 3.39Å; Y440-E469 WeakPolarHBondContact CD2-O 3.36Å; Y440-I470 HydrophobicContact CD2-CG1 4.23Å
441	I	87.2	Confident	80.5	Confident	47 Å²	47	68.7 Å²	68.7	24%	0.241	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	113.6	176.2	-60.5	165.7	0	0	0	106.6	P449 E469 L471	I441-P449 HydrophobicContact CD1-CB 4.43Å; I441-P449 HydrophobicContact CG1-CB 3.78Å; I441-E469 HydrophobicContact CB-CB 4.08Å; I441-E469 PolarHBondContact N-O 2.85Å; I441-E469 PolarHBondContact O-N 3.46Å; I441-L471 HydrophobicContact CD1-CB 4.29Å
442	D	82.1	Confident	80.9	Confident	42 Å²	42	66.8 Å²	66.8	23%	0.225	37%	0.372	C	S	.	.			trans	-87	120.6	171.4	-176.1	1.5	0	0	0	108.8	Y440 D444 S445	Y440-D442 HydrophobicContact CE1-CB 3.85Å; D442-D444 PolarHBondContact O-N 2.72Å; D442-D444 PolarHBondContact OD1-N 3.44Å; D442-D444 VanDerWaalsContact OD1-N 3.15Å; D442-S445 PolarHBondContact O-N 3.31Å
443	K	71.9	Confident	81.2	Confident	111 Å²	111	70.3 Å²	70.3	48%	0.483	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-23.5	-178.1	-73.3	-178.6	175.1	158.8	0	112.5	E400 G467 E469	E400-K443 IonicContact OE2-NZ 3.25Å; E400-K443 PolarHBondContact OE2-NZ 3.03Å; K443-G467 WeakPolarHBondContact CD-O 3.23Å; K443-G467 WeakPolarHBondContact CE-O 3.5Å; K443-G467 PolarHBondContact NZ-O 3.2Å; K443-G467 VanDerWaalsContact NZ-O 3.11Å; K443-E469 WeakPolarHBondContact CE-OE1 3.29Å; K443-E469 IonicContact NZ-OE1 3.14Å; K443-E469 PolarHBondContact NZ-OE1 2.79Å
444	D	68	Low	81.6	Confident	147 Å²	147	73.9 Å²	73.9	79%	0.786	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-0.5	-177.4	-64.2	-38.6	0	0	0	113.1	D442	D442-D444 PolarHBondContact O-N 2.72Å; D442-D444 PolarHBondContact OD1-N 3.44Å; D442-D444 VanDerWaalsContact OD1-N 3.15Å
445	S	66	Low	82.1	Confident	45 Å²	45	71.7 Å²	71.7	32%	0.315	38%	0.377	S	S	.	.			trans	-96.6	132.1	-178.5	-174.3	0	0	0	0	112.4	D442 F447	D442-S445 PolarHBondContact O-N 3.31Å; S445-F447 PolarHBondContact O-N 2.81Å; S445-F447 PolarHBondContact OG-N 2.91Å
446	A	66.2	Low	82.5	Confident	105 Å²	105	76.4 Å²	76.4	87%	0.868	40%	0.399	S	S	*	.	S	Bend	trans	-73.6	-6.3	171.7	0	0	0	0	0	113.3
447	F	60	Low	82.7	Confident	173 Å²	173	81 Å²	81	76%	0.759	42%	0.416	S	S	*	.	S	Bend	trans	-95.8	128.5	178.2	-59.2	-84.5	0	0	0	108.6	S445	S445-F447 PolarHBondContact O-N 2.81Å; S445-F447 PolarHBondContact OG-N 2.91Å
448	G	72.6	Confident	82.9	Confident	60 Å²	60	76.5 Å²	76.5	62%	0.619	40%	0.404	S	S	*	.			trans	-60.4	-176.8	-178.2	0	0	0	0	0	114.5	E450	G448-E450 PolarHBondContact O-N 3.34Å
449	P	84.6	Confident	82.8	Confident	76 Å²	76	76.5 Å²	76.5	49%	0.494	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-50.1	123.6	-172.7	13.6	-27.6	0	0	0	113.7	Y439 Y440 I441	Y439-P449 HydrophobicContact CD1-CB 4.21Å; Y439-P449 HydrophobicContact CG-CB 4.38Å; Y440-P449 WeakPolarHBondContact O-CA 3.39Å; I441-P449 HydrophobicContact CD1-CB 4.43Å; I441-P449 HydrophobicContact CG1-CB 3.78Å
450	E	89.2	Confident	82.6	Confident	91 Å²	91	79.9 Å²	79.9	43%	0.425	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	122	175.2	-172	179.8	-178.9	0	0	110.4	Y439 Y440 G448 L452 Y462	Y439-E450 CarbonylContact C-O 3.53Å; Y439-E450 VanDerWaalsContact CA-O 3.29Å; Y439-E450 WeakPolarHBondContact CA-O 3.31Å; Y440-E450 PolarHBondContact N-O 3.31Å; Y440-E450 PolarHBondContact O-N 3.18Å; G448-E450 PolarHBondContact O-N 3.34Å; E450-L452 PolarHBondContact O-N 3.13Å; E450-Y462 HydrophobicContact CG-CD1 4.46Å; E450-Y462 WeakPolarHBondContact OE1-CD1 3.21Å
451	E	90.7	Very high	82.4	Confident	75 Å²	75	81.4 Å²	81.4	35%	0.35	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	124.7	177.7	-166.4	177.3	170.7	0	0	111.6	Y439 K453	Y439-E451 HydrophobicContact CD1-CB 3.73Å; Y439-E451 HydrophobicContact CD1-CG 4.04Å; Y439-E451 HydrophobicContact CE1-CB 3.54Å; Y439-E451 HydrophobicContact CE1-CG 3.61Å; E451-K453 HydrophobicContact CG-CB 4.47Å; E451-K453 PolarHBondContact O-N 3.24Å
452	L	90.5	Very high	82.3	Confident	1 Å²	1	79.5 Å²	79.5	1%	0.005	42%	0.423	C	S	.	.			trans	-74.8	69.2	170	-58.2	175.7	0	0	0	109.7	V418 L421 L438 E450 L459 Y462	V418-L452 HydrophobicContact CG1-CB 3.91Å; V418-L452 WeakPolarHBondContact CG1-O 3.08Å; V418-L452 HydrophobicContact CG2-CB 3.92Å; V418-L452 HydrophobicContact CG2-CD2 4.42Å; L421-L452 HydrophobicContact CD2-CD1 4.06Å; L438-L452 HydrophobicContact CB-CB 4.06Å; L438-L452 HydrophobicContact CB-CD1 3.83Å; L438-L452 HydrophobicContact CB-CG 4.3Å; L438-L452 HydrophobicContact CD1-CD1 4.2Å; L438-L452 PolarHBondContact O-N 2.84Å; E450-L452 PolarHBondContact O-N 3.13Å; L452-L459 HydrophobicContact CD1-CD2 4.33Å; L452-Y462 HydrophobicContact CD2-CD1 3.53Å; L452-Y462 HydrophobicContact CD2-CD2 3.52Å; L452-Y462 HydrophobicContact CD2-CE1 3.66Å; L452-Y462 HydrophobicContact CD2-CE2 3.65Å; L452-Y462 HydrophobicContact CD2-CG 3.44Å; L452-Y462 VanDerWaalsContact CD2-CG 3.44Å
453	K	86.8	Confident	82.5	Confident	133 Å²	133	81.6 Å²	81.6	58%	0.578	44%	0.441	S	S	*	.			trans	-72.5	-38.8	-169.7	-174.7	178.9	-179.7	-179	0	113.4	E451	E451-K453 HydrophobicContact CG-CB 4.47Å; E451-K453 PolarHBondContact O-N 3.24Å
454	Y	89.9	Confident	83.2	Confident	122 Å²	122	76.7 Å²	76.7	48%	0.478	42%	0.419	S	S	.	.			trans	-95.1	106.2	-170.1	-58.7	-74.3	0	0	0	111.4	N456 R457	Y454-N456 PolarHBondContact O-N 3.43Å; Y454-R457 WeakPolarHBondContact O-CB 3.15Å; Y454-R457 PolarHBondContact O-N 2.9Å; Y454-R457 VanDerWaalsContact O-N 3.09Å
455	N	89.1	Confident	84	Confident	75 Å²	75	73.8 Å²	73.8	40%	0.401	40%	0.401	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-29.6	-176.1	-82.5	-13.8	0	0	0	114.4	T417 A419 K422	T417-N455 WeakPolarHBondContact CB-O 3.44Å; A419-N455 HydrophobicContact CB-CB 4.15Å; A419-N455 WeakPolarHBondContact CB-O 3.47Å; A419-N455 PolarHBondContact N-O 2.98Å; K422-N455 PolarHBondContact NZ-OD1 3.27Å
456	N	90.3	Very high	85	Confident	136 Å²	136	75.4 Å²	75.4	73%	0.727	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-5.8	-179.9	62.8	-24.2	0	0	0	113.7	Y454	Y454-N456 PolarHBondContact O-N 3.43Å
457	R	91.2	Very high	85.7	Confident	96 Å²	96	72.2 Å²	72.2	36%	0.362	38%	0.383	S	S	.	.	S	Bend	trans	-82.9	136.2	-179.2	-174	165.7	175.6	-173.8	-5.1	109.6	T417 V418 Y454 S461 Y462	T417-R457 WeakPolarHBondContact CA-O 3.42Å; V418-R457 PolarHBondContact N-O 3.09Å; Y454-R457 WeakPolarHBondContact O-CB 3.15Å; Y454-R457 PolarHBondContact O-N 2.9Å; Y454-R457 VanDerWaalsContact O-N 3.09Å; R457-S461 WeakPolarHBondContact CD-OG 3.48Å; R457-S461 WeakPolarHBondContact CG-OG 3.29Å; R457-S461 PolarHBondContact NE-OG 2.9Å; R457-S461 PolarHBondContact NH2-O 2.91Å; R457-Y462 HydrophobicContact CB-CE2 4.25Å; R457-Y462 HydrophobicContact CG-CE2 3.83Å
458	A	90.9	Very high	87	Confident	21 Å²	21	64 Å²	64	17%	0.174	35%	0.348	C	S	.	.	B	Isolated β-bridge	trans	-76.6	149.2	178.6	0	0	0	0	0	111.8	Q416 H460 S461	Q416-A458 CarbonylContact O-C 3.58Å; Q416-A458 WeakPolarHBondContact O-CA 3.36Å; A458-H460 WeakPolarHBondContact CB-CE1 3.41Å; A458-H460 PolarHBondContact O-N 3.46Å; A458-S461 WeakPolarHBondContact O-CB 3.45Å; A458-S461 PolarHBondContact O-N 2.84Å; A458-S461 PolarHBondContact O-OG 2.79Å
459	L	89.3	Confident	87.8	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	-66.9	-31.6	-172	-69.3	-173.1	0	0	0	114.3	I412 L414 Q416 V418 L421 L452 S461 Y462 I464	I412-L459 HydrophobicContact CD1-CD1 3.88Å; L414-L459 HydrophobicContact CD2-CB 4.34Å; L414-L459 PolarHBondContact O-N 3.32Å; Q416-L459 HydrophobicContact CG-CD1 3.69Å; Q416-L459 HydrophobicContact CG-CG 4.16Å; Q416-L459 WeakPolarHBondContact O-CG 3.34Å; Q416-L459 PolarHBondContact O-N 3.11Å; V418-L459 HydrophobicContact CG2-CD2 3.86Å; L421-L459 HydrophobicContact CB-CD1 4.15Å; L421-L459 HydrophobicContact CD1-CD1 4.36Å; L421-L459 HydrophobicContact CD2-CD1 3.83Å; L421-L459 HydrophobicContact CD2-CD2 3.88Å; L421-L459 HydrophobicContact CG-CD1 4.33Å; L452-L459 HydrophobicContact CD1-CD2 4.33Å; L459-S461 PolarHBondContact O-N 2.63Å; L459-Y462 PolarHBondContact O-N 3.45Å; L459-I464 HydrophobicContact CB-CD1 4.14Å; L459-I464 HydrophobicContact CD2-CD1 4.17Å
460	H	87	Confident	88.1	Confident	115 Å²	115	59.6 Å²	59.6	53%	0.532	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-58.8	-22.8	176.8	60.8	-98.4	0	0	0	113.2	L414 A458 Y462 S463	L414-H460 HydrophobicContact CB-CB 4.06Å; L414-H460 WeakPolarHBondContact O-CB 3.45Å; L414-H460 PolarHBondContact O-N 3.25Å; L414-H460 PolarHBondContact O-ND1 3.35Å; A458-H460 WeakPolarHBondContact CB-CE1 3.41Å; A458-H460 PolarHBondContact O-N 3.46Å; H460-Y462 PolarHBondContact O-N 2.75Å; H460-S463 PolarHBondContact O-N 3.38Å
461	S	86.8	Confident	88.1	Confident	38 Å²	38	58.1 Å²	58.1	27%	0.266	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-78	-2.8	179.1	72.7	0	0	0	0	114.5	R457 A458 L459	R457-S461 WeakPolarHBondContact CD-OG 3.48Å; R457-S461 WeakPolarHBondContact CG-OG 3.29Å; R457-S461 PolarHBondContact NE-OG 2.9Å; R457-S461 PolarHBondContact NH2-O 2.91Å; A458-S461 WeakPolarHBondContact O-CB 3.45Å; A458-S461 PolarHBondContact O-N 2.84Å; A458-S461 PolarHBondContact O-OG 2.79Å; L459-S461 PolarHBondContact O-N 2.63Å
462	Y	86	Confident	88.1	Confident	7 Å²	7	54.7 Å²	54.7	3%	0.027	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-106.8	12.3	173.3	-59.9	-86	0	0	0	111.7	V418 E450 L452 R457 L459 H460 I464	V418-Y462 HydrophobicContact CG2-CE2 3.79Å; E450-Y462 HydrophobicContact CG-CD1 4.46Å; E450-Y462 WeakPolarHBondContact OE1-CD1 3.21Å; L452-Y462 HydrophobicContact CD2-CD1 3.53Å; L452-Y462 HydrophobicContact CD2-CD2 3.52Å; L452-Y462 HydrophobicContact CD2-CE1 3.66Å; L452-Y462 HydrophobicContact CD2-CE2 3.65Å; L452-Y462 HydrophobicContact CD2-CG 3.44Å; L452-Y462 VanDerWaalsContact CD2-CG 3.44Å; R457-Y462 HydrophobicContact CB-CE2 4.25Å; R457-Y462 HydrophobicContact CG-CE2 3.83Å; L459-Y462 PolarHBondContact O-N 3.45Å; H460-Y462 PolarHBondContact O-N 2.75Å; Y462-I464 PolarHBondContact O-N 2.89Å; Y462-I464 VanDerWaalsContact O-N 3.08Å
463	S	84.9	Confident	88	Confident	86 Å²	86	57.2 Å²	57.2	60%	0.601	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	35.2	177.2	-58.1	0	0	0	0	114.4	H460 Q465	H460-S463 PolarHBondContact O-N 3.38Å; S463-Q465 WeakPolarHBondContact O-CG 3.47Å; S463-Q465 PolarHBondContact O-N 2.84Å
464	I	87	Confident	87.8	Confident	8 Å²	8	53.1 Å²	53.1	4%	0.041	29%	0.286	C	S	.	.			trans	-64.2	130.7	-178	-59.5	178.4	0	0	0	110.4	A397 V399 I412 L414 Y440 L459 Y462	A397-I464 HydrophobicContact CB-CG2 4.11Å; V399-I464 HydrophobicContact CG1-CG2 3.66Å; I412-I464 HydrophobicContact CD1-CD1 4.32Å; I412-I464 HydrophobicContact CD1-CG2 4.13Å; L414-I464 HydrophobicContact CD2-CB 3.83Å; L414-I464 HydrophobicContact CD2-CG2 4.15Å; Y440-I464 HydrophobicContact CD1-CG1 4.03Å; Y440-I464 HydrophobicContact CD2-CD1 4.32Å; Y440-I464 HydrophobicContact CD2-CG1 3.94Å; Y440-I464 HydrophobicContact CD2-CG2 4.23Å; Y440-I464 HydrophobicContact CE1-CB 4.45Å; Y440-I464 HydrophobicContact CE1-CG1 4.05Å; Y440-I464 HydrophobicContact CE2-CB 4.1Å; Y440-I464 HydrophobicContact CE2-CG1 3.96Å; Y440-I464 HydrophobicContact CE2-CG2 3.63Å; Y440-I464 HydrophobicContact CG-CD1 4.45Å; Y440-I464 HydrophobicContact CG-CG1 3.98Å; Y440-I464 WeakPolarHBondContact OH-CA 3.49Å; L459-I464 HydrophobicContact CB-CD1 4.14Å; L459-I464 HydrophobicContact CD2-CD1 4.17Å; Y462-I464 PolarHBondContact O-N 2.89Å; Y462-I464 VanDerWaalsContact O-N 3.08Å
465	Q	85.8	Confident	87.4	Confident	86 Å²	86	51.7 Å²	51.7	40%	0.402	28%	0.282	S	S	.	.			trans	-118.4	165.8	-178.2	-51.6	-163	24.8	0	0	112.1	Y440 S463 G467 G468	Y440-Q465 PolarHBondContact OH-N 3.42Å; S463-Q465 WeakPolarHBondContact O-CG 3.47Å; S463-Q465 PolarHBondContact O-N 2.84Å; Q465-G467 PolarHBondContact O-N 3.35Å; Q465-G468 PolarHBondContact O-N 2.78Å
466	D	85.3	Confident	86.3	Confident	80 Å²	80	54.7 Å²	54.7	43%	0.428	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	133.9	171.9	-74.5	-26.9	0	0	0	110.4	R394 A397 Q398 G468	R394-D466 IonicContact CZ-OD2 3.88Å; R394-D466 VanDerWaalsContact NH2-CG 3.31Å; R394-D466 IonicContact NH2-OD2 3.48Å; R394-D466 PolarHBondContact NH2-OD2 2.88Å; A397-D466 WeakPolarHBondContact CA-OD1 3.45Å; Q398-D466 PolarHBondContact N-OD1 3.38Å; Q398-D466 WeakPolarHBondContact O-CA 3.28Å; D466-G468 VanDerWaalsContact C-N 3.33Å
467	G	82.3	Confident	84.4	Confident	37 Å²	37	61.6 Å²	61.6	38%	0.381	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	-3	-179.1	0	0	0	0	0	115	Q398 K443 Q465	Q398-G467 PolarHBondContact O-N 2.67Å; K443-G467 WeakPolarHBondContact CD-O 3.23Å; K443-G467 WeakPolarHBondContact CE-O 3.5Å; K443-G467 PolarHBondContact NZ-O 3.2Å; K443-G467 VanDerWaalsContact NZ-O 3.11Å; Q465-G467 PolarHBondContact O-N 3.35Å
468	G	86.2	Confident	84	Confident	2 Å²	2	59.9 Å²	59.9	2%	0.021	33%	0.325	C	S	.	.			trans	-69.8	160.9	173.8	0	0	0	0	0	113.2	V399 E400 Q465 D466	V399-G468 CarbonylContact C-O 3.57Å; V399-G468 VanDerWaalsContact CA-O 3.26Å; V399-G468 WeakPolarHBondContact CA-O 3.5Å; V399-G468 WeakPolarHBondContact CB-O 3.38Å; E400-G468 PolarHBondContact N-O 3.36Å; Q465-G468 PolarHBondContact O-N 2.78Å; D466-G468 VanDerWaalsContact C-N 3.33Å
469	E	90.3	Very high	83.7	Confident	43 Å²	43	61.9 Å²	61.9	20%	0.201	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	138.4	-174.7	-72.4	172.9	-159.8	0	0	111.5	E400 H402 Y440 I441 K443	E400-E469 HydrophobicContact CB-CG 4.14Å; E400-E469 CarbonylContact O-C 3.53Å; E400-E469 VanDerWaalsContact O-CA 3.29Å; E400-E469 WeakPolarHBondContact O-CA 3.16Å; H402-E469 IonicContact NE2-OE2 2.62Å; Y440-E469 CarbonylContact C-O 3.59Å; Y440-E469 WeakPolarHBondContact CA-O 3.39Å; Y440-E469 WeakPolarHBondContact CD2-O 3.36Å; I441-E469 HydrophobicContact CB-CB 4.08Å; I441-E469 PolarHBondContact N-O 2.85Å; I441-E469 PolarHBondContact O-N 3.46Å; K443-E469 WeakPolarHBondContact CE-OE1 3.29Å; K443-E469 IonicContact NZ-OE1 3.14Å; K443-E469 PolarHBondContact NZ-OE1 2.79Å
470	I	91.3	Very high	83.4	Confident	0 Å²	0	65.3 Å²	65.3	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	107.3	171.9	-59.9	-173.6	0	0	0	108.7	V399 E400 V401 H402 I412 L421 L438 Y439 Y440	V399-I470 HydrophobicContact CB-CD1 4.34Å; V399-I470 HydrophobicContact CB-CG1 4.29Å; V399-I470 HydrophobicContact CG1-CD1 4.48Å; V399-I470 HydrophobicContact CG2-CD1 3.82Å; V399-I470 HydrophobicContact CG2-CG1 4.19Å; E400-I470 PolarHBondContact O-N 2.66Å; V401-I470 CarbonylContact C-O 3.5Å; V401-I470 VanDerWaalsContact CA-O 3.31Å; V401-I470 WeakPolarHBondContact CA-O 3.36Å; V401-I470 HydrophobicContact CG2-CB 4.48Å; H402-I470 PolarHBondContact N-O 3.16Å; I412-I470 HydrophobicContact CD1-CD1 3.99Å; L421-I470 HydrophobicContact CD2-CD1 3.92Å; L438-I470 HydrophobicContact CB-CG2 4.45Å; L438-I470 HydrophobicContact CD2-CG2 4.35Å; Y439-I470 CarbonylContact O-C 3.59Å; Y439-I470 WeakPolarHBondContact O-CA 3.36Å; Y440-I470 HydrophobicContact CD2-CG1 4.23Å
471	L	89.4	Confident	83.1	Confident	60 Å²	60	62.4 Å²	62.4	31%	0.314	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	123.8	175	-177.7	70.1	0	0	0	110.4	H402 L438 Y439 I441 V473	H402-L471 HydrophobicContact CB-CD1 3.9Å; L438-L471 CarbonylContact C-O 3.59Å; L438-L471 WeakPolarHBondContact CA-O 2.96Å; Y439-L471 PolarHBondContact N-O 3.42Å; Y439-L471 PolarHBondContact O-N 3.45Å; I441-L471 HydrophobicContact CD1-CB 4.29Å; L471-V473 HydrophobicContact CD2-CG2 3.95Å; L471-V473 HydrophobicContact CG-CG2 3.94Å
472	V	89.6	Confident	82.9	Confident	3 Å²	3	63.9 Å²	63.9	2%	0.018	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	114.2	176.2	-170.2	0	0	0	0	109.3	V401 H402 C403 L425 V429 L431 M436 L438	V401-V472 HydrophobicContact CG1-CG2 3.61Å; H402-V472 PolarHBondContact O-N 3.32Å; C403-V472 HydrophobicContact CB-CB 4.06Å; L425-V472 HydrophobicContact CD1-CG2 4.12Å; V429-V472 HydrophobicContact CG1-CB 4.43Å; V429-V472 HydrophobicContact CG1-CG1 4.43Å; V429-V472 HydrophobicContact CG1-CG2 4.18Å; V429-V472 HydrophobicContact CG2-CG1 4.24Å; L431-V472 HydrophobicContact CD1-CG1 4.32Å; M436-V472 HydrophobicContact CB-CG1 4.15Å; M436-V472 HydrophobicContact CG-CG1 4Å; M436-V472 HydrophobicContact SD-CG1 4.3Å; L438-V472 HydrophobicContact CD2-CB 4.13Å; L438-V472 HydrophobicContact CD2-CG1 3.89Å; L438-V472 HydrophobicContact CD2-CG2 3.64Å
473	V	87.9	Confident	82.7	Confident	54 Å²	54	67.7 Å²	67.7	33%	0.327	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125	179.6	-175	0	0	0	0	109.9	R437 Y439 L471	R437-V473 HydrophobicContact CB-CB 4.45Å; R437-V473 PolarHBondContact N-O 2.71Å; R437-V473 PolarHBondContact O-N 2.83Å; Y439-V473 HydrophobicContact CD2-CG2 3.9Å; Y439-V473 HydrophobicContact CE2-CB 4.18Å; Y439-V473 HydrophobicContact CE2-CG2 3.83Å; L471-V473 HydrophobicContact CD2-CG2 3.95Å; L471-V473 HydrophobicContact CG-CG2 3.94Å
474	P	84.1	Confident	82.5	Confident	46 Å²	46	66.4 Å²	66.4	30%	0.299	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62	135	172.6	-19.5	30.6	0	0	0	111.3	L431 S435 T476	L431-P474 HydrophobicContact CD1-CB 4.46Å; L431-P474 HydrophobicContact CD1-CG 4.05Å; S435-P474 CarbonylContact O-C 3.54Å; S435-P474 WeakPolarHBondContact O-CA 3.29Å; P474-T476 PolarHBondContact O-N 3.1Å
475	K	81.5	Confident	82.2	Confident	93 Å²	93	70.9 Å²	70.9	40%	0.404	37%	0.374	S	S	.	.			trans	-73.7	109.6	167.3	-67.1	-175.3	-168.3	165.1	0	108.3	N434 S435 R437	N434-K475 WeakPolarHBondContact O-CD 3.13Å; N434-K475 WeakPolarHBondContact O-CE 3.19Å; N434-K475 PolarHBondContact O-NZ 3.12Å; S435-K475 PolarHBondContact O-N 2.98Å; R437-K475 HydrophobicContact CG-CD 4.34Å; R437-K475 HydrophobicContact CG-CG 3.76Å
476	T	65.5	Low	81.9	Confident	138 Å²	138	69.7 Å²	69.7	85%	0.847	37%	0.371	S	S	*	.			trans	-60	135.2	163.4	28.7	0	0	0	0	109.3	P474	P474-T476 PolarHBondContact O-N 3.1Å
477	K	49.6	Very low	81.6	Confident	280 Å²	280	68.7 Å²	68.7	100%	1.217	37%	0.366	S	S	*	.			trans	-66.8	0	178.8	-93.1	-173.5	177.1	179.7	0	111.9

Retrieved 477 of 477 residues in 744.5 ms (Link to these results)

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